#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bkh s LYS 5 N 0.00 3.39 0.53 1.61 -2.85 -1.26 -4.97 119.74 116.19 2bkh s LYS 5 Ca 0.00 -0.62 -0.22 0.00 -1.00 0.00 0.00 55.97 54.13 2bkh s LYS 5 Cb 0.00 -2.78 -0.06 0.00 -2.06 0.00 0.00 37.83 32.94 2bkh s LYS 5 CO 0.00 0.24 1.37 -0.35 0.10 0.00 0.00 175.35 176.70 2bkh n PRO 6 N -1.62 1.78 -4.26 1.78 -0.04 -1.26 -4.72 135.00 126.66 2bkh n PRO 6 Ca -0.06 0.65 -0.15 0.00 -0.04 0.00 0.00 63.50 63.91 2bkh n PRO 6 Cb 0.57 -2.58 -0.10 0.00 -0.04 0.00 0.00 33.50 31.35 2bkh n PRO 6 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2bkh s VAL 7 N -1.27 1.10 0.03 0.52 -7.23 -0.53 -3.18 120.40 109.84 2bkh s VAL 7 Ca 0.70 -2.05 -0.17 0.00 -1.81 0.00 0.00 61.98 58.65 2bkh s VAL 7 Cb -0.42 -1.95 -0.06 0.00 0.56 0.00 0.00 36.38 34.51 2bkh s VAL 7 CO 0.51 -0.66 0.47 0.26 -0.31 0.00 0.00 175.10 175.37 2bkh s TRP 8 N -3.37 3.76 0.04 2.82 0.52 0.63 -1.47 118.94 121.86 2bkh s TRP 8 Ca 0.19 1.10 -0.00 0.00 0.02 0.00 0.00 56.10 57.41 2bkh s TRP 8 Cb 0.03 -2.37 -0.03 0.00 -1.15 0.00 0.00 33.47 29.95 2bkh s TRP 8 CO 0.02 0.62 -0.04 0.00 0.02 0.00 0.00 176.95 177.57 2bkh s ALA 9 N -1.06 0.36 0.45 0.98 0.00 -0.50 -1.53 121.76 120.46 2bkh s ALA 9 Ca 0.26 -0.89 -0.25 0.00 0.00 0.00 0.00 51.96 51.08 2bkh s ALA 9 Cb -0.18 0.19 -0.09 0.00 0.00 0.00 0.00 23.12 23.04 2bkh s ALA 9 CO 0.15 -0.23 1.31 -2.30 0.00 0.00 0.00 175.76 174.70 2bkh n PRO 10 N 0.92 1.95 -3.99 0.00 -0.02 -1.26 -0.78 135.00 131.82 2bkh n PRO 10 Ca -0.19 0.70 -0.16 0.00 -2.02 0.00 0.00 63.50 61.83 2bkh n PRO 10 Cb 0.58 -2.47 -0.15 0.00 -0.02 0.00 0.00 33.50 31.44 2bkh n PRO 10 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2bkh s HIS 11 N -1.22 0.30 0.42 6.00 2.46 -0.68 -4.60 115.29 117.98 2bkh s HIS 11 Ca 0.63 -0.03 0.08 0.00 0.47 0.00 0.00 55.06 56.21 2bkh s HIS 11 Cb -0.48 -0.30 0.91 0.00 -0.13 0.00 0.00 32.58 32.58 2bkh s HIS 11 CO 0.56 -0.07 2.07 -1.00 -2.47 0.00 0.00 174.74 173.83 2bkh h PRO 12 N 6.68 0.48 0.00 2.88 0.13 -1.96 -2.21 132.00 137.99 2bkh h PRO 12 Ca -0.35 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 64.68 2bkh h PRO 12 Cb 1.17 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 2bkh h PRO 12 CO 0.49 0.32 -1.39 0.25 -0.23 0.00 0.00 178.00 177.44 2bkh n THR 13 N -4.48 0.28 1.02 1.56 -2.24 -1.26 -4.61 114.28 104.55 2bkh n THR 13 Ca 0.03 -0.23 0.12 0.00 -2.27 0.00 0.00 64.05 61.70 2bkh n THR 13 Cb 0.07 -0.43 0.20 0.00 -2.10 0.00 0.00 70.33 68.06 2bkh n THR 13 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2bkh n ASP 14 N -2.06 0.63 0.00 3.42 10.43 -1.25 -1.52 116.55 126.19 2bkh n ASP 14 Ca -0.07 -0.42 0.00 0.00 2.57 0.00 0.00 54.79 56.87 2bkh n ASP 14 Cb 0.52 0.36 0.00 0.00 1.84 0.00 0.00 41.12 43.85 2bkh n ASP 14 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2bkh n GLY 15 N 1.49 2.01 3.23 0.44 0.00 -0.83 -3.66 105.19 107.87 2bkh n GLY 15 Ca 0.06 -0.27 -0.15 0.00 0.00 0.00 0.00 46.02 45.66 2bkh n GLY 15 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bkh s PHE 16 N 0.00 1.22 0.05 1.61 0.08 -1.26 -1.68 117.98 118.00 2bkh s PHE 16 Ca 0.00 -0.71 0.01 0.00 0.12 0.00 0.00 56.93 56.35 2bkh s PHE 16 Cb 0.00 -0.64 -0.03 0.00 -0.57 0.00 0.00 43.02 41.78 2bkh s PHE 16 CO 0.00 0.06 -0.06 1.14 -0.10 0.00 0.00 175.22 176.27 2bkh s GLN 17 N -3.38 0.57 0.19 0.44 -2.07 0.04 -4.71 119.66 110.75 2bkh s GLN 17 Ca 0.13 -0.95 -0.23 0.00 -1.82 0.00 0.00 55.36 52.49 2bkh s GLN 17 Cb 0.00 -0.10 -0.08 0.00 -1.09 0.00 0.00 33.01 31.74 2bkh s GLN 17 CO 0.01 -0.02 0.74 0.54 -1.32 0.00 0.00 175.29 175.24 2bkh s VAL 18 N -2.40 4.47 0.37 3.63 0.11 -1.26 -1.41 120.40 123.91 2bkh s VAL 18 Ca -0.03 1.50 -0.17 0.00 -2.93 0.00 0.00 61.98 60.35 2bkh s VAL 18 Cb -0.03 -4.00 0.05 0.00 -1.53 0.00 0.00 36.38 30.87 2bkh s VAL 18 CO -0.03 0.38 0.80 -0.83 -3.33 0.00 0.00 175.10 172.09 2bkh s GLY 19 N -1.37 0.31 0.12 6.54 0.00 -0.54 -2.45 107.32 109.93 2bkh s GLY 19 Ca 0.39 -0.69 0.10 0.00 0.00 0.00 0.00 44.72 44.52 2bkh s GLY 19 CO 0.23 -0.17 -0.26 -1.31 0.00 0.00 0.00 173.10 171.60 2bkh s ASN 20 N -3.07 3.18 -0.28 1.64 -0.87 -0.43 -1.45 114.94 113.66 2bkh s ASN 20 Ca 0.15 -0.72 -0.25 0.00 -1.57 0.00 0.00 52.86 50.48 2bkh s ASN 20 Cb -0.05 -0.22 0.00 0.00 -0.02 0.00 0.00 41.25 40.96 2bkh s ASN 20 CO 0.11 0.17 0.84 -0.63 -2.57 0.00 0.00 177.10 175.02 2bkh s ILE 21 N -1.04 4.78 -0.01 0.60 1.01 -1.26 -1.01 121.20 124.26 2bkh s ILE 21 Ca 0.13 1.41 0.10 0.00 0.00 0.00 0.00 60.65 62.29 2bkh s ILE 21 Cb -0.10 -4.17 -0.15 0.00 0.01 0.00 0.00 42.46 38.05 2bkh s ILE 21 CO 0.05 -0.20 0.21 1.33 0.00 0.00 0.00 174.94 176.33 2bkh n VAL 22 N 5.46 0.01 -3.83 2.92 0.24 -0.62 -4.99 118.33 117.52 2bkh n VAL 22 Ca 0.06 -0.23 -0.10 0.00 -2.04 0.00 0.00 64.34 62.03 2bkh n VAL 22 Cb 0.48 0.26 -0.07 0.00 -1.47 0.00 0.00 33.84 33.04 2bkh n VAL 22 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2bkh s ASP 23 N -3.14 0.05 0.17 -1.34 3.68 -1.23 -5.01 116.67 109.85 2bkh s ASP 23 Ca -0.04 -0.50 0.11 0.00 2.13 0.00 0.00 52.55 54.25 2bkh s ASP 23 Cb 0.06 0.34 -0.04 0.00 -1.45 0.00 0.00 42.92 41.83 2bkh s ASP 23 CO 0.41 -0.68 -0.24 -0.63 0.13 0.00 0.00 175.17 174.16 2bkh s ILE 24 N -3.38 2.40 0.31 4.11 1.01 -1.26 -1.04 121.20 123.35 2bkh s ILE 24 Ca 0.01 -1.92 0.06 0.00 0.00 0.00 0.00 60.65 58.80 2bkh s ILE 24 Cb 0.02 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2bkh s ILE 24 CO -0.08 -0.05 0.25 -0.83 0.00 0.00 0.00 174.94 174.22 2bkh s GLY 25 N -2.50 2.19 0.19 6.18 0.00 -0.32 -4.91 107.32 108.14 2bkh s GLY 25 Ca 0.19 -1.98 -0.11 0.00 0.00 0.00 0.00 44.72 42.82 2bkh s GLY 25 CO 0.09 -1.48 1.82 -0.56 0.00 0.00 0.00 173.10 172.97 2bkh h PRO 26 N 2.21 0.93 0.00 2.90 0.13 -2.02 -3.28 132.00 132.87 2bkh h PRO 26 Ca -0.27 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2bkh h PRO 26 Cb 1.24 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2bkh h PRO 26 CO 0.40 0.68 -0.28 -0.40 -0.23 0.00 0.00 178.00 178.17 2bkh n ASP 27 N -4.53 0.66 -4.12 1.44 5.75 -1.26 -5.09 116.55 109.40 2bkh n ASP 27 Ca 0.05 -2.11 -0.09 0.00 -0.01 0.00 0.00 54.79 52.63 2bkh n ASP 27 Cb 0.08 -0.21 -0.10 0.00 -1.03 0.00 0.00 41.12 39.86 2bkh n ASP 27 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2bkh s SER 28 N -1.29 0.30 0.03 -1.12 1.04 -1.24 -2.51 113.70 108.91 2bkh s SER 28 Ca 0.07 -1.14 0.03 0.00 0.48 0.00 0.00 55.95 55.40 2bkh s SER 28 Cb 0.06 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.47 2bkh s SER 28 CO 0.01 -0.73 -0.10 -0.76 0.98 0.00 0.00 173.24 172.64 2bkh s LEU 29 N -3.02 2.16 -0.24 2.42 1.43 0.43 -1.18 118.68 120.68 2bkh s LEU 29 Ca 0.21 -0.40 -0.12 0.00 -1.03 0.00 0.00 54.13 52.78 2bkh s LEU 29 Cb 0.07 -0.39 -0.05 0.00 0.03 0.00 0.00 46.19 45.85 2bkh s LEU 29 CO -0.00 -0.03 0.25 -0.89 0.23 0.00 0.00 176.35 175.91 2bkh s THR 30 N -0.84 5.29 -0.13 5.49 2.01 -0.21 -1.56 115.64 125.69 2bkh s THR 30 Ca -0.02 0.35 -0.02 0.00 0.31 0.00 0.00 61.69 62.31 2bkh s THR 30 Cb -0.07 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 68.83 2bkh s THR 30 CO 0.01 0.28 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.50 2bkh s ILE 31 N 1.41 3.52 -0.36 1.82 -1.09 -0.42 -1.59 121.20 124.48 2bkh s ILE 31 Ca 0.11 -0.50 -0.11 0.00 -2.23 0.00 0.00 60.65 57.91 2bkh s ILE 31 Cb -0.15 -2.50 0.01 0.00 -1.58 0.00 0.00 42.46 38.25 2bkh s ILE 31 CO 0.07 0.52 0.21 -0.70 -1.23 0.00 0.00 174.94 173.82 2bkh s GLU 32 N 0.18 3.03 0.47 2.79 2.12 -0.18 -1.94 118.70 125.17 2bkh s GLU 32 Ca -0.04 -0.95 -0.24 0.00 0.36 0.00 0.00 54.97 54.10 2bkh s GLU 32 Cb -0.14 -3.74 -0.07 0.00 0.26 0.00 0.00 34.13 30.43 2bkh s GLU 32 CO 0.04 -0.62 1.34 -2.14 -0.54 0.00 0.00 175.26 173.34 2bkh s PRO 33 N 1.60 3.61 0.21 4.30 0.02 -1.26 -1.31 135.00 142.18 2bkh s PRO 33 Ca 0.03 2.22 -0.08 0.00 0.02 0.00 0.00 61.00 63.20 2bkh s PRO 33 Cb -0.18 -2.54 0.16 0.00 0.02 0.00 0.00 34.50 31.96 2bkh s PRO 33 CO 0.07 -0.81 1.78 -0.07 -0.33 0.00 0.00 177.00 177.65 2bkh h LEU 34 N 2.14 1.11 -3.10 -5.54 3.38 -1.83 -2.84 115.31 108.62 2bkh h LEU 34 Ca -0.50 -0.17 -0.28 0.00 0.09 0.00 0.00 57.88 57.02 2bkh h LEU 34 Cb 1.27 -0.29 -0.15 0.00 0.09 0.00 0.00 40.66 41.58 2bkh h LEU 34 CO 0.60 0.98 0.35 0.59 0.09 0.00 0.00 178.44 181.05 2bkh n ASN 35 N -4.28 4.06 0.00 -0.43 3.02 -1.26 -4.21 115.26 112.16 2bkh n ASN 35 Ca 0.07 -2.86 0.00 0.00 -0.03 0.00 0.00 54.58 51.76 2bkh n ASN 35 Cb 0.18 -0.75 0.00 0.00 -0.61 0.00 0.00 39.78 38.60 2bkh n ASN 35 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 2bkh n GLN 36 N -0.19 0.00 -2.73 3.52 -0.06 -1.25 -5.11 117.38 111.55 2bkh n GLN 36 Ca 0.30 0.00 -0.05 0.00 -2.00 0.00 0.00 57.00 55.26 2bkh n GLN 36 Cb 0.98 0.00 0.01 0.00 -4.06 0.00 0.00 30.24 27.16 2bkh n GLN 36 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 2bkh n LYS 37 N -1.05 -1.75 0.00 3.69 4.81 -1.07 -4.69 118.16 118.10 2bkh n LYS 37 Ca 0.00 1.73 0.00 0.00 -0.87 0.00 0.00 58.31 59.17 2bkh n LYS 37 Cb 0.00 -5.16 0.00 0.00 0.02 0.00 0.00 35.03 29.89 2bkh n LYS 37 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2bkh n GLY 38 N -0.79 1.37 2.39 3.14 0.00 -1.26 -5.00 105.19 105.03 2bkh n GLY 38 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 2bkh n GLY 38 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2bkh n LYS 39 N -0.10 3.06 -1.41 1.61 2.85 -1.26 -5.11 118.16 117.81 2bkh n LYS 39 Ca 0.00 -4.16 -0.47 0.00 -1.05 0.00 0.00 58.31 52.63 2bkh n LYS 39 Cb 0.00 -2.08 -0.03 0.00 -0.65 0.00 0.00 35.03 32.27 2bkh n LYS 39 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2bkh n THR 40 N -0.51 1.90 -4.04 0.58 5.66 -1.26 -4.81 114.28 111.80 2bkh n THR 40 Ca 0.34 -0.50 -0.10 0.00 -3.05 0.00 0.00 64.05 60.75 2bkh n THR 40 Cb 0.79 -0.07 -0.08 0.00 -1.55 0.00 0.00 70.33 69.42 2bkh n THR 40 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 2bkh s PHE 41 N -1.06 0.59 0.09 1.09 -0.12 -0.82 -4.98 117.98 112.77 2bkh s PHE 41 Ca 0.63 -0.95 -0.11 0.00 -0.05 0.00 0.00 56.93 56.45 2bkh s PHE 41 Cb -0.89 -0.22 -0.06 0.00 -0.63 0.00 0.00 43.02 41.22 2bkh s PHE 41 CO 0.57 -0.65 0.44 -0.51 -0.05 0.00 0.00 175.22 175.01 2bkh s LEU 42 N -3.00 4.36 -0.02 -1.99 1.43 -1.26 -1.30 118.68 116.89 2bkh s LEU 42 Ca 0.21 0.88 -0.02 0.00 -1.03 0.00 0.00 54.13 54.16 2bkh s LEU 42 Cb 0.05 -3.01 0.00 0.00 0.03 0.00 0.00 46.19 43.27 2bkh s LEU 42 CO 0.01 0.17 0.06 0.00 0.23 0.00 0.00 176.35 176.82 2bkh s ALA 43 N -1.38 -0.14 0.54 4.21 0.00 -0.60 -4.97 121.76 119.42 2bkh s ALA 43 Ca 0.33 0.13 -0.21 0.00 0.00 0.00 0.00 51.96 52.21 2bkh s ALA 43 Cb -0.14 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 2bkh s ALA 43 CO 0.18 -0.04 1.22 -0.51 0.00 0.00 0.00 175.76 176.62 2bkh s LEU 44 N -0.05 3.80 0.29 0.00 1.43 -1.26 -0.43 118.68 122.46 2bkh s LEU 44 Ca -0.01 2.44 -0.01 0.00 -1.03 0.00 0.00 54.13 55.52 2bkh s LEU 44 Cb -0.01 -4.43 0.43 0.00 0.03 0.00 0.00 46.19 42.21 2bkh s LEU 44 CO 0.00 -1.38 1.87 0.40 0.23 0.00 0.00 176.35 177.46 2bkh h ILE 45 N 1.29 1.22 0.00 -0.59 2.04 -1.80 -1.18 117.51 118.49 2bkh h ILE 45 Ca -0.50 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 64.67 2bkh h ILE 45 Cb 1.28 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 2bkh h ILE 45 CO 0.57 0.27 0.00 -0.46 0.00 0.00 0.00 178.15 178.53 2bkh n ASN 46 N -4.31 0.00 -0.95 1.72 0.23 -1.26 -2.45 115.26 108.24 2bkh n ASN 46 Ca 0.05 -0.51 0.10 0.00 -0.53 0.00 0.00 54.58 53.68 2bkh n ASN 46 Cb 0.17 -0.12 0.18 0.00 -2.08 0.00 0.00 39.78 37.93 2bkh n ASN 46 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2bkh n GLN 47 N -1.12 2.25 -4.69 -3.83 6.02 -0.45 -4.93 117.38 110.63 2bkh n GLN 47 Ca 0.17 -2.07 -0.33 0.00 -0.01 0.00 0.00 57.00 54.76 2bkh n GLN 47 Cb 0.14 -1.42 -0.13 0.00 1.02 0.00 0.00 30.24 29.85 2bkh n GLN 47 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2bkh s VAL 48 N -1.29 3.35 0.05 5.09 1.01 -1.03 -4.13 120.40 123.45 2bkh s VAL 48 Ca 0.32 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.77 2bkh s VAL 48 Cb 0.19 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 2bkh s VAL 48 CO 0.26 0.54 -0.13 -0.36 0.00 0.00 0.00 175.10 175.41 2bkh s PHE 49 N -0.03 1.14 0.54 5.22 0.40 -0.58 -4.98 117.98 119.68 2bkh s PHE 49 Ca -0.02 -0.41 -0.20 0.00 -0.60 0.00 0.00 56.93 55.71 2bkh s PHE 49 Cb -0.14 -0.66 -0.06 0.00 0.51 0.00 0.00 43.02 42.67 2bkh s PHE 49 CO 0.03 0.03 1.12 -1.25 0.70 0.00 0.00 175.22 175.86 2bkh s PRO 50 N -1.43 3.39 0.03 0.24 0.04 -1.26 -0.27 135.00 135.73 2bkh s PRO 50 Ca -0.01 1.60 0.06 0.00 0.04 0.00 0.00 61.00 62.68 2bkh s PRO 50 Cb -0.09 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2bkh s PRO 50 CO 0.02 -0.82 -0.14 0.00 0.04 0.00 0.00 177.00 176.10 2bkh s ALA 51 N -1.78 2.74 0.13 8.56 0.00 -1.19 -4.65 121.76 125.56 2bkh s ALA 51 Ca 0.72 -1.13 -0.31 0.00 0.00 0.00 0.00 51.96 51.24 2bkh s ALA 51 Cb -0.23 -0.87 -0.10 0.00 0.00 0.00 0.00 23.12 21.91 2bkh s ALA 51 CO 0.26 0.59 1.77 -2.00 0.00 0.00 0.00 175.76 176.38 2bkh s GLU 52 N -1.43 4.15 0.20 0.00 2.56 -1.26 -4.92 118.70 118.00 2bkh s GLU 52 Ca 0.16 2.54 -0.12 0.00 0.00 0.00 0.00 54.97 57.55 2bkh s GLU 52 Cb -0.11 -3.49 0.26 0.00 2.00 0.00 0.00 34.13 32.79 2bkh s GLU 52 CO 0.06 -0.80 1.67 0.93 -0.56 0.00 0.00 175.26 176.56 2bkh h GLU 53 N 8.19 0.12 -5.57 4.30 4.39 -1.98 -3.37 114.58 120.65 2bkh h GLU 53 Ca -0.45 -0.01 -0.63 0.00 0.34 0.00 0.00 59.36 58.61 2bkh h GLU 53 Cb 1.21 -0.03 -0.14 0.00 -0.10 0.00 0.00 28.75 29.70 2bkh h GLU 53 CO 0.94 0.08 0.42 0.34 -1.16 0.00 0.00 179.01 179.64 2bkh s ASP 54 N -5.24 6.29 0.00 1.42 3.68 -1.26 -4.90 116.67 116.65 2bkh s ASP 54 Ca -0.13 -0.57 0.26 0.00 2.13 0.00 0.00 52.55 54.24 2bkh s ASP 54 Cb 0.18 -2.40 1.21 0.00 -1.45 0.00 0.00 42.92 40.47 2bkh s ASP 54 CO 0.73 -1.16 1.87 -1.54 0.13 0.00 0.00 175.17 175.20 2bkh n SER 55 N 7.14 0.00 -0.06 -0.34 3.41 -1.26 -3.11 113.62 119.40 2bkh n SER 55 Ca -0.01 0.26 0.07 0.00 -0.26 0.00 0.00 58.87 58.93 2bkh n SER 55 Cb 0.47 -0.42 -0.07 0.00 -0.26 0.00 0.00 64.21 63.93 2bkh n SER 55 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2bkh n LYS 56 N -1.42 2.17 -1.99 4.33 4.76 -1.26 -4.99 118.16 119.76 2bkh n LYS 56 Ca 0.09 -0.14 -0.39 0.00 -2.87 0.00 0.00 58.31 55.00 2bkh n LYS 56 Cb 0.27 -1.19 0.01 0.00 -1.84 0.00 0.00 35.03 32.28 2bkh n LYS 56 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2bkh s LYS 57 N -2.26 3.74 0.01 1.97 2.20 -1.18 -5.05 119.74 119.18 2bkh s LYS 57 Ca 0.07 2.16 -0.00 0.00 -0.36 0.00 0.00 55.97 57.84 2bkh s LYS 57 Cb 0.11 -2.60 -0.01 0.00 -1.51 0.00 0.00 37.83 33.82 2bkh s LYS 57 CO 0.55 -0.68 -0.01 0.16 -0.36 0.00 0.00 175.35 175.01 2bkh s ASP 58 N -0.82 0.09 0.12 1.43 3.84 -1.26 -4.93 116.67 115.14 2bkh s ASP 58 Ca 0.61 -0.18 0.09 0.00 -0.00 0.00 0.00 52.55 53.07 2bkh s ASP 58 Cb -0.38 0.04 -0.04 0.00 -1.38 0.00 0.00 42.92 41.16 2bkh s ASP 58 CO 0.48 -0.11 -0.23 0.68 -0.00 0.00 0.00 175.17 175.99 2bkh s VAL 59 N -0.54 1.91 0.14 2.11 -7.23 -1.26 -5.04 120.40 110.49 2bkh s VAL 59 Ca -0.06 -1.66 -0.02 0.00 -1.81 0.00 0.00 61.98 58.44 2bkh s VAL 59 Cb -0.04 -1.73 -0.17 0.00 0.56 0.00 0.00 36.38 35.00 2bkh s VAL 59 CO -0.00 -0.04 1.32 -0.33 -0.31 0.00 0.00 175.10 175.74 2bkh h GLU 60 N 3.92 0.31 -5.10 4.82 5.08 -1.95 -3.41 114.58 118.24 2bkh h GLU 60 Ca -0.47 -0.35 -0.67 0.00 -1.00 0.00 0.00 59.36 56.87 2bkh h GLU 60 Cb 1.18 0.10 -0.34 0.00 0.50 0.00 0.00 28.75 30.19 2bkh h GLU 60 CO 0.41 1.05 -0.85 0.34 -1.00 0.00 0.00 179.01 178.96 2bkh s ASP 61 N -7.02 3.25 0.53 1.42 3.68 -1.26 -0.78 116.67 116.48 2bkh s ASP 61 Ca -0.04 -0.61 0.35 0.00 2.13 0.00 0.00 52.55 54.38 2bkh s ASP 61 Cb 0.09 -1.50 1.76 0.00 -1.45 0.00 0.00 42.92 41.83 2bkh s ASP 61 CO 0.85 0.03 2.07 0.78 0.13 0.00 0.00 175.17 179.03 2bkh h ASN 62 N 7.74 0.00 0.38 -0.34 2.35 -1.27 -0.19 115.58 124.24 2bkh h ASN 62 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 2bkh h ASN 62 Cb 1.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.53 2bkh h ASN 62 CO 0.61 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.39 2bkh h SER 64 N 0.00 0.00 -4.21 0.00 0.02 -1.11 -1.26 113.55 106.99 2bkh h SER 64 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2bkh h SER 64 Cb 0.19 0.00 0.15 0.00 0.14 0.00 0.00 62.40 62.88 2bkh h SER 64 CO 0.00 0.00 0.35 -0.76 -1.14 0.00 0.00 176.83 175.28 2bkh s LEU 65 N -4.83 3.22 0.25 5.07 1.43 -0.83 -4.84 118.68 118.16 2bkh s LEU 65 Ca 0.08 2.22 0.15 0.00 -1.03 0.00 0.00 54.13 55.54 2bkh s LEU 65 Cb 0.10 -4.57 0.03 0.00 0.03 0.00 0.00 46.19 41.78 2bkh s LEU 65 CO 0.54 -2.27 1.37 0.24 0.23 0.00 0.00 176.35 176.46 2bkh h MET 66 N -0.58 0.00 -4.00 1.70 2.86 -1.88 -3.42 114.93 109.61 2bkh h MET 66 Ca -0.46 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 56.65 2bkh h MET 66 Cb 1.28 0.00 -0.38 0.00 0.06 0.00 0.00 31.60 32.55 2bkh h MET 66 CO 0.49 0.52 -0.78 0.71 1.06 0.00 0.00 176.91 178.90 2bkh s TYR 67 N -2.94 1.44 -0.55 -0.22 1.51 -1.26 -4.28 117.35 111.05 2bkh s TYR 67 Ca 0.03 -0.91 -0.17 0.00 -1.01 0.00 0.00 57.07 55.01 2bkh s TYR 67 Cb 0.08 -1.19 0.12 0.00 -0.11 0.00 0.00 41.96 40.86 2bkh s TYR 67 CO 0.76 -0.57 0.55 -1.17 -1.11 0.00 0.00 175.55 174.00 2bkh s LEU 68 N 1.72 6.01 0.25 -1.29 2.96 -1.26 -4.76 118.68 122.31 2bkh s LEU 68 Ca 0.01 -1.71 -0.04 0.00 -0.22 0.00 0.00 54.13 52.17 2bkh s LEU 68 Cb -0.15 -2.23 -0.02 0.00 0.50 0.00 0.00 46.19 44.29 2bkh s LEU 68 CO -0.07 -0.92 0.31 0.54 -1.32 0.00 0.00 176.35 174.89 2bkh s ASN 69 N 3.61 0.35 0.54 3.68 2.20 -1.26 -4.97 114.94 119.08 2bkh s ASN 69 Ca 0.05 -1.29 0.21 0.00 -0.94 0.00 0.00 52.86 50.89 2bkh s ASN 69 Cb -0.29 0.51 1.46 0.00 -2.00 0.00 0.00 41.25 40.93 2bkh s ASN 69 CO 0.04 -1.04 2.17 1.05 -2.94 0.00 0.00 177.10 176.38 2bkh h GLU 70 N 2.37 0.00 0.17 3.55 4.11 -1.95 0.47 114.58 123.31 2bkh h GLU 70 Ca -0.30 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 58.87 2bkh h GLU 70 Cb 1.25 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.53 2bkh h GLU 70 CO 0.43 0.02 -1.11 0.00 0.07 0.00 0.00 179.01 178.43 2bkh h ALA 71 N 1.98 -0.10 -0.12 1.06 0.00 -1.97 -2.30 119.26 117.81 2bkh h ALA 71 Ca -0.00 -0.76 -0.15 0.00 0.00 0.00 0.00 54.91 54.00 2bkh h ALA 71 Cb 0.05 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2bkh h ALA 71 CO 0.00 0.53 -0.57 1.79 0.00 0.00 0.00 179.25 181.01 2bkh h THR 72 N -0.07 1.35 -0.02 0.00 1.35 -1.74 -1.96 112.91 111.82 2bkh h THR 72 Ca -0.19 -1.87 -0.00 0.00 -0.55 0.00 0.00 66.41 63.81 2bkh h THR 72 Cb 1.86 1.88 -0.00 0.00 -1.73 0.00 0.00 68.15 70.16 2bkh h THR 72 CO 0.21 0.56 0.01 0.25 -0.25 0.00 0.00 175.52 176.30 2bkh h LEU 73 N 0.28 0.03 -0.52 3.87 5.85 -1.01 -0.43 115.31 123.37 2bkh h LEU 73 Ca 0.00 -0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.73 2bkh h LEU 73 Cb 1.08 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.04 2bkh h LEU 73 CO 0.10 0.09 0.16 0.25 -0.34 0.00 0.00 178.44 178.69 2bkh h LEU 74 N -0.04 0.11 -0.52 2.25 5.85 -1.29 -1.62 115.31 120.04 2bkh h LEU 74 Ca 0.01 0.08 -0.15 0.00 0.84 0.00 0.00 57.88 58.65 2bkh h LEU 74 Cb 0.07 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2bkh h LEU 74 CO -0.00 0.09 -0.41 -0.74 -0.34 0.00 0.00 178.44 177.03 2bkh h HIS 75 N 0.31 0.89 -0.66 1.25 2.76 -1.29 -1.66 115.15 116.76 2bkh h HIS 75 Ca 0.26 -0.27 -0.07 0.00 -2.20 0.00 0.00 60.37 58.09 2bkh h HIS 75 Cb 0.32 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 29.07 2bkh h HIS 75 CO -0.19 1.03 0.13 -0.97 -1.30 0.00 0.00 177.93 176.63 2bkh h ASN 76 N 0.60 1.02 1.68 3.26 -1.24 -0.54 -2.05 115.58 118.31 2bkh h ASN 76 Ca 0.05 -0.25 -0.01 0.00 0.71 0.00 0.00 56.30 56.80 2bkh h ASN 76 Cb 0.96 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 39.74 2bkh h ASN 76 CO 0.09 1.01 -0.04 0.16 -1.29 0.00 0.00 177.43 177.36 2bkh h ILE 77 N 0.99 0.08 -0.05 2.57 3.07 -1.15 -2.54 117.51 120.48 2bkh h ILE 77 Ca 0.20 -0.96 -0.01 0.00 1.55 0.00 0.00 64.86 65.64 2bkh h ILE 77 Cb 0.40 1.90 -0.00 0.00 -0.27 0.00 0.00 36.82 38.85 2bkh h ILE 77 CO 0.01 0.04 -0.00 0.50 -1.05 0.00 0.00 178.15 177.65 2bkh h LYS 78 N 0.00 0.09 -0.75 0.16 3.64 -0.93 -0.66 116.57 118.11 2bkh h LYS 78 Ca -0.00 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 2bkh h LYS 78 Cb 0.89 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 2bkh h LYS 78 CO 0.01 0.39 0.27 0.28 -2.27 0.00 0.00 179.45 178.13 2bkh h VAL 79 N -0.22 1.26 -0.28 2.00 2.07 -1.29 -1.10 116.25 118.69 2bkh h VAL 79 Ca 0.01 -0.84 -0.17 0.00 0.82 0.00 0.00 66.70 66.52 2bkh h VAL 79 Cb 0.35 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2bkh h VAL 79 CO 0.00 0.34 -0.49 0.03 0.02 0.00 0.00 177.57 177.47 2bkh h ARG 80 N 1.10 0.76 -0.79 1.57 3.08 -1.48 -3.01 114.38 115.62 2bkh h ARG 80 Ca 0.25 -0.45 -0.03 0.00 0.07 0.00 0.00 59.98 59.82 2bkh h ARG 80 Cb 0.25 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.30 2bkh h ARG 80 CO -0.02 1.08 0.38 -0.92 -1.07 0.00 0.00 179.97 179.42 2bkh h TYR 81 N 0.60 1.13 0.00 3.04 3.20 -0.50 0.13 116.97 124.57 2bkh h TYR 81 Ca 0.03 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 2bkh h TYR 81 Cb 1.07 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.98 2bkh h TYR 81 CO 0.06 0.82 -0.08 0.66 -1.64 0.00 0.00 178.16 177.98 2bkh h SER 82 N 1.12 0.00 -0.47 -2.11 4.64 -1.17 -1.32 113.55 114.25 2bkh h SER 82 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2bkh h SER 82 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2bkh h SER 82 CO -0.03 0.08 0.00 0.29 -0.87 0.00 0.00 176.83 176.29 2bkh n LYS 83 N -4.19 3.66 -1.56 4.77 5.02 -0.83 -4.94 118.16 120.10 2bkh n LYS 83 Ca -0.03 -2.35 -0.19 0.00 -2.02 0.00 0.00 58.31 53.72 2bkh n LYS 83 Cb 0.16 -1.96 -0.08 0.00 -0.02 0.00 0.00 35.03 33.13 2bkh n LYS 83 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2bkh n ASP 84 N 0.63 -5.56 -4.42 4.39 10.43 -0.50 -4.94 116.55 116.59 2bkh n ASP 84 Ca 0.21 0.47 -0.44 0.00 2.57 0.00 0.00 54.79 57.60 2bkh n ASP 84 Cb 0.88 -4.74 -0.04 0.00 1.84 0.00 0.00 41.12 39.06 2bkh n ASP 84 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 2bkh s ARG 85 N -3.62 3.27 0.01 -1.24 0.52 0.39 -4.85 118.95 113.43 2bkh s ARG 85 Ca 0.00 -1.39 0.27 0.00 -0.52 0.00 0.00 55.73 54.09 2bkh s ARG 85 Cb 0.00 -4.46 0.88 0.00 0.52 0.00 0.00 34.95 31.89 2bkh s ARG 85 CO 0.00 -1.68 1.68 0.44 0.02 0.00 0.00 175.30 175.77 2bkh n ILE 86 N 5.53 0.03 -4.67 1.52 -5.35 -1.26 -3.37 119.36 111.79 2bkh n ILE 86 Ca 0.04 -0.02 -0.33 0.00 -0.27 0.00 0.00 62.75 62.17 2bkh n ILE 86 Cb 0.46 -0.17 -0.13 0.00 -1.74 0.00 0.00 39.64 38.05 2bkh n ILE 86 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2bkh s TYR 87 N -3.01 2.87 -0.13 4.28 4.12 -1.26 -1.28 117.35 122.94 2bkh s TYR 87 Ca 0.12 -0.32 -0.14 0.00 0.02 0.00 0.00 57.07 56.75 2bkh s TYR 87 Cb 0.18 -1.80 0.04 0.00 -1.52 0.00 0.00 41.96 38.86 2bkh s TYR 87 CO 0.61 0.03 0.39 0.99 0.02 0.00 0.00 175.55 177.59 2bkh s THR 88 N -0.11 0.01 0.17 -0.71 2.01 -0.55 -4.66 115.64 111.80 2bkh s THR 88 Ca -0.00 -0.05 -0.04 0.00 0.31 0.00 0.00 61.69 61.91 2bkh s THR 88 Cb -0.13 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.75 2bkh s THR 88 CO 0.03 -0.03 0.40 -0.31 -0.69 0.00 0.00 174.62 174.02 2bkh s TYR 89 N 0.01 3.48 -0.35 4.92 4.12 0.04 0.45 117.35 130.02 2bkh s TYR 89 Ca -0.02 0.52 0.00 0.00 0.02 0.00 0.00 57.07 57.59 2bkh s TYR 89 Cb -0.03 -1.98 0.09 0.00 -1.52 0.00 0.00 41.96 38.52 2bkh s TYR 89 CO 0.01 0.40 0.08 0.08 0.02 0.00 0.00 175.55 176.14 2bkh s VAL 90 N -1.74 2.75 0.00 0.71 1.01 -0.32 -0.92 120.40 121.89 2bkh s VAL 90 Ca 0.41 -2.02 0.00 0.00 0.00 0.00 0.00 61.98 60.37 2bkh s VAL 90 Cb -0.12 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2bkh s VAL 90 CO 0.26 -0.50 0.00 0.00 0.00 0.00 0.00 175.10 174.86 2bkh n ALA 91 N 4.45 0.00 1.12 5.51 0.00 -1.26 -0.89 120.51 129.45 2bkh n ALA 91 Ca -0.03 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.53 2bkh n ALA 91 Cb 0.42 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.05 2bkh n ALA 91 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2bkh n ASN 92 N 8.70 1.94 -4.74 0.00 3.02 -1.26 -4.92 115.26 117.99 2bkh n ASN 92 Ca 0.00 -1.47 -0.41 0.00 -0.03 0.00 0.00 54.58 52.67 2bkh n ASN 92 Cb 0.00 0.23 -0.05 0.00 -0.61 0.00 0.00 39.78 39.36 2bkh n ASN 92 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bkh s ILE 93 N -2.32 4.17 -0.24 2.41 1.01 -0.06 -4.62 121.20 121.54 2bkh s ILE 93 Ca 0.24 1.97 -0.08 0.00 0.00 0.00 0.00 60.65 62.78 2bkh s ILE 93 Cb 0.19 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 2bkh s ILE 93 CO 0.47 0.38 0.09 -0.22 0.00 0.00 0.00 174.94 175.66 2bkh s LEU 94 N -0.60 3.65 -0.10 2.97 2.96 -0.49 -1.17 118.68 125.90 2bkh s LEU 94 Ca 0.45 -0.09 -0.14 0.00 -0.22 0.00 0.00 54.13 54.13 2bkh s LEU 94 Cb -0.26 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.41 2bkh s LEU 94 CO 0.32 0.02 0.35 -0.63 -1.32 0.00 0.00 176.35 175.09 2bkh s ILE 95 N 1.30 5.22 -0.18 6.68 -1.09 0.17 -0.25 121.20 133.05 2bkh s ILE 95 Ca 0.05 0.68 -0.04 0.00 -2.23 0.00 0.00 60.65 59.12 2bkh s ILE 95 Cb -0.15 -3.67 0.06 0.00 -1.58 0.00 0.00 42.46 37.12 2bkh s ILE 95 CO 0.04 0.45 0.05 0.00 -1.23 0.00 0.00 174.94 174.26 2bkh s ALA 96 N -0.09 0.79 -0.25 9.38 0.00 -0.14 -1.48 121.76 129.97 2bkh s ALA 96 Ca 0.20 -0.54 -0.13 0.00 0.00 0.00 0.00 51.96 51.49 2bkh s ALA 96 Cb -0.14 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.82 2bkh s ALA 96 CO 0.08 -1.15 0.26 0.08 0.00 0.00 0.00 175.76 175.03 2bkh s VAL 97 N 1.96 5.27 -0.03 0.00 1.01 -0.40 -0.93 120.40 127.27 2bkh s VAL 97 Ca 0.00 0.37 -0.31 0.00 0.00 0.00 0.00 61.98 62.04 2bkh s VAL 97 Cb -0.17 -3.60 -0.10 0.00 0.00 0.00 0.00 36.38 32.52 2bkh s VAL 97 CO -0.08 0.26 1.98 -3.20 0.00 0.00 0.00 175.10 174.05 2bkh n ASN 98 N 4.77 3.84 0.17 3.32 2.85 -0.68 -4.75 115.26 124.77 2bkh n ASN 98 Ca -0.12 0.85 0.03 0.00 -0.11 0.00 0.00 54.58 55.24 2bkh n ASN 98 Cb 0.52 -1.48 0.28 0.00 1.24 0.00 0.00 39.78 40.34 2bkh n ASN 98 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2bkh h PRO 99 N 10.61 0.00 -2.90 1.20 0.13 -1.95 -3.41 132.00 135.68 2bkh h PRO 99 Ca -0.48 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.24 2bkh h PRO 99 Cb 1.25 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 2bkh h PRO 99 CO 0.95 0.46 -0.50 0.66 -0.23 0.00 0.00 178.00 179.33 2bkh n TYR 100 N -3.62 -0.95 -3.53 1.56 0.53 -1.26 -4.26 117.16 105.62 2bkh n TYR 100 Ca -0.01 0.00 -0.11 0.00 -1.02 0.00 0.00 57.90 56.77 2bkh n TYR 100 Cb 0.55 -3.83 -0.02 0.00 -1.03 0.00 0.00 39.34 35.00 2bkh n TYR 100 CO 0.00 0.00 0.00 -0.59 -1.02 0.00 0.00 176.86 175.25 2bkh s PHE 101 N -2.98 -0.44 -0.51 -0.72 -0.12 -1.26 -4.50 117.98 107.45 2bkh s PHE 101 Ca 0.00 0.17 -0.25 0.00 -0.05 0.00 0.00 56.93 56.80 2bkh s PHE 101 Cb 0.00 0.57 0.03 0.00 -0.63 0.00 0.00 43.02 43.00 2bkh s PHE 101 CO 0.00 -0.92 0.97 -0.51 -0.05 0.00 0.00 175.22 174.71 2bkh s ASP 102 N -2.79 6.44 -0.08 1.98 1.01 -1.26 -4.99 116.67 116.97 2bkh s ASP 102 Ca 0.03 -0.05 -0.30 0.00 0.71 0.00 0.00 52.55 52.95 2bkh s ASP 102 Cb -0.02 -2.46 -0.03 0.00 1.01 0.00 0.00 42.92 41.42 2bkh s ASP 102 CO -0.09 -1.18 1.23 -0.63 0.21 0.00 0.00 175.17 174.72 2bkh s ILE 103 N 4.00 4.22 0.38 0.77 1.01 -1.26 -4.98 121.20 125.35 2bkh s ILE 103 Ca 0.36 1.54 -0.27 0.00 0.00 0.00 0.00 60.65 62.28 2bkh s ILE 103 Cb -0.11 -3.99 -0.09 0.00 0.01 0.00 0.00 42.46 38.28 2bkh s ILE 103 CO 0.24 -0.03 1.31 -2.16 0.00 0.00 0.00 174.94 174.30 2bkh s PRO 104 N 2.53 4.08 0.00 2.79 0.04 -1.26 -4.10 135.00 139.08 2bkh s PRO 104 Ca 0.56 2.19 0.00 0.00 0.04 0.00 0.00 61.00 63.79 2bkh s PRO 104 Cb -0.24 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.45 2bkh s PRO 104 CO 0.21 -0.41 0.00 0.36 0.04 0.00 0.00 177.00 177.19 2bkh n LYS 105 N 0.32 0.00 0.14 4.56 2.85 -1.26 -4.76 118.16 120.01 2bkh n LYS 105 Ca 0.03 0.00 0.13 0.00 -1.05 0.00 0.00 58.31 57.41 2bkh n LYS 105 Cb 0.43 -1.43 0.49 0.00 -0.65 0.00 0.00 35.03 33.87 2bkh n LYS 105 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 177.40 176.51 2bkh h ILE 106 N 0.00 0.00 -0.19 0.58 3.07 -2.01 -2.85 117.51 116.11 2bkh h ILE 106 Ca 0.00 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 66.09 2bkh h ILE 106 Cb 0.00 1.13 0.00 0.00 -0.27 0.00 0.00 36.82 37.68 2bkh h ILE 106 CO 0.00 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 175.88 2bkh n TYR 107 N -2.35 0.45 -1.68 0.16 4.02 -1.26 -4.81 117.16 111.69 2bkh n TYR 107 Ca 0.03 -0.72 -0.31 0.00 -0.01 0.00 0.00 57.90 56.88 2bkh n TYR 107 Cb 0.28 -0.15 0.04 0.00 -0.02 0.00 0.00 39.34 39.49 2bkh n TYR 107 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2bkh s SER 108 N -1.68 5.55 0.46 7.72 1.04 -1.08 -4.82 113.70 120.90 2bkh s SER 108 Ca 0.27 1.62 0.16 0.00 0.48 0.00 0.00 55.95 58.48 2bkh s SER 108 Cb 0.20 -2.50 1.13 0.00 0.10 0.00 0.00 66.02 64.96 2bkh s SER 108 CO 0.08 -1.33 2.00 0.28 0.98 0.00 0.00 173.24 175.26 2bkh h SER 109 N -0.50 0.25 -0.32 7.02 0.02 -1.96 0.08 113.55 118.13 2bkh h SER 109 Ca -0.44 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.41 2bkh h SER 109 Cb 1.21 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2bkh h SER 109 CO 0.57 0.15 -0.20 -0.08 -1.14 0.00 0.00 176.83 176.14 2bkh h GLU 110 N 0.28 0.70 -0.53 3.45 4.81 -1.93 -1.85 114.58 119.51 2bkh h GLU 110 Ca 0.24 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 2bkh h GLU 110 Cb 0.57 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 2bkh h GLU 110 CO -0.05 0.93 0.21 1.15 -0.73 0.00 0.00 179.01 180.51 2bkh h THR 111 N 0.46 1.22 -0.52 0.32 2.02 -1.48 -1.36 112.91 113.56 2bkh h THR 111 Ca 0.07 -0.68 0.10 0.00 0.77 0.00 0.00 66.41 66.67 2bkh h THR 111 Cb 0.74 0.68 -0.09 0.00 -1.74 0.00 0.00 68.15 67.74 2bkh h THR 111 CO 0.06 0.26 -0.04 0.40 0.37 0.00 0.00 175.52 176.56 2bkh h ILE 112 N 0.71 0.55 -0.64 3.11 2.04 -0.96 -2.06 117.51 120.25 2bkh h ILE 112 Ca 0.18 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.97 2bkh h ILE 112 Cb 0.20 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 2bkh h ILE 112 CO -0.01 0.01 0.25 0.11 0.00 0.00 0.00 178.15 178.51 2bkh h LYS 113 N 0.08 0.96 0.00 2.37 1.57 -1.00 -2.78 116.57 117.77 2bkh h LYS 113 Ca 0.26 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2bkh h LYS 113 Cb 0.41 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2bkh h LYS 113 CO -0.47 0.81 0.00 0.66 -0.57 0.00 0.00 179.45 179.88 2bkh h SER 114 N 0.90 0.00 0.69 0.86 4.64 -0.55 -2.62 113.55 117.48 2bkh h SER 114 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2bkh h SER 114 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2bkh h SER 114 CO -0.02 0.00 -0.80 -1.22 -0.87 0.00 0.00 176.83 173.92 2bkh n TYR 115 N -2.85 0.45 -2.06 4.77 4.01 -1.04 -4.79 117.16 115.66 2bkh n TYR 115 Ca -0.01 0.13 -0.42 0.00 -0.16 0.00 0.00 57.90 57.44 2bkh n TYR 115 Cb 0.15 -0.58 -0.03 0.00 -0.31 0.00 0.00 39.34 38.58 2bkh n TYR 115 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2bkh s GLN 116 N -3.19 4.23 0.00 -0.72 -0.21 -0.99 -2.49 119.66 116.30 2bkh s GLN 116 Ca 0.05 2.17 0.00 0.00 0.02 0.00 0.00 55.36 57.60 2bkh s GLN 116 Cb 0.14 -3.59 0.00 0.00 1.00 0.00 0.00 33.01 30.55 2bkh s GLN 116 CO 0.76 -0.67 0.00 0.41 -2.12 0.00 0.00 175.29 173.67 2bkh n GLY 117 N 3.85 3.04 3.73 3.09 0.00 -1.26 -5.02 105.19 112.62 2bkh n GLY 117 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2bkh n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bkh s LYS 118 N -0.17 4.56 0.54 1.61 -0.14 -1.04 -5.00 119.74 120.09 2bkh s LYS 118 Ca 0.00 1.69 -0.22 0.00 -1.36 0.00 0.00 55.97 56.08 2bkh s LYS 118 Cb 0.00 -3.31 -0.05 0.00 -1.68 0.00 0.00 37.83 32.78 2bkh s LYS 118 CO 0.00 -0.01 1.35 0.43 -0.76 0.00 0.00 175.35 176.37 2bkh n SER 119 N 2.88 2.69 -4.66 2.83 7.64 -1.26 -4.86 113.62 118.87 2bkh n SER 119 Ca 0.04 0.99 -0.42 0.00 1.01 0.00 0.00 58.87 60.49 2bkh n SER 119 Cb 0.47 -1.57 -0.03 0.00 -1.01 0.00 0.00 64.21 62.07 2bkh n SER 119 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2bkh s LEU 120 N -3.30 4.34 0.00 -3.43 0.20 -1.26 -2.01 118.68 113.21 2bkh s LEU 120 Ca 0.71 2.31 0.00 0.00 0.69 0.00 0.00 54.13 57.84 2bkh s LEU 120 Cb -0.42 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 41.80 2bkh s LEU 120 CO 0.50 -0.93 0.00 0.61 -0.29 0.00 0.00 176.35 176.24 2bkh n GLY 121 N 4.15 2.06 0.64 7.98 0.00 -1.26 -4.92 105.19 113.84 2bkh n GLY 121 Ca 0.17 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 2bkh n GLY 121 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bkh n THR 122 N -0.68 0.00 -4.26 2.61 -2.24 -0.85 -4.96 114.28 103.89 2bkh n THR 122 Ca 0.00 -0.37 -0.15 0.00 -2.27 0.00 0.00 64.05 61.26 2bkh n THR 122 Cb 0.00 1.33 -0.10 0.00 -2.10 0.00 0.00 70.33 69.46 2bkh n THR 122 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2bkh s MET 123 N -2.11 1.10 0.61 -0.78 -1.94 -1.26 -5.02 119.30 109.90 2bkh s MET 123 Ca 0.21 -1.47 -0.18 0.00 -1.71 0.00 0.00 55.69 52.53 2bkh s MET 123 Cb 0.17 -0.69 -0.05 0.00 2.01 0.00 0.00 34.83 36.28 2bkh s MET 123 CO 0.42 0.09 0.94 -2.30 -0.01 0.00 0.00 175.02 174.16 2bkh n PRO 124 N -0.22 0.85 -1.61 2.03 -0.02 -1.26 -4.90 135.00 129.86 2bkh n PRO 124 Ca -0.10 0.33 -0.44 0.00 -2.02 0.00 0.00 63.50 61.27 2bkh n PRO 124 Cb 0.61 -2.14 -0.02 0.00 -0.02 0.00 0.00 33.50 31.93 2bkh n PRO 124 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2bkh n PRO 125 N -1.02 1.53 -3.60 0.52 -0.02 -1.26 -4.94 135.00 126.21 2bkh n PRO 125 Ca 0.14 0.54 -0.10 0.00 -2.02 0.00 0.00 63.50 62.05 2bkh n PRO 125 Cb 0.48 -1.97 -0.06 0.00 -0.02 0.00 0.00 33.50 31.93 2bkh n PRO 125 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2bkh s HIS 126 N -0.97 -0.43 0.37 6.00 2.46 -1.26 -4.74 115.29 116.72 2bkh s HIS 126 Ca 0.59 0.89 0.12 0.00 0.47 0.00 0.00 55.06 57.13 2bkh s HIS 126 Cb -0.68 0.41 0.92 0.00 -0.13 0.00 0.00 32.58 33.10 2bkh s HIS 126 CO 0.60 -0.30 1.84 -0.24 -2.47 0.00 0.00 174.74 174.16 2bkh h VAL 127 N 3.04 0.74 -0.54 0.89 3.04 -1.98 -1.95 116.25 119.49 2bkh h VAL 127 Ca -0.23 -0.20 -0.00 0.00 -1.01 0.00 0.00 66.70 65.26 2bkh h VAL 127 Cb 1.17 0.10 -0.03 0.00 -2.01 0.00 0.00 31.29 30.53 2bkh h VAL 127 CO 0.22 0.11 0.34 -0.26 -1.01 0.00 0.00 177.57 176.97 2bkh h PHE 128 N 0.58 0.70 -0.10 3.17 0.04 -1.95 -1.48 116.94 117.90 2bkh h PHE 128 Ca 0.49 0.01 -0.08 0.00 2.80 0.00 0.00 57.97 61.19 2bkh h PHE 128 Cb 0.96 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.87 2bkh h PHE 128 CO -0.00 0.46 -0.29 0.00 -0.60 0.00 0.00 178.31 177.88 2bkh h ALA 129 N 1.63 1.32 -0.17 2.45 0.00 -1.70 -0.85 119.26 121.94 2bkh h ALA 129 Ca 0.20 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2bkh h ALA 129 Cb -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2bkh h ALA 129 CO -0.04 0.47 -0.15 0.82 0.00 0.00 0.00 179.25 180.35 2bkh h ILE 130 N 0.17 1.33 -0.57 0.00 1.08 -1.22 -1.70 117.51 116.61 2bkh h ILE 130 Ca 0.02 -1.28 0.03 0.00 -0.39 0.00 0.00 64.86 63.24 2bkh h ILE 130 Cb 0.61 1.79 -0.04 0.00 -3.07 0.00 0.00 36.82 36.11 2bkh h ILE 130 CO 0.04 0.38 0.34 0.00 -0.69 0.00 0.00 178.15 178.23 2bkh h ALA 131 N 0.64 0.73 -0.18 1.87 0.00 -1.19 -1.73 119.26 119.40 2bkh h ALA 131 Ca 0.03 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2bkh h ALA 131 Cb 0.67 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2bkh h ALA 131 CO 0.04 0.05 -0.42 0.22 0.00 0.00 0.00 179.25 179.14 2bkh h ASP 132 N 0.66 0.45 -0.45 0.00 1.82 -1.18 -0.85 116.42 116.87 2bkh h ASP 132 Ca 0.23 -0.20 -0.06 0.00 -0.39 0.00 0.00 57.03 56.61 2bkh h ASP 132 Cb 0.04 -0.13 -0.02 0.00 0.68 0.00 0.00 39.33 39.91 2bkh h ASP 132 CO -0.11 0.82 0.06 0.50 -1.61 0.00 0.00 179.24 178.90 2bkh h LYS 133 N 0.35 0.76 -0.60 0.28 3.64 -0.93 -0.55 116.57 119.51 2bkh h LYS 133 Ca 0.03 -0.21 0.06 0.00 -1.27 0.00 0.00 60.65 59.25 2bkh h LYS 133 Cb 0.89 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.57 2bkh h LYS 133 CO 0.07 0.79 0.31 0.00 -2.27 0.00 0.00 179.45 178.35 2bkh h ALA 134 N 0.94 0.79 0.25 5.00 0.00 -1.05 -1.67 119.26 123.52 2bkh h ALA 134 Ca 0.14 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2bkh h ALA 134 Cb 0.41 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2bkh h ALA 134 CO 0.01 -0.03 -0.12 0.35 0.00 0.00 0.00 179.25 179.46 2bkh h PHE 135 N 0.58 -0.31 -0.59 0.00 3.04 -0.71 -1.22 116.94 117.74 2bkh h PHE 135 Ca 0.27 -0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.17 2bkh h PHE 135 Cb 0.19 0.10 -0.03 0.00 2.56 0.00 0.00 35.95 38.77 2bkh h PHE 135 CO -0.10 -0.17 0.18 0.00 -2.02 0.00 0.00 178.31 176.20 2bkh h ARG 136 N -0.36 0.89 -0.20 1.11 3.08 -1.00 -1.32 114.38 116.58 2bkh h ARG 136 Ca -0.03 -0.17 -0.14 0.00 0.07 0.00 0.00 59.98 59.71 2bkh h ARG 136 Cb 0.28 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2bkh h ARG 136 CO 0.06 0.77 -0.47 -0.44 -1.07 0.00 0.00 179.97 178.81 2bkh h ASP 137 N 0.86 0.56 -0.40 7.04 3.32 -1.19 -2.12 116.42 124.48 2bkh h ASP 137 Ca 0.19 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.94 2bkh h ASP 137 Cb 0.26 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2bkh h ASP 137 CO -0.01 0.94 0.10 -0.03 -1.72 0.00 0.00 179.24 178.52 2bkh h MET 138 N 0.41 0.63 -0.15 3.56 4.05 -0.54 -0.36 114.93 122.53 2bkh h MET 138 Ca 0.02 -0.15 -0.04 0.00 -0.28 0.00 0.00 59.70 59.25 2bkh h MET 138 Cb 0.98 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 31.70 2bkh h MET 138 CO 0.09 0.66 -0.05 -0.22 0.23 0.00 0.00 176.91 177.61 2bkh h LYS 139 N 0.50 0.31 0.09 0.39 3.64 -1.25 -1.56 116.57 118.68 2bkh h LYS 139 Ca 0.12 -0.13 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 2bkh h LYS 139 Cb 0.31 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2bkh h LYS 139 CO 0.00 0.61 -0.57 0.28 -2.27 0.00 0.00 179.45 177.50 2bkh h VAL 140 N -0.01 1.59 -0.01 2.00 2.07 -1.39 -3.31 116.25 117.19 2bkh h VAL 140 Ca 0.04 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 65.09 2bkh h VAL 140 Cb 0.51 3.24 0.00 0.00 -1.52 0.00 0.00 31.29 33.51 2bkh h VAL 140 CO 0.02 0.67 -0.17 0.18 0.02 0.00 0.00 177.57 178.30 2bkh n LEU 141 N -4.29 0.75 -3.63 2.57 4.77 -0.15 -4.95 117.00 112.08 2bkh n LEU 141 Ca -0.13 -0.13 -0.21 0.00 -0.03 0.00 0.00 56.01 55.51 2bkh n LEU 141 Cb 0.71 -0.15 0.05 0.00 -2.33 0.00 0.00 43.42 41.70 2bkh n LEU 141 CO 0.43 0.14 0.02 0.29 -1.33 0.00 0.00 177.39 176.94 2bkh n LYS 142 N -0.77 -5.69 -3.76 3.23 4.76 -0.61 -4.98 118.16 110.34 2bkh n LYS 142 Ca 0.14 0.70 -0.17 0.00 -2.87 0.00 0.00 58.31 56.11 2bkh n LYS 142 Cb 0.31 -5.46 -0.17 0.00 -1.84 0.00 0.00 35.03 27.87 2bkh n LYS 142 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2bkh s LEU 143 N -6.67 0.75 0.72 -0.35 2.96 -1.08 -5.06 118.68 109.96 2bkh s LEU 143 Ca 0.09 0.04 -0.16 0.00 -0.22 0.00 0.00 54.13 53.89 2bkh s LEU 143 Cb -0.04 -0.13 0.03 0.00 0.50 0.00 0.00 46.19 46.54 2bkh s LEU 143 CO 0.78 -0.17 1.23 -0.44 -1.32 0.00 0.00 176.35 176.44 2bkh s SER 144 N 1.48 4.21 0.07 3.68 0.01 -1.26 -3.97 113.70 117.92 2bkh s SER 144 Ca -0.04 2.44 0.07 0.00 1.31 0.00 0.00 55.95 59.72 2bkh s SER 144 Cb -0.13 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.48 2bkh s SER 144 CO -0.03 -2.26 -0.18 -1.10 0.41 0.00 0.00 173.24 170.09 2bkh s GLN 145 N -3.79 1.08 0.10 12.44 -1.52 0.21 -1.48 119.66 126.70 2bkh s GLN 145 Ca 0.77 -0.98 0.09 0.00 -1.95 0.00 0.00 55.36 53.29 2bkh s GLN 145 Cb -0.31 -1.20 -0.04 0.00 -0.22 0.00 0.00 33.01 31.24 2bkh s GLN 145 CO 0.44 0.29 -0.22 -1.12 -0.25 0.00 0.00 175.29 174.43 2bkh s SER 146 N -1.54 3.62 -0.20 5.90 0.01 0.12 -1.18 113.70 120.43 2bkh s SER 146 Ca 0.04 -0.61 -0.01 0.00 1.31 0.00 0.00 55.95 56.67 2bkh s SER 146 Cb -0.09 -0.42 0.06 0.00 0.21 0.00 0.00 66.02 65.78 2bkh s SER 146 CO 0.03 0.20 -0.00 -0.63 0.41 0.00 0.00 173.24 173.24 2bkh s ILE 147 N -1.05 0.88 -0.33 1.44 1.01 0.58 -1.39 121.20 122.34 2bkh s ILE 147 Ca 0.16 -0.75 -0.08 0.00 0.00 0.00 0.00 60.65 59.98 2bkh s ILE 147 Cb -0.10 -1.28 0.02 0.00 0.01 0.00 0.00 42.46 41.11 2bkh s ILE 147 CO 0.07 -0.14 0.12 -0.63 0.00 0.00 0.00 174.94 174.37 2bkh s ILE 148 N 1.70 4.04 -0.17 2.92 1.01 0.04 -1.04 121.20 129.70 2bkh s ILE 148 Ca -0.02 -0.89 -0.05 0.00 0.00 0.00 0.00 60.65 59.68 2bkh s ILE 148 Cb -0.17 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.06 2bkh s ILE 148 CO -0.07 -0.09 0.01 -0.69 0.00 0.00 0.00 174.94 174.10 2bkh s VAL 149 N 1.48 4.27 0.35 2.92 1.01 -1.03 -1.91 120.40 127.48 2bkh s VAL 149 Ca 0.01 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 61.84 2bkh s VAL 149 Cb -0.19 -2.90 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 2bkh s VAL 149 CO 0.04 0.47 0.33 -0.94 0.00 0.00 0.00 175.10 175.00 2bkh s SER 150 N 0.47 5.37 0.00 3.32 1.04 -0.74 -4.52 113.70 118.64 2bkh s SER 150 Ca -0.00 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2bkh s SER 150 Cb -0.14 -0.96 0.00 0.00 0.10 0.00 0.00 66.02 65.02 2bkh s SER 150 CO 0.02 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.44 2bkh n GLY 151 N -1.44 4.38 3.69 7.32 0.00 -1.26 -2.03 105.19 115.84 2bkh n GLY 151 Ca -0.01 -1.32 -0.31 0.00 0.00 0.00 0.00 46.02 44.38 2bkh n GLY 151 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bkh s GLU 152 N -3.20 1.24 0.32 1.61 2.02 -1.26 -4.49 118.70 114.94 2bkh s GLU 152 Ca 0.00 1.54 -0.29 0.00 0.02 0.00 0.00 54.97 56.24 2bkh s GLU 152 Cb 0.00 -1.75 -0.11 0.00 0.10 0.00 0.00 34.13 32.37 2bkh s GLU 152 CO 0.00 -2.47 1.47 -1.12 0.02 0.00 0.00 175.26 173.16 2bkh s SER 153 N -2.67 6.50 -0.03 -0.19 0.01 -1.26 -2.42 113.70 113.64 2bkh s SER 153 Ca 0.67 2.88 0.00 0.00 1.31 0.00 0.00 55.95 60.81 2bkh s SER 153 Cb -0.23 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.35 2bkh s SER 153 CO 0.56 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 174.04 2bkh n GLY 154 N 1.28 0.46 0.91 3.44 0.00 -1.26 -4.93 105.19 105.10 2bkh n GLY 154 Ca 0.04 -0.43 0.05 0.00 0.00 0.00 0.00 46.02 45.67 2bkh n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkh n ALA 155 N 1.01 2.76 -0.20 4.61 0.00 -1.01 -4.84 120.51 122.84 2bkh n ALA 155 Ca -0.00 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.64 2bkh n ALA 155 Cb 0.02 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.46 2bkh n ALA 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bkh n GLY 156 N 0.78 0.90 0.18 0.00 0.00 -1.26 -3.79 105.19 102.00 2bkh n GLY 156 Ca 0.13 -0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 2bkh n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bkh h LYS 157 N 2.74 0.57 -0.27 1.61 1.57 -1.88 -0.95 116.57 119.95 2bkh h LYS 157 Ca 0.00 -0.32 0.06 0.00 -1.87 0.00 0.00 60.65 58.51 2bkh h LYS 157 Cb 0.00 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.28 2bkh h LYS 157 CO 0.00 0.92 -0.09 1.15 -0.57 0.00 0.00 179.45 180.86 2bkh h THR 158 N 0.25 0.67 -0.78 -0.16 2.02 -1.97 -0.73 112.91 112.21 2bkh h THR 158 Ca 0.03 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.18 2bkh h THR 158 Cb 0.85 0.67 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 2bkh h THR 158 CO 0.07 0.00 0.37 -0.33 0.37 0.00 0.00 175.52 175.99 2bkh h GLU 159 N -0.04 1.13 -0.35 6.66 3.07 -1.97 -2.27 114.58 120.82 2bkh h GLU 159 Ca 0.14 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2bkh h GLU 159 Cb 0.24 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 27.94 2bkh h GLU 159 CO -0.30 0.88 0.21 -0.97 -1.40 0.00 0.00 179.01 177.43 2bkh h ASN 160 N 1.10 0.42 -0.57 1.42 -0.73 -0.50 -1.22 115.58 115.51 2bkh h ASN 160 Ca 0.27 -0.06 0.02 0.00 1.87 0.00 0.00 56.30 58.40 2bkh h ASN 160 Cb 0.13 -0.11 -0.03 0.00 0.27 0.00 0.00 38.32 38.58 2bkh h ASN 160 CO -0.03 0.35 0.36 0.74 -0.37 0.00 0.00 177.43 178.48 2bkh h THR 161 N 0.45 1.10 -0.98 -3.57 2.02 -1.00 -2.12 112.91 108.81 2bkh h THR 161 Ca 0.12 -0.25 0.04 0.00 0.77 0.00 0.00 66.41 67.09 2bkh h THR 161 Cb 0.01 0.32 -0.06 0.00 -1.74 0.00 0.00 68.15 66.68 2bkh h THR 161 CO -0.02 0.13 0.64 0.11 0.37 0.00 0.00 175.52 176.75 2bkh h LYS 162 N 0.72 1.21 -0.65 6.66 1.57 -0.81 -1.38 116.57 123.90 2bkh h LYS 162 Ca 0.22 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.84 2bkh h LYS 162 Cb -0.03 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 31.98 2bkh h LYS 162 CO -0.07 0.80 0.08 0.74 -0.57 0.00 0.00 179.45 180.43 2bkh h PHE 163 N 1.24 1.15 0.15 -1.35 0.05 -0.76 -0.16 116.94 117.27 2bkh h PHE 163 Ca 0.39 -0.17 -0.01 0.00 3.82 0.00 0.00 57.97 62.01 2bkh h PHE 163 Cb -0.00 -0.31 0.00 0.00 2.00 0.00 0.00 35.95 37.63 2bkh h PHE 163 CO -0.00 0.98 -0.07 0.28 -0.18 0.00 0.00 178.31 179.31 2bkh h VAL 164 N 1.01 0.93 -0.44 -0.55 2.07 -0.80 -0.37 116.25 118.10 2bkh h VAL 164 Ca 0.19 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 2bkh h VAL 164 Cb 0.46 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 2bkh h VAL 164 CO 0.02 0.08 0.22 -0.07 0.02 0.00 0.00 177.57 177.83 2bkh h LEU 165 N -0.35 0.58 -0.55 2.57 3.38 -1.14 -1.19 115.31 118.61 2bkh h LEU 165 Ca -0.02 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2bkh h LEU 165 Cb 0.28 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2bkh h LEU 165 CO 0.03 0.54 0.34 -0.09 0.09 0.00 0.00 178.44 179.35 2bkh h ARG 166 N 0.57 0.65 -0.68 1.13 9.65 -1.03 -1.16 114.38 123.52 2bkh h ARG 166 Ca 0.15 -0.04 0.01 0.00 -1.10 0.00 0.00 59.98 59.00 2bkh h ARG 166 Cb 0.11 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.51 2bkh h ARG 166 CO -0.02 0.43 0.45 -0.92 2.80 0.00 0.00 179.97 182.71 2bkh h TYR 167 N 0.67 0.85 -0.04 2.20 5.03 -0.52 -1.86 116.97 123.30 2bkh h TYR 167 Ca 0.22 0.02 -0.21 0.00 2.58 0.00 0.00 58.73 61.34 2bkh h TYR 167 Cb 0.00 -0.29 0.00 0.00 1.55 0.00 0.00 36.73 38.00 2bkh h TYR 167 CO -0.06 0.53 -0.84 -0.07 -1.32 0.00 0.00 178.16 176.40 2bkh h LEU 168 N 0.91 0.54 0.12 2.82 3.38 -0.90 -2.43 115.31 119.75 2bkh h LEU 168 Ca 0.25 -0.39 -0.24 0.00 0.09 0.00 0.00 57.88 57.59 2bkh h LEU 168 Cb -0.09 -0.16 0.03 0.00 0.09 0.00 0.00 40.66 40.53 2bkh h LEU 168 CO -0.06 1.17 -1.01 0.71 0.09 0.00 0.00 178.44 179.33 2bkh h THR 169 N 0.27 1.38 -0.07 0.22 1.35 -1.09 -1.46 112.91 113.51 2bkh h THR 169 Ca -0.06 -2.44 -0.10 0.00 -0.55 0.00 0.00 66.41 63.26 2bkh h THR 169 Cb 1.46 2.88 -0.01 0.00 -1.73 0.00 0.00 68.15 70.74 2bkh h THR 169 CO 0.15 0.72 -0.43 -0.08 -0.25 0.00 0.00 175.52 175.62 2bkh h GLU 170 N -0.02 0.16 0.09 4.72 4.81 -1.43 -1.19 114.58 121.72 2bkh h GLU 170 Ca -0.16 -0.08 -0.23 0.00 -0.13 0.00 0.00 59.36 58.76 2bkh h GLU 170 Cb 1.74 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.12 2bkh h GLU 170 CO 0.19 0.57 -1.18 0.77 -0.73 0.00 0.00 179.01 178.63 2bkh h SER 171 N 0.13 0.28 0.00 1.04 0.02 -1.50 -3.41 113.55 110.11 2bkh h SER 171 Ca 0.01 -0.82 0.00 0.00 -0.84 0.00 0.00 61.79 60.13 2bkh h SER 171 Cb 0.82 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.27 2bkh h SER 171 CO 0.06 1.51 -0.09 -1.22 -1.14 0.00 0.00 176.83 175.96 2bkh n TYR 172 N -4.09 0.00 -4.22 3.45 0.53 -0.55 -5.03 117.16 107.24 2bkh n TYR 172 Ca -0.23 -0.69 -0.25 0.00 -1.02 0.00 0.00 57.90 55.71 2bkh n TYR 172 Cb 0.81 -0.11 -0.08 0.00 -1.03 0.00 0.00 39.34 38.94 2bkh n TYR 172 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 2bkh s GLY 173 N -2.09 2.25 -0.70 2.72 0.00 -0.45 -2.37 107.32 106.68 2bkh s GLY 173 Ca 0.19 -2.06 0.05 0.00 0.00 0.00 0.00 44.72 42.90 2bkh s GLY 173 CO 0.02 -1.91 0.80 -1.30 0.00 0.00 0.00 173.10 170.70 2bkh n THR 174 N -1.13 2.62 0.00 0.90 -2.24 -1.26 -4.86 114.28 108.30 2bkh n THR 174 Ca -0.02 -5.26 0.00 0.00 -2.27 0.00 0.00 64.05 56.50 2bkh n THR 174 Cb 0.64 -2.12 0.00 0.00 -2.10 0.00 0.00 70.33 66.75 2bkh n THR 174 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bkh n GLY 175 N 1.05 2.99 3.68 3.38 0.00 -1.26 -4.97 105.19 110.07 2bkh n GLY 175 Ca 0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 2bkh n GLY 175 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bkh s GLN 176 N 0.00 4.36 -1.22 1.61 1.03 -1.26 -4.95 119.66 119.23 2bkh s GLN 176 Ca 0.00 1.36 -0.11 0.00 0.04 0.00 0.00 55.36 56.65 2bkh s GLN 176 Cb 0.00 -3.58 0.19 0.00 0.03 0.00 0.00 33.01 29.65 2bkh s GLN 176 CO 0.00 -0.43 1.59 -0.40 -2.54 0.00 0.00 175.29 173.51 2bkh n ASP 177 N 5.48 5.27 -0.09 12.60 5.68 -1.26 -4.79 116.55 139.44 2bkh n ASP 177 Ca 0.10 -3.06 -0.12 0.00 -0.50 0.00 0.00 54.79 51.20 2bkh n ASP 177 Cb 0.48 -1.50 0.00 0.00 -1.14 0.00 0.00 41.12 38.96 2bkh n ASP 177 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 2bkh h ILE 178 N 4.14 1.28 0.00 2.12 1.08 -1.97 -3.08 117.51 121.08 2bkh h ILE 178 Ca 0.33 -1.58 -0.05 0.00 -0.39 0.00 0.00 64.86 63.17 2bkh h ILE 178 Cb 0.76 1.43 -0.01 0.00 -3.07 0.00 0.00 36.82 35.93 2bkh h ILE 178 CO 1.38 0.52 -0.25 -2.24 -0.69 0.00 0.00 178.15 176.88 2bkh h ASP 179 N 0.70 0.00 0.59 1.72 2.03 -1.87 -2.32 116.42 117.27 2bkh h ASP 179 Ca 0.05 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.20 2bkh h ASP 179 Cb 0.98 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.46 2bkh h ASP 179 CO 0.09 0.25 -0.69 0.44 -1.03 0.00 0.00 179.24 178.31 2bkh h ASP 180 N 0.00 0.09 0.12 4.15 3.45 -1.95 -2.83 116.42 119.45 2bkh h ASP 180 Ca -0.00 -0.06 -0.17 0.00 0.43 0.00 0.00 57.03 57.23 2bkh h ASP 180 Cb 0.55 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 39.28 2bkh h ASP 180 CO 0.03 0.75 -0.60 0.03 -1.57 0.00 0.00 179.24 177.88 2bkh h ARG 181 N 0.05 0.49 -0.40 3.56 2.47 -1.35 -2.27 114.38 116.93 2bkh h ARG 181 Ca -0.01 -0.33 -0.16 0.00 -1.26 0.00 0.00 59.98 58.22 2bkh h ARG 181 Cb 1.22 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.58 2bkh h ARG 181 CO 0.10 0.94 -0.37 0.82 0.56 0.00 0.00 179.97 182.02 2bkh h ILE 182 N 0.36 1.27 -0.48 2.04 2.04 -1.51 -2.73 117.51 118.51 2bkh h ILE 182 Ca -0.00 -1.54 -0.06 0.00 1.00 0.00 0.00 64.86 64.26 2bkh h ILE 182 Cb 1.15 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.56 2bkh h ILE 182 CO 0.11 0.52 0.05 0.58 0.00 0.00 0.00 178.15 179.41 2bkh h VAL 183 N 0.77 1.23 0.00 1.67 2.07 -1.48 -2.53 116.25 117.98 2bkh h VAL 183 Ca 0.07 -0.89 -0.10 0.00 0.82 0.00 0.00 66.70 66.60 2bkh h VAL 183 Cb 0.96 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2bkh h VAL 183 CO 0.09 0.32 -0.47 -0.33 0.02 0.00 0.00 177.57 177.20 2bkh h GLU 184 N 0.72 0.00 0.00 1.57 5.08 -1.34 -2.72 114.58 117.89 2bkh h GLU 184 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2bkh h GLU 184 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2bkh h GLU 184 CO 0.01 0.47 0.00 0.00 -1.00 0.00 0.00 179.01 178.49 2bkh h ALA 185 N 1.53 1.00 -0.51 3.43 0.00 -1.16 -3.40 119.26 120.16 2bkh h ALA 185 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2bkh h ALA 185 Cb 0.87 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 2bkh h ALA 185 CO 0.06 0.00 0.18 -0.97 0.00 0.00 0.00 179.25 178.52 2bkh h ASN 186 N 0.00 0.17 -0.11 0.00 -1.24 -1.13 -1.09 115.58 112.19 2bkh h ASN 186 Ca 0.00 0.06 0.03 0.00 0.71 0.00 0.00 56.30 57.11 2bkh h ASN 186 Cb 0.81 0.05 -0.00 0.00 0.73 0.00 0.00 38.32 39.90 2bkh h ASN 186 CO 0.00 0.12 0.13 -0.65 -1.29 0.00 0.00 177.43 175.75 2bkh h PRO 187 N 0.35 0.00 0.05 6.67 0.11 -1.79 -0.33 132.00 137.06 2bkh h PRO 187 Ca 0.25 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.35 2bkh h PRO 187 Cb 0.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.38 2bkh h PRO 187 CO -0.26 0.00 -0.02 1.25 -0.21 0.00 0.00 178.00 178.76 2bkh h LEU 188 N 0.00 -0.06 -0.51 2.35 5.85 -1.50 -2.73 115.31 118.71 2bkh h LEU 188 Ca 0.05 -0.58 0.04 0.00 0.84 0.00 0.00 57.88 58.23 2bkh h LEU 188 Cb 0.32 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2bkh h LEU 188 CO -0.00 0.60 0.27 -0.07 -0.34 0.00 0.00 178.44 178.91 2bkh h LEU 189 N -0.76 0.41 -1.28 2.25 3.38 -1.05 -2.47 115.31 115.79 2bkh h LEU 189 Ca -0.01 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 2bkh h LEU 189 Cb 0.64 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2bkh h LEU 189 CO 0.01 0.29 -0.14 -0.33 0.09 0.00 0.00 178.44 178.36 2bkh h GLU 190 N 0.54 0.33 -0.67 1.13 5.08 -1.21 0.04 114.58 119.80 2bkh h GLU 190 Ca 0.22 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2bkh h GLU 190 Cb 0.10 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 2bkh h GLU 190 CO -0.14 0.47 0.17 0.00 -1.00 0.00 0.00 179.01 178.52 2bkh h ALA 191 N 1.56 1.03 0.00 3.43 0.00 -1.11 -0.39 119.26 123.78 2bkh h ALA 191 Ca 0.06 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2bkh h ALA 191 Cb 0.43 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2bkh h ALA 191 CO 0.03 0.64 -1.14 1.19 0.00 0.00 0.00 179.25 179.96 2bkh n PHE 192 N -4.24 0.29 -0.32 0.00 3.01 -1.04 -0.20 117.46 114.96 2bkh n PHE 192 Ca 0.05 0.09 0.00 0.00 1.01 0.00 0.00 57.45 58.60 2bkh n PHE 192 Cb 0.25 -0.48 0.00 0.00 -0.01 0.00 0.00 39.48 39.24 2bkh n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2bkh n GLY 193 N 1.34 -0.67 3.53 1.37 0.00 -0.03 -4.93 105.19 105.81 2bkh n GLY 193 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 2bkh n GLY 193 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bkh s ASN 194 N -0.01 3.88 0.07 1.61 0.02 -0.16 -1.18 114.94 119.16 2bkh s ASN 194 Ca 0.00 -0.96 -0.26 0.00 -1.02 0.00 0.00 52.86 50.62 2bkh s ASN 194 Cb 0.00 -0.45 0.08 0.00 0.02 0.00 0.00 41.25 40.90 2bkh s ASN 194 CO 0.00 -0.02 0.69 0.00 0.02 0.00 0.00 177.10 177.79 2bkh s ALA 195 N -2.48 -1.70 -0.01 0.60 0.00 -0.45 -1.82 121.76 115.91 2bkh s ALA 195 Ca 0.31 0.83 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 2bkh s ALA 195 Cb -0.04 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 2bkh s ALA 195 CO 0.17 -0.64 1.23 0.21 0.00 0.00 0.00 175.76 176.72 2bkh s LYS 196 N -2.93 4.37 0.51 0.00 2.20 -1.17 -1.01 119.74 121.70 2bkh s LYS 196 Ca -0.01 1.75 0.06 0.00 -0.36 0.00 0.00 55.97 57.41 2bkh s LYS 196 Cb -0.01 -3.49 0.02 0.00 -1.51 0.00 0.00 37.83 32.84 2bkh s LYS 196 CO -0.06 -0.40 0.40 0.95 -0.36 0.00 0.00 175.35 175.87 2bkh s THR 197 N 1.85 1.95 0.29 3.43 -4.23 0.75 -1.99 115.64 117.69 2bkh s THR 197 Ca 0.58 -1.45 0.03 0.00 -1.18 0.00 0.00 61.69 59.67 2bkh s THR 197 Cb -0.27 -2.40 0.28 0.00 1.34 0.00 0.00 72.50 71.44 2bkh s THR 197 CO 0.25 0.00 1.77 0.58 -0.54 0.00 0.00 174.62 176.68 2bkh h VAL 198 N 0.84 0.71 0.00 2.29 2.07 -1.90 -3.05 116.25 117.21 2bkh h VAL 198 Ca -0.38 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2bkh h VAL 198 Cb 1.29 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2bkh h VAL 198 CO 0.57 0.13 -1.85 0.54 0.02 0.00 0.00 177.57 176.98 2bkh n ARG 199 N -4.81 0.59 -3.73 1.57 1.74 -1.26 -4.97 116.66 105.81 2bkh n ARG 199 Ca 0.21 -0.16 -0.16 0.00 -0.77 0.00 0.00 57.85 56.97 2bkh n ARG 199 Cb 0.52 -1.53 -0.16 0.00 -1.02 0.00 0.00 32.46 30.27 2bkh n ARG 199 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2bkh s ASN 200 N -4.41 0.36 0.33 0.55 -0.87 -1.15 -5.04 114.94 104.71 2bkh s ASN 200 Ca -0.06 0.17 0.14 0.00 -1.57 0.00 0.00 52.86 51.54 2bkh s ASN 200 Cb 0.14 0.04 0.54 0.00 -0.02 0.00 0.00 41.25 41.95 2bkh s ASN 200 CO 0.90 -0.18 1.69 0.78 -2.57 0.00 0.00 177.10 177.72 2bkh h ASN 201 N 7.71 0.00 -2.12 -1.22 2.35 -1.86 0.21 115.58 120.65 2bkh h ASN 201 Ca -0.33 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 54.88 2bkh h ASN 201 Cb 1.12 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 39.09 2bkh h ASN 201 CO 0.34 0.49 -0.93 -3.20 -1.65 0.00 0.00 177.43 172.48 2bkh n ASN 202 N -3.74 2.38 -4.67 5.81 4.05 -1.26 -3.04 115.26 114.79 2bkh n ASN 202 Ca -0.01 -3.26 -0.39 0.00 0.45 0.00 0.00 54.58 51.36 2bkh n ASN 202 Cb 0.54 -0.60 -0.06 0.00 1.23 0.00 0.00 39.78 40.89 2bkh n ASN 202 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 2bkh s SER 203 N -2.68 6.62 -0.01 1.20 0.15 -0.18 -4.82 113.70 113.98 2bkh s SER 203 Ca 0.43 0.75 -0.30 0.00 0.70 0.00 0.00 55.95 57.53 2bkh s SER 203 Cb 0.29 -2.31 -0.06 0.00 -1.71 0.00 0.00 66.02 62.23 2bkh s SER 203 CO -0.10 -0.19 1.48 -0.55 1.20 0.00 0.00 173.24 175.08 2bkh s SER 204 N 1.12 6.78 -0.29 5.45 0.15 -1.26 -1.33 113.70 124.31 2bkh s SER 204 Ca 0.26 2.17 0.11 0.00 0.70 0.00 0.00 55.95 59.19 2bkh s SER 204 Cb -0.16 -2.55 0.63 0.00 -1.71 0.00 0.00 66.02 62.23 2bkh s SER 204 CO 0.10 -0.79 1.64 0.54 1.20 0.00 0.00 173.24 175.93 2bkh n ARG 205 N 5.81 2.93 -4.00 5.44 5.12 -0.33 -4.60 116.66 127.04 2bkh n ARG 205 Ca 0.14 -3.05 -0.08 0.00 -1.93 0.00 0.00 57.85 52.93 2bkh n ARG 205 Cb 0.43 -2.02 -0.10 0.00 -1.16 0.00 0.00 32.46 29.61 2bkh n ARG 205 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 2bkh s PHE 206 N -3.05 0.34 -0.21 -1.55 -0.12 -1.26 -1.53 117.98 110.61 2bkh s PHE 206 Ca 0.50 -0.74 -0.27 0.00 -0.05 0.00 0.00 56.93 56.36 2bkh s PHE 206 Cb 0.41 -0.25 -0.00 0.00 -0.63 0.00 0.00 43.02 42.55 2bkh s PHE 206 CO 0.09 -0.34 0.92 0.20 -0.05 0.00 0.00 175.22 176.04 2bkh s GLY 207 N -2.34 1.89 -0.12 1.99 0.00 0.19 -4.64 107.32 104.28 2bkh s GLY 207 Ca -0.02 0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.78 2bkh s GLY 207 CO -0.06 1.92 -0.17 1.25 0.00 0.00 0.00 173.10 176.03 2bkh s LYS 208 N 2.71 3.26 -0.27 2.90 2.20 0.46 -0.74 119.74 130.25 2bkh s LYS 208 Ca 0.40 -0.76 -0.01 0.00 -0.36 0.00 0.00 55.97 55.24 2bkh s LYS 208 Cb -0.16 -2.51 0.08 0.00 -1.51 0.00 0.00 37.83 33.74 2bkh s LYS 208 CO 0.09 0.20 0.06 0.12 -0.36 0.00 0.00 175.35 175.46 2bkh s PHE 209 N 0.36 1.74 -0.34 4.03 5.36 -0.29 -0.52 117.98 128.31 2bkh s PHE 209 Ca -0.14 -1.59 -0.16 0.00 -0.96 0.00 0.00 56.93 54.09 2bkh s PHE 209 Cb -0.17 -1.58 -0.01 0.00 -0.34 0.00 0.00 43.02 40.92 2bkh s PHE 209 CO 0.07 -0.80 0.41 0.08 -1.46 0.00 0.00 175.22 173.51 2bkh s VAL 210 N 1.61 5.13 -0.17 3.12 1.01 -0.29 -1.50 120.40 129.30 2bkh s VAL 210 Ca 0.05 0.15 -0.06 0.00 0.00 0.00 0.00 61.98 62.12 2bkh s VAL 210 Cb -0.18 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2bkh s VAL 210 CO -0.18 -0.12 0.02 -1.61 0.00 0.00 0.00 175.10 173.22 2bkh s GLU 211 N 2.12 3.85 -0.27 2.72 2.02 -0.39 -1.30 118.70 127.46 2bkh s GLU 211 Ca 0.14 -0.41 -0.14 0.00 0.02 0.00 0.00 54.97 54.58 2bkh s GLU 211 Cb -0.16 -3.10 -0.04 0.00 0.10 0.00 0.00 34.13 30.93 2bkh s GLU 211 CO 0.12 0.25 0.32 0.42 0.02 0.00 0.00 175.26 176.40 2bkh s ILE 212 N 0.39 5.21 0.09 -1.63 -1.09 0.09 -1.90 121.20 122.36 2bkh s ILE 212 Ca 0.00 0.47 -0.08 0.00 -2.23 0.00 0.00 60.65 58.82 2bkh s ILE 212 Cb -0.13 -3.65 -0.06 0.00 -1.58 0.00 0.00 42.46 37.04 2bkh s ILE 212 CO 0.01 0.19 0.37 -1.00 -1.23 0.00 0.00 174.94 173.29 2bkh s HIS 213 N 1.92 3.55 0.05 3.97 3.76 -0.45 -1.32 115.29 126.75 2bkh s HIS 213 Ca 0.13 0.68 0.05 0.00 -0.15 0.00 0.00 55.06 55.77 2bkh s HIS 213 Cb -0.16 -2.08 -0.02 0.00 1.11 0.00 0.00 32.58 31.43 2bkh s HIS 213 CO 0.10 0.50 -0.15 -0.06 -0.85 0.00 0.00 174.74 174.28 2bkh s PHE 214 N -1.47 1.31 0.91 1.40 0.40 0.68 -1.26 117.98 119.94 2bkh s PHE 214 Ca 0.35 -0.37 -0.13 0.00 -0.60 0.00 0.00 56.93 56.18 2bkh s PHE 214 Cb -0.13 -0.77 0.20 0.00 0.51 0.00 0.00 43.02 42.83 2bkh s PHE 214 CO 0.20 0.05 1.24 0.27 0.70 0.00 0.00 175.22 177.67 2bkh n ASN 215 N 1.79 0.37 -0.34 1.36 0.23 -0.50 -0.82 115.26 117.35 2bkh n ASN 215 Ca -0.18 -1.62 0.14 0.00 -0.53 0.00 0.00 54.58 52.39 2bkh n ASN 215 Cb 0.54 -0.92 0.35 0.00 -2.08 0.00 0.00 39.78 37.67 2bkh n ASN 215 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2bkh h GLU 216 N 0.00 0.70 -0.13 -3.83 4.81 -1.95 -0.83 114.58 113.35 2bkh h GLU 216 Ca -0.40 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2bkh h GLU 216 Cb 1.17 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.40 2bkh h GLU 216 CO 0.31 0.46 0.00 1.63 -0.73 0.00 0.00 179.01 180.68 2bkh n LYS 217 N -4.73 0.69 -3.94 1.92 5.02 -1.26 -4.85 118.16 111.01 2bkh n LYS 217 Ca 0.23 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.27 2bkh n LYS 217 Cb 0.59 -1.06 -0.02 0.00 -0.02 0.00 0.00 35.03 34.52 2bkh n LYS 217 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2bkh n SER 218 N -0.38 -0.39 -4.27 4.39 7.64 -0.32 -5.00 113.62 115.30 2bkh n SER 218 Ca 0.00 -1.00 -0.27 0.00 1.01 0.00 0.00 58.87 58.61 2bkh n SER 218 Cb 0.03 -3.10 -0.15 0.00 -1.01 0.00 0.00 64.21 59.99 2bkh n SER 218 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2bkh s SER 219 N -4.36 2.64 0.23 6.43 0.15 -1.26 -4.92 113.70 112.61 2bkh s SER 219 Ca 0.01 -0.49 -0.30 0.00 0.70 0.00 0.00 55.95 55.87 2bkh s SER 219 Cb -0.00 -0.25 -0.10 0.00 -1.71 0.00 0.00 66.02 63.96 2bkh s SER 219 CO 0.88 0.22 1.41 -0.69 1.20 0.00 0.00 173.24 176.26 2bkh s VAL 220 N -0.70 2.81 -0.02 4.45 1.01 -1.00 -1.41 120.40 125.54 2bkh s VAL 220 Ca 0.09 0.67 0.01 0.00 0.00 0.00 0.00 61.98 62.74 2bkh s VAL 220 Cb -0.09 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.85 2bkh s VAL 220 CO 0.01 0.10 -0.02 1.33 0.00 0.00 0.00 175.10 176.53 2bkh n VAL 221 N 2.48 0.14 -2.86 2.92 0.24 -0.39 -4.61 118.33 116.25 2bkh n VAL 221 Ca 0.07 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 2bkh n VAL 221 Cb 0.41 -0.66 0.00 0.00 -1.47 0.00 0.00 33.84 32.12 2bkh n VAL 221 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bkh n GLY 222 N 3.28 1.99 3.27 7.63 0.00 -1.23 -4.83 105.19 115.30 2bkh n GLY 222 Ca -0.04 -0.89 -0.15 0.00 0.00 0.00 0.00 46.02 44.94 2bkh n GLY 222 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bkh s GLY 223 N -0.98 1.24 -0.28 -0.02 0.00 -0.99 -1.34 107.32 104.95 2bkh s GLY 223 Ca 0.00 -1.59 -0.12 0.00 0.00 0.00 0.00 44.72 43.01 2bkh s GLY 223 CO 0.00 -1.61 0.63 -0.12 0.00 0.00 0.00 173.10 172.00 2bkh s PHE 224 N -3.39 -1.15 -0.50 1.90 5.36 -0.80 -4.69 117.98 114.70 2bkh s PHE 224 Ca 0.21 2.14 -0.20 0.00 -0.96 0.00 0.00 56.93 58.11 2bkh s PHE 224 Cb 0.04 0.67 0.05 0.00 -0.34 0.00 0.00 43.02 43.44 2bkh s PHE 224 CO 0.03 -0.58 0.69 0.08 -1.46 0.00 0.00 175.22 173.98 2bkh s VAL 225 N 2.31 4.77 0.19 3.12 1.01 -1.26 -1.26 120.40 129.28 2bkh s VAL 225 Ca -0.07 -0.22 -0.26 0.00 0.00 0.00 0.00 61.98 61.43 2bkh s VAL 225 Cb -0.09 -4.33 -0.08 0.00 0.00 0.00 0.00 36.38 31.88 2bkh s VAL 225 CO -0.18 -0.83 0.81 -0.44 0.00 0.00 0.00 175.10 174.46 2bkh s SER 226 N 2.58 7.41 0.04 3.32 0.01 -0.57 -4.94 113.70 121.55 2bkh s SER 226 Ca 0.20 1.70 0.04 0.00 1.31 0.00 0.00 55.95 59.19 2bkh s SER 226 Cb -0.17 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.52 2bkh s SER 226 CO 0.15 0.17 -0.11 -1.38 0.41 0.00 0.00 173.24 172.47 2bkh s HIS 227 N -1.21 1.00 0.01 2.43 -3.43 -1.26 -1.14 115.29 111.68 2bkh s HIS 227 Ca 0.38 -0.37 -0.06 0.00 -0.80 0.00 0.00 55.06 54.22 2bkh s HIS 227 Cb -0.23 -0.59 -0.00 0.00 -1.43 0.00 0.00 32.58 30.33 2bkh s HIS 227 CO 0.27 0.00 0.10 0.71 -2.00 0.00 0.00 174.74 173.82 2bkh s TYR 228 N -0.94 0.09 -1.41 0.38 1.51 0.08 -4.98 117.35 112.08 2bkh s TYR 228 Ca -0.02 -0.22 -0.10 0.00 -1.01 0.00 0.00 57.07 55.73 2bkh s TYR 228 Cb -0.08 -0.08 0.03 0.00 -0.11 0.00 0.00 41.96 41.73 2bkh s TYR 228 CO 0.01 -0.26 1.11 1.28 -1.11 0.00 0.00 175.55 176.58 2bkh n LEU 229 N 1.52 -3.16 -4.68 -1.29 4.77 -1.26 -0.64 117.00 112.25 2bkh n LEU 229 Ca -0.23 -0.62 -0.45 0.00 -0.03 0.00 0.00 56.01 54.68 2bkh n LEU 229 Cb 0.55 -2.89 -0.04 0.00 -2.33 0.00 0.00 43.42 38.72 2bkh n LEU 229 CO 0.21 0.59 1.20 -0.11 -1.33 0.00 0.00 177.39 177.94 2bkh n LEU 230 N -4.87 3.34 -4.56 2.23 7.94 -1.26 -4.50 117.00 115.32 2bkh n LEU 230 Ca 0.00 1.09 -0.40 0.00 -1.11 0.00 0.00 56.01 55.59 2bkh n LEU 230 Cb 0.56 -1.46 -0.03 0.00 0.53 0.00 0.00 43.42 43.01 2bkh n LEU 230 CO 0.68 -0.21 1.34 -0.70 -1.11 0.00 0.00 177.39 177.39 2bkh s GLU 231 N 0.63 3.06 0.35 1.96 2.12 -0.58 -4.86 118.70 121.37 2bkh s GLU 231 Ca 0.75 0.30 0.19 0.00 0.36 0.00 0.00 54.97 56.57 2bkh s GLU 231 Cb -0.63 -4.23 0.35 0.00 0.26 0.00 0.00 34.13 29.89 2bkh s GLU 231 CO 0.40 -2.25 1.58 0.87 -0.54 0.00 0.00 175.26 175.32 2bkh h LYS 232 N 11.98 0.00 -0.28 4.30 1.79 -1.91 -3.29 116.57 129.15 2bkh h LYS 232 Ca -0.27 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.08 2bkh h LYS 232 Cb 1.10 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.74 2bkh h LYS 232 CO 1.22 0.35 -0.31 0.66 -1.08 0.00 0.00 179.45 180.29 2bkh h SER 233 N 0.00 0.60 -0.44 0.86 4.64 -1.93 -2.53 113.55 114.76 2bkh h SER 233 Ca -0.00 -0.23 0.13 0.00 -0.47 0.00 0.00 61.79 61.21 2bkh h SER 233 Cb 1.14 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 2bkh h SER 233 CO 0.05 0.88 0.39 -0.09 -0.87 0.00 0.00 176.83 177.18 2bkh h ARG 234 N 0.50 0.00 -0.10 4.77 2.43 -1.70 -2.75 114.38 117.52 2bkh h ARG 234 Ca 0.06 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2bkh h ARG 234 Cb 0.79 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 2bkh h ARG 234 CO 0.06 0.00 -0.05 0.82 -1.51 0.00 0.00 179.97 179.29 2bkh h ILE 235 N 0.00 1.11 0.00 1.20 2.04 -1.65 -3.32 117.51 116.88 2bkh h ILE 235 Ca 0.21 -0.44 -0.19 0.00 1.00 0.00 0.00 64.86 65.44 2bkh h ILE 235 Cb 0.98 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 2bkh h ILE 235 CO -0.00 0.14 -1.70 0.00 0.00 0.00 0.00 178.15 176.58 2bkh s VAL 237 N -2.25 0.30 0.03 0.00 0.11 -1.11 -4.15 120.40 113.34 2bkh s VAL 237 Ca -0.15 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.00 2bkh s VAL 237 Cb 0.04 -0.40 -0.02 0.00 -1.53 0.00 0.00 36.38 34.46 2bkh s VAL 237 CO 0.31 -0.40 -0.04 -1.10 -3.33 0.00 0.00 175.10 170.53 2bkh s GLN 238 N -1.39 0.43 0.96 1.54 1.11 -1.26 -4.07 119.66 116.99 2bkh s GLN 238 Ca -0.12 -0.77 -0.12 0.00 0.01 0.00 0.00 55.36 54.36 2bkh s GLN 238 Cb -0.09 0.01 0.17 0.00 -1.01 0.00 0.00 33.01 32.08 2bkh s GLN 238 CO -0.00 -0.03 1.10 0.20 0.01 0.00 0.00 175.29 176.56 2bkh s GLY 239 N -1.77 1.58 0.57 3.09 0.00 -1.26 -3.58 107.32 105.95 2bkh s GLY 239 Ca -0.10 -0.34 -0.19 0.00 0.00 0.00 0.00 44.72 44.09 2bkh s GLY 239 CO -0.02 0.24 1.18 0.54 0.00 0.00 0.00 173.10 175.04 2bkh s LYS 240 N -5.02 3.13 0.00 2.90 1.02 -1.26 -2.38 119.74 118.13 2bkh s LYS 240 Ca 0.65 1.76 0.00 0.00 0.02 0.00 0.00 55.97 58.40 2bkh s LYS 240 Cb -0.18 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 2bkh s LYS 240 CO 0.57 -1.07 0.00 0.39 -0.92 0.00 0.00 175.35 174.32 2bkh n GLU 241 N -1.45 -0.10 -4.37 1.68 1.02 -1.26 -4.88 120.64 111.27 2bkh n GLU 241 Ca 0.13 0.03 -0.22 0.00 -0.02 0.00 0.00 57.16 57.07 2bkh n GLU 241 Cb 0.50 -3.04 -0.11 0.00 -0.02 0.00 0.00 31.44 28.77 2bkh n GLU 241 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2bkh s GLU 242 N -0.26 1.39 0.29 3.49 2.02 -1.00 -3.92 118.70 120.70 2bkh s GLU 242 Ca 0.00 -1.52 0.08 0.00 0.02 0.00 0.00 54.97 53.55 2bkh s GLU 242 Cb 0.00 -1.44 -0.06 0.00 0.10 0.00 0.00 34.13 32.73 2bkh s GLU 242 CO 0.00 0.28 -0.08 1.03 0.02 0.00 0.00 175.26 176.51 2bkh s ARG 243 N -3.05 1.60 0.88 1.61 0.52 -0.84 -0.43 118.95 119.24 2bkh s ARG 243 Ca 0.20 -1.80 -0.15 0.00 -0.52 0.00 0.00 55.73 53.47 2bkh s ARG 243 Cb -0.05 -1.31 0.22 0.00 0.52 0.00 0.00 34.95 34.33 2bkh s ARG 243 CO 0.09 0.10 0.64 -1.71 0.02 0.00 0.00 175.30 174.43 2bkh n ASN 244 N -0.61 -2.54 -4.75 0.23 2.85 -1.26 -4.49 115.26 104.68 2bkh n ASN 244 Ca -0.06 -0.76 -0.38 0.00 -0.11 0.00 0.00 54.58 53.28 2bkh n ASN 244 Cb 0.63 -0.65 0.04 0.00 1.24 0.00 0.00 39.78 41.04 2bkh n ASN 244 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 2bkh s TYR 245 N -2.01 2.34 0.34 1.20 2.02 -1.26 -4.47 117.35 115.51 2bkh s TYR 245 Ca 0.45 1.42 0.09 0.00 -0.37 0.00 0.00 57.07 58.66 2bkh s TYR 245 Cb -0.06 -3.71 0.83 0.00 -0.40 0.00 0.00 41.96 38.63 2bkh s TYR 245 CO 0.36 -2.67 1.80 0.45 -1.57 0.00 0.00 175.55 173.92 2bkh h HIS 246 N 1.36 0.92 -0.77 2.71 3.86 -1.25 -2.08 115.15 119.90 2bkh h HIS 246 Ca -0.51 0.03 0.18 0.00 -1.16 0.00 0.00 60.37 58.91 2bkh h HIS 246 Cb 1.30 -0.28 -0.12 0.00 1.06 0.00 0.00 27.41 29.37 2bkh h HIS 246 CO 0.46 0.22 0.15 0.97 0.86 0.00 0.00 177.93 180.60 2bkh h ILE 247 N 0.67 0.44 -0.81 2.45 6.09 -0.88 0.36 117.51 125.84 2bkh h ILE 247 Ca 0.55 -0.08 0.06 0.00 -1.37 0.00 0.00 64.86 64.02 2bkh h ILE 247 Cb 0.97 0.20 -0.06 0.00 0.47 0.00 0.00 36.82 38.39 2bkh h ILE 247 CO -0.31 0.04 0.49 -0.26 -3.07 0.00 0.00 178.15 175.04 2bkh h PHE 248 N 0.22 0.90 0.05 2.19 -1.00 -1.65 -1.04 116.94 116.62 2bkh h PHE 248 Ca 0.44 0.03 -0.23 0.00 2.81 0.00 0.00 57.97 61.01 2bkh h PHE 248 Cb 0.79 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 40.05 2bkh h PHE 248 CO -0.30 0.45 -1.07 1.88 -1.61 0.00 0.00 178.31 177.67 2bkh h TYR 249 N 0.89 0.25 -0.60 -0.55 -1.99 -1.13 -2.52 116.97 111.33 2bkh h TYR 249 Ca 0.35 -0.17 -0.08 0.00 2.00 0.00 0.00 58.73 60.83 2bkh h TYR 249 Cb 0.18 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 38.87 2bkh h TYR 249 CO -0.04 1.10 0.08 0.00 -0.00 0.00 0.00 178.16 179.30 2bkh h ARG 250 N 0.05 1.01 -0.31 4.88 3.08 -0.84 -1.70 114.38 120.54 2bkh h ARG 250 Ca -0.07 -0.28 -0.08 0.00 0.07 0.00 0.00 59.98 59.63 2bkh h ARG 250 Cb 1.79 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.72 2bkh h ARG 250 CO 0.16 0.96 -0.10 1.25 -1.07 0.00 0.00 179.97 181.16 2bkh h LEU 251 N 0.91 0.63 -0.98 3.04 5.85 -1.23 -1.75 115.31 121.78 2bkh h LEU 251 Ca 0.18 -0.38 -0.10 0.00 0.84 0.00 0.00 57.88 58.41 2bkh h LEU 251 Cb 0.45 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2bkh h LEU 251 CO 0.02 0.87 -0.41 0.00 -0.34 0.00 0.00 178.44 178.58 2bkh h ALA 253 N 1.41 0.71 0.00 0.00 0.00 -1.32 -3.42 119.26 116.63 2bkh h ALA 253 Ca 0.02 -1.15 -0.06 0.00 0.00 0.00 0.00 54.91 53.72 2bkh h ALA 253 Cb 0.80 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2bkh h ALA 253 CO 0.06 1.25 -1.39 0.41 0.00 0.00 0.00 179.25 179.59 2bkh n GLY 254 N 1.47 -0.33 3.75 0.00 0.00 -0.66 -4.69 105.19 104.74 2bkh n GLY 254 Ca -0.13 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 2bkh n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkh n ALA 255 N -1.98 1.96 -0.68 4.61 0.00 -1.01 -4.97 120.51 118.44 2bkh n ALA 255 Ca -0.06 0.26 -0.31 0.00 0.00 0.00 0.00 53.44 53.33 2bkh n ALA 255 Cb 0.43 -2.38 0.17 0.00 0.00 0.00 0.00 19.45 17.67 2bkh n ALA 255 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bkh n SER 256 N -0.07 -0.80 0.16 0.00 3.41 -1.26 -4.75 113.62 110.31 2bkh n SER 256 Ca 0.05 0.29 0.06 0.00 -0.26 0.00 0.00 58.87 59.01 2bkh n SER 256 Cb 0.41 -1.34 0.54 0.00 -0.26 0.00 0.00 64.21 63.55 2bkh n SER 256 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2bkh h GLU 257 N -1.91 0.21 -0.17 4.33 4.39 -1.98 -1.36 114.58 118.08 2bkh h GLU 257 Ca -0.46 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.22 2bkh h GLU 257 Cb 1.29 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 2bkh h GLU 257 CO 0.40 0.16 0.09 0.22 -1.16 0.00 0.00 179.01 178.72 2bkh h ASP 258 N 0.21 0.21 0.10 1.42 1.82 -2.00 -1.65 116.42 116.53 2bkh h ASP 258 Ca 0.06 -0.08 -0.12 0.00 -0.39 0.00 0.00 57.03 56.49 2bkh h ASP 258 Cb 0.03 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 39.97 2bkh h ASP 258 CO -0.01 0.23 -0.42 0.40 -1.61 0.00 0.00 179.24 177.83 2bkh h ILE 259 N 0.17 1.31 -0.94 2.25 2.04 -1.85 -2.33 117.51 118.15 2bkh h ILE 259 Ca 0.06 -1.58 0.03 0.00 1.00 0.00 0.00 64.86 64.36 2bkh h ILE 259 Cb 0.07 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.74 2bkh h ILE 259 CO -0.01 0.49 0.62 -0.09 0.00 0.00 0.00 178.15 179.16 2bkh h ARG 260 N 0.33 1.18 0.03 2.37 1.12 -0.95 -0.98 114.38 117.48 2bkh h ARG 260 Ca 0.03 -0.07 -0.22 0.00 -1.11 0.00 0.00 59.98 58.60 2bkh h ARG 260 Cb 0.89 -0.27 -0.00 0.00 -0.01 0.00 0.00 29.97 30.58 2bkh h ARG 260 CO 0.07 0.78 -0.98 0.93 -3.11 0.00 0.00 179.97 177.67 2bkh h GLU 261 N 1.22 0.28 0.00 0.20 5.08 -1.17 -0.40 114.58 119.79 2bkh h GLU 261 Ca 0.37 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 2bkh h GLU 261 Cb -0.04 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2bkh h GLU 261 CO -0.10 1.07 -0.36 -0.09 -1.00 0.00 0.00 179.01 178.52 2bkh h ARG 262 N 0.14 0.00 -0.06 2.33 2.43 -0.88 -3.17 114.38 115.17 2bkh h ARG 262 Ca -0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2bkh h ARG 262 Cb 1.64 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.19 2bkh h ARG 262 CO 0.16 0.36 0.00 1.28 -1.51 0.00 0.00 179.97 180.26 2bkh n LEU 263 N -3.48 2.02 -3.86 3.80 4.77 -0.42 -5.00 117.00 114.83 2bkh n LEU 263 Ca 0.00 -1.16 -0.28 0.00 -0.03 0.00 0.00 56.01 54.54 2bkh n LEU 263 Cb 0.52 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.60 2bkh n LEU 263 CO 0.37 0.41 0.09 1.41 -1.33 0.00 0.00 177.39 178.34 2bkh n HIS 264 N 0.56 -2.27 -1.79 -1.77 8.25 -0.30 -4.91 115.22 113.00 2bkh n HIS 264 Ca 0.07 0.90 -0.30 0.00 -0.26 0.00 0.00 57.72 58.13 2bkh n HIS 264 Cb 0.28 -4.12 0.06 0.00 1.12 0.00 0.00 29.99 27.33 2bkh n HIS 264 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2bkh s LEU 265 N -7.18 2.82 0.00 2.41 1.43 -0.39 -5.03 118.68 112.74 2bkh s LEU 265 Ca 0.54 1.18 -0.07 0.00 -1.03 0.00 0.00 54.13 54.76 2bkh s LEU 265 Cb -0.27 -3.93 0.03 0.00 0.03 0.00 0.00 46.19 42.05 2bkh s LEU 265 CO 0.82 -1.52 0.34 -1.54 0.23 0.00 0.00 176.35 174.68 2bkh n SER 266 N -3.13 -0.91 -4.61 2.29 3.41 -1.26 -4.87 113.62 104.53 2bkh n SER 266 Ca 0.07 -1.61 -0.37 0.00 -0.26 0.00 0.00 58.87 56.71 2bkh n SER 266 Cb 0.57 1.51 0.07 0.00 -0.26 0.00 0.00 64.21 66.10 2bkh n SER 266 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2bkh n SER 267 N -1.16 0.57 0.32 4.04 3.41 -1.19 -4.85 113.62 114.75 2bkh n SER 267 Ca -0.03 0.72 0.20 0.00 -0.26 0.00 0.00 58.87 59.50 2bkh n SER 267 Cb 0.24 -1.40 1.08 0.00 -0.26 0.00 0.00 64.21 63.87 2bkh n SER 267 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2bkh h PRO 268 N 0.06 0.00 0.00 4.33 0.11 -1.84 -2.33 132.00 132.33 2bkh h PRO 268 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2bkh h PRO 268 Cb 1.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.46 2bkh h PRO 268 CO 0.48 0.01 0.00 0.38 -0.21 0.00 0.00 178.00 178.66 2bkh h ASP 269 N 0.00 0.00 0.13 -2.05 2.03 -1.89 -2.69 116.42 111.95 2bkh h ASP 269 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2bkh h ASP 269 Cb 0.09 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.59 2bkh h ASP 269 CO 0.00 0.00 -0.02 0.59 -1.03 0.00 0.00 179.24 178.79 2bkh n ASN 270 N -2.37 0.28 -4.08 4.15 4.13 -0.88 -4.80 115.26 111.70 2bkh n ASN 270 Ca 0.01 -0.89 -0.30 0.00 1.68 0.00 0.00 54.58 55.08 2bkh n ASN 270 Cb 0.19 -0.05 -0.17 0.00 -1.54 0.00 0.00 39.78 38.21 2bkh n ASN 270 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2bkh s PHE 271 N -2.15 2.20 0.27 3.10 0.08 -1.01 -4.98 117.98 115.50 2bkh s PHE 271 Ca 0.41 -1.11 0.01 0.00 0.12 0.00 0.00 56.93 56.36 2bkh s PHE 271 Cb 0.21 -1.57 0.63 0.00 -0.57 0.00 0.00 43.02 41.72 2bkh s PHE 271 CO 0.39 -0.56 1.72 -0.09 -0.10 0.00 0.00 175.22 176.58 2bkh h ARG 272 N 7.54 0.44 0.00 0.44 2.43 -1.85 0.10 114.38 123.48 2bkh h ARG 272 Ca -0.33 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 2bkh h ARG 272 Cb 1.17 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 2bkh h ARG 272 CO 0.52 0.29 0.00 0.66 -1.51 0.00 0.00 179.97 179.93 2bkh n TYR 273 N -5.00 0.00 -0.02 2.20 0.53 -1.26 -3.01 117.16 110.60 2bkh n TYR 273 Ca 0.19 0.00 -0.01 0.00 -1.02 0.00 0.00 57.90 57.06 2bkh n TYR 273 Cb 0.55 -0.46 -0.04 0.00 -1.03 0.00 0.00 39.34 38.36 2bkh n TYR 273 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 2bkh n LEU 274 N -1.46 0.00 -0.96 7.72 4.77 -0.35 -4.59 117.00 122.12 2bkh n LEU 274 Ca 0.04 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.11 2bkh n LEU 274 Cb 0.15 0.08 0.26 0.00 -2.33 0.00 0.00 43.42 41.58 2bkh n LEU 274 CO 0.12 0.08 0.71 -0.46 -1.33 0.00 0.00 177.39 176.52 2bkh n ASN 275 N -2.03 2.82 0.03 -1.43 0.23 0.20 -2.77 115.26 112.31 2bkh n ASN 275 Ca -0.06 -1.96 0.11 0.00 -0.53 0.00 0.00 54.58 52.15 2bkh n ASN 275 Cb 0.51 -0.31 -0.04 0.00 -2.08 0.00 0.00 39.78 37.86 2bkh n ASN 275 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2bkh n ARG 276 N 1.04 0.43 -0.33 -3.83 3.00 -1.26 -4.96 116.66 110.76 2bkh n ARG 276 Ca 0.18 -0.02 0.00 0.00 -0.01 0.00 0.00 57.85 58.00 2bkh n ARG 276 Cb 0.46 -1.62 0.00 0.00 0.00 0.00 0.00 32.46 31.30 2bkh n ARG 276 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2bkh n GLY 277 N 1.31 2.05 3.66 -0.13 0.00 -1.11 -4.01 105.19 106.95 2bkh n GLY 277 Ca 0.00 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.53 2bkh n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkh n THR 279 N 5.53 0.72 -3.46 0.00 -2.24 -1.26 -4.63 114.28 108.94 2bkh n THR 279 Ca 0.15 -0.78 -0.31 0.00 -2.27 0.00 0.00 64.05 60.85 2bkh n THR 279 Cb 0.44 0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 69.15 2bkh n THR 279 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2bkh s ARG 280 N -1.28 3.71 0.23 -0.78 0.52 -1.26 -4.61 118.95 115.47 2bkh s ARG 280 Ca 0.40 0.12 -0.12 0.00 -0.52 0.00 0.00 55.73 55.61 2bkh s ARG 280 Cb 0.22 -2.70 -0.08 0.00 0.52 0.00 0.00 34.95 32.91 2bkh s ARG 280 CO 0.29 0.33 0.60 0.71 0.02 0.00 0.00 175.30 177.24 2bkh s TYR 281 N -1.85 3.47 -0.28 -0.53 2.02 -1.26 -4.81 117.35 114.12 2bkh s TYR 281 Ca 0.45 1.02 -0.29 0.00 -0.37 0.00 0.00 57.07 57.88 2bkh s TYR 281 Cb -0.11 -2.36 -0.01 0.00 -0.40 0.00 0.00 41.96 39.07 2bkh s TYR 281 CO 0.24 0.28 1.53 -0.06 -1.57 0.00 0.00 175.55 175.98 2bkh s PHE 282 N -1.74 2.25 0.10 2.71 0.40 -1.26 -1.11 117.98 119.32 2bkh s PHE 282 Ca 0.46 0.65 -0.13 0.00 -0.60 0.00 0.00 56.93 57.31 2bkh s PHE 282 Cb -0.12 -4.03 0.02 0.00 0.51 0.00 0.00 43.02 39.40 2bkh s PHE 282 CO 0.20 -2.51 0.30 0.00 0.70 0.00 0.00 175.22 173.90 2bkh s ALA 283 N 5.23 -0.60 0.26 5.36 0.00 -0.94 -1.41 121.76 129.66 2bkh s ALA 283 Ca 0.67 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.38 2bkh s ALA 283 Cb -0.21 0.55 0.01 0.00 0.00 0.00 0.00 23.12 23.47 2bkh s ALA 283 CO 0.29 -0.55 0.11 0.27 0.00 0.00 0.00 175.76 175.88 2bkh n ASN 284 N -0.03 2.22 -0.31 0.00 0.23 -1.26 -4.57 115.26 111.53 2bkh n ASN 284 Ca -0.16 -1.99 0.01 0.00 -0.53 0.00 0.00 54.58 51.91 2bkh n ASN 284 Cb 0.62 0.07 0.14 0.00 -2.08 0.00 0.00 39.78 38.53 2bkh n ASN 284 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 2bkh h LYS 285 N 0.00 0.95 -0.02 -3.83 3.64 -2.00 -0.97 116.57 114.33 2bkh h LYS 285 Ca -0.18 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.11 2bkh h LYS 285 Cb 0.62 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2bkh h LYS 285 CO 0.30 0.63 -0.09 0.93 -2.27 0.00 0.00 179.45 178.94 2bkh h GLU 286 N 0.97 0.09 0.00 1.90 4.39 -2.01 -3.29 114.58 116.64 2bkh h GLU 286 Ca 0.37 -0.08 -0.06 0.00 0.34 0.00 0.00 59.36 59.93 2bkh h GLU 286 Cb 0.16 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 2bkh h GLU 286 CO -0.17 0.75 -0.30 1.79 -1.16 0.00 0.00 179.01 179.92 2bkh h THR 287 N -0.54 0.78 -0.08 1.13 1.35 -1.94 -2.58 112.91 111.03 2bkh h THR 287 Ca -0.01 -1.25 -0.02 0.00 -0.55 0.00 0.00 66.41 64.58 2bkh h THR 287 Cb 0.77 1.78 -0.01 0.00 -1.73 0.00 0.00 68.15 68.96 2bkh h THR 287 CO 0.02 0.29 -0.03 -0.78 -0.25 0.00 0.00 175.52 174.77 2bkh h ASP 288 N 0.00 0.10 1.39 5.36 3.58 -1.27 -2.07 116.42 123.51 2bkh h ASP 288 Ca -0.00 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.41 2bkh h ASP 288 Cb 0.76 -0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.78 2bkh h ASP 288 CO 0.04 0.15 -0.13 0.11 -2.88 0.00 0.00 179.24 176.53 2bkh h LYS 289 N 0.11 0.00 0.00 0.28 1.57 -1.52 -3.20 116.57 113.81 2bkh h LYS 289 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2bkh h LYS 289 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2bkh h LYS 289 CO 0.01 0.13 -0.38 1.04 -0.57 0.00 0.00 179.45 179.68 2bkh n GLN 290 N -3.19 0.03 -3.25 3.15 6.02 -0.79 -4.77 117.38 114.58 2bkh n GLN 290 Ca 0.02 0.01 -0.39 0.00 -0.01 0.00 0.00 57.00 56.63 2bkh n GLN 290 Cb 0.48 -1.52 -0.07 0.00 1.02 0.00 0.00 30.24 30.15 2bkh n GLN 290 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2bkh s ILE 291 N -3.02 5.10 0.55 5.09 1.01 -1.18 -5.03 121.20 123.72 2bkh s ILE 291 Ca 0.11 0.92 -0.22 0.00 0.00 0.00 0.00 60.65 61.46 2bkh s ILE 291 Cb 0.17 -3.83 -0.05 0.00 0.01 0.00 0.00 42.46 38.76 2bkh s ILE 291 CO 0.66 0.16 1.34 0.18 0.00 0.00 0.00 174.94 177.28 2bkh n LEU 292 N 4.97 5.42 -0.10 2.97 4.77 -1.26 -4.89 117.00 128.87 2bkh n LEU 292 Ca -0.05 0.97 0.17 0.00 -0.03 0.00 0.00 56.01 57.08 2bkh n LEU 292 Cb 0.50 -1.57 0.58 0.00 -2.33 0.00 0.00 43.42 40.60 2bkh n LEU 292 CO 0.41 -0.64 1.20 -0.61 -1.33 0.00 0.00 177.39 176.42 2bkh h GLN 293 N 1.40 0.25 0.00 3.23 5.75 -1.96 -2.05 115.11 121.72 2bkh h GLN 293 Ca -0.51 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 57.98 2bkh h GLN 293 Cb 1.31 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.80 2bkh h GLN 293 CO 0.57 0.16 0.00 0.27 -2.65 0.00 0.00 178.83 177.18 2bkh n ASN 294 N -4.44 0.00 -0.00 -0.69 6.94 -1.26 -2.23 115.26 113.58 2bkh n ASN 294 Ca 0.13 -0.83 0.09 0.00 -0.02 0.00 0.00 54.58 53.94 2bkh n ASN 294 Cb 0.56 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.87 2bkh n ASN 294 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2bkh n ARG 295 N -0.90 0.75 -3.57 -3.83 5.12 -0.77 -3.20 116.66 110.26 2bkh n ARG 295 Ca 0.14 -0.02 -0.37 0.00 -1.93 0.00 0.00 57.85 55.67 2bkh n ARG 295 Cb 0.06 -1.40 -0.07 0.00 -1.16 0.00 0.00 32.46 29.90 2bkh n ARG 295 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2bkh s LYS 296 N -2.84 4.12 0.60 5.56 1.02 -0.95 -4.27 119.74 122.99 2bkh s LYS 296 Ca 0.06 0.12 -0.13 0.00 0.02 0.00 0.00 55.97 56.03 2bkh s LYS 296 Cb 0.14 -3.37 -0.04 0.00 -0.52 0.00 0.00 37.83 34.04 2bkh s LYS 296 CO 0.78 0.36 1.03 -1.54 -0.92 0.00 0.00 175.35 175.05 2bkh s SER 297 N 0.09 6.11 0.29 2.83 1.04 -1.26 -4.85 113.70 117.96 2bkh s SER 297 Ca 0.17 1.57 0.03 0.00 0.48 0.00 0.00 55.95 58.21 2bkh s SER 297 Cb -0.13 -2.50 0.73 0.00 0.10 0.00 0.00 66.02 64.22 2bkh s SER 297 CO 0.05 -0.94 1.68 -0.65 0.98 0.00 0.00 173.24 174.35 2bkh h PRO 298 N 0.10 0.31 0.00 4.02 0.11 -1.98 -0.26 132.00 134.30 2bkh h PRO 298 Ca -0.45 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.54 2bkh h PRO 298 Cb 1.20 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2bkh h PRO 298 CO 0.60 0.21 -0.49 1.49 -0.21 0.00 0.00 178.00 179.60 2bkh h GLU 299 N 0.32 0.00 -0.05 1.05 4.57 -1.96 -2.27 114.58 116.24 2bkh h GLU 299 Ca 0.56 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.73 2bkh h GLU 299 Cb 1.10 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.69 2bkh h GLU 299 CO -0.58 0.49 0.00 -0.92 -1.18 0.00 0.00 179.01 176.83 2bkh h TYR 300 N 0.00 0.10 0.00 0.92 3.20 -1.34 -0.62 116.97 119.23 2bkh h TYR 300 Ca -0.00 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 2bkh h TYR 300 Cb 0.92 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 2bkh h TYR 300 CO 0.00 0.35 -0.09 -0.07 -1.64 0.00 0.00 178.16 176.71 2bkh h LEU 301 N -0.18 0.00 0.00 2.82 3.38 -1.29 -0.46 115.31 119.58 2bkh h LEU 301 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2bkh h LEU 301 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2bkh h LEU 301 CO 0.00 0.09 -0.35 0.50 0.09 0.00 0.00 178.44 178.78 2bkh h LYS 302 N 0.00 0.00 -0.01 1.13 3.64 -1.34 -3.40 116.57 116.59 2bkh h LYS 302 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2bkh h LYS 302 Cb 0.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2bkh h LYS 302 CO 0.01 0.19 -0.32 0.00 -2.27 0.00 0.00 179.45 177.05 2bkh n ALA 303 N -3.20 3.22 0.00 5.00 0.00 -0.25 -5.08 120.51 120.21 2bkh n ALA 303 Ca -0.07 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2bkh n ALA 303 Cb 0.22 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2bkh n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bkh n GLY 304 N 1.36 -2.24 3.90 0.00 0.00 -0.18 -4.98 105.19 103.04 2bkh n GLY 304 Ca 0.11 -1.52 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 2bkh n GLY 304 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bkh s SER 305 N -2.83 5.64 0.46 1.61 1.04 -1.26 -4.63 113.70 113.72 2bkh s SER 305 Ca 0.00 0.99 -0.18 0.00 0.48 0.00 0.00 55.95 57.24 2bkh s SER 305 Cb 0.00 -1.92 -0.09 0.00 0.10 0.00 0.00 66.02 64.11 2bkh s SER 305 CO 0.00 -1.13 0.94 -0.76 0.98 0.00 0.00 173.24 173.27 2bkh s LEU 306 N -5.16 3.81 -0.09 2.42 1.43 -0.27 -4.88 118.68 115.94 2bkh s LEU 306 Ca 0.55 1.57 0.03 0.00 -1.03 0.00 0.00 54.13 55.26 2bkh s LEU 306 Cb -0.11 -4.46 -0.01 0.00 0.03 0.00 0.00 46.19 41.64 2bkh s LEU 306 CO 0.49 -0.45 -0.18 -0.54 0.23 0.00 0.00 176.35 175.90 2bkh s LYS 307 N -3.58 2.94 -0.17 1.70 -0.14 -1.26 -2.21 119.74 117.02 2bkh s LYS 307 Ca 0.59 -0.77 -0.20 0.00 -1.36 0.00 0.00 55.97 54.23 2bkh s LYS 307 Cb -0.10 -2.41 0.05 0.00 -1.68 0.00 0.00 37.83 33.70 2bkh s LYS 307 CO 0.22 0.33 0.54 0.34 -0.76 0.00 0.00 175.35 176.03 2bkh s ASP 308 N -0.00 -0.55 0.33 2.83 2.15 -1.26 -5.05 116.67 115.12 2bkh s ASP 308 Ca -0.06 0.96 0.26 0.00 0.43 0.00 0.00 52.55 54.14 2bkh s ASP 308 Cb -0.15 0.97 1.03 0.00 -0.30 0.00 0.00 42.92 44.48 2bkh s ASP 308 CO 0.05 -0.27 1.78 1.55 -0.17 0.00 0.00 175.17 178.11 2bkh h PRO 309 N 4.84 0.00 0.00 4.34 0.13 -2.01 -3.39 132.00 135.91 2bkh h PRO 309 Ca -0.28 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2bkh h PRO 309 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2bkh h PRO 309 CO 0.21 0.00 -0.40 -0.11 -0.23 0.00 0.00 178.00 177.48 2bkh n LEU 310 N -2.47 0.68 -4.77 1.56 7.94 -1.26 -5.06 117.00 113.62 2bkh n LEU 310 Ca 0.02 0.09 -0.41 0.00 -1.11 0.00 0.00 56.01 54.60 2bkh n LEU 310 Cb 0.28 -0.21 -0.01 0.00 0.53 0.00 0.00 43.42 44.01 2bkh n LEU 310 CO 0.23 -0.46 1.01 -0.76 -1.11 0.00 0.00 177.39 176.30 2bkh s LEU 311 N -6.61 4.37 -0.30 -1.96 1.43 -1.26 -4.99 118.68 109.36 2bkh s LEU 311 Ca -0.00 2.76 -0.09 0.00 -1.03 0.00 0.00 54.13 55.78 2bkh s LEU 311 Cb 0.00 -3.69 0.17 0.00 0.03 0.00 0.00 46.19 42.70 2bkh s LEU 311 CO 0.00 -0.66 0.80 -0.62 0.23 0.00 0.00 176.35 176.10 2bkh s ASP 312 N -0.45 -0.95 0.32 2.29 2.15 -1.26 -4.48 116.67 114.28 2bkh s ASP 312 Ca 0.51 0.89 0.06 0.00 0.43 0.00 0.00 52.55 54.43 2bkh s ASP 312 Cb -0.41 1.92 0.54 0.00 -0.30 0.00 0.00 42.92 44.66 2bkh s ASP 312 CO 0.55 -0.18 1.78 0.44 -0.17 0.00 0.00 175.17 177.59 2bkh h ASP 313 N 7.88 0.35 -0.02 -0.34 3.32 -1.60 0.50 116.42 126.51 2bkh h ASP 313 Ca -0.18 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 56.73 2bkh h ASP 313 Cb 1.14 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2bkh h ASP 313 CO 0.11 0.60 -0.09 -0.74 -1.72 0.00 0.00 179.24 177.40 2bkh h HIS 314 N 0.32 0.13 -0.39 4.55 2.76 -1.87 -2.00 115.15 118.65 2bkh h HIS 314 Ca 0.05 -0.06 -0.06 0.00 -2.20 0.00 0.00 60.37 58.10 2bkh h HIS 314 Cb 0.60 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.52 2bkh h HIS 314 CO 0.01 0.73 -0.00 0.78 -1.30 0.00 0.00 177.93 178.15 2bkh h GLY 315 N -0.50 0.74 2.00 5.26 0.00 -1.89 -2.58 103.07 106.10 2bkh h GLY 315 Ca -0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 2bkh h GLY 315 CO 0.02 0.50 -0.14 -0.55 0.00 0.00 0.00 176.54 176.37 2bkh h ASP 316 N 0.51 0.00 0.43 0.19 3.45 -0.07 -1.17 116.42 119.76 2bkh h ASP 316 Ca 0.11 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.55 2bkh h ASP 316 Cb 0.47 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.25 2bkh h ASP 316 CO 0.02 0.14 -0.21 0.15 -1.57 0.00 0.00 179.24 177.77 2bkh h PHE 317 N 0.00 -0.54 -0.15 4.55 3.57 -0.95 0.19 116.94 123.61 2bkh h PHE 317 Ca -0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 2bkh h PHE 317 Cb 0.32 0.18 -0.06 0.00 2.79 0.00 0.00 35.95 39.18 2bkh h PHE 317 CO 0.00 -0.28 -0.26 0.82 -2.23 0.00 0.00 178.31 176.36 2bkh h ILE 318 N -0.70 0.38 -0.48 1.41 2.04 -1.37 -0.50 117.51 118.29 2bkh h ILE 318 Ca -0.06 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.84 2bkh h ILE 318 Cb 0.51 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2bkh h ILE 318 CO 0.10 0.00 0.32 0.03 0.00 0.00 0.00 178.15 178.60 2bkh h ARG 319 N -0.32 0.50 -0.30 2.37 3.08 -1.20 -0.67 114.38 117.85 2bkh h ARG 319 Ca 0.11 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 2bkh h ARG 319 Cb 0.48 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2bkh h ARG 319 CO -0.33 0.33 -0.12 1.98 -1.07 0.00 0.00 179.97 180.76 2bkh h MET 320 N 0.52 0.60 -0.24 0.04 4.05 0.16 -1.89 114.93 118.17 2bkh h MET 320 Ca 0.20 -0.25 -0.06 0.00 -0.28 0.00 0.00 59.70 59.30 2bkh h MET 320 Cb 0.15 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 2bkh h MET 320 CO -0.05 0.82 -0.12 0.00 0.23 0.00 0.00 176.91 177.79 2bkh h THR 322 N 0.37 1.26 -0.09 0.00 2.02 -1.08 -2.53 112.91 112.86 2bkh h THR 322 Ca 0.07 -1.19 -0.08 0.00 0.77 0.00 0.00 66.41 65.98 2bkh h THR 322 Cb 0.44 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2bkh h THR 322 CO 0.03 0.42 -0.30 0.00 0.37 0.00 0.00 175.52 176.03 2bkh h ALA 323 N 1.06 1.32 -0.37 6.16 0.00 -0.74 -2.64 119.26 124.04 2bkh h ALA 323 Ca 0.14 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 2bkh h ALA 323 Cb 0.60 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2bkh h ALA 323 CO 0.04 0.47 -0.18 0.52 0.00 0.00 0.00 179.25 180.10 2bkh h MET 324 N 0.16 0.78 -0.88 0.00 2.86 -1.02 -2.76 114.93 114.07 2bkh h MET 324 Ca 0.02 -0.34 0.03 0.00 -2.06 0.00 0.00 59.70 57.36 2bkh h MET 324 Cb 0.62 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.21 2bkh h MET 324 CO 0.04 0.96 0.56 0.87 1.06 0.00 0.00 176.91 180.41 2bkh h LYS 325 N 0.57 1.06 0.00 1.72 1.57 -1.27 -1.05 116.57 119.16 2bkh h LYS 325 Ca 0.08 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.70 2bkh h LYS 325 Cb 0.73 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 2bkh h LYS 325 CO 0.06 0.70 -0.45 0.87 -0.57 0.00 0.00 179.45 180.06 2bkh h LYS 326 N 1.09 0.00 -0.64 3.15 1.57 -1.35 -2.07 116.57 118.32 2bkh h LYS 326 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 2bkh h LYS 326 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2bkh h LYS 326 CO -0.12 0.45 0.00 0.44 -0.57 0.00 0.00 179.45 179.65 2bkh n ILE 327 N -3.94 1.07 -0.15 1.86 -5.35 -1.05 -4.90 119.36 106.90 2bkh n ILE 327 Ca -0.02 -0.63 0.00 0.00 -0.27 0.00 0.00 62.75 61.84 2bkh n ILE 327 Cb 0.48 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.22 2bkh n ILE 327 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2bkh n GLY 328 N 0.59 1.03 3.63 3.28 0.00 -0.78 -4.90 105.19 108.04 2bkh n GLY 328 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2bkh n GLY 328 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bkh s LEU 329 N 0.00 3.88 1.04 0.99 1.02 -0.42 -4.97 118.68 120.21 2bkh s LEU 329 Ca 0.00 1.80 -0.13 0.00 0.02 0.00 0.00 54.13 55.82 2bkh s LEU 329 Cb 0.00 -3.53 0.21 0.00 0.02 0.00 0.00 46.19 42.89 2bkh s LEU 329 CO 0.00 -1.37 1.09 1.51 0.02 0.00 0.00 176.35 177.60 2bkh s ASP 330 N 5.06 2.30 0.52 2.29 -4.77 -1.26 -4.03 116.67 116.78 2bkh s ASP 330 Ca 0.79 1.11 0.28 0.00 -3.30 0.00 0.00 52.55 51.43 2bkh s ASP 330 Cb -0.29 -1.74 1.42 0.00 -1.09 0.00 0.00 42.92 41.22 2bkh s ASP 330 CO 0.32 -3.32 2.05 0.44 0.70 0.00 0.00 175.17 175.36 2bkh h ASP 331 N -2.03 0.00 -0.07 2.11 3.45 -1.99 -2.61 116.42 115.29 2bkh h ASP 331 Ca -0.54 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 56.89 2bkh h ASP 331 Cb 1.33 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.10 2bkh h ASP 331 CO 0.55 0.12 -0.07 -0.33 -1.57 0.00 0.00 179.24 177.95 2bkh h GLU 332 N 0.00 0.16 -0.06 3.56 5.08 -1.99 -2.67 114.58 118.66 2bkh h GLU 332 Ca -0.00 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 2bkh h GLU 332 Cb 0.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2bkh h GLU 332 CO 0.02 0.60 -0.35 1.49 -1.00 0.00 0.00 179.01 179.77 2bkh h GLU 333 N -0.28 0.11 -0.48 2.33 4.81 -1.87 -0.87 114.58 118.33 2bkh h GLU 333 Ca 0.01 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.13 2bkh h GLU 333 Cb 0.57 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2bkh h GLU 333 CO 0.02 0.45 0.02 -0.22 -0.73 0.00 0.00 179.01 178.54 2bkh h LYS 334 N 0.10 0.83 0.00 1.92 3.64 -1.53 -1.71 116.57 119.82 2bkh h LYS 334 Ca 0.01 -0.26 -0.14 0.00 -1.27 0.00 0.00 60.65 58.99 2bkh h LYS 334 Cb 0.66 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 2bkh h LYS 334 CO 0.05 0.87 -0.68 1.25 -2.27 0.00 0.00 179.45 178.67 2bkh h LEU 335 N 0.69 0.00 -0.72 5.20 5.85 -1.13 -2.42 115.31 122.78 2bkh h LEU 335 Ca 0.14 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 2bkh h LEU 335 Cb 0.48 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2bkh h LEU 335 CO 0.02 0.68 0.44 0.44 -0.34 0.00 0.00 178.44 179.68 2bkh h ASP 336 N 0.00 0.86 -0.16 1.25 3.45 -1.00 -0.08 116.42 120.74 2bkh h ASP 336 Ca -0.01 -0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.39 2bkh h ASP 336 Cb 1.29 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.84 2bkh h ASP 336 CO 0.09 0.66 0.08 -0.07 -1.57 0.00 0.00 179.24 178.43 2bkh h LEU 337 N 0.98 0.20 -1.16 1.55 3.38 -1.05 -2.64 115.31 116.56 2bkh h LEU 337 Ca 0.26 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 2bkh h LEU 337 Cb -0.04 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2bkh h LEU 337 CO -0.05 0.25 -0.14 -0.26 0.09 0.00 0.00 178.44 178.33 2bkh h PHE 338 N 0.14 0.44 -0.67 1.13 0.05 -1.24 -2.26 116.94 114.53 2bkh h PHE 338 Ca 0.05 -0.07 -0.07 0.00 3.82 0.00 0.00 57.97 61.71 2bkh h PHE 338 Cb 0.10 -0.12 -0.03 0.00 2.00 0.00 0.00 35.95 37.91 2bkh h PHE 338 CO -0.03 0.54 0.13 -0.09 -0.18 0.00 0.00 178.31 178.68 2bkh h ARG 339 N 0.38 1.09 -0.47 1.51 2.43 -0.86 -1.37 114.38 117.10 2bkh h ARG 339 Ca 0.07 -0.28 -0.13 0.00 -0.81 0.00 0.00 59.98 58.83 2bkh h ARG 339 Cb 0.48 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2bkh h ARG 339 CO 0.03 0.99 -0.23 0.28 -1.51 0.00 0.00 179.97 179.53 2bkh h VAL 340 N 1.01 1.27 -0.40 0.20 2.07 -1.13 0.02 116.25 119.29 2bkh h VAL 340 Ca 0.21 -1.40 0.01 0.00 0.82 0.00 0.00 66.70 66.33 2bkh h VAL 340 Cb 0.41 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2bkh h VAL 340 CO 0.01 0.48 0.27 0.58 0.02 0.00 0.00 177.57 178.92 2bkh h VAL 341 N 0.83 1.10 -0.27 2.57 2.07 -1.10 -1.36 116.25 120.08 2bkh h VAL 341 Ca 0.10 -0.19 -0.15 0.00 0.82 0.00 0.00 66.70 67.29 2bkh h VAL 341 Cb 0.81 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2bkh h VAL 341 CO 0.07 0.10 -0.44 0.00 0.02 0.00 0.00 177.57 177.32 2bkh h ALA 342 N 1.15 0.73 -0.68 1.67 0.00 -1.15 -2.37 119.26 118.61 2bkh h ALA 342 Ca 0.15 -0.46 0.14 0.00 0.00 0.00 0.00 54.91 54.74 2bkh h ALA 342 Cb -0.06 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 17.52 2bkh h ALA 342 CO -0.04 0.67 0.11 0.78 0.00 0.00 0.00 179.25 180.77 2bkh h GLY 343 N 0.97 0.87 1.37 0.00 0.00 -0.54 -1.39 103.07 104.34 2bkh h GLY 343 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.27 2bkh h GLY 343 CO 0.09 -0.19 -0.15 -2.08 0.00 0.00 0.00 176.54 174.21 2bkh h VAL 344 N 0.22 1.26 -0.32 4.60 2.07 -0.90 -1.00 116.25 122.18 2bkh h VAL 344 Ca 0.37 -1.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.64 2bkh h VAL 344 Cb 0.61 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 2bkh h VAL 344 CO -0.50 0.41 0.05 -0.07 0.02 0.00 0.00 177.57 177.48 2bkh h LEU 345 N 0.67 0.50 -0.84 2.57 3.38 -0.86 -2.88 115.31 117.86 2bkh h LEU 345 Ca 0.11 -0.26 -0.12 0.00 0.09 0.00 0.00 57.88 57.70 2bkh h LEU 345 Cb 0.63 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2bkh h LEU 345 CO 0.04 0.63 -0.53 0.45 0.09 0.00 0.00 178.44 179.13 2bkh h HIS 346 N 0.35 0.17 -0.74 1.13 3.86 -1.19 -2.75 115.15 115.98 2bkh h HIS 346 Ca 0.10 -0.06 0.11 0.00 -1.16 0.00 0.00 60.37 59.36 2bkh h HIS 346 Cb 0.35 -0.03 -0.08 0.00 1.06 0.00 0.00 27.41 28.70 2bkh h HIS 346 CO 0.02 0.63 0.35 1.25 0.86 0.00 0.00 177.93 181.04 2bkh h LEU 347 N 0.11 0.41 -0.89 2.43 5.85 -1.04 -2.39 115.31 119.79 2bkh h LEU 347 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2bkh h LEU 347 Cb 0.97 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2bkh h LEU 347 CO 0.08 0.21 0.00 1.23 -0.34 0.00 0.00 178.44 179.62 2bkh h GLY 348 N 0.56 0.00 -0.60 3.75 0.00 -1.27 -2.92 103.07 102.58 2bkh h GLY 348 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2bkh h GLY 348 CO -0.32 0.00 0.00 0.70 0.00 0.00 0.00 176.54 176.92 2bkh n ASN 349 N -2.40 1.53 -4.66 0.19 3.02 -0.90 -4.53 115.26 107.53 2bkh n ASN 349 Ca 0.02 -1.59 -0.43 0.00 -0.03 0.00 0.00 54.58 52.54 2bkh n ASN 349 Cb 0.23 -0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.33 2bkh n ASN 349 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bkh s ILE 350 N -1.89 4.68 0.43 2.41 1.01 -1.11 -4.83 121.20 121.90 2bkh s ILE 350 Ca 0.35 1.94 0.08 0.00 0.00 0.00 0.00 60.65 63.02 2bkh s ILE 350 Cb 0.19 -4.30 -0.01 0.00 0.01 0.00 0.00 42.46 38.35 2bkh s ILE 350 CO 0.30 -0.21 0.43 -1.81 0.00 0.00 0.00 174.94 173.65 2bkh s ASP 351 N 1.27 5.16 0.08 3.58 1.01 -1.26 -4.98 116.67 121.53 2bkh s ASP 351 Ca 0.43 -0.70 -0.02 0.00 0.71 0.00 0.00 52.55 52.97 2bkh s ASP 351 Cb -0.15 -0.53 -0.04 0.00 1.01 0.00 0.00 42.92 43.22 2bkh s ASP 351 CO 0.07 -0.71 0.02 -0.36 0.21 0.00 0.00 175.17 174.40 2bkh s PHE 352 N -2.47 0.62 -0.04 4.23 0.40 -1.26 -2.55 117.98 116.92 2bkh s PHE 352 Ca 0.49 -1.10 -0.04 0.00 -0.60 0.00 0.00 56.93 55.69 2bkh s PHE 352 Cb -0.05 -0.40 0.01 0.00 0.51 0.00 0.00 43.02 43.09 2bkh s PHE 352 CO 0.29 -0.45 0.10 -1.83 0.70 0.00 0.00 175.22 174.03 2bkh s GLU 353 N -3.97 0.14 -0.32 0.44 -1.05 -0.30 -4.80 118.70 108.86 2bkh s GLU 353 Ca 0.13 0.09 -0.36 0.00 -0.15 0.00 0.00 54.97 54.69 2bkh s GLU 353 Cb 0.08 0.07 -0.12 0.00 -0.44 0.00 0.00 34.13 33.71 2bkh s GLU 353 CO -0.05 -0.02 2.11 -1.91 0.95 0.00 0.00 175.26 176.33 2bkh n GLU 354 N 2.90 1.17 0.00 -4.83 2.13 -1.26 -1.44 120.64 119.31 2bkh n GLU 354 Ca -0.13 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.04 2bkh n GLU 354 Cb 0.59 -2.42 0.00 0.00 0.27 0.00 0.00 31.44 29.88 2bkh n GLU 354 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2bkh n ALA 355 N 8.98 0.00 -0.09 4.31 0.00 -1.26 -4.90 120.51 127.54 2bkh n ALA 355 Ca 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.80 2bkh n ALA 355 Cb 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.65 2bkh n ALA 355 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bkh n GLY 361 N -0.10 -2.67 3.58 0.00 0.00 -1.26 -5.08 105.19 99.66 2bkh n GLY 361 Ca 0.00 0.65 -0.09 0.00 0.00 0.00 0.00 46.02 46.57 2bkh n GLY 361 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkh s ASN 363 N -2.90 -0.01 0.11 0.00 0.01 -0.52 -4.92 114.94 106.70 2bkh s ASN 363 Ca 0.11 -0.11 -0.31 0.00 -0.71 0.00 0.00 52.86 51.84 2bkh s ASN 363 Cb -0.02 0.23 -0.11 0.00 0.41 0.00 0.00 41.25 41.77 2bkh s ASN 363 CO 0.00 -0.31 1.85 0.18 -1.51 0.00 0.00 177.10 177.31 2bkh n LEU 364 N 1.73 4.03 -4.57 0.60 4.32 -1.26 -1.15 117.00 120.70 2bkh n LEU 364 Ca -0.21 0.98 -0.34 0.00 -0.02 0.00 0.00 56.01 56.42 2bkh n LEU 364 Cb 0.56 -1.54 0.11 0.00 -1.62 0.00 0.00 43.42 40.93 2bkh n LEU 364 CO 0.21 0.17 0.40 0.29 -1.22 0.00 0.00 177.39 177.24 2bkh n LYS 365 N 5.79 0.14 0.06 3.23 5.02 -1.06 -4.87 118.16 126.47 2bkh n LYS 365 Ca 0.18 0.11 -0.07 0.00 -2.02 0.00 0.00 58.31 56.51 2bkh n LYS 365 Cb 0.37 -2.15 0.07 0.00 -0.02 0.00 0.00 35.03 33.30 2bkh n LYS 365 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 2bkh h ASN 366 N -0.85 0.38 0.12 4.39 -0.73 -1.93 -2.95 115.58 114.01 2bkh h ASN 366 Ca -0.46 -0.23 -0.00 0.00 1.87 0.00 0.00 56.30 57.48 2bkh h ASN 366 Cb 1.31 -0.11 -0.00 0.00 0.27 0.00 0.00 38.32 39.79 2bkh h ASN 366 CO 0.43 0.93 -0.01 0.07 -0.37 0.00 0.00 177.43 178.48 2bkh h LYS 367 N 0.24 0.00 -0.16 6.67 2.10 -1.99 -2.88 116.57 120.56 2bkh h LYS 367 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2bkh h LYS 367 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 2bkh h LYS 367 CO 0.11 0.01 0.00 0.43 -2.00 0.00 0.00 179.45 177.99 2bkh n SER 368 N -3.23 1.59 -0.32 7.07 7.64 -1.11 -4.40 113.62 120.85 2bkh n SER 368 Ca -0.03 -1.69 0.01 0.00 1.01 0.00 0.00 58.87 58.17 2bkh n SER 368 Cb 0.10 -0.10 0.19 0.00 -1.01 0.00 0.00 64.21 63.40 2bkh n SER 368 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2bkh h THR 369 N 2.11 1.15 0.08 0.44 2.02 -1.65 -2.16 112.91 114.91 2bkh h THR 369 Ca 0.00 -0.39 -0.25 0.00 0.77 0.00 0.00 66.41 66.54 2bkh h THR 369 Cb 0.46 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 2bkh h THR 369 CO 0.00 0.21 -1.13 0.06 0.37 0.00 0.00 175.52 175.03 2bkh h GLN 370 N 1.15 0.19 -0.29 6.66 3.07 -1.86 -2.44 115.11 121.59 2bkh h GLN 370 Ca 0.37 -0.30 0.05 0.00 0.09 0.00 0.00 58.65 58.86 2bkh h GLN 370 Cb 0.02 0.11 -0.05 0.00 0.08 0.00 0.00 27.48 27.65 2bkh h GLN 370 CO -0.11 1.13 -0.02 0.00 0.09 0.00 0.00 178.83 179.92 2bkh h ALA 371 N 0.74 0.23 -0.42 0.06 0.00 -1.79 0.49 119.26 118.57 2bkh h ALA 371 Ca -0.09 0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2bkh h ALA 371 Cb 1.87 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 19.76 2bkh h ALA 371 CO 0.18 -0.43 0.06 1.25 0.00 0.00 0.00 179.25 180.31 2bkh h LEU 372 N 0.06 -0.05 -0.42 0.00 5.85 -1.39 0.23 115.31 119.58 2bkh h LEU 372 Ca 0.14 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 2bkh h LEU 372 Cb 0.19 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2bkh h LEU 372 CO -0.25 0.01 0.25 -0.08 -0.34 0.00 0.00 178.44 178.04 2bkh h GLU 373 N 0.18 0.58 -0.13 1.25 4.81 -0.92 0.75 114.58 121.10 2bkh h GLU 373 Ca 0.21 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 2bkh h GLU 373 Cb 0.27 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 2bkh h GLU 373 CO -0.29 0.43 -0.15 1.88 -0.73 0.00 0.00 179.01 180.15 2bkh h TYR 374 N 0.56 0.40 -0.35 0.92 0.99 -0.55 -1.30 116.97 117.65 2bkh h TYR 374 Ca 0.15 -0.12 0.04 0.00 2.00 0.00 0.00 58.73 60.80 2bkh h TYR 374 Cb 0.00 -0.08 -0.04 0.00 1.00 0.00 0.00 36.73 37.61 2bkh h TYR 374 CO -0.03 0.74 0.12 0.00 -0.00 0.00 0.00 178.16 178.99 2bkh h ALA 376 N 1.23 0.74 -0.37 0.00 0.00 -0.78 -0.49 119.26 119.59 2bkh h ALA 376 Ca 0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2bkh h ALA 376 Cb 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2bkh h ALA 376 CO -0.17 0.56 0.18 1.49 0.00 0.00 0.00 179.25 181.31 2bkh h GLU 377 N 0.85 0.53 -0.05 0.00 4.81 -1.04 0.21 114.58 119.89 2bkh h GLU 377 Ca 0.16 -0.08 -0.16 0.00 -0.13 0.00 0.00 59.36 59.15 2bkh h GLU 377 Cb 0.53 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2bkh h GLU 377 CO 0.03 0.47 -0.69 -0.07 -0.73 0.00 0.00 179.01 178.01 2bkh h LEU 378 N 0.45 0.27 -2.00 1.64 3.38 -0.87 -2.77 115.31 115.41 2bkh h LEU 378 Ca 0.13 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2bkh h LEU 378 Cb 0.11 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2bkh h LEU 378 CO -0.02 0.87 0.00 0.18 0.09 0.00 0.00 178.44 179.57 2bkh n LEU 379 N -3.80 2.95 -2.98 1.67 4.77 -0.23 -4.68 117.00 114.70 2bkh n LEU 379 Ca -0.03 -1.36 -0.18 0.00 -0.03 0.00 0.00 56.01 54.40 2bkh n LEU 379 Cb 0.68 -0.29 0.07 0.00 -2.33 0.00 0.00 43.42 41.55 2bkh n LEU 379 CO 0.45 0.68 0.19 0.61 -1.33 0.00 0.00 177.39 177.99 2bkh n GLY 380 N 1.40 -0.24 3.43 -0.72 0.00 -0.60 -4.62 105.19 103.84 2bkh n GLY 380 Ca 0.19 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 2bkh n GLY 380 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bkh s LEU 381 N -5.98 2.50 0.15 0.99 1.43 0.63 -0.09 118.68 118.30 2bkh s LEU 381 Ca 0.41 -0.57 -0.31 0.00 -1.03 0.00 0.00 54.13 52.63 2bkh s LEU 381 Cb -0.18 -1.42 -0.08 0.00 0.03 0.00 0.00 46.19 44.54 2bkh s LEU 381 CO 0.58 0.22 1.39 -0.62 0.23 0.00 0.00 176.35 178.15 2bkh s ASP 382 N -1.76 6.81 0.28 2.29 -1.08 -1.26 -4.25 116.67 117.70 2bkh s ASP 382 Ca 0.15 2.39 0.03 0.00 -0.52 0.00 0.00 52.55 54.59 2bkh s ASP 382 Cb -0.10 -2.59 0.63 0.00 -1.46 0.00 0.00 42.92 39.40 2bkh s ASP 382 CO 0.06 -0.64 1.78 1.56 0.52 0.00 0.00 175.17 178.45 2bkh h GLN 383 N 6.38 0.71 -0.02 4.34 4.20 -1.91 -2.06 115.11 126.76 2bkh h GLN 383 Ca -0.43 -0.04 -0.15 0.00 0.06 0.00 0.00 58.65 58.09 2bkh h GLN 383 Cb 1.21 -0.16 0.01 0.00 0.30 0.00 0.00 27.48 28.84 2bkh h GLN 383 CO 0.84 0.47 -0.56 0.22 -0.67 0.00 0.00 178.83 179.13 2bkh h ASP 384 N 0.74 0.53 -0.92 1.46 1.82 -1.98 -1.93 116.42 116.14 2bkh h ASP 384 Ca 0.52 -0.74 0.09 0.00 -0.39 0.00 0.00 57.03 56.52 2bkh h ASP 384 Cb 0.75 -0.16 -0.07 0.00 0.68 0.00 0.00 39.33 40.54 2bkh h ASP 384 CO -0.36 1.20 0.59 0.44 -1.61 0.00 0.00 179.24 179.49 2bkh h ASP 385 N -0.09 0.85 -0.20 2.28 3.32 -1.88 -1.37 116.42 119.33 2bkh h ASP 385 Ca -0.07 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 2bkh h ASP 385 Cb 1.27 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.66 2bkh h ASP 385 CO 0.11 0.51 -0.24 0.25 -1.72 0.00 0.00 179.24 178.15 2bkh h LEU 386 N 0.95 0.56 -0.67 1.55 5.85 -1.35 -1.34 115.31 120.85 2bkh h LEU 386 Ca 0.42 -0.50 0.06 0.00 0.84 0.00 0.00 57.88 58.71 2bkh h LEU 386 Cb 0.36 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 2bkh h LEU 386 CO -0.18 0.94 0.37 -0.09 -0.34 0.00 0.00 178.44 179.14 2bkh h ARG 387 N 0.19 0.66 -0.10 1.25 2.43 -0.95 -1.55 114.38 116.30 2bkh h ARG 387 Ca 0.03 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.08 2bkh h ARG 387 Cb 0.80 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 2bkh h ARG 387 CO 0.06 0.44 -0.24 0.28 -1.51 0.00 0.00 179.97 179.00 2bkh h VAL 388 N 0.68 1.39 0.00 0.20 2.07 -1.15 -2.84 116.25 116.60 2bkh h VAL 388 Ca 0.30 -1.55 0.00 0.00 0.82 0.00 0.00 66.70 66.27 2bkh h VAL 388 Cb 0.20 2.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2bkh h VAL 388 CO -0.19 0.45 0.00 0.28 0.02 0.00 0.00 177.57 178.13 2bkh h SER 389 N -0.10 0.00 0.80 0.57 0.02 -1.11 0.23 113.55 113.96 2bkh h SER 389 Ca -0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.71 2bkh h SER 389 Cb 0.84 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.36 2bkh h SER 389 CO 0.05 0.00 -1.20 -0.07 -1.14 0.00 0.00 176.83 174.48 2bkh h LEU 390 N 0.00 0.12 -0.81 5.07 3.38 -1.24 -3.37 115.31 118.47 2bkh h LEU 390 Ca 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2bkh h LEU 390 Cb 0.42 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2bkh h LEU 390 CO 0.00 1.12 -0.46 0.35 0.09 0.00 0.00 178.44 179.54 2bkh n THR 391 N -3.36 0.00 -3.88 0.22 -2.24 -0.90 -4.45 114.28 99.68 2bkh n THR 391 Ca -0.06 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.35 2bkh n THR 391 Cb 0.98 1.19 -0.09 0.00 -2.10 0.00 0.00 70.33 70.31 2bkh n THR 391 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2bkh s THR 392 N -2.22 0.11 0.07 4.28 -4.23 0.74 -1.04 115.64 113.35 2bkh s THR 392 Ca 0.14 -0.93 0.05 0.00 -1.18 0.00 0.00 61.69 59.78 2bkh s THR 392 Cb 0.15 -0.83 -0.03 0.00 1.34 0.00 0.00 72.50 73.13 2bkh s THR 392 CO 0.51 -0.51 -0.13 0.00 -0.54 0.00 0.00 174.62 173.95 2bkh s ARG 393 N -2.38 0.80 0.71 3.99 1.70 -0.52 -4.37 118.95 118.89 2bkh s ARG 393 Ca -0.07 -0.97 -0.08 0.00 -0.47 0.00 0.00 55.73 54.15 2bkh s ARG 393 Cb -0.02 -0.74 0.06 0.00 -0.57 0.00 0.00 34.95 33.68 2bkh s ARG 393 CO -0.03 0.16 1.04 0.14 -1.08 0.00 0.00 175.30 175.52 2bkh s VAL 394 N -1.46 2.36 -0.23 4.99 -7.23 -1.26 -1.39 120.40 116.17 2bkh s VAL 394 Ca -0.01 -0.19 -0.27 0.00 -1.81 0.00 0.00 61.98 59.70 2bkh s VAL 394 Cb -0.09 -3.05 0.12 0.00 0.56 0.00 0.00 36.38 33.92 2bkh s VAL 394 CO 0.02 -0.05 0.99 -0.04 -0.31 0.00 0.00 175.10 175.71 2bkh s MET 395 N -5.28 0.57 0.36 4.82 -1.94 -1.01 -4.89 119.30 111.92 2bkh s MET 395 Ca 0.60 0.46 -0.20 0.00 -1.71 0.00 0.00 55.69 54.83 2bkh s MET 395 Cb -0.11 0.27 -0.10 0.00 2.01 0.00 0.00 34.83 36.91 2bkh s MET 395 CO 0.46 -0.11 0.87 -1.17 -0.01 0.00 0.00 175.02 175.06 2bkh s LEU 396 N -0.25 4.09 0.19 -0.03 2.96 -1.26 -1.55 118.68 122.83 2bkh s LEU 396 Ca 0.01 1.59 0.25 0.00 -0.22 0.00 0.00 54.13 55.76 2bkh s LEU 396 Cb -0.03 -4.22 0.90 0.00 0.50 0.00 0.00 46.19 43.34 2bkh s LEU 396 CO -0.03 -0.22 1.75 0.35 -1.32 0.00 0.00 176.35 176.89 2bkh n THR 397 N -0.18 0.63 -4.55 3.68 -2.24 -0.14 -4.79 114.28 106.68 2bkh n THR 397 Ca 0.04 -0.06 -0.25 0.00 -2.27 0.00 0.00 64.05 61.51 2bkh n THR 397 Cb 0.53 -0.78 -0.11 0.00 -2.10 0.00 0.00 70.33 67.86 2bkh n THR 397 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2bkh s THR 398 N -3.15 1.70 0.00 4.28 -4.23 -1.26 -4.94 115.64 108.03 2bkh s THR 398 Ca 0.09 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 2bkh s THR 398 Cb 0.12 -2.89 0.00 0.00 1.34 0.00 0.00 72.50 71.06 2bkh s THR 398 CO 0.50 -0.02 0.00 0.00 -0.54 0.00 0.00 174.62 174.57 2bkh n ALA 399 N -0.85 1.88 -2.59 3.99 0.00 -1.26 -4.95 120.51 116.74 2bkh n ALA 399 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.10 2bkh n ALA 399 Cb 0.67 0.27 -0.01 0.00 0.00 0.00 0.00 19.45 20.38 2bkh n ALA 399 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bkh n GLY 400 N 2.56 5.84 0.00 0.00 0.00 -1.26 -4.94 105.19 107.38 2bkh n GLY 400 Ca 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 46.02 43.29 2bkh n GLY 400 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bkh n GLY 401 N -0.38 3.08 3.67 -0.02 0.00 -1.26 -5.05 105.19 105.23 2bkh n GLY 401 Ca 0.39 -0.89 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 2bkh n GLY 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkh n ALA 402 N 0.00 0.78 -1.65 4.61 0.00 -1.26 -4.88 120.51 118.11 2bkh n ALA 402 Ca 0.00 0.13 -0.47 0.00 0.00 0.00 0.00 53.44 53.11 2bkh n ALA 402 Cb 0.00 -2.20 -0.04 0.00 0.00 0.00 0.00 19.45 17.21 2bkh n ALA 402 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2bkh n LYS 403 N -0.59 1.91 -4.38 0.00 4.81 -1.26 -4.81 118.16 113.85 2bkh n LYS 403 Ca 0.11 0.69 -0.19 0.00 -0.87 0.00 0.00 58.31 58.04 2bkh n LYS 403 Cb 0.43 -2.38 -0.10 0.00 0.02 0.00 0.00 35.03 33.00 2bkh n LYS 403 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2bkh s GLY 404 N 0.59 1.90 0.15 3.14 0.00 -1.26 -4.85 107.32 106.99 2bkh s GLY 404 Ca 0.76 -1.94 0.11 0.00 0.00 0.00 0.00 44.72 43.64 2bkh s GLY 404 CO 0.44 -1.69 -0.23 -1.59 0.00 0.00 0.00 173.10 170.02 2bkh s THR 405 N -3.55 2.46 -0.10 0.90 2.01 -1.26 -4.87 115.64 111.24 2bkh s THR 405 Ca 0.37 -1.78 -0.26 0.00 0.31 0.00 0.00 61.69 60.32 2bkh s THR 405 Cb 0.08 -2.14 -0.02 0.00 0.01 0.00 0.00 72.50 70.43 2bkh s THR 405 CO 0.15 0.02 0.84 -0.69 -0.69 0.00 0.00 174.62 174.25 2bkh s VAL 406 N -1.30 4.92 0.25 3.82 1.01 -1.26 -0.96 120.40 126.87 2bkh s VAL 406 Ca 0.17 1.71 0.11 0.00 0.00 0.00 0.00 61.98 63.98 2bkh s VAL 406 Cb -0.09 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 2bkh s VAL 406 CO 0.09 0.12 -0.19 0.27 0.00 0.00 0.00 175.10 175.38 2bkh s ILE 407 N 1.50 2.32 -0.23 2.22 -4.36 -0.60 -4.98 121.20 117.08 2bkh s ILE 407 Ca 0.42 -2.32 -0.09 0.00 -0.26 0.00 0.00 60.65 58.40 2bkh s ILE 407 Cb -0.18 -2.22 -0.04 0.00 1.25 0.00 0.00 42.46 41.27 2bkh s ILE 407 CO 0.18 -0.40 0.12 -0.54 0.24 0.00 0.00 174.94 174.54 2bkh s LYS 408 N -3.41 3.94 -0.17 0.37 1.02 -1.26 -2.41 119.74 117.81 2bkh s LYS 408 Ca 0.27 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 55.92 2bkh s LYS 408 Cb -0.05 -3.43 0.01 0.00 -0.52 0.00 0.00 37.83 33.84 2bkh s LYS 408 CO 0.13 0.02 -0.16 0.08 -0.92 0.00 0.00 175.35 174.50 2bkh s VAL 409 N 1.12 2.48 0.43 3.17 1.01 -0.49 -5.01 120.40 123.10 2bkh s VAL 409 Ca 0.06 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.00 2bkh s VAL 409 Cb -0.14 -2.05 -0.10 0.00 0.00 0.00 0.00 36.38 34.09 2bkh s VAL 409 CO 0.04 0.52 0.98 -2.84 0.00 0.00 0.00 175.10 173.80 2bkh s PRO 410 N 1.05 4.15 -0.02 2.72 0.02 -1.26 -1.43 135.00 140.22 2bkh s PRO 410 Ca -0.01 1.24 -0.04 0.00 0.02 0.00 0.00 61.00 62.22 2bkh s PRO 410 Cb -0.14 -2.26 -0.04 0.00 0.02 0.00 0.00 34.50 32.08 2bkh s PRO 410 CO -0.05 -0.12 0.19 -0.51 -0.33 0.00 0.00 177.00 176.19 2bkh s LEU 411 N -3.09 4.37 0.96 -5.54 1.43 -0.21 -4.84 118.68 111.76 2bkh s LEU 411 Ca 0.62 0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 53.99 2bkh s LEU 411 Cb -0.13 -2.57 0.16 0.00 0.03 0.00 0.00 46.19 43.69 2bkh s LEU 411 CO 0.17 0.28 1.09 -0.54 0.23 0.00 0.00 176.35 177.58 2bkh s LYS 412 N -1.81 0.77 0.18 1.70 1.02 -1.26 -2.48 119.74 117.86 2bkh s LYS 412 Ca 0.26 0.62 -0.13 0.00 0.02 0.00 0.00 55.97 56.74 2bkh s LYS 412 Cb -0.13 -1.77 0.14 0.00 -0.52 0.00 0.00 37.83 35.56 2bkh s LYS 412 CO 0.17 -2.52 1.79 0.28 -0.92 0.00 0.00 175.35 174.14 2bkh h VAL 413 N -1.75 0.95 0.00 3.17 2.07 -1.91 -2.10 116.25 116.69 2bkh h VAL 413 Ca -0.52 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 2bkh h VAL 413 Cb 1.31 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2bkh h VAL 413 CO 0.57 0.09 -0.14 -0.33 0.02 0.00 0.00 177.57 177.78 2bkh h GLU 414 N 0.50 0.00 0.00 1.57 4.39 -1.98 -2.12 114.58 116.94 2bkh h GLU 414 Ca 0.23 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.78 2bkh h GLU 414 Cb 0.14 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2bkh h GLU 414 CO -0.16 0.14 -0.71 1.96 -1.16 0.00 0.00 179.01 179.08 2bkh h GLN 415 N 0.00 0.00 -0.17 2.33 4.20 -1.76 -3.00 115.11 116.71 2bkh h GLN 415 Ca -0.00 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.55 2bkh h GLN 415 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.46 2bkh h GLN 415 CO 0.02 0.71 -0.52 0.00 -0.67 0.00 0.00 178.83 178.37 2bkh h ALA 416 N 1.29 0.29 -0.78 3.87 0.00 -0.78 -2.24 119.26 120.91 2bkh h ALA 416 Ca -0.01 -0.50 0.11 0.00 0.00 0.00 0.00 54.91 54.51 2bkh h ALA 416 Cb 1.45 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.13 2bkh h ALA 416 CO 0.09 0.48 0.40 -0.91 0.00 0.00 0.00 179.25 179.32 2bkh h ASN 417 N 0.32 0.53 -0.40 0.00 -0.26 -1.51 -1.48 115.58 112.78 2bkh h ASN 417 Ca -0.02 0.07 -0.12 0.00 -0.56 0.00 0.00 56.30 55.67 2bkh h ASN 417 Cb 1.14 -0.03 -0.02 0.00 -1.06 0.00 0.00 38.32 38.36 2bkh h ASN 417 CO 0.11 0.28 -0.19 0.78 -1.06 0.00 0.00 177.43 177.36 2bkh h ASN 418 N 0.66 0.90 -0.23 5.81 -0.26 -1.41 -1.64 115.58 119.41 2bkh h ASN 418 Ca 0.39 -0.32 -0.19 0.00 -0.56 0.00 0.00 56.30 55.62 2bkh h ASN 418 Cb 0.44 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 37.46 2bkh h ASN 418 CO -0.29 1.07 -0.62 0.00 -1.06 0.00 0.00 177.43 176.53 2bkh h ALA 419 N 1.00 0.38 -0.32 -0.83 0.00 -1.18 0.86 119.26 119.17 2bkh h ALA 419 Ca 0.11 -0.54 0.06 0.00 0.00 0.00 0.00 54.91 54.54 2bkh h ALA 419 Cb 0.73 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 2bkh h ALA 419 CO 0.06 0.64 -0.05 -0.09 0.00 0.00 0.00 179.25 179.81 2bkh h ARG 420 N 0.57 0.04 -0.09 0.00 1.12 -1.20 -0.44 114.38 114.38 2bkh h ARG 420 Ca -0.01 -0.00 -0.20 0.00 -1.11 0.00 0.00 59.98 58.65 2bkh h ARG 420 Cb 1.24 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 31.19 2bkh h ARG 420 CO 0.13 0.02 -0.79 -0.44 -3.11 0.00 0.00 179.97 175.79 2bkh h ASP 421 N 0.04 0.65 -0.41 -3.80 3.32 -1.25 -1.90 116.42 113.06 2bkh h ASP 421 Ca 0.15 -0.44 0.01 0.00 0.02 0.00 0.00 57.03 56.77 2bkh h ASP 421 Cb 0.22 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2bkh h ASP 421 CO -0.30 1.21 0.26 0.00 -1.72 0.00 0.00 179.24 178.69 2bkh h ALA 422 N 0.77 0.53 -0.54 3.45 0.00 -0.75 0.00 119.26 122.72 2bkh h ALA 422 Ca -0.05 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2bkh h ALA 422 Cb 1.39 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2bkh h ALA 422 CO 0.14 -0.05 0.09 1.25 0.00 0.00 0.00 179.25 180.69 2bkh h LEU 423 N 0.53 0.80 -0.19 0.00 5.85 -0.93 -1.93 115.31 119.45 2bkh h LEU 423 Ca 0.16 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2bkh h LEU 423 Cb -0.03 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 2bkh h LEU 423 CO -0.05 0.81 0.07 0.00 -0.34 0.00 0.00 178.44 178.93 2bkh h ALA 424 N 1.29 0.25 -0.61 1.25 0.00 -0.83 -1.52 119.26 119.09 2bkh h ALA 424 Ca 0.17 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2bkh h ALA 424 Cb 0.35 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2bkh h ALA 424 CO 0.01 -0.15 0.18 0.87 0.00 0.00 0.00 179.25 180.15 2bkh h LYS 425 N 0.15 0.93 -0.23 0.00 1.57 -0.81 -0.69 116.57 117.50 2bkh h LYS 425 Ca 0.06 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.54 2bkh h LYS 425 Cb 0.18 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 2bkh h LYS 425 CO -0.00 0.81 -0.30 1.15 -0.57 0.00 0.00 179.45 180.53 2bkh h THR 426 N 0.90 1.32 0.11 -0.16 2.02 -1.23 -0.36 112.91 115.51 2bkh h THR 426 Ca 0.20 -1.50 -0.01 0.00 0.77 0.00 0.00 66.41 65.88 2bkh h THR 426 Cb 0.28 1.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 2bkh h THR 426 CO -0.01 0.47 -0.05 0.58 0.37 0.00 0.00 175.52 176.88 2bkh h VAL 427 N 0.31 0.99 -0.54 3.16 2.07 -1.17 -1.84 116.25 119.22 2bkh h VAL 427 Ca 0.03 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 2bkh h VAL 427 Cb 0.88 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 2bkh h VAL 427 CO 0.07 0.10 0.33 0.22 0.02 0.00 0.00 177.57 178.31 2bkh h TYR 428 N -0.34 0.71 -0.75 1.57 5.03 -1.13 -1.09 116.97 120.96 2bkh h TYR 428 Ca -0.02 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.25 2bkh h TYR 428 Cb 0.28 -0.23 -0.03 0.00 1.55 0.00 0.00 36.73 38.29 2bkh h TYR 428 CO -0.01 0.48 0.29 1.03 -1.32 0.00 0.00 178.16 178.63 2bkh h SER 429 N 0.72 1.03 0.06 -2.11 0.87 -1.06 -0.64 113.55 112.43 2bkh h SER 429 Ca 0.19 -0.16 -0.11 0.00 -1.23 0.00 0.00 61.79 60.48 2bkh h SER 429 Cb -0.02 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.66 2bkh h SER 429 CO -0.04 0.92 -0.36 0.45 -0.53 0.00 0.00 176.83 177.27 2bkh h HIS 430 N 1.09 0.48 -0.59 2.24 3.86 -1.05 -1.21 115.15 119.98 2bkh h HIS 430 Ca 0.25 -0.12 -0.08 0.00 -1.16 0.00 0.00 60.37 59.26 2bkh h HIS 430 Cb 0.22 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 2bkh h HIS 430 CO 0.02 0.72 0.07 1.25 0.86 0.00 0.00 177.93 180.85 2bkh h LEU 431 N 0.35 0.95 -0.59 2.43 5.85 -0.86 -1.07 115.31 122.38 2bkh h LEU 431 Ca 0.04 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 2bkh h LEU 431 Cb 0.80 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 2bkh h LEU 431 CO 0.06 0.99 0.27 0.15 -0.34 0.00 0.00 178.44 179.58 2bkh h PHE 432 N 0.89 0.85 -0.83 1.25 3.57 -0.69 -1.38 116.94 120.60 2bkh h PHE 432 Ca 0.17 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.65 2bkh h PHE 432 Cb 0.46 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 2bkh h PHE 432 CO 0.03 0.66 0.55 -0.44 -2.23 0.00 0.00 178.31 176.89 2bkh h ASP 433 N 0.80 0.93 -0.45 0.41 3.45 -0.99 -1.73 116.42 118.84 2bkh h ASP 433 Ca 0.20 -0.02 -0.07 0.00 0.43 0.00 0.00 57.03 57.57 2bkh h ASP 433 Cb 0.14 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.67 2bkh h ASP 433 CO -0.02 0.66 0.01 -0.74 -1.57 0.00 0.00 179.24 177.57 2bkh h HIS 434 N 1.09 0.86 -0.68 4.55 2.76 -0.79 -1.81 115.15 121.12 2bkh h HIS 434 Ca 0.32 -0.15 -0.04 0.00 -2.20 0.00 0.00 60.37 58.30 2bkh h HIS 434 Cb -0.06 -0.22 -0.03 0.00 1.55 0.00 0.00 27.41 28.65 2bkh h HIS 434 CO -0.00 0.83 0.27 0.28 -1.30 0.00 0.00 177.93 178.02 2bkh h VAL 435 N 0.63 1.24 -0.31 5.26 2.07 -0.69 -1.16 116.25 123.30 2bkh h VAL 435 Ca 0.13 -0.76 -0.16 0.00 0.82 0.00 0.00 66.70 66.72 2bkh h VAL 435 Cb 0.49 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2bkh h VAL 435 CO 0.02 0.30 -0.45 0.58 0.02 0.00 0.00 177.57 178.05 2bkh h VAL 436 N 0.97 1.28 -0.34 2.57 2.07 -1.26 -1.77 116.25 119.77 2bkh h VAL 436 Ca 0.23 -1.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.10 2bkh h VAL 436 Cb 0.21 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 2bkh h VAL 436 CO -0.02 0.53 0.12 -1.13 0.02 0.00 0.00 177.57 177.09 2bkh h ASN 437 N 0.63 0.43 -0.33 0.57 -0.73 -1.14 -1.74 115.58 113.28 2bkh h ASN 437 Ca 0.03 -0.04 -0.12 0.00 1.87 0.00 0.00 56.30 58.04 2bkh h ASN 437 Cb 1.05 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 39.51 2bkh h ASN 437 CO 0.10 0.41 -0.21 -0.09 -0.37 0.00 0.00 177.43 177.27 2bkh h ARG 438 N 0.48 0.81 -0.55 6.67 9.65 -0.86 -2.34 114.38 128.24 2bkh h ARG 438 Ca 0.12 -0.33 -0.02 0.00 -1.10 0.00 0.00 59.98 58.65 2bkh h ARG 438 Cb 0.13 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.65 2bkh h ARG 438 CO -0.01 0.95 0.26 0.28 2.80 0.00 0.00 179.97 184.25 2bkh h VAL 439 N 0.71 1.20 0.00 0.20 2.07 -0.87 -3.03 116.25 116.53 2bkh h VAL 439 Ca 0.10 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 2bkh h VAL 439 Cb 0.74 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2bkh h VAL 439 CO 0.06 0.23 -0.07 0.78 0.02 0.00 0.00 177.57 178.59 2bkh h ASN 440 N 0.74 0.00 0.15 0.57 2.35 -0.97 -1.58 115.58 116.84 2bkh h ASN 440 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2bkh h ASN 440 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2bkh h ASN 440 CO -0.02 0.07 0.00 0.00 -1.65 0.00 0.00 177.43 175.83 2bkh n GLN 441 N -3.47 0.65 0.00 0.81 6.02 -0.91 -2.90 117.38 117.57 2bkh n GLN 441 Ca -0.02 0.02 0.13 0.00 -0.01 0.00 0.00 57.00 57.12 2bkh n GLN 441 Cb 0.21 -1.50 0.45 0.00 1.02 0.00 0.00 30.24 30.41 2bkh n GLN 441 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bkh n PHE 443 N -0.86 -1.90 -1.65 0.00 1.16 -1.14 -5.03 117.46 108.05 2bkh n PHE 443 Ca 0.12 -2.27 -0.30 0.00 -1.87 0.00 0.00 57.45 53.13 2bkh n PHE 443 Cb 0.32 1.18 0.08 0.00 -1.61 0.00 0.00 39.48 39.46 2bkh n PHE 443 CO 0.00 0.00 0.00 -1.25 -1.87 0.00 0.00 176.76 173.64 2bkh s PRO 444 N -0.44 2.19 -0.13 3.97 0.04 -1.23 -2.35 135.00 137.06 2bkh s PRO 444 Ca 0.24 0.55 -0.20 0.00 0.04 0.00 0.00 61.00 61.63 2bkh s PRO 444 Cb 0.37 -1.94 0.05 0.00 0.04 0.00 0.00 34.50 33.02 2bkh s PRO 444 CO -0.06 -1.52 0.51 -0.59 0.04 0.00 0.00 177.00 175.38 2bkh s PHE 445 N -3.23 -0.51 0.02 0.56 -0.12 -1.26 -4.78 117.98 108.66 2bkh s PHE 445 Ca 0.60 1.10 -0.19 0.00 -0.05 0.00 0.00 56.93 58.40 2bkh s PHE 445 Cb -0.13 0.22 -0.21 0.00 -0.63 0.00 0.00 43.02 42.26 2bkh s PHE 445 CO 0.53 -0.37 1.15 1.05 -0.05 0.00 0.00 175.22 177.54 2bkh h GLU 446 N 4.55 0.44 -4.40 1.99 4.11 -1.98 -3.47 114.58 115.80 2bkh h GLU 446 Ca -0.28 -0.41 -0.20 0.00 0.07 0.00 0.00 59.36 58.54 2bkh h GLU 446 Cb 1.17 0.10 -0.18 0.00 0.50 0.00 0.00 28.75 30.35 2bkh h GLU 446 CO 0.27 1.07 -0.70 -0.08 0.07 0.00 0.00 179.01 179.63 2bkh s THR 447 N -3.40 0.43 -0.08 -1.06 -1.32 -1.26 -5.16 115.64 103.79 2bkh s THR 447 Ca -0.13 -1.50 -0.24 0.00 -1.21 0.00 0.00 61.69 58.61 2bkh s THR 447 Cb 0.04 -1.11 0.05 0.00 -1.51 0.00 0.00 72.50 69.97 2bkh s THR 447 CO 0.82 -0.71 0.55 -0.94 -2.21 0.00 0.00 174.62 172.12 2bkh s SER 448 N -2.35 -0.51 -0.13 8.08 1.04 -1.26 -4.83 113.70 113.74 2bkh s SER 448 Ca 0.00 0.64 -0.08 0.00 0.48 0.00 0.00 55.95 56.99 2bkh s SER 448 Cb -0.01 0.63 -0.26 0.00 0.10 0.00 0.00 66.02 66.48 2bkh s SER 448 CO -0.04 -0.47 0.35 -1.20 0.98 0.00 0.00 173.24 172.87 2bkh n SER 449 N 1.46 2.10 -3.98 7.02 7.64 -0.00 -4.99 113.62 122.86 2bkh n SER 449 Ca -0.18 0.23 -0.09 0.00 1.01 0.00 0.00 58.87 59.83 2bkh n SER 449 Cb 0.56 -0.88 -0.06 0.00 -1.01 0.00 0.00 64.21 62.83 2bkh n SER 449 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2bkh s TYR 450 N -2.54 0.39 0.08 1.43 1.51 -1.14 -4.90 117.35 112.19 2bkh s TYR 450 Ca -0.23 -0.74 0.01 0.00 -1.01 0.00 0.00 57.07 55.10 2bkh s TYR 450 Cb 0.07 0.09 -0.04 0.00 -0.11 0.00 0.00 41.96 41.97 2bkh s TYR 450 CO 0.75 -0.90 -0.06 -0.59 -1.11 0.00 0.00 175.55 173.64 2bkh s PHE 451 N -4.01 0.79 -0.18 2.71 -0.71 -1.26 -0.23 117.98 115.09 2bkh s PHE 451 Ca 0.22 -0.87 -0.00 0.00 -1.04 0.00 0.00 56.93 55.24 2bkh s PHE 451 Cb 0.01 -0.47 0.01 0.00 -1.21 0.00 0.00 43.02 41.35 2bkh s PHE 451 CO 0.06 -0.18 -0.15 0.42 -1.34 0.00 0.00 175.22 174.04 2bkh s ILE 452 N -3.29 2.50 0.01 -4.49 1.01 -0.44 -0.62 121.20 115.89 2bkh s ILE 452 Ca 0.07 -0.80 0.07 0.00 0.00 0.00 0.00 60.65 59.99 2bkh s ILE 452 Cb 0.03 -2.08 -0.02 0.00 0.01 0.00 0.00 42.46 40.41 2bkh s ILE 452 CO -0.05 0.51 -0.21 -0.83 0.00 0.00 0.00 174.94 174.36 2bkh s GLY 453 N 1.22 1.07 -0.18 6.18 0.00 -0.32 -0.73 107.32 114.55 2bkh s GLY 453 Ca 0.02 -0.97 -0.05 0.00 0.00 0.00 0.00 44.72 43.72 2bkh s GLY 453 CO -0.07 -0.85 -0.00 0.14 0.00 0.00 0.00 173.10 172.32 2bkh s VAL 454 N -0.62 4.09 -0.17 1.40 1.01 -0.42 -0.31 120.40 125.38 2bkh s VAL 454 Ca 0.08 -0.28 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 2bkh s VAL 454 Cb -0.08 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 2bkh s VAL 454 CO 0.00 0.46 0.08 -0.22 0.00 0.00 0.00 175.10 175.42 2bkh s LEU 455 N 0.65 3.93 -0.16 3.92 2.96 -0.21 -1.14 118.68 128.64 2bkh s LEU 455 Ca -0.00 0.16 -0.00 0.00 -0.22 0.00 0.00 54.13 54.06 2bkh s LEU 455 Cb -0.14 -1.99 0.04 0.00 0.50 0.00 0.00 46.19 44.60 2bkh s LEU 455 CO 0.02 0.22 -0.06 -0.62 -1.32 0.00 0.00 176.35 174.59 2bkh s ASP 456 N 0.08 2.71 -0.11 3.68 -1.08 0.32 -2.48 116.67 119.78 2bkh s ASP 456 Ca 0.06 -0.59 -0.13 0.00 -0.52 0.00 0.00 52.55 51.37 2bkh s ASP 456 Cb -0.12 -0.92 0.03 0.00 -1.46 0.00 0.00 42.92 40.46 2bkh s ASP 456 CO 0.00 -0.17 0.35 -0.51 0.52 0.00 0.00 175.17 175.36 2bkh s ILE 457 N 1.64 0.01 0.05 4.11 2.07 -1.26 -0.40 121.20 127.41 2bkh s ILE 457 Ca 0.02 -0.09 -0.38 0.00 -1.41 0.00 0.00 60.65 58.79 2bkh s ILE 457 Cb -0.15 -0.52 -0.19 0.00 0.13 0.00 0.00 42.46 41.74 2bkh s ILE 457 CO -0.08 -0.05 1.12 0.00 -1.91 0.00 0.00 174.94 174.02 2bkh n ALA 458 N 2.59 -2.63 -1.95 1.50 0.00 -1.26 -4.83 120.51 113.92 2bkh n ALA 458 Ca -0.15 0.56 -0.26 0.00 0.00 0.00 0.00 53.44 53.59 2bkh n ALA 458 Cb 0.57 -1.86 0.12 0.00 0.00 0.00 0.00 19.45 18.28 2bkh n ALA 458 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2bkh s GLY 459 N 0.07 1.74 0.28 0.00 0.00 -1.26 -4.85 107.32 103.30 2bkh s GLY 459 Ca 0.86 -1.29 -0.30 0.00 0.00 0.00 0.00 44.72 44.00 2bkh s GLY 459 CO 0.54 -0.72 1.32 0.33 0.00 0.00 0.00 173.10 174.57 2bkh n PHE 460 N -3.14 2.12 -3.71 1.90 7.35 -1.26 -4.86 117.46 115.86 2bkh n PHE 460 Ca 0.13 0.51 -0.14 0.00 -0.76 0.00 0.00 57.45 57.18 2bkh n PHE 460 Cb 0.60 -2.42 -0.09 0.00 0.35 0.00 0.00 39.48 37.92 2bkh n PHE 460 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 2bkh s GLU 461 N -1.08 0.67 0.04 -4.13 -1.05 -1.26 -4.90 118.70 106.98 2bkh s GLU 461 Ca 0.62 0.21 -0.06 0.00 -0.15 0.00 0.00 54.97 55.60 2bkh s GLU 461 Cb -0.62 0.31 -0.01 0.00 -0.44 0.00 0.00 34.13 33.36 2bkh s GLU 461 CO 0.56 -0.16 0.10 1.52 0.95 0.00 0.00 175.26 178.23 2bkh s TYR 462 N -0.66 0.21 0.20 4.83 -0.85 -1.26 -4.89 117.35 114.92 2bkh s TYR 462 Ca -0.08 -0.53 0.02 0.00 -0.52 0.00 0.00 57.07 55.97 2bkh s TYR 462 Cb -0.04 -0.15 -0.01 0.00 0.38 0.00 0.00 41.96 42.15 2bkh s TYR 462 CO 0.04 -0.38 0.08 1.19 -1.52 0.00 0.00 175.55 174.97 2bkh n PHE 463 N 0.70 -0.01 -0.18 -3.49 3.01 -1.26 -5.05 117.46 111.19 2bkh n PHE 463 Ca -0.19 -1.32 -0.08 0.00 1.01 0.00 0.00 57.45 56.87 2bkh n PHE 463 Cb 0.59 0.02 0.01 0.00 -0.01 0.00 0.00 39.48 40.09 2bkh n PHE 463 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2bkh h GLU 464 N 0.00 0.73 -5.23 -1.08 5.08 -2.02 -3.41 114.58 108.65 2bkh h GLU 464 Ca -0.15 -0.11 -0.67 0.00 -1.00 0.00 0.00 59.36 57.43 2bkh h GLU 464 Cb 0.60 -0.13 -0.31 0.00 0.50 0.00 0.00 28.75 29.42 2bkh h GLU 464 CO 0.24 0.62 -0.82 -1.01 -1.00 0.00 0.00 179.01 177.04 2bkh s HIS 465 N -5.68 2.74 -0.18 4.33 3.76 -1.26 -5.02 115.29 113.97 2bkh s HIS 465 Ca -0.13 -1.04 0.01 0.00 -0.15 0.00 0.00 55.06 53.75 2bkh s HIS 465 Cb 0.12 -1.85 0.03 0.00 1.11 0.00 0.00 32.58 31.99 2bkh s HIS 465 CO 0.77 -0.46 -0.15 -0.80 -0.85 0.00 0.00 174.74 173.25 2bkh s ASN 466 N 0.70 3.21 0.00 1.40 0.01 -1.26 -5.04 114.94 113.96 2bkh s ASN 466 Ca -0.08 -0.75 0.00 0.00 -0.71 0.00 0.00 52.86 51.33 2bkh s ASN 466 Cb -0.16 -1.33 0.00 0.00 0.41 0.00 0.00 41.25 40.17 2bkh s ASN 466 CO 0.01 -0.08 0.00 -0.24 -1.51 0.00 0.00 177.10 175.29 2bkh n SER 467 N 4.66 0.58 0.12 -1.22 2.88 -1.26 -1.94 113.62 117.45 2bkh n SER 467 Ca -0.17 -0.03 0.04 0.00 -1.33 0.00 0.00 58.87 57.37 2bkh n SER 467 Cb 0.48 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 64.38 2bkh n SER 467 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 2bkh h PHE 468 N 0.01 0.25 -0.28 0.66 3.57 -1.89 -2.45 116.94 116.81 2bkh h PHE 468 Ca 0.00 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 2bkh h PHE 468 Cb 0.00 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 2bkh h PHE 468 CO 0.00 0.30 0.16 0.93 -2.23 0.00 0.00 178.31 177.46 2bkh h GLU 469 N 0.24 0.38 -0.62 1.11 3.07 -1.99 -1.71 114.58 115.06 2bkh h GLU 469 Ca 0.05 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 58.82 2bkh h GLU 469 Cb 0.24 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.04 2bkh h GLU 469 CO 0.01 0.32 0.15 1.96 -1.40 0.00 0.00 179.01 180.05 2bkh h GLN 470 N 0.34 0.96 -0.35 2.33 7.50 -1.85 -2.60 115.11 121.44 2bkh h GLN 470 Ca 0.10 -0.21 -0.00 0.00 0.50 0.00 0.00 58.65 59.04 2bkh h GLN 470 Cb 0.04 -0.14 -0.02 0.00 0.05 0.00 0.00 27.48 27.42 2bkh h GLN 470 CO -0.02 0.85 0.21 0.35 -1.50 0.00 0.00 178.83 178.73 2bkh h PHE 471 N 0.92 0.47 0.33 2.96 3.04 -1.06 0.31 116.94 123.92 2bkh h PHE 471 Ca 0.20 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.13 2bkh h PHE 471 Cb 0.33 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.69 2bkh h PHE 471 CO 0.02 0.34 -0.16 0.00 -2.02 0.00 0.00 178.31 176.50 2bkh h ILE 473 N -0.49 0.81 0.00 0.00 2.04 -1.33 0.16 117.51 118.70 2bkh h ILE 473 Ca -0.04 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.57 2bkh h ILE 473 Cb 0.37 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2bkh h ILE 473 CO 0.07 0.08 -0.45 0.78 0.00 0.00 0.00 178.15 178.63 2bkh h ASN 474 N 0.43 0.00 -0.10 1.72 2.35 -0.86 -0.98 115.58 118.14 2bkh h ASN 474 Ca 0.29 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.00 2bkh h ASN 474 Cb 0.33 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.70 2bkh h ASN 474 CO -0.28 0.45 -0.11 0.22 -1.65 0.00 0.00 177.43 176.06 2bkh h TYR 475 N 0.00 0.30 -0.32 1.19 3.20 -0.33 -0.28 116.97 120.74 2bkh h TYR 475 Ca -0.00 -0.09 0.07 0.00 3.14 0.00 0.00 58.73 61.84 2bkh h TYR 475 Cb 0.91 -0.06 -0.07 0.00 1.54 0.00 0.00 36.73 39.04 2bkh h TYR 475 CO 0.00 0.68 -0.19 0.00 -1.64 0.00 0.00 178.16 177.01 2bkh h ASN 477 N -0.16 0.00 -0.42 0.00 2.35 -1.13 -1.65 115.58 114.58 2bkh h ASN 477 Ca 0.16 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2bkh h ASN 477 Cb 0.41 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 2bkh h ASN 477 CO -0.41 0.29 0.21 -0.08 -1.65 0.00 0.00 177.43 175.80 2bkh h GLU 478 N 0.00 0.60 -0.39 0.81 4.57 -0.42 0.67 114.58 120.43 2bkh h GLU 478 Ca -0.00 -0.08 -0.14 0.00 -1.18 0.00 0.00 59.36 57.96 2bkh h GLU 478 Cb 0.69 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 2bkh h GLU 478 CO 0.04 0.51 -0.31 0.87 -1.18 0.00 0.00 179.01 178.94 2bkh h LYS 479 N 0.54 0.84 -0.16 1.92 1.57 -1.04 -1.84 116.57 118.41 2bkh h LYS 479 Ca 0.15 -0.39 -0.08 0.00 -1.87 0.00 0.00 60.65 58.45 2bkh h LYS 479 Cb 0.10 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2bkh h LYS 479 CO -0.02 1.03 -0.25 -0.07 -0.57 0.00 0.00 179.45 179.57 2bkh h LEU 480 N 0.71 0.29 -0.38 2.94 3.38 -1.17 -2.40 115.31 118.69 2bkh h LEU 480 Ca 0.08 -0.09 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 2bkh h LEU 480 Cb 0.86 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 2bkh h LEU 480 CO 0.08 0.55 -0.48 -0.61 0.09 0.00 0.00 178.44 178.06 2bkh h GLN 481 N 0.26 0.85 -0.86 1.13 5.75 -0.53 -0.72 115.11 120.99 2bkh h GLN 481 Ca 0.04 -0.50 0.04 0.00 -0.15 0.00 0.00 58.65 58.08 2bkh h GLN 481 Cb 0.59 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.13 2bkh h GLN 481 CO 0.04 1.14 0.56 0.37 -2.65 0.00 0.00 178.83 178.29 2bkh h GLN 482 N 0.67 1.05 -0.44 1.69 4.15 -1.23 -0.27 115.11 120.72 2bkh h GLN 482 Ca 0.03 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.37 2bkh h GLN 482 Cb 1.08 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 28.51 2bkh h GLN 482 CO 0.11 0.69 0.20 0.35 -1.93 0.00 0.00 178.83 178.25 2bkh h PHE 483 N 1.08 0.64 -0.49 3.99 3.57 -1.08 -0.03 116.94 124.62 2bkh h PHE 483 Ca 0.35 -0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.87 2bkh h PHE 483 Cb 0.02 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 38.51 2bkh h PHE 483 CO -0.02 0.53 0.20 0.35 -2.23 0.00 0.00 178.31 177.14 2bkh h PHE 484 N 0.56 0.35 -0.21 0.41 -0.00 -0.79 -2.46 116.94 114.80 2bkh h PHE 484 Ca 0.15 0.02 -0.09 0.00 -0.00 0.00 0.00 57.97 58.05 2bkh h PHE 484 Cb 0.14 -0.08 -0.00 0.00 -0.00 0.00 0.00 35.95 36.01 2bkh h PHE 484 CO -0.01 0.14 -0.23 -0.91 -0.00 0.00 0.00 178.31 177.30 2bkh h ASN 485 N 0.39 0.57 -0.77 0.41 -0.26 -0.82 -2.10 115.58 112.99 2bkh h ASN 485 Ca 0.23 -0.48 0.09 0.00 -0.56 0.00 0.00 56.30 55.58 2bkh h ASN 485 Cb 0.21 -0.16 -0.07 0.00 -1.06 0.00 0.00 38.32 37.24 2bkh h ASN 485 CO -0.21 0.94 0.42 -0.33 -1.06 0.00 0.00 177.43 177.19 2bkh h GLU 486 N 0.21 0.70 0.01 0.81 5.08 -0.89 -0.64 114.58 119.87 2bkh h GLU 486 Ca 0.03 -0.04 -0.21 0.00 -1.00 0.00 0.00 59.36 58.14 2bkh h GLU 486 Cb 0.78 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 2bkh h GLU 486 CO 0.06 0.46 -0.93 0.00 -1.00 0.00 0.00 179.01 177.60 2bkh h ARG 487 N 0.72 0.25 -0.40 2.33 2.47 -1.32 -1.98 114.38 116.45 2bkh h ARG 487 Ca 0.37 -0.29 -0.09 0.00 -1.26 0.00 0.00 59.98 58.71 2bkh h ARG 487 Cb 0.35 0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.74 2bkh h ARG 487 CO -0.25 1.01 -0.12 0.82 0.56 0.00 0.00 179.97 182.00 2bkh h ILE 488 N 0.13 1.28 -0.65 2.04 1.08 -1.19 -0.62 117.51 119.58 2bkh h ILE 488 Ca -0.06 -1.22 0.09 0.00 -0.39 0.00 0.00 64.86 63.29 2bkh h ILE 488 Cb 1.57 1.23 -0.07 0.00 -3.07 0.00 0.00 36.82 36.48 2bkh h ILE 488 CO 0.15 0.41 0.28 0.25 -0.69 0.00 0.00 178.15 178.55 2bkh h LEU 489 N 0.60 0.33 -0.18 1.44 5.85 -0.99 -1.09 115.31 121.27 2bkh h LEU 489 Ca 0.10 0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 2bkh h LEU 489 Cb 0.65 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 2bkh h LEU 489 CO 0.04 0.19 -0.28 0.50 -0.34 0.00 0.00 178.44 178.56 2bkh h LYS 490 N 0.49 0.50 -0.93 1.25 3.64 -1.23 -2.08 116.57 118.21 2bkh h LYS 490 Ca 0.32 -0.30 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 2bkh h LYS 490 Cb 0.37 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.16 2bkh h LYS 490 CO -0.29 0.90 0.58 0.93 -2.27 0.00 0.00 179.45 179.31 2bkh h GLU 491 N 0.15 1.02 0.07 1.90 5.08 -0.83 -1.39 114.58 120.58 2bkh h GLU 491 Ca 0.02 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2bkh h GLU 491 Cb 0.85 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2bkh h GLU 491 CO 0.06 0.68 -0.03 0.93 -1.00 0.00 0.00 179.01 179.65 2bkh h GLU 492 N 1.05 -0.09 -0.77 2.33 4.39 -1.13 -0.79 114.58 119.58 2bkh h GLU 492 Ca 0.41 0.01 0.14 0.00 0.34 0.00 0.00 59.36 60.25 2bkh h GLU 492 Cb 0.20 0.02 -0.09 0.00 -0.10 0.00 0.00 28.75 28.77 2bkh h GLU 492 CO -0.18 0.34 0.33 1.96 -1.16 0.00 0.00 179.01 180.30 2bkh h GLN 493 N -0.54 0.48 -0.28 2.33 4.20 -1.33 -1.17 115.11 118.78 2bkh h GLN 493 Ca -0.01 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.56 2bkh h GLN 493 Cb 0.47 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2bkh h GLN 493 CO 0.02 0.32 -0.29 0.93 -0.67 0.00 0.00 178.83 179.13 2bkh h GLU 494 N 0.49 0.58 -0.63 1.46 5.08 -1.22 -2.32 114.58 118.02 2bkh h GLU 494 Ca 0.42 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 58.47 2bkh h GLU 494 Cb 0.60 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 2bkh h GLU 494 CO -0.38 0.81 0.17 1.25 -1.00 0.00 0.00 179.01 179.86 2bkh h LEU 495 N 0.50 0.95 -0.72 1.33 5.85 -0.46 -1.07 115.31 121.69 2bkh h LEU 495 Ca 0.06 -0.22 -0.12 0.00 0.84 0.00 0.00 57.88 58.44 2bkh h LEU 495 Cb 0.75 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2bkh h LEU 495 CO 0.06 0.92 -0.33 1.88 -0.34 0.00 0.00 178.44 180.63 2bkh h TYR 496 N 0.93 0.71 -0.02 1.25 0.05 -1.07 -1.07 116.97 117.75 2bkh h TYR 496 Ca 0.20 -0.18 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 2bkh h TYR 496 Cb 0.33 -0.16 -0.00 0.00 1.01 0.00 0.00 36.73 37.91 2bkh h TYR 496 CO 0.02 0.86 -0.02 0.37 -1.05 0.00 0.00 178.16 178.35 2bkh h GLN 497 N 0.52 0.05 -0.69 4.88 5.75 -1.32 -0.86 115.11 123.44 2bkh h GLN 497 Ca 0.06 -0.03 0.18 0.00 -0.15 0.00 0.00 58.65 58.71 2bkh h GLN 497 Cb 0.82 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.34 2bkh h GLN 497 CO 0.07 0.56 0.48 -0.22 -2.65 0.00 0.00 178.83 177.07 2bkh h LYS 498 N -0.47 0.14 -0.01 1.69 3.64 -1.05 -1.26 116.57 119.26 2bkh h LYS 498 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2bkh h LYS 498 Cb 0.56 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2bkh h LYS 498 CO 0.01 0.09 -0.30 0.39 -2.27 0.00 0.00 179.45 177.37 2bkh n GLU 499 N -4.40 1.09 -1.35 1.90 -0.58 -0.42 -4.88 120.64 112.00 2bkh n GLU 499 Ca 0.13 -0.76 0.00 0.00 -0.42 0.00 0.00 57.16 56.12 2bkh n GLU 499 Cb 0.66 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 2bkh n GLU 499 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2bkh n GLY 500 N 1.36 0.50 0.00 0.62 0.00 -0.48 -1.86 105.19 105.34 2bkh n GLY 500 Ca 0.12 -0.88 0.13 0.00 0.00 0.00 0.00 46.02 45.39 2bkh n GLY 500 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bkh n LEU 501 N 0.00 0.00 0.00 0.99 4.77 -0.37 -4.94 117.00 117.45 2bkh n LEU 501 Ca 0.00 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.47 2bkh n LEU 501 Cb 0.23 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 2bkh n LEU 501 CO 0.00 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.63 2bkh n GLY 502 N 1.24 0.35 3.61 -0.72 0.00 -1.26 -4.85 105.19 103.56 2bkh n GLY 502 Ca 0.07 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 2bkh n GLY 502 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bkh s VAL 503 N 0.00 4.95 -0.31 1.61 1.01 -1.26 -4.79 120.40 121.60 2bkh s VAL 503 Ca 0.00 0.98 0.03 0.00 0.00 0.00 0.00 61.98 63.00 2bkh s VAL 503 Cb 0.00 -3.98 0.17 0.00 0.00 0.00 0.00 36.38 32.56 2bkh s VAL 503 CO 0.00 -0.08 0.45 0.20 0.00 0.00 0.00 175.10 175.67 2bkh s ASN 504 N 1.57 0.09 0.16 3.32 0.01 -1.26 -5.13 114.94 113.70 2bkh s ASN 504 Ca 0.26 -0.55 -0.30 0.00 -0.71 0.00 0.00 52.86 51.56 2bkh s ASN 504 Cb -0.15 1.21 -0.07 0.00 0.41 0.00 0.00 41.25 42.65 2bkh s ASN 504 CO 0.10 -0.32 0.99 -1.61 -1.51 0.00 0.00 177.10 174.76 2bkh s GLU 505 N 2.33 4.71 -0.15 -0.60 2.02 -1.26 -4.99 118.70 120.75 2bkh s GLU 505 Ca 0.11 1.53 -0.06 0.00 0.02 0.00 0.00 54.97 56.58 2bkh s GLU 505 Cb -0.12 -3.33 -0.04 0.00 0.10 0.00 0.00 34.13 30.75 2bkh s GLU 505 CO -0.23 0.24 0.04 0.14 0.02 0.00 0.00 175.26 175.47 2bkh s VAL 506 N -0.32 4.59 -0.14 2.63 -7.23 -1.26 -4.92 120.40 113.74 2bkh s VAL 506 Ca 0.46 -0.12 -0.29 0.00 -1.81 0.00 0.00 61.98 60.22 2bkh s VAL 506 Cb -0.25 -3.02 -0.04 0.00 0.56 0.00 0.00 36.38 33.62 2bkh s VAL 506 CO 0.32 0.51 1.66 -2.28 -0.31 0.00 0.00 175.10 175.00 2bkh s HIS 507 N -0.00 2.00 -0.24 2.82 2.46 -1.25 -4.97 115.29 116.10 2bkh s HIS 507 Ca 0.05 0.38 0.03 0.00 0.47 0.00 0.00 55.06 55.99 2bkh s HIS 507 Cb -0.12 -3.95 0.05 0.00 -0.13 0.00 0.00 32.58 28.43 2bkh s HIS 507 CO 0.01 -3.42 -0.13 -0.47 -2.47 0.00 0.00 174.74 168.27 2bkh s TYR 508 N 4.82 3.17 -0.60 3.88 6.04 -1.26 -4.64 117.35 128.77 2bkh s TYR 508 Ca 0.74 -2.20 -0.22 0.00 0.04 0.00 0.00 57.07 55.44 2bkh s TYR 508 Cb -0.29 -1.93 0.07 0.00 -1.04 0.00 0.00 41.96 38.77 2bkh s TYR 508 CO 0.30 -0.87 0.85 0.54 -1.54 0.00 0.00 175.55 174.83 2bkh s VAL 509 N 1.14 4.52 0.71 3.14 0.11 -1.26 -5.05 120.40 123.70 2bkh s VAL 509 Ca -0.06 -0.39 -0.14 0.00 -2.93 0.00 0.00 61.98 58.46 2bkh s VAL 509 Cb -0.19 -4.56 0.02 0.00 -1.53 0.00 0.00 36.38 30.13 2bkh s VAL 509 CO -0.07 -1.23 1.12 -0.62 -3.33 0.00 0.00 175.10 170.98 2bkh s ASP 510 N 3.36 4.75 -0.14 3.54 -1.08 -1.26 -4.97 116.67 120.87 2bkh s ASP 510 Ca 0.20 2.02 0.15 0.00 -0.52 0.00 0.00 52.55 54.40 2bkh s ASP 510 Cb -0.18 -2.55 0.53 0.00 -1.46 0.00 0.00 42.92 39.26 2bkh s ASP 510 CO 0.11 -1.88 1.44 -0.46 0.52 0.00 0.00 175.17 174.91 2bkh n ASN 511 N -2.78 3.95 -0.15 -0.34 6.94 -1.26 -4.62 115.26 117.00 2bkh n ASN 511 Ca 0.11 -2.72 0.17 0.00 -0.02 0.00 0.00 54.58 52.11 2bkh n ASN 511 Cb 0.52 -0.49 0.54 0.00 -2.36 0.00 0.00 39.78 37.99 2bkh n ASN 511 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 2bkh h GLN 512 N 2.31 0.33 -0.40 -3.83 5.75 -1.98 -2.30 115.11 114.99 2bkh h GLN 512 Ca 0.00 -0.02 -0.10 0.00 -0.15 0.00 0.00 58.65 58.38 2bkh h GLN 512 Cb 1.34 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.80 2bkh h GLN 512 CO 0.20 0.22 -0.16 0.38 -2.65 0.00 0.00 178.83 176.82 2bkh h ASP 513 N 0.34 0.74 -0.64 -0.69 2.03 -1.99 0.15 116.42 116.36 2bkh h ASP 513 Ca 0.36 -0.24 -0.08 0.00 -0.73 0.00 0.00 57.03 56.34 2bkh h ASP 513 Cb 0.93 -0.20 -0.02 0.00 -0.83 0.00 0.00 39.33 39.21 2bkh h ASP 513 CO -0.10 0.91 0.08 0.00 -1.03 0.00 0.00 179.24 179.10 2bkh h ILE 515 N 0.99 1.20 -0.82 0.00 2.04 -1.04 -2.68 117.51 117.21 2bkh h ILE 515 Ca 0.19 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.42 2bkh h ILE 515 Cb 0.46 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 2bkh h ILE 515 CO 0.02 0.22 0.53 0.44 0.00 0.00 0.00 178.15 179.35 2bkh h ASP 516 N 0.34 0.95 -0.72 1.72 3.45 -0.66 0.71 116.42 122.21 2bkh h ASP 516 Ca 0.10 -0.03 0.06 0.00 0.43 0.00 0.00 57.03 57.59 2bkh h ASP 516 Cb 0.24 -0.24 -0.06 0.00 -0.56 0.00 0.00 39.33 38.71 2bkh h ASP 516 CO -0.00 0.70 0.41 0.25 -1.57 0.00 0.00 179.24 179.03 2bkh h LEU 517 N 1.12 0.62 0.01 1.55 5.85 -1.05 -0.85 115.31 122.56 2bkh h LEU 517 Ca 0.30 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 59.05 2bkh h LEU 517 Cb -0.11 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.83 2bkh h LEU 517 CO -0.06 0.39 -0.01 0.40 -0.34 0.00 0.00 178.44 178.82 2bkh h ILE 518 N 0.75 1.54 -0.01 4.05 2.04 -1.06 0.71 117.51 125.55 2bkh h ILE 518 Ca 0.32 -1.97 0.00 0.00 1.00 0.00 0.00 64.86 64.22 2bkh h ILE 518 Cb 0.20 2.83 0.00 0.00 -0.74 0.00 0.00 36.82 39.11 2bkh h ILE 518 CO -0.19 0.49 -0.20 -1.84 0.00 0.00 0.00 178.15 176.41 2bkh n GLU 519 N -4.69 2.49 -1.80 2.37 0.28 0.18 -1.85 120.64 117.62 2bkh n GLU 519 Ca -0.09 -0.47 -0.38 0.00 -0.16 0.00 0.00 57.16 56.05 2bkh n GLU 519 Cb 0.39 -1.01 0.04 0.00 1.43 0.00 0.00 31.44 32.29 2bkh n GLU 519 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2bkh s ALA 520 N -1.27 2.84 0.40 -1.84 0.00 -0.33 -4.82 121.76 116.73 2bkh s ALA 520 Ca 0.06 1.32 -0.26 0.00 0.00 0.00 0.00 51.96 53.09 2bkh s ALA 520 Cb 0.07 -3.56 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 2bkh s ALA 520 CO 0.22 -1.34 1.28 1.03 0.00 0.00 0.00 175.76 176.95 2bkh s ARG 521 N -2.89 4.01 0.00 0.00 0.52 -1.26 -0.74 118.95 118.60 2bkh s ARG 521 Ca 0.71 2.11 0.00 0.00 -0.52 0.00 0.00 55.73 58.03 2bkh s ARG 521 Cb -0.40 -2.77 0.00 0.00 0.52 0.00 0.00 34.95 32.30 2bkh s ARG 521 CO 0.47 -0.44 0.00 1.28 0.02 0.00 0.00 175.30 176.64 2bkh n LEU 522 N 0.18 0.00 -0.00 2.53 4.77 -1.26 -4.28 117.00 118.94 2bkh n LEU 522 Ca 0.03 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.10 2bkh n LEU 522 Cb 0.44 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.41 2bkh n LEU 522 CO 0.55 0.00 -0.32 1.33 -1.33 0.00 0.00 177.39 177.63 2bkh n VAL 523 N 0.00 0.00 -1.40 4.08 0.24 -1.24 -4.29 118.33 115.72 2bkh n VAL 523 Ca 0.00 -0.21 -0.32 0.00 -2.04 0.00 0.00 64.34 61.77 2bkh n VAL 523 Cb 0.00 0.63 0.08 0.00 -1.47 0.00 0.00 33.84 33.08 2bkh n VAL 523 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2bkh s GLY 524 N -3.32 1.82 0.29 7.63 0.00 0.08 -4.82 107.32 109.00 2bkh s GLY 524 Ca 0.01 0.35 0.00 0.00 0.00 0.00 0.00 44.72 45.09 2bkh s GLY 524 CO 0.77 0.70 1.89 -2.22 0.00 0.00 0.00 173.10 174.24 2bkh h ILE 525 N -0.79 1.04 -0.65 0.90 2.04 -0.08 -1.86 117.51 118.10 2bkh h ILE 525 Ca -0.44 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 64.97 2bkh h ILE 525 Cb 1.24 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2bkh h ILE 525 CO 0.52 0.19 0.09 -0.07 0.00 0.00 0.00 178.15 178.88 2bkh h LEU 526 N 1.06 1.04 -0.58 1.44 3.38 -1.67 -1.15 115.31 118.83 2bkh h LEU 526 Ca 0.43 -0.25 -0.15 0.00 0.09 0.00 0.00 57.88 57.99 2bkh h LEU 526 Cb 0.27 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2bkh h LEU 526 CO -0.18 1.04 -0.71 0.44 0.09 0.00 0.00 178.44 179.12 2bkh h ASP 527 N 1.01 0.03 0.13 -0.43 3.45 -1.69 -1.51 116.42 117.41 2bkh h ASP 527 Ca 0.20 -0.02 -0.14 0.00 0.43 0.00 0.00 57.03 57.49 2bkh h ASP 527 Cb 0.46 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 2bkh h ASP 527 CO 0.02 0.72 -0.52 0.40 -1.57 0.00 0.00 179.24 178.29 2bkh h ILE 528 N 0.01 1.33 -0.30 0.35 2.04 -1.24 -0.74 117.51 118.96 2bkh h ILE 528 Ca -0.01 -1.76 -0.06 0.00 1.00 0.00 0.00 64.86 64.03 2bkh h ILE 528 Cb 1.25 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 39.10 2bkh h ILE 528 CO 0.09 0.54 -0.06 0.25 0.00 0.00 0.00 178.15 178.97 2bkh h LEU 529 N 0.34 0.58 -1.13 1.44 5.85 -1.03 -2.15 115.31 119.21 2bkh h LEU 529 Ca 0.01 -0.35 0.10 0.00 0.84 0.00 0.00 57.88 58.48 2bkh h LEU 529 Cb 1.02 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.82 2bkh h LEU 529 CO 0.09 0.80 0.60 0.44 -0.34 0.00 0.00 178.44 180.03 2bkh h ASP 530 N 0.35 0.86 0.15 1.25 3.45 -1.16 -2.29 116.42 119.04 2bkh h ASP 530 Ca 0.08 0.03 -0.08 0.00 0.43 0.00 0.00 57.03 57.49 2bkh h ASP 530 Cb 0.54 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 39.14 2bkh h ASP 530 CO 0.03 0.50 -0.29 -0.08 -1.57 0.00 0.00 179.24 177.83 2bkh h GLU 531 N 0.95 0.22 -0.85 3.56 4.57 -0.87 -2.84 114.58 119.32 2bkh h GLU 531 Ca 0.44 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.53 2bkh h GLU 531 Cb 0.40 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.94 2bkh h GLU 531 CO -0.20 0.50 0.52 1.49 -1.18 0.00 0.00 179.01 180.14 2bkh h GLU 532 N 0.20 1.14 -0.27 1.92 4.57 -0.79 -1.99 114.58 119.36 2bkh h GLU 532 Ca 0.03 -0.10 0.08 0.00 -1.18 0.00 0.00 59.36 58.19 2bkh h GLU 532 Cb 0.62 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 2bkh h GLU 532 CO 0.05 0.80 0.19 -0.91 -1.18 0.00 0.00 179.01 177.96 2bkh h ASN 533 N 1.17 0.01 1.50 1.04 -0.26 -1.49 -2.63 115.58 114.92 2bkh h ASN 533 Ca 0.31 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.05 2bkh h ASN 533 Cb -0.06 -0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 2bkh h ASN 533 CO -0.06 0.01 0.00 0.03 -1.06 0.00 0.00 177.43 176.35 2bkh h ARG 534 N 0.01 0.00 -7.14 0.81 3.08 -1.44 -3.46 114.38 106.23 2bkh h ARG 534 Ca 0.13 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.68 2bkh h ARG 534 Cb 0.50 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.59 2bkh h ARG 534 CO -0.00 0.00 0.28 -0.51 -1.07 0.00 0.00 179.97 178.67 2bkh s LEU 535 N -4.62 3.48 0.28 3.04 1.43 -0.99 -4.97 118.68 116.33 2bkh s LEU 535 Ca 0.10 1.26 -0.02 0.00 -1.03 0.00 0.00 54.13 54.45 2bkh s LEU 535 Cb 0.12 -4.25 0.43 0.00 0.03 0.00 0.00 46.19 42.52 2bkh s LEU 535 CO 0.60 -0.68 1.91 -0.65 0.23 0.00 0.00 176.35 177.76 2bkh h PRO 536 N 0.24 1.13 -2.69 1.29 0.11 -1.90 -3.31 132.00 126.86 2bkh h PRO 536 Ca -0.46 -0.07 -0.60 0.00 0.11 0.00 0.00 66.00 64.98 2bkh h PRO 536 Cb 1.19 -0.25 -0.40 0.00 0.11 0.00 0.00 31.00 31.65 2bkh h PRO 536 CO 0.62 0.75 -0.77 1.04 -0.21 0.00 0.00 178.00 179.42 2bkh n GLN 537 N -4.47 1.06 -1.69 1.05 6.02 -1.26 -5.11 117.38 112.98 2bkh n GLN 537 Ca 0.14 -3.85 -0.44 0.00 -0.01 0.00 0.00 57.00 52.84 2bkh n GLN 537 Cb 0.15 -1.97 -0.02 0.00 1.02 0.00 0.00 30.24 29.41 2bkh n GLN 537 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2bkh n PRO 538 N 2.32 2.12 -3.81 -1.09 -0.02 -1.25 -5.00 135.00 128.27 2bkh n PRO 538 Ca 0.25 0.75 -0.12 0.00 -2.02 0.00 0.00 63.50 62.36 2bkh n PRO 538 Cb 0.42 -2.39 -0.12 0.00 -0.02 0.00 0.00 33.50 31.38 2bkh n PRO 538 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2bkh s SER 539 N 0.08 -0.17 0.34 2.55 0.15 -1.26 -5.02 113.70 110.36 2bkh s SER 539 Ca 0.63 0.34 0.02 0.00 0.70 0.00 0.00 55.95 57.64 2bkh s SER 539 Cb -0.61 0.33 0.62 0.00 -1.71 0.00 0.00 66.02 64.66 2bkh s SER 539 CO 0.54 -0.06 1.97 0.44 1.20 0.00 0.00 173.24 177.33 2bkh h ASP 540 N 5.94 0.67 -0.28 5.45 3.32 -1.94 -1.99 116.42 127.60 2bkh h ASP 540 Ca -0.26 -0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.58 2bkh h ASP 540 Cb 1.20 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.58 2bkh h ASP 540 CO 0.40 0.55 -0.48 1.56 -1.72 0.00 0.00 179.24 179.56 2bkh h GLN 541 N 0.76 0.81 -0.40 3.56 7.50 -1.93 -1.48 115.11 123.93 2bkh h GLN 541 Ca 0.20 -0.50 -0.05 0.00 0.50 0.00 0.00 58.65 58.79 2bkh h GLN 541 Cb 0.03 0.06 -0.02 0.00 0.05 0.00 0.00 27.48 27.60 2bkh h GLN 541 CO -0.03 1.14 0.06 1.25 -1.50 0.00 0.00 178.83 179.75 2bkh h HIS 542 N 0.57 0.71 -0.70 2.96 2.76 -1.84 -1.54 115.15 118.08 2bkh h HIS 542 Ca 0.02 -0.10 0.08 0.00 -2.20 0.00 0.00 60.37 58.17 2bkh h HIS 542 Cb 1.08 -0.20 -0.07 0.00 1.55 0.00 0.00 27.41 29.78 2bkh h HIS 542 CO 0.08 0.70 0.36 0.35 -1.30 0.00 0.00 177.93 178.12 2bkh h PHE 543 N 0.52 0.65 -0.25 5.26 3.57 -1.31 -1.35 116.94 124.03 2bkh h PHE 543 Ca 0.12 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.46 2bkh h PHE 543 Cb 0.37 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.93 2bkh h PHE 543 CO 0.03 0.26 -0.61 1.15 -2.23 0.00 0.00 178.31 176.91 2bkh h THR 544 N 0.62 1.28 -0.56 4.41 2.02 -1.04 -2.07 112.91 117.58 2bkh h THR 544 Ca 0.33 -1.80 -0.08 0.00 0.77 0.00 0.00 66.41 65.64 2bkh h THR 544 Cb 0.32 1.73 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 2bkh h THR 544 CO -0.24 0.58 0.05 0.28 0.37 0.00 0.00 175.52 176.55 2bkh h SER 545 N 0.62 0.93 -0.50 4.18 0.02 -1.18 -2.22 113.55 115.40 2bkh h SER 545 Ca -0.00 -0.28 0.02 0.00 -0.84 0.00 0.00 61.79 60.68 2bkh h SER 545 Cb 1.22 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.48 2bkh h SER 545 CO 0.13 0.98 0.33 0.00 -1.14 0.00 0.00 176.83 177.13 2bkh h ALA 546 N 0.98 1.70 -0.17 3.77 0.00 -1.09 0.24 119.26 124.70 2bkh h ALA 546 Ca 0.17 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2bkh h ALA 546 Cb 0.48 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2bkh h ALA 546 CO 0.02 0.25 -0.02 0.28 0.00 0.00 0.00 179.25 179.78 2bkh h VAL 547 N 0.62 1.27 0.00 0.00 2.07 -1.03 -1.99 116.25 117.19 2bkh h VAL 547 Ca 0.19 -0.94 -0.07 0.00 0.82 0.00 0.00 66.70 66.70 2bkh h VAL 547 Cb 0.01 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2bkh h VAL 547 CO -0.05 0.28 -0.34 0.45 0.02 0.00 0.00 177.57 177.93 2bkh h HIS 548 N 0.05 0.00 0.01 1.57 3.86 -0.72 -2.31 115.15 117.61 2bkh h HIS 548 Ca 0.05 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.12 2bkh h HIS 548 Cb 0.43 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.92 2bkh h HIS 548 CO 0.04 0.34 -0.53 0.37 0.86 0.00 0.00 177.93 179.02 2bkh h GLN 549 N 0.00 0.33 0.00 2.45 4.15 -0.52 -2.52 115.11 118.99 2bkh h GLN 549 Ca -0.00 -0.38 -0.06 0.00 0.77 0.00 0.00 58.65 58.98 2bkh h GLN 549 Cb 0.61 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 2bkh h GLN 549 CO 0.04 1.07 -0.29 -0.22 -1.93 0.00 0.00 178.83 177.51 2bkh h LYS 550 N -0.25 0.00 -0.56 1.69 1.63 -1.30 -3.26 116.57 114.51 2bkh h LYS 550 Ca -0.07 0.00 -0.40 0.00 -0.85 0.00 0.00 60.65 59.33 2bkh h LYS 550 Cb 1.27 0.00 -0.37 0.00 -0.60 0.00 0.00 32.23 32.52 2bkh h LYS 550 CO 0.10 0.29 -0.86 0.72 -3.45 0.00 0.00 179.45 176.25 2bkh n HIS 551 N -3.37 1.99 -0.33 1.91 8.25 -0.88 -4.90 115.22 117.90 2bkh n HIS 551 Ca 0.01 -2.05 0.30 0.00 -0.26 0.00 0.00 57.72 55.71 2bkh n HIS 551 Cb 0.50 -0.30 0.56 0.00 1.12 0.00 0.00 29.99 31.87 2bkh n HIS 551 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2bkh h LYS 552 N 2.10 0.09 -0.33 -0.41 3.64 -1.50 -2.11 116.57 118.05 2bkh h LYS 552 Ca 0.19 -0.01 -0.26 0.00 -1.27 0.00 0.00 60.65 59.30 2bkh h LYS 552 Cb 1.43 -0.02 -0.30 0.00 -0.41 0.00 0.00 32.23 32.94 2bkh h LYS 552 CO 0.52 0.06 -0.84 -0.40 -2.27 0.00 0.00 179.45 176.51 2bkh n ASP 553 N -5.19 2.57 -4.73 4.20 3.85 -1.26 -5.04 116.55 110.95 2bkh n ASP 553 Ca 0.36 -3.08 -0.41 0.00 -0.71 0.00 0.00 54.79 50.94 2bkh n ASP 553 Cb 1.21 -0.42 -0.04 0.00 -1.35 0.00 0.00 41.12 40.53 2bkh n ASP 553 CO 0.00 0.00 0.00 -2.28 -1.01 0.00 0.00 177.20 173.91 2bkh s HIS 554 N -2.87 3.68 0.46 2.11 2.46 -0.80 -4.94 115.29 115.40 2bkh s HIS 554 Ca 0.39 1.67 0.20 0.00 0.47 0.00 0.00 55.06 57.79 2bkh s HIS 554 Cb 0.38 -3.17 1.18 0.00 -0.13 0.00 0.00 32.58 30.84 2bkh s HIS 554 CO -0.05 -0.22 1.92 0.35 -2.47 0.00 0.00 174.74 174.27 2bkh h PHE 555 N 5.85 0.34 -0.17 3.88 3.04 -1.96 -2.95 116.94 124.97 2bkh h PHE 555 Ca -0.43 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.53 2bkh h PHE 555 Cb 1.21 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.62 2bkh h PHE 555 CO 0.65 0.12 0.00 0.54 -2.02 0.00 0.00 178.31 177.60 2bkh n ARG 556 N -4.44 1.80 -4.97 1.11 1.74 -1.26 -4.89 116.66 105.75 2bkh n ARG 556 Ca 0.15 -1.77 -0.32 0.00 -0.77 0.00 0.00 57.85 55.13 2bkh n ARG 556 Cb 0.63 -1.36 -0.15 0.00 -1.02 0.00 0.00 32.46 30.56 2bkh n ARG 556 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2bkh s LEU 557 N -1.31 2.52 0.04 0.55 2.96 -1.11 -1.03 118.68 121.30 2bkh s LEU 557 Ca 0.25 -0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 53.80 2bkh s LEU 557 Cb 0.16 -1.52 -0.03 0.00 0.50 0.00 0.00 46.19 45.30 2bkh s LEU 557 CO 0.22 0.25 -0.01 -0.44 -1.32 0.00 0.00 176.35 175.05 2bkh s SER 558 N -0.17 0.36 0.61 3.68 0.01 -0.92 -4.67 113.70 112.60 2bkh s SER 558 Ca -0.01 -0.76 -0.16 0.00 1.31 0.00 0.00 55.95 56.33 2bkh s SER 558 Cb -0.14 0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.24 2bkh s SER 558 CO 0.03 -0.49 1.08 0.27 0.41 0.00 0.00 173.24 174.54 2bkh s ILE 559 N -2.91 3.60 0.48 1.44 -4.36 -1.26 -0.65 121.20 117.54 2bkh s ILE 559 Ca -0.02 0.76 0.17 0.00 -0.26 0.00 0.00 60.65 61.29 2bkh s ILE 559 Cb 0.01 -3.29 0.33 0.00 1.25 0.00 0.00 42.46 40.76 2bkh s ILE 559 CO -0.06 -0.44 2.02 -0.65 0.24 0.00 0.00 174.94 176.05 2bkh h PRO 560 N 0.33 0.22 -0.71 0.37 0.11 -1.84 -2.49 132.00 127.98 2bkh h PRO 560 Ca -0.47 -0.01 0.15 0.00 0.11 0.00 0.00 66.00 65.78 2bkh h PRO 560 Cb 1.23 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 2bkh h PRO 560 CO 0.56 0.14 0.48 0.00 -0.21 0.00 0.00 178.00 178.98 2bkh h ARG 561 N 0.22 0.31 0.00 1.05 -0.00 -1.75 -2.38 114.38 111.83 2bkh h ARG 561 Ca 0.20 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.67 2bkh h ARG 561 Cb 0.52 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 30.42 2bkh h ARG 561 CO -0.04 0.20 0.00 1.63 0.00 0.00 0.00 179.97 181.77 2bkh n LYS 562 N -4.45 0.71 -1.81 0.04 4.76 -0.94 -4.89 118.16 111.59 2bkh n LYS 562 Ca 0.14 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.21 2bkh n LYS 562 Cb 0.56 -1.32 0.06 0.00 -1.84 0.00 0.00 35.03 32.49 2bkh n LYS 562 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2bkh s SER 563 N -1.74 4.76 0.00 4.39 0.15 -0.90 -4.93 113.70 115.43 2bkh s SER 563 Ca 0.22 2.52 0.27 0.00 0.70 0.00 0.00 55.95 59.67 2bkh s SER 563 Cb 0.10 -2.61 0.96 0.00 -1.71 0.00 0.00 66.02 62.76 2bkh s SER 563 CO 0.17 -1.89 1.71 0.29 1.20 0.00 0.00 173.24 174.71 2bkh n LYS 564 N -1.87 0.40 -3.57 5.44 5.02 -1.26 -4.88 118.16 117.45 2bkh n LYS 564 Ca 0.15 -0.17 -0.22 0.00 -2.02 0.00 0.00 58.31 56.05 2bkh n LYS 564 Cb 0.49 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.99 2bkh n LYS 564 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2bkh s LEU 565 N -2.71 4.09 -0.06 -0.35 1.43 -1.26 -5.05 118.68 114.76 2bkh s LEU 565 Ca 0.21 0.26 -0.21 0.00 -1.03 0.00 0.00 54.13 53.36 2bkh s LEU 565 Cb 0.19 -3.10 -0.16 0.00 0.03 0.00 0.00 46.19 43.15 2bkh s LEU 565 CO 0.55 -0.25 0.81 0.00 0.23 0.00 0.00 176.35 177.69 2bkh h ALA 566 N 0.88 -0.17 0.00 4.21 0.00 -2.02 -3.37 119.26 118.79 2bkh h ALA 566 Ca -0.50 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2bkh h ALA 566 Cb 1.23 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2bkh h ALA 566 CO 0.60 -0.24 0.00 0.82 0.00 0.00 0.00 179.25 180.43 2bkh h ILE 567 N -0.87 0.00 -0.02 0.00 2.04 -1.99 -1.30 117.51 115.36 2bkh h ILE 567 Ca -0.02 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2bkh h ILE 567 Cb 0.54 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 2bkh h ILE 567 CO 0.03 0.00 0.00 1.41 0.00 0.00 0.00 178.15 179.59 2bkh n HIS 568 N -2.61 0.02 -0.08 1.37 8.25 -1.26 -4.52 115.22 116.38 2bkh n HIS 568 Ca -0.01 -0.01 -0.14 0.00 -0.26 0.00 0.00 57.72 57.29 2bkh n HIS 568 Cb 0.09 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.15 2bkh n HIS 568 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 2bkh h ARG 569 N 1.21 0.76 -0.04 -0.41 0.11 -1.47 -3.04 114.38 111.51 2bkh h ARG 569 Ca 0.00 -0.45 0.00 0.00 0.10 0.00 0.00 59.98 59.63 2bkh h ARG 569 Cb 0.26 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.38 2bkh h ARG 569 CO 0.00 1.07 0.00 0.09 0.10 0.00 0.00 179.97 181.23 2bkh n ASN 570 N -4.17 0.90 -4.68 0.08 5.03 -1.26 -4.62 115.26 106.54 2bkh n ASN 570 Ca -0.04 -1.38 -0.42 0.00 0.87 0.00 0.00 54.58 53.60 2bkh n ASN 570 Cb 0.54 -0.02 -0.03 0.00 -1.02 0.00 0.00 39.78 39.25 2bkh n ASN 570 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2bkh s ILE 571 N -1.96 3.92 0.92 2.41 1.01 -1.15 -5.01 121.20 121.33 2bkh s ILE 571 Ca 0.39 1.27 -0.12 0.00 0.00 0.00 0.00 60.65 62.19 2bkh s ILE 571 Cb 0.20 -3.81 0.14 0.00 0.01 0.00 0.00 42.46 38.99 2bkh s ILE 571 CO 0.32 -0.01 1.09 -0.13 0.00 0.00 0.00 174.94 176.20 2bkh s ARG 572 N 2.48 1.08 0.46 2.79 0.52 -1.26 -4.33 118.95 120.70 2bkh s ARG 572 Ca 0.61 0.85 0.17 0.00 -0.52 0.00 0.00 55.73 56.84 2bkh s ARG 572 Cb -0.29 -1.79 1.11 0.00 0.52 0.00 0.00 34.95 34.50 2bkh s ARG 572 CO 0.24 -2.37 2.01 -0.44 0.02 0.00 0.00 175.30 174.77 2bkh h ASP 573 N -1.64 0.00 -0.00 0.23 3.45 -1.95 -2.48 116.42 114.03 2bkh h ASP 573 Ca -0.50 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.96 2bkh h ASP 573 Cb 1.29 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.06 2bkh h ASP 573 CO 0.54 0.17 -0.05 -0.90 -1.57 0.00 0.00 179.24 177.43 2bkh n ASP 574 N -4.19 2.13 -0.44 6.45 3.85 -1.26 -4.03 116.55 119.06 2bkh n ASP 574 Ca -0.02 -1.67 0.11 0.00 -0.71 0.00 0.00 54.79 52.50 2bkh n ASP 574 Cb 0.24 0.04 0.06 0.00 -1.35 0.00 0.00 41.12 40.11 2bkh n ASP 574 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2bkh n GLU 575 N 0.60 1.11 -3.69 0.11 1.02 -0.93 -4.13 120.64 114.73 2bkh n GLU 575 Ca 0.16 -0.89 0.02 0.00 -0.02 0.00 0.00 57.16 56.43 2bkh n GLU 575 Cb 0.46 -1.48 -0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2bkh n GLU 575 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2bkh s GLY 576 N -2.50 -0.36 0.06 0.62 0.00 -1.23 -1.27 107.32 102.66 2bkh s GLY 576 Ca 0.19 0.56 -0.10 0.00 0.00 0.00 0.00 44.72 45.37 2bkh s GLY 576 CO 0.57 1.14 0.22 -0.11 0.00 0.00 0.00 173.10 174.93 2bkh s PHE 577 N -2.34 0.05 -0.11 1.90 -0.71 -0.47 -4.42 117.98 111.89 2bkh s PHE 577 Ca 0.17 -0.35 -0.04 0.00 -1.04 0.00 0.00 56.93 55.67 2bkh s PHE 577 Cb 0.04 -0.00 -0.04 0.00 -1.21 0.00 0.00 43.02 41.81 2bkh s PHE 577 CO -0.03 -0.50 0.06 0.42 -1.34 0.00 0.00 175.22 173.82 2bkh s ILE 578 N -3.14 4.79 -0.08 -4.49 1.01 0.18 -0.12 121.20 119.35 2bkh s ILE 578 Ca -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 60.65 60.63 2bkh s ILE 578 Cb 0.01 -3.06 -0.00 0.00 0.01 0.00 0.00 42.46 39.42 2bkh s ILE 578 CO -0.07 0.59 -0.24 -0.63 0.00 0.00 0.00 174.94 174.59 2bkh s ILE 579 N -0.76 2.01 -1.11 2.92 1.01 -0.16 -2.17 121.20 122.94 2bkh s ILE 579 Ca 0.12 -1.01 -0.15 0.00 0.00 0.00 0.00 60.65 59.62 2bkh s ILE 579 Cb -0.12 -1.73 0.17 0.00 0.01 0.00 0.00 42.46 40.80 2bkh s ILE 579 CO 0.03 0.55 1.29 -0.13 0.00 0.00 0.00 174.94 176.68 2bkh s ARG 580 N 0.19 3.96 1.03 2.79 0.52 -0.20 -1.54 118.95 125.71 2bkh s ARG 580 Ca -0.14 -2.44 -0.14 0.00 -0.52 0.00 0.00 55.73 52.50 2bkh s ARG 580 Cb -0.16 -4.94 0.21 0.00 0.52 0.00 0.00 34.95 30.57 2bkh s ARG 580 CO 0.07 -1.69 1.10 -1.01 0.02 0.00 0.00 175.30 173.79 2bkh s HIS 581 N 1.50 1.85 0.31 -0.53 3.76 -1.03 -4.91 115.29 116.24 2bkh s HIS 581 Ca 0.38 0.87 0.04 0.00 -0.15 0.00 0.00 55.06 56.20 2bkh s HIS 581 Cb -0.04 -3.32 0.64 0.00 1.11 0.00 0.00 32.58 30.96 2bkh s HIS 581 CO -0.04 -3.06 1.86 0.27 -0.85 0.00 0.00 174.74 172.93 2bkh h PHE 582 N -2.01 1.02 0.00 1.40 -5.15 -1.95 -2.68 116.94 107.58 2bkh h PHE 582 Ca -0.53 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 57.27 2bkh h PHE 582 Cb 1.33 -0.33 0.00 0.00 0.22 0.00 0.00 35.95 37.17 2bkh h PHE 582 CO -0.11 0.42 -0.79 0.00 -2.00 0.00 0.00 178.31 175.83 2bkh n ALA 583 N -2.38 3.62 0.00 12.09 0.00 -1.26 -4.84 120.51 127.74 2bkh n ALA 583 Ca 0.17 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2bkh n ALA 583 Cb 0.36 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2bkh n ALA 583 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bkh n GLY 584 N 1.44 3.00 3.76 0.00 0.00 -1.01 -4.79 105.19 107.58 2bkh n GLY 584 Ca 0.04 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 2bkh n GLY 584 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkh s ALA 585 N -2.00 3.54 -0.06 4.61 0.00 -1.26 -2.47 121.76 124.12 2bkh s ALA 585 Ca 0.00 1.28 0.03 0.00 0.00 0.00 0.00 51.96 53.27 2bkh s ALA 585 Cb 0.00 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.62 2bkh s ALA 585 CO 0.00 -0.68 -0.14 0.08 0.00 0.00 0.00 175.76 175.02 2bkh s VAL 586 N -0.66 1.28 -0.26 0.00 1.01 -0.59 -4.94 120.40 116.24 2bkh s VAL 586 Ca 0.53 -0.58 -0.15 0.00 0.00 0.00 0.00 61.98 61.78 2bkh s VAL 586 Cb -0.40 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2bkh s VAL 586 CO 0.49 0.38 0.38 0.00 0.00 0.00 0.00 175.10 176.35 2bkh s TYR 588 N 1.95 3.20 -0.08 0.00 2.02 0.83 -4.25 117.35 121.02 2bkh s TYR 588 Ca 0.16 -0.02 -0.24 0.00 -0.37 0.00 0.00 57.07 56.60 2bkh s TYR 588 Cb -0.16 -2.07 -0.03 0.00 -0.40 0.00 0.00 41.96 39.30 2bkh s TYR 588 CO 0.09 0.09 0.71 -1.21 -1.57 0.00 0.00 175.55 173.67 2bkh s GLU 589 N 0.46 4.42 0.00 -0.62 2.02 -0.82 -1.37 118.70 122.80 2bkh s GLU 589 Ca 0.02 0.89 0.25 0.00 0.02 0.00 0.00 54.97 56.16 2bkh s GLU 589 Cb -0.13 -3.46 0.54 0.00 0.10 0.00 0.00 34.13 31.18 2bkh s GLU 589 CO 0.01 0.02 1.44 0.25 0.02 0.00 0.00 175.26 177.00 2bkh n THR 590 N 3.90 0.00 -1.60 3.63 -2.24 -0.39 -4.51 114.28 113.06 2bkh n THR 590 Ca -0.01 -0.27 -0.46 0.00 -2.27 0.00 0.00 64.05 61.04 2bkh n THR 590 Cb 0.51 0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 69.57 2bkh n THR 590 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2bkh n THR 591 N 0.16 1.35 -0.83 4.28 5.66 -1.26 -1.03 114.28 122.61 2bkh n THR 591 Ca 0.14 -0.34 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 2bkh n THR 591 Cb 0.43 -1.03 0.00 0.00 -1.55 0.00 0.00 70.33 68.18 2bkh n THR 591 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bkh n GLN 592 N 1.38 -0.10 -0.17 1.09 6.02 -1.26 -4.87 117.38 119.47 2bkh n GLN 592 Ca 0.12 0.03 0.02 0.00 -0.01 0.00 0.00 57.00 57.16 2bkh n GLN 592 Cb 0.29 -3.35 0.30 0.00 1.02 0.00 0.00 30.24 28.50 2bkh n GLN 592 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2bkh h PHE 593 N 0.00 0.83 -0.18 1.08 0.05 -1.43 -1.06 116.94 116.23 2bkh h PHE 593 Ca 0.00 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 61.75 2bkh h PHE 593 Cb 0.05 -0.28 -0.00 0.00 2.00 0.00 0.00 35.95 37.72 2bkh h PHE 593 CO 0.03 0.51 -0.13 0.28 -0.18 0.00 0.00 178.31 178.83 2bkh h VAL 594 N 0.88 1.32 -0.24 -0.55 2.07 -1.91 -1.85 116.25 115.98 2bkh h VAL 594 Ca 0.26 -1.23 -0.17 0.00 0.82 0.00 0.00 66.70 66.38 2bkh h VAL 594 Cb -0.03 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2bkh h VAL 594 CO -0.06 0.37 -0.53 1.05 0.02 0.00 0.00 177.57 178.42 2bkh h GLU 595 N 0.07 0.70 0.00 1.57 4.11 -1.88 -2.69 114.58 116.46 2bkh h GLU 595 Ca 0.04 -0.43 0.00 0.00 0.07 0.00 0.00 59.36 59.04 2bkh h GLU 595 Cb 0.63 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2bkh h GLU 595 CO 0.03 1.05 0.00 0.87 0.07 0.00 0.00 179.01 181.03 2bkh h LYS 596 N 0.54 0.00 -0.00 1.06 1.57 -1.19 -1.89 116.57 116.66 2bkh h LYS 596 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2bkh h LYS 596 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2bkh h LYS 596 CO 0.11 0.00 -0.03 -1.71 -0.57 0.00 0.00 179.45 177.25 2bkh n ASN 597 N -2.71 0.13 -4.26 0.86 5.15 -0.70 -4.73 115.26 109.00 2bkh n ASN 597 Ca 0.00 -0.38 -0.33 0.00 -0.60 0.00 0.00 54.58 53.28 2bkh n ASN 597 Cb 0.22 -0.19 -0.16 0.00 -0.53 0.00 0.00 39.78 39.13 2bkh n ASN 597 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2bkh s ASN 598 N -2.47 3.52 0.00 1.20 3.84 -0.71 -1.69 114.94 118.63 2bkh s ASN 598 Ca 0.31 -0.49 0.07 0.00 0.21 0.00 0.00 52.86 52.97 2bkh s ASN 598 Cb 0.20 -1.52 0.12 0.00 -0.55 0.00 0.00 41.25 39.50 2bkh s ASN 598 CO 0.45 0.11 0.94 -0.90 -2.79 0.00 0.00 177.10 174.91 2bkh n ASP 599 N 3.88 0.03 -4.75 -4.21 3.85 -1.26 -4.95 116.55 109.14 2bkh n ASP 599 Ca -0.19 -1.78 -0.42 0.00 -0.71 0.00 0.00 54.79 51.69 2bkh n ASP 599 Cb 0.52 -0.06 -0.01 0.00 -1.35 0.00 0.00 41.12 40.22 2bkh n ASP 599 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2bkh n ALA 600 N 0.14 2.39 -2.55 2.12 0.00 -1.26 -4.57 120.51 116.77 2bkh n ALA 600 Ca -0.05 0.37 -0.40 0.00 0.00 0.00 0.00 53.44 53.35 2bkh n ALA 600 Cb 0.78 -2.44 -0.09 0.00 0.00 0.00 0.00 19.45 17.70 2bkh n ALA 600 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2bkh s LEU 601 N -0.79 4.38 0.73 0.00 2.96 -1.26 -4.77 118.68 119.94 2bkh s LEU 601 Ca 0.62 -0.17 -0.13 0.00 -0.22 0.00 0.00 54.13 54.23 2bkh s LEU 601 Cb -0.50 -2.33 0.04 0.00 0.50 0.00 0.00 46.19 43.90 2bkh s LEU 601 CO 0.52 -0.30 1.12 -1.38 -1.32 0.00 0.00 176.35 174.99 2bkh s HIS 602 N 2.00 2.41 0.15 5.38 -3.43 -1.26 -4.82 115.29 115.72 2bkh s HIS 602 Ca 0.12 1.59 -0.03 0.00 -0.80 0.00 0.00 55.06 55.93 2bkh s HIS 602 Cb -0.16 -3.19 -0.04 0.00 -1.43 0.00 0.00 32.58 27.76 2bkh s HIS 602 CO 0.11 -1.98 1.36 1.98 -2.00 0.00 0.00 174.74 174.21 2bkh h MET 603 N -0.61 0.42 -0.86 -0.38 4.05 -1.98 -2.81 114.93 112.77 2bkh h MET 603 Ca -0.45 -0.40 -0.02 0.00 -0.28 0.00 0.00 59.70 58.54 2bkh h MET 603 Cb 1.25 0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 32.11 2bkh h MET 603 CO 0.51 1.06 0.45 0.66 0.23 0.00 0.00 176.91 179.82 2bkh h SER 604 N 0.26 1.10 -0.15 1.39 4.64 -1.92 0.01 113.55 118.88 2bkh h SER 604 Ca -0.06 -0.11 -0.16 0.00 -0.47 0.00 0.00 61.79 60.99 2bkh h SER 604 Cb 1.46 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2bkh h SER 604 CO 0.15 0.90 -0.48 0.25 -0.87 0.00 0.00 176.83 176.78 2bkh h LEU 605 N 1.22 0.78 -0.33 5.97 5.85 -1.79 -0.98 115.31 126.02 2bkh h LEU 605 Ca 0.30 -0.39 -0.08 0.00 0.84 0.00 0.00 57.88 58.56 2bkh h LEU 605 Cb 0.07 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2bkh h LEU 605 CO -0.04 1.13 -0.10 -0.08 -0.34 0.00 0.00 178.44 179.01 2bkh h GLU 606 N 0.57 0.65 -0.30 1.25 4.81 -1.23 -2.70 114.58 117.62 2bkh h GLU 606 Ca 0.03 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 2bkh h GLU 606 Cb 1.04 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 2bkh h GLU 606 CO 0.10 0.83 0.16 1.03 -0.73 0.00 0.00 179.01 180.40 2bkh h SER 607 N 0.42 0.36 -0.03 1.04 0.87 -0.91 -2.24 113.55 113.06 2bkh h SER 607 Ca 0.08 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2bkh h SER 607 Cb 0.60 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2bkh h SER 607 CO 0.04 0.30 0.01 0.25 -0.53 0.00 0.00 176.83 176.89 2bkh h LEU 608 N 0.41 0.04 -1.26 2.23 5.85 -0.90 -2.88 115.31 118.81 2bkh h LEU 608 Ca 0.11 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 2bkh h LEU 608 Cb 0.02 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2bkh h LEU 608 CO -0.02 0.15 -0.33 -0.29 -0.34 0.00 0.00 178.44 177.62 2bkh h ILE 609 N -0.09 1.25 -0.03 4.05 6.09 -1.23 -2.46 117.51 125.10 2bkh h ILE 609 Ca 0.01 -1.20 -0.03 0.00 -1.37 0.00 0.00 64.86 62.27 2bkh h ILE 609 Cb 0.13 1.60 -0.01 0.00 0.47 0.00 0.00 36.82 39.01 2bkh h ILE 609 CO -0.00 0.35 -0.12 0.00 -3.07 0.00 0.00 178.15 175.30 2bkh n GLU 611 N -4.37 3.30 -2.16 0.00 4.71 -0.93 -4.53 120.64 116.65 2bkh n GLU 611 Ca -0.02 -4.23 -0.40 0.00 -0.01 0.00 0.00 57.16 52.50 2bkh n GLU 611 Cb 0.21 -2.27 -0.02 0.00 -1.01 0.00 0.00 31.44 28.35 2bkh n GLU 611 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2bkh s SER 612 N -2.63 6.75 0.26 1.62 0.15 -1.09 -4.94 113.70 113.84 2bkh s SER 612 Ca 0.49 2.61 -0.05 0.00 0.70 0.00 0.00 55.95 59.70 2bkh s SER 612 Cb 0.39 -2.64 0.51 0.00 -1.71 0.00 0.00 66.02 62.57 2bkh s SER 612 CO -0.26 -0.54 1.61 0.03 1.20 0.00 0.00 173.24 175.29 2bkh h ARG 613 N 3.28 0.07 -6.46 5.44 3.08 -0.76 -3.42 114.38 115.61 2bkh h ARG 613 Ca -0.49 -0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.02 2bkh h ARG 613 Cb 1.23 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2bkh h ARG 613 CO 0.65 0.04 0.65 0.34 -1.07 0.00 0.00 179.97 180.58 2bkh s ASP 614 N -5.16 6.99 0.27 7.04 2.15 -1.26 -4.95 116.67 121.75 2bkh s ASP 614 Ca -0.13 2.07 -0.01 0.00 0.43 0.00 0.00 52.55 54.90 2bkh s ASP 614 Cb 0.24 -2.58 0.36 0.00 -0.30 0.00 0.00 42.92 40.64 2bkh s ASP 614 CO 0.76 -0.55 1.75 0.50 -0.17 0.00 0.00 175.17 177.46 2bkh h LYS 615 N 7.02 0.72 -0.75 4.34 3.64 -2.00 -2.80 116.57 126.74 2bkh h LYS 615 Ca -0.40 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 58.74 2bkh h LYS 615 Cb 1.20 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 2bkh h LYS 615 CO 0.84 0.77 0.35 0.35 -2.27 0.00 0.00 179.45 179.50 2bkh h PHE 616 N 0.66 1.08 -0.38 1.91 3.57 -1.95 -1.36 116.94 120.47 2bkh h PHE 616 Ca 0.12 -0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.47 2bkh h PHE 616 Cb 0.50 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2bkh h PHE 616 CO 0.02 0.80 -0.12 0.82 -2.23 0.00 0.00 178.31 177.60 2bkh h ILE 617 N 1.05 1.28 -0.73 1.41 2.04 -1.91 -2.24 117.51 118.42 2bkh h ILE 617 Ca 0.25 -1.23 0.01 0.00 1.00 0.00 0.00 64.86 64.90 2bkh h ILE 617 Cb 0.13 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 2bkh h ILE 617 CO -0.03 0.41 0.49 0.03 0.00 0.00 0.00 178.15 179.04 2bkh h ARG 618 N 0.56 0.96 -0.27 2.37 3.08 -1.24 -2.21 114.38 117.63 2bkh h ARG 618 Ca 0.09 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 2bkh h ARG 618 Cb 0.65 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2bkh h ARG 618 CO 0.04 0.63 -0.19 0.93 -1.07 0.00 0.00 179.97 180.31 2bkh h GLU 619 N 0.99 0.49 -0.62 0.04 5.08 -1.00 -2.56 114.58 117.00 2bkh h GLU 619 Ca 0.27 -0.16 0.07 0.00 -1.00 0.00 0.00 59.36 58.54 2bkh h GLU 619 Cb -0.10 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 2bkh h GLU 619 CO -0.06 0.66 0.41 -0.07 -1.00 0.00 0.00 179.01 178.95 2bkh h LEU 620 N 0.44 0.49 -2.01 1.33 3.38 -0.79 -2.59 115.31 115.56 2bkh h LEU 620 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2bkh h LEU 620 Cb 0.59 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2bkh h LEU 620 CO 0.04 0.31 0.00 0.49 0.09 0.00 0.00 178.44 179.37 2bkh n PHE 621 N -4.48 0.79 -3.49 1.13 3.01 -0.97 -4.90 117.46 108.55 2bkh n PHE 621 Ca 0.09 -0.37 -0.27 0.00 1.01 0.00 0.00 57.45 57.92 2bkh n PHE 621 Cb 0.28 -0.05 -0.10 0.00 -0.01 0.00 0.00 39.48 39.60 2bkh n PHE 621 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 2bkh n GLU 622 N 0.95 0.65 -0.96 -1.08 0.28 -0.98 -5.06 120.64 114.44 2bkh n GLU 622 Ca 0.18 -3.51 0.00 0.00 -0.16 0.00 0.00 57.16 53.67 2bkh n GLU 622 Cb 0.49 -1.79 0.00 0.00 1.43 0.00 0.00 31.44 31.58 2bkh n GLU 622 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 2bkh n PHE 640 N 2.48 0.00 -4.70 -1.84 -0.00 -1.26 -5.04 117.46 107.10 2bkh n PHE 640 Ca 0.27 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.39 2bkh n PHE 640 Cb 0.45 -0.32 -0.12 0.00 -0.00 0.00 0.00 39.48 39.49 2bkh n PHE 640 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 2bkh s ILE 641 N -2.57 3.50 0.80 1.97 1.01 -1.26 -5.12 121.20 119.52 2bkh s ILE 641 Ca 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 60.65 59.98 2bkh s ILE 641 Cb 0.00 -2.42 0.07 0.00 0.01 0.00 0.00 42.46 40.13 2bkh s ILE 641 CO 0.00 0.59 1.09 -0.94 0.00 0.00 0.00 174.94 175.68 2bkh s SER 642 N -0.71 4.38 0.17 3.58 1.04 -1.26 -4.76 113.70 116.14 2bkh s SER 642 Ca 0.11 1.49 -0.15 0.00 0.48 0.00 0.00 55.95 57.88 2bkh s SER 642 Cb -0.11 -2.23 0.06 0.00 0.10 0.00 0.00 66.02 63.84 2bkh s SER 642 CO 0.01 -2.07 1.83 0.58 0.98 0.00 0.00 173.24 174.58 2bkh h VAL 643 N -1.15 1.12 -0.56 5.02 2.07 -1.61 0.77 116.25 121.90 2bkh h VAL 643 Ca -0.47 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 66.85 2bkh h VAL 643 Cb 1.26 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 2bkh h VAL 643 CO 0.56 0.12 0.34 1.23 0.02 0.00 0.00 177.57 179.85 2bkh h GLY 644 N 0.66 0.80 1.59 2.17 0.00 -1.88 0.31 103.07 106.72 2bkh h GLY 644 Ca 0.18 -0.26 -0.28 0.00 0.00 0.00 0.00 47.33 46.98 2bkh h GLY 644 CO -0.04 0.23 -1.23 3.43 0.00 0.00 0.00 176.54 178.92 2bkh h ASN 645 N 0.69 0.48 -0.98 0.19 2.35 -1.85 -0.74 115.58 115.71 2bkh h ASN 645 Ca 0.22 -0.50 0.07 0.00 -0.55 0.00 0.00 56.30 55.54 2bkh h ASN 645 Cb 0.01 -0.16 -0.07 0.00 0.05 0.00 0.00 38.32 38.15 2bkh h ASN 645 CO -0.09 1.38 0.63 0.11 -1.65 0.00 0.00 177.43 177.81 2bkh h LYS 646 N 0.10 1.10 0.18 0.81 1.57 -0.79 -0.46 116.57 119.08 2bkh h LYS 646 Ca -0.14 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 2bkh h LYS 646 Cb 1.95 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 34.01 2bkh h LYS 646 CO 0.21 0.73 -0.11 0.35 -0.57 0.00 0.00 179.45 180.05 2bkh h PHE 647 N 1.13 -0.29 -0.30 -1.35 3.57 -0.67 -1.87 116.94 117.16 2bkh h PHE 647 Ca 0.43 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.98 2bkh h PHE 647 Cb 0.19 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.98 2bkh h PHE 647 CO -0.01 -0.18 -0.04 -0.22 -2.23 0.00 0.00 178.31 175.64 2bkh h LYS 648 N -0.29 0.04 -0.00 1.11 3.64 -0.82 0.45 116.57 120.71 2bkh h LYS 648 Ca -0.02 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2bkh h LYS 648 Cb 0.24 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2bkh h LYS 648 CO 0.02 0.03 -0.15 1.15 -2.27 0.00 0.00 179.45 178.22 2bkh h THR 649 N 0.04 0.62 -0.40 1.00 2.02 -1.06 0.10 112.91 115.23 2bkh h THR 649 Ca 0.15 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.27 2bkh h THR 649 Cb 0.21 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2bkh h THR 649 CO -0.28 0.00 0.03 1.56 0.37 0.00 0.00 175.52 177.21 2bkh h GLN 650 N -0.25 0.68 -0.70 6.66 1.08 -1.06 -2.23 115.11 119.29 2bkh h GLN 650 Ca 0.05 -0.20 0.13 0.00 -1.45 0.00 0.00 58.65 57.19 2bkh h GLN 650 Cb 0.32 -0.07 -0.09 0.00 -0.05 0.00 0.00 27.48 27.59 2bkh h GLN 650 CO -0.15 0.75 0.23 1.25 -0.95 0.00 0.00 178.83 179.96 2bkh h LEU 651 N 0.52 0.16 -1.21 1.46 5.85 -0.76 -1.75 115.31 119.58 2bkh h LEU 651 Ca 0.12 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 2bkh h LEU 651 Cb 0.42 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 2bkh h LEU 651 CO 0.01 0.06 -0.20 0.78 -0.34 0.00 0.00 178.44 178.76 2bkh h ASN 652 N 0.37 0.30 -0.62 1.25 2.35 -0.66 -0.82 115.58 117.74 2bkh h ASN 652 Ca 0.38 -0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.98 2bkh h ASN 652 Cb 0.58 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.85 2bkh h ASN 652 CO -0.41 0.51 0.12 -0.07 -1.65 0.00 0.00 177.43 175.93 2bkh h LEU 653 N 0.28 0.98 -0.18 1.61 3.38 -0.76 0.48 115.31 121.11 2bkh h LEU 653 Ca 0.05 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2bkh h LEU 653 Cb 0.51 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2bkh h LEU 653 CO 0.03 0.97 0.11 0.25 0.09 0.00 0.00 178.44 179.90 2bkh h LEU 654 N 0.97 0.21 -1.23 1.67 5.85 -0.52 -2.45 115.31 119.81 2bkh h LEU 654 Ca 0.20 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 2bkh h LEU 654 Cb 0.40 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2bkh h LEU 654 CO 0.01 0.18 -0.22 -0.07 -0.34 0.00 0.00 178.44 178.00 2bkh h LEU 655 N 0.23 0.25 -0.41 2.25 3.38 -0.97 -2.17 115.31 117.87 2bkh h LEU 655 Ca 0.07 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bkh h LEU 655 Cb 0.00 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2bkh h LEU 655 CO -0.01 0.48 0.25 0.44 0.09 0.00 0.00 178.44 179.69 2bkh h ASP 656 N 0.23 0.49 -0.28 -0.43 3.45 -0.70 0.01 116.42 119.20 2bkh h ASP 656 Ca 0.04 -0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.44 2bkh h ASP 656 Cb 0.52 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 39.16 2bkh h ASP 656 CO 0.04 0.40 0.16 0.50 -1.57 0.00 0.00 179.24 178.77 2bkh h LYS 657 N 0.54 0.39 -0.55 3.56 3.64 -1.11 -2.67 116.57 120.36 2bkh h LYS 657 Ca 0.15 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.39 2bkh h LYS 657 Cb 0.00 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 2bkh h LYS 657 CO -0.03 0.32 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.36 2bkh h LEU 658 N 0.35 0.99 -2.23 5.20 3.38 -1.14 -2.74 115.31 119.12 2bkh h LEU 658 Ca 0.10 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 2bkh h LEU 658 Cb 0.03 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2bkh h LEU 658 CO -0.02 1.07 -0.06 0.03 0.09 0.00 0.00 178.44 179.56 2bkh h ARG 659 N 0.88 0.00 -0.01 1.13 3.08 -0.92 -2.04 114.38 116.51 2bkh h ARG 659 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2bkh h ARG 659 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2bkh h ARG 659 CO 0.04 0.06 -0.07 -1.13 -1.07 0.00 0.00 179.97 177.79 2bkh n SER 660 N -3.52 0.58 -4.68 7.04 3.41 -1.02 -4.89 113.62 110.54 2bkh n SER 660 Ca -0.02 -0.83 -0.24 0.00 -0.26 0.00 0.00 58.87 57.52 2bkh n SER 660 Cb 0.17 -0.04 -0.07 0.00 -0.26 0.00 0.00 64.21 64.01 2bkh n SER 660 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2bkh s THR 661 N -2.30 2.94 0.40 6.66 -4.23 -0.77 -4.66 115.64 113.69 2bkh s THR 661 Ca 0.34 -1.83 -0.24 0.00 -1.18 0.00 0.00 61.69 58.78 2bkh s THR 661 Cb 0.21 -2.89 -0.09 0.00 1.34 0.00 0.00 72.50 71.06 2bkh s THR 661 CO 0.43 -0.22 1.06 -0.83 -0.54 0.00 0.00 174.62 174.52 2bkh s GLY 662 N -3.77 2.74 -0.03 3.99 0.00 -0.55 -4.86 107.32 104.83 2bkh s GLY 662 Ca 0.36 0.72 0.07 0.00 0.00 0.00 0.00 44.72 45.87 2bkh s GLY 662 CO 0.21 1.15 -0.24 0.00 0.00 0.00 0.00 173.10 174.22 2bkh s ALA 663 N -1.65 2.05 0.16 3.20 0.00 -1.26 0.14 121.76 124.40 2bkh s ALA 663 Ca 0.58 -1.04 0.06 0.00 0.00 0.00 0.00 51.96 51.57 2bkh s ALA 663 Cb -0.23 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 2bkh s ALA 663 CO 0.28 0.46 -0.14 -1.12 0.00 0.00 0.00 175.76 175.25 2bkh s SER 664 N -0.43 2.22 -0.05 0.00 0.01 -0.48 -4.96 113.70 110.02 2bkh s SER 664 Ca 0.05 -0.95 0.02 0.00 1.31 0.00 0.00 55.95 56.39 2bkh s SER 664 Cb -0.11 -0.09 0.01 0.00 0.21 0.00 0.00 66.02 66.05 2bkh s SER 664 CO 0.01 -0.19 -0.10 -0.36 0.41 0.00 0.00 173.24 173.00 2bkh s PHE 665 N -2.75 1.17 -0.05 2.43 0.08 -1.26 -0.78 117.98 116.83 2bkh s PHE 665 Ca 0.17 -0.36 0.05 0.00 0.12 0.00 0.00 56.93 56.90 2bkh s PHE 665 Cb -0.02 -0.86 -0.00 0.00 -0.57 0.00 0.00 43.02 41.57 2bkh s PHE 665 CO 0.04 -0.19 -0.19 0.42 -0.10 0.00 0.00 175.22 175.21 2bkh s ILE 666 N 0.49 1.55 -0.34 0.64 1.01 -0.80 -1.40 121.20 122.35 2bkh s ILE 666 Ca -0.09 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.78 2bkh s ILE 666 Cb -0.13 -1.33 0.09 0.00 0.01 0.00 0.00 42.46 41.10 2bkh s ILE 666 CO 0.02 0.44 0.07 -0.13 0.00 0.00 0.00 174.94 175.34 2bkh s ARG 667 N -0.01 1.94 0.02 2.79 1.81 0.65 -1.80 118.95 124.35 2bkh s ARG 667 Ca -0.03 -1.66 -0.23 0.00 -1.72 0.00 0.00 55.73 52.08 2bkh s ARG 667 Cb -0.12 -3.28 -0.05 0.00 -0.45 0.00 0.00 34.95 31.05 2bkh s ARG 667 CO 0.02 -0.87 0.68 0.00 -0.68 0.00 0.00 175.30 174.46 2bkh s ILE 669 N -0.09 1.77 -0.38 0.00 -1.09 -0.11 -4.33 121.20 116.97 2bkh s ILE 669 Ca 0.35 -0.90 -0.16 0.00 -2.23 0.00 0.00 60.65 57.71 2bkh s ILE 669 Cb -0.19 -1.51 0.01 0.00 -1.58 0.00 0.00 42.46 39.18 2bkh s ILE 669 CO 0.20 0.50 0.36 -0.75 -1.23 0.00 0.00 174.94 174.02 2bkh s LYS 670 N 0.01 3.28 0.44 2.79 2.20 -1.26 -1.69 119.74 125.50 2bkh s LYS 670 Ca -0.06 -0.68 0.23 0.00 -0.36 0.00 0.00 55.97 55.10 2bkh s LYS 670 Cb -0.13 -3.90 0.97 0.00 -1.51 0.00 0.00 37.83 33.26 2bkh s LYS 670 CO 0.04 -0.67 1.85 -1.00 -0.36 0.00 0.00 175.35 175.21 2bkh h PRO 671 N 8.59 0.00 -2.98 4.03 0.13 -1.87 -3.44 132.00 136.46 2bkh h PRO 671 Ca -0.28 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.90 2bkh h PRO 671 Cb 1.13 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.22 2bkh h PRO 671 CO 0.73 0.24 0.25 0.54 -0.23 0.00 0.00 178.00 179.53 2bkh s ASN 672 N -6.25 -0.20 0.00 1.44 2.20 -1.26 -1.32 114.94 109.55 2bkh s ASN 672 Ca -0.00 -0.71 0.16 0.00 -0.94 0.00 0.00 52.86 51.36 2bkh s ASN 672 Cb 0.11 0.75 0.55 0.00 -2.00 0.00 0.00 41.25 40.66 2bkh s ASN 672 CO 0.64 -1.40 1.41 0.18 -2.94 0.00 0.00 177.10 174.99 2bkh n LEU 673 N -0.48 1.64 -0.24 3.54 4.77 -1.26 -4.21 117.00 120.76 2bkh n LEU 673 Ca -0.05 -0.75 0.02 0.00 -0.03 0.00 0.00 56.01 55.20 2bkh n LEU 673 Cb 0.59 -0.15 0.06 0.00 -2.33 0.00 0.00 43.42 41.59 2bkh n LEU 673 CO 0.17 0.38 0.55 0.29 -1.33 0.00 0.00 177.39 177.45 2bkh n LYS 674 N 0.34 2.94 -3.56 3.23 4.76 -1.26 -4.98 118.16 119.63 2bkh n LYS 674 Ca 0.14 -1.72 -0.26 0.00 -2.87 0.00 0.00 58.31 53.60 2bkh n LYS 674 Cb 0.29 -1.11 0.02 0.00 -1.84 0.00 0.00 35.03 32.40 2bkh n LYS 674 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2bkh n MET 675 N -0.13 -4.75 -4.47 1.97 2.81 -1.26 -4.96 117.12 106.33 2bkh n MET 675 Ca 0.04 0.62 -0.32 0.00 -1.81 0.00 0.00 57.70 56.24 2bkh n MET 675 Cb 0.32 -5.45 -0.11 0.00 -0.71 0.00 0.00 33.22 27.27 2bkh n MET 675 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2bkh s THR 676 N -3.15 3.55 0.51 2.03 -1.32 -1.26 -4.97 115.64 111.03 2bkh s THR 676 Ca 0.51 -0.84 -0.13 0.00 -1.21 0.00 0.00 61.69 60.02 2bkh s THR 676 Cb -0.26 -2.55 -0.06 0.00 -1.51 0.00 0.00 72.50 68.13 2bkh s THR 676 CO 0.63 0.37 0.92 -0.94 -2.21 0.00 0.00 174.62 173.39 2bkh s SER 677 N -1.47 6.48 -1.37 8.08 1.04 -1.26 -4.33 113.70 120.87 2bkh s SER 677 Ca 0.17 1.37 -0.06 0.00 0.48 0.00 0.00 55.95 57.90 2bkh s SER 677 Cb -0.11 -2.43 0.03 0.00 0.10 0.00 0.00 66.02 63.61 2bkh s SER 677 CO 0.08 -0.60 0.97 1.41 0.98 0.00 0.00 173.24 176.07 2bkh n HIS 678 N -1.84 -2.34 -3.37 5.02 8.25 -1.26 -4.95 115.22 114.73 2bkh n HIS 678 Ca 0.05 0.93 -0.17 0.00 -0.26 0.00 0.00 57.72 58.27 2bkh n HIS 678 Cb 0.54 -4.58 -0.08 0.00 1.12 0.00 0.00 29.99 26.99 2bkh n HIS 678 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2bkh s HIS 679 N -3.41 -0.33 -0.44 4.41 5.04 -1.26 -5.11 115.29 114.19 2bkh s HIS 679 Ca 0.35 -0.69 -0.24 0.00 -1.54 0.00 0.00 55.06 52.95 2bkh s HIS 679 Cb -0.17 -0.42 0.02 0.00 0.04 0.00 0.00 32.58 32.06 2bkh s HIS 679 CO 0.78 -0.96 0.82 0.12 -2.34 0.00 0.00 174.74 173.16 2bkh s PHE 680 N 1.63 3.00 -0.58 3.88 5.36 -1.26 -4.26 117.98 125.74 2bkh s PHE 680 Ca 0.15 0.29 -0.17 0.00 -0.96 0.00 0.00 56.93 56.24 2bkh s PHE 680 Cb -0.15 -3.68 0.12 0.00 -0.34 0.00 0.00 43.02 38.97 2bkh s PHE 680 CO -0.10 -0.96 0.61 -2.00 -1.46 0.00 0.00 175.22 171.31 2bkh s GLU 681 N 3.36 3.05 0.11 10.12 2.56 -0.43 -4.98 118.70 132.49 2bkh s GLU 681 Ca 0.32 -1.57 -0.27 0.00 0.00 0.00 0.00 54.97 53.45 2bkh s GLU 681 Cb -0.12 -4.30 -0.08 0.00 2.00 0.00 0.00 34.13 31.63 2bkh s GLU 681 CO 0.22 -1.43 1.63 0.78 -0.56 0.00 0.00 175.26 175.90 2bkh h GLY 682 N 9.36 -0.51 1.42 -1.50 0.00 -1.73 -2.18 103.07 107.92 2bkh h GLY 682 Ca -0.27 0.32 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 2bkh h GLY 682 CO 1.06 -0.23 -0.10 0.00 0.00 0.00 0.00 176.54 177.26 2bkh h ALA 683 N 0.23 1.08 -0.51 3.60 0.00 -1.34 0.15 119.26 122.46 2bkh h ALA 683 Ca 0.03 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 2bkh h ALA 683 Cb 0.51 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2bkh h ALA 683 CO -0.16 0.57 0.03 1.96 0.00 0.00 0.00 179.25 181.64 2bkh h GLN 684 N 0.63 0.85 0.01 0.00 4.20 -1.78 -1.05 115.11 117.97 2bkh h GLN 684 Ca 0.11 -0.22 -0.26 0.00 0.06 0.00 0.00 58.65 58.34 2bkh h GLN 684 Cb 0.55 -0.10 0.02 0.00 0.30 0.00 0.00 27.48 28.25 2bkh h GLN 684 CO 0.03 0.83 -1.03 0.82 -0.67 0.00 0.00 178.83 178.82 2bkh h ILE 685 N 0.79 1.29 -0.69 2.54 2.04 -1.03 -2.60 117.51 119.86 2bkh h ILE 685 Ca 0.16 -2.24 0.08 0.00 1.00 0.00 0.00 64.86 63.85 2bkh h ILE 685 Cb 0.44 2.41 -0.07 0.00 -0.74 0.00 0.00 36.82 38.87 2bkh h ILE 685 CO 0.02 0.69 0.35 0.25 0.00 0.00 0.00 178.15 179.46 2bkh h LEU 686 N 0.35 0.48 -0.78 1.44 5.85 -0.56 -0.65 115.31 121.45 2bkh h LEU 686 Ca -0.13 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 2bkh h LEU 686 Cb 1.69 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.64 2bkh h LEU 686 CO 0.20 0.29 0.47 -1.28 -0.34 0.00 0.00 178.44 177.78 2bkh h SER 687 N 0.62 0.93 0.08 1.25 0.87 -1.14 -1.74 113.55 114.42 2bkh h SER 687 Ca 0.33 -0.06 -0.13 0.00 -1.23 0.00 0.00 61.79 60.70 2bkh h SER 687 Cb 0.30 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2bkh h SER 687 CO -0.24 0.71 -0.45 1.56 -0.53 0.00 0.00 176.83 177.88 2bkh h GLN 688 N 1.06 0.45 -0.64 2.24 4.20 -1.02 -0.58 115.11 120.82 2bkh h GLN 688 Ca 0.28 -0.24 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 2bkh h GLN 688 Cb -0.05 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 2bkh h GLN 688 CO -0.05 0.81 0.26 -0.07 -0.67 0.00 0.00 178.83 179.11 2bkh h LEU 689 N 0.36 0.85 0.20 1.46 3.38 -0.66 -0.96 115.31 119.94 2bkh h LEU 689 Ca 0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2bkh h LEU 689 Cb 0.94 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2bkh h LEU 689 CO 0.08 0.76 -0.10 1.56 0.09 0.00 0.00 178.44 180.83 2bkh h GLN 690 N 0.91 -0.26 0.00 1.13 4.20 -1.08 -2.44 115.11 117.58 2bkh h GLN 690 Ca 0.22 0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.91 2bkh h GLN 690 Cb 0.17 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 2bkh h GLN 690 CO -0.02 0.12 -0.15 0.00 -0.67 0.00 0.00 178.83 178.11 2bkh n SER 692 N -3.74 1.26 0.00 0.00 3.41 -0.37 -4.31 113.62 109.87 2bkh n SER 692 Ca -0.02 -1.54 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 2bkh n SER 692 Cb 0.27 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2bkh n SER 692 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bkh n GLY 693 N 1.09 1.01 0.36 5.00 0.00 -0.82 -4.91 105.19 106.93 2bkh n GLY 693 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2bkh n GLY 693 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2bkh h MET 694 N 3.39 1.17 -0.42 1.61 2.07 -1.66 -1.72 114.93 119.38 2bkh h MET 694 Ca 0.00 -0.07 -0.09 0.00 -2.07 0.00 0.00 59.70 57.47 2bkh h MET 694 Cb 0.00 -0.26 -0.01 0.00 -1.87 0.00 0.00 31.60 29.45 2bkh h MET 694 CO 0.00 0.78 -0.07 0.28 1.07 0.00 0.00 176.91 178.97 2bkh h VAL 695 N 1.21 1.27 -1.01 -2.22 2.07 -1.78 -1.56 116.25 114.23 2bkh h VAL 695 Ca 0.39 -1.15 0.06 0.00 0.82 0.00 0.00 66.70 66.81 2bkh h VAL 695 Cb 0.02 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 30.89 2bkh h VAL 695 CO -0.13 0.39 0.65 -1.28 0.02 0.00 0.00 177.57 177.22 2bkh h SER 696 N 0.61 1.06 -0.55 0.57 0.87 -1.80 -1.44 113.55 112.88 2bkh h SER 696 Ca 0.11 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.56 2bkh h SER 696 Cb 0.59 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 2bkh h SER 696 CO 0.04 0.69 -0.09 0.58 -0.53 0.00 0.00 176.83 177.51 2bkh h VAL 697 N 1.21 1.27 -0.95 2.23 2.07 -1.05 -2.31 116.25 118.72 2bkh h VAL 697 Ca 0.42 -1.25 0.04 0.00 0.82 0.00 0.00 66.70 66.73 2bkh h VAL 697 Cb 0.11 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 2bkh h VAL 697 CO -0.16 0.44 0.62 -0.07 0.02 0.00 0.00 177.57 178.42 2bkh h LEU 698 N 0.92 1.02 -0.37 2.57 3.38 -0.70 -1.24 115.31 120.90 2bkh h LEU 698 Ca 0.15 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2bkh h LEU 698 Cb 0.66 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2bkh h LEU 698 CO 0.05 0.69 0.19 0.44 0.09 0.00 0.00 178.44 179.90 2bkh h ASP 699 N 1.18 0.47 -0.76 -0.43 3.32 -1.02 -2.63 116.42 116.55 2bkh h ASP 699 Ca 0.39 -0.10 0.07 0.00 0.02 0.00 0.00 57.03 57.40 2bkh h ASP 699 Cb 0.04 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.41 2bkh h ASP 699 CO -0.13 0.44 0.44 0.25 -1.72 0.00 0.00 179.24 178.51 2bkh h LEU 700 N 0.46 0.65 -1.13 1.55 6.46 -1.05 -2.35 115.31 119.90 2bkh h LEU 700 Ca 0.13 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 2bkh h LEU 700 Cb 0.08 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 39.91 2bkh h LEU 700 CO -0.02 0.40 0.00 0.24 -0.62 0.00 0.00 178.44 178.44 2bkh h MET 701 N 0.78 0.00 0.00 1.25 2.86 -0.92 -2.11 114.93 116.78 2bkh h MET 701 Ca 0.35 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.96 2bkh h MET 701 Cb 0.24 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 2bkh h MET 701 CO -0.20 0.00 -0.10 1.96 1.06 0.00 0.00 176.91 179.63 2bkh h GLN 702 N 0.00 0.00 0.00 1.72 1.08 -1.07 -2.26 115.11 114.59 2bkh h GLN 702 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2bkh h GLN 702 Cb 0.53 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 2bkh h GLN 702 CO 0.00 0.10 0.00 0.41 -0.95 0.00 0.00 178.83 178.39 2bkh n GLY 703 N -0.82 -1.11 0.00 3.46 0.00 -0.79 -4.64 105.19 101.29 2bkh n GLY 703 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2bkh n GLY 703 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bkh n GLY 704 N 1.02 1.62 2.75 -0.02 0.00 -0.85 -3.93 105.19 105.79 2bkh n GLY 704 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2bkh n GLY 704 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bkh s PHE 705 N 3.65 2.50 0.23 1.61 0.40 -1.25 -4.64 117.98 120.47 2bkh s PHE 705 Ca 0.00 -2.80 0.22 0.00 -0.60 0.00 0.00 56.93 53.75 2bkh s PHE 705 Cb 0.00 -2.12 0.95 0.00 0.51 0.00 0.00 43.02 42.36 2bkh s PHE 705 CO 0.00 -0.71 1.85 -1.00 0.70 0.00 0.00 175.22 176.06 2bkh h PRO 706 N 6.12 0.00 -5.68 0.24 0.13 -1.56 -3.43 132.00 127.82 2bkh h PRO 706 Ca 0.07 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.54 2bkh h PRO 706 Cb 0.87 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.84 2bkh h PRO 706 CO 0.57 0.26 -0.61 -1.12 -0.23 0.00 0.00 178.00 176.87 2bkh s SER 707 N -6.32 5.31 -0.02 1.44 0.01 -1.22 -4.56 113.70 108.34 2bkh s SER 707 Ca -0.01 0.10 -0.23 0.00 1.31 0.00 0.00 55.95 57.12 2bkh s SER 707 Cb 0.11 -1.67 0.05 0.00 0.21 0.00 0.00 66.02 64.72 2bkh s SER 707 CO 0.65 0.30 0.51 -0.13 0.41 0.00 0.00 173.24 174.98 2bkh s ARG 708 N -0.39 0.92 -0.16 12.44 0.52 -0.47 -0.64 118.95 131.17 2bkh s ARG 708 Ca 0.08 -0.01 -0.12 0.00 -0.52 0.00 0.00 55.73 55.15 2bkh s ARG 708 Cb -0.12 0.42 0.05 0.00 0.52 0.00 0.00 34.95 35.82 2bkh s ARG 708 CO 0.02 -0.29 0.40 0.00 0.02 0.00 0.00 175.30 175.45 2bkh s ALA 709 N -1.53 -1.00 0.63 2.13 0.00 -0.96 -3.77 121.76 117.26 2bkh s ALA 709 Ca -0.11 1.25 -0.17 0.00 0.00 0.00 0.00 51.96 52.94 2bkh s ALA 709 Cb -0.02 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2bkh s ALA 709 CO 0.05 -0.21 1.15 -1.54 0.00 0.00 0.00 175.76 175.21 2bkh s SER 710 N 0.59 5.07 0.34 0.00 1.04 -1.26 -1.56 113.70 117.92 2bkh s SER 710 Ca -0.03 2.19 0.09 0.00 0.48 0.00 0.00 55.95 58.68 2bkh s SER 710 Cb -0.05 -2.58 0.81 0.00 0.10 0.00 0.00 66.02 64.30 2bkh s SER 710 CO -0.04 -1.66 1.83 -0.26 0.98 0.00 0.00 173.24 174.09 2bkh h PHE 711 N 0.40 0.89 -0.85 5.02 0.04 -1.87 -1.20 116.94 119.36 2bkh h PHE 711 Ca -0.48 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.28 2bkh h PHE 711 Cb 1.27 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 39.11 2bkh h PHE 711 CO 0.51 0.28 0.41 1.25 -0.60 0.00 0.00 178.31 180.15 2bkh h HIS 712 N 0.71 1.23 -0.35 -0.55 2.76 -1.87 0.36 115.15 117.44 2bkh h HIS 712 Ca 0.50 -0.06 -0.10 0.00 -2.20 0.00 0.00 60.37 58.51 2bkh h HIS 712 Cb 0.83 -0.38 -0.01 0.00 1.55 0.00 0.00 27.41 29.40 2bkh h HIS 712 CO -0.00 0.89 -0.16 1.49 -1.30 0.00 0.00 177.93 178.85 2bkh h GLU 713 N 1.22 0.73 -0.37 5.26 4.81 -1.61 -2.75 114.58 121.87 2bkh h GLU 713 Ca 0.29 -0.31 -0.11 0.00 -0.13 0.00 0.00 59.36 59.10 2bkh h GLU 713 Cb 0.12 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2bkh h GLU 713 CO -0.04 0.92 -0.21 -0.07 -0.73 0.00 0.00 179.01 178.88 2bkh h LEU 714 N 0.51 0.73 -0.42 1.64 3.38 -1.01 -1.86 115.31 118.28 2bkh h LEU 714 Ca 0.08 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2bkh h LEU 714 Cb 0.69 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2bkh h LEU 714 CO 0.05 0.93 0.26 0.22 0.09 0.00 0.00 178.44 179.99 2bkh h TYR 715 N 0.64 0.50 0.00 1.13 3.20 -0.96 -2.05 116.97 119.42 2bkh h TYR 715 Ca 0.09 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.84 2bkh h TYR 715 Cb 0.71 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.79 2bkh h TYR 715 CO 0.03 0.30 -0.67 -0.91 -1.64 0.00 0.00 178.16 175.28 2bkh h ASN 716 N 0.53 0.00 -0.17 -2.11 2.35 -1.25 -1.88 115.58 113.05 2bkh h ASN 716 Ca 0.16 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.73 2bkh h ASN 716 Cb -0.02 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 2bkh h ASN 716 CO -0.06 0.67 -0.57 0.24 -1.65 0.00 0.00 177.43 176.06 2bkh h MET 717 N 0.00 0.77 -0.00 0.81 2.86 -1.20 -3.40 114.93 114.76 2bkh h MET 717 Ca -0.01 -0.50 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 2bkh h MET 717 Cb 1.21 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.93 2bkh h MET 717 CO 0.09 1.12 -0.01 0.66 1.06 0.00 0.00 176.91 179.83 2bkh n TYR 718 N -3.98 0.00 0.19 -0.22 4.01 -0.78 -4.67 117.16 111.71 2bkh n TYR 718 Ca -0.04 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.74 2bkh n TYR 718 Cb 0.63 0.00 0.40 0.00 -0.31 0.00 0.00 39.34 40.06 2bkh n TYR 718 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 2bkh h LYS 719 N 0.29 0.00 -0.01 -0.72 2.10 -1.56 -2.35 116.57 114.31 2bkh h LYS 719 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2bkh h LYS 719 Cb 0.06 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2bkh h LYS 719 CO 0.00 0.34 0.02 1.57 -2.00 0.00 0.00 179.45 179.38 2bkh h LYS 720 N 0.00 0.00 0.00 0.07 2.10 -1.84 -1.43 116.57 115.47 2bkh h LYS 720 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2bkh h LYS 720 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 2bkh h LYS 720 CO 0.04 0.00 -0.35 0.66 -2.00 0.00 0.00 179.45 177.80 2bkh n TYR 721 N -3.66 0.07 -3.99 0.07 0.53 -0.89 -4.93 117.16 104.35 2bkh n TYR 721 Ca -0.03 0.02 -0.27 0.00 -1.02 0.00 0.00 57.90 56.61 2bkh n TYR 721 Cb 0.10 -0.37 -0.04 0.00 -1.03 0.00 0.00 39.34 38.00 2bkh n TYR 721 CO 0.00 0.00 0.00 -1.64 -1.02 0.00 0.00 176.86 174.20 2bkh s MET 722 N -3.02 3.23 0.64 -0.72 -1.94 -0.54 -5.01 119.30 111.95 2bkh s MET 722 Ca 0.11 -0.68 -0.17 0.00 -1.71 0.00 0.00 55.69 53.24 2bkh s MET 722 Cb 0.17 -2.85 -0.04 0.00 2.01 0.00 0.00 34.83 34.12 2bkh s MET 722 CO 0.65 0.52 0.80 -2.30 -0.01 0.00 0.00 175.02 174.67 2bkh n PRO 723 N -0.39 0.63 -0.20 2.03 -0.02 -1.26 -4.75 135.00 131.04 2bkh n PRO 723 Ca -0.07 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.79 2bkh n PRO 723 Cb 0.54 -2.02 0.43 0.00 -0.02 0.00 0.00 33.50 32.42 2bkh n PRO 723 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2bkh h ASP 724 N 0.13 0.54 -0.57 2.55 3.45 -1.97 -1.83 116.42 118.73 2bkh h ASP 724 Ca -0.47 0.02 0.06 0.00 0.43 0.00 0.00 57.03 57.07 2bkh h ASP 724 Cb 1.37 -0.09 -0.08 0.00 -0.56 0.00 0.00 39.33 39.97 2bkh h ASP 724 CO 0.48 0.30 -0.49 0.50 -1.57 0.00 0.00 179.24 178.45 2bkh h LYS 725 N 0.59 -0.19 -0.05 3.56 3.64 -2.01 -2.11 116.57 120.00 2bkh h LYS 725 Ca 0.38 0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.67 2bkh h LYS 725 Cb 0.67 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 2bkh h LYS 725 CO -0.15 -0.13 -0.48 -0.07 -2.27 0.00 0.00 179.45 176.36 2bkh h LEU 726 N -0.20 0.13 -0.47 5.20 4.07 -1.71 -2.86 115.31 119.47 2bkh h LEU 726 Ca 0.09 -0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.00 2bkh h LEU 726 Cb 0.45 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.15 2bkh h LEU 726 CO -0.64 0.59 0.00 0.00 -1.08 0.00 0.00 178.44 177.31 2bkh n ALA 727 N -2.46 1.46 0.72 1.53 0.00 -0.80 -2.12 120.51 118.84 2bkh n ALA 727 Ca -0.02 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.58 2bkh n ALA 727 Cb 0.51 -1.26 0.07 0.00 0.00 0.00 0.00 19.45 18.77 2bkh n ALA 727 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2bkh n ARG 728 N -1.88 0.18 -1.19 0.00 1.74 -0.90 -4.94 116.66 109.67 2bkh n ARG 728 Ca 0.02 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.78 2bkh n ARG 728 Cb 0.14 -1.57 0.11 0.00 -1.02 0.00 0.00 32.46 30.13 2bkh n ARG 728 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2bkh s LEU 729 N -3.61 3.09 0.63 0.55 1.43 -0.90 -5.01 118.68 114.87 2bkh s LEU 729 Ca 0.06 2.11 -0.17 0.00 -1.03 0.00 0.00 54.13 55.10 2bkh s LEU 729 Cb 0.15 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.80 2bkh s LEU 729 CO 0.78 -2.40 1.16 1.51 0.23 0.00 0.00 176.35 177.64 2bkh s ASP 730 N -2.68 5.07 0.25 2.29 1.47 -1.26 -4.77 116.67 117.04 2bkh s ASP 730 Ca 0.67 2.22 -0.03 0.00 1.18 0.00 0.00 52.55 56.60 2bkh s ASP 730 Cb -0.23 -2.58 0.48 0.00 -0.34 0.00 0.00 42.92 40.25 2bkh s ASP 730 CO 0.52 -1.66 1.75 -0.65 0.68 0.00 0.00 175.17 175.80 2bkh h PRO 731 N 0.46 0.51 -0.21 2.11 0.11 -1.95 -0.88 132.00 132.14 2bkh h PRO 731 Ca -0.49 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 2bkh h PRO 731 Cb 1.27 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2bkh h PRO 731 CO 0.54 0.34 0.12 -0.09 -0.21 0.00 0.00 178.00 178.70 2bkh h ARG 732 N 0.52 0.29 -0.34 1.05 2.43 -1.92 -1.62 114.38 114.80 2bkh h ARG 732 Ca 0.43 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.42 2bkh h ARG 732 Cb 0.62 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 2bkh h ARG 732 CO -0.38 0.25 -0.40 1.25 -1.51 0.00 0.00 179.97 179.19 2bkh h LEU 733 N 0.25 0.87 -0.55 3.80 5.85 -1.84 -0.62 115.31 123.06 2bkh h LEU 733 Ca 0.08 -0.40 0.11 0.00 0.84 0.00 0.00 57.88 58.51 2bkh h LEU 733 Cb 0.04 -0.24 -0.11 0.00 0.37 0.00 0.00 40.66 40.72 2bkh h LEU 733 CO -0.01 1.15 -0.23 0.15 -0.34 0.00 0.00 178.44 179.17 2bkh h PHE 734 N 0.66 -0.57 -0.33 1.25 3.57 -1.09 -0.04 116.94 120.40 2bkh h PHE 734 Ca 0.05 0.06 -0.14 0.00 3.53 0.00 0.00 57.97 61.47 2bkh h PHE 734 Cb 0.96 0.33 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 2bkh h PHE 734 CO 0.05 -0.31 -0.37 0.00 -2.23 0.00 0.00 178.31 175.45 2bkh h LYS 736 N 0.63 0.40 -0.48 0.00 1.57 -0.70 -0.50 116.57 117.50 2bkh h LYS 736 Ca 0.06 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2bkh h LYS 736 Cb 0.91 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.13 2bkh h LYS 736 CO 0.08 0.39 0.31 0.00 -0.57 0.00 0.00 179.45 179.66 2bkh h ALA 737 N 0.99 0.61 -0.47 3.86 0.00 -0.89 -0.72 119.26 122.63 2bkh h ALA 737 Ca 0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2bkh h ALA 737 Cb 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2bkh h ALA 737 CO -0.01 0.06 0.14 1.25 0.00 0.00 0.00 179.25 180.69 2bkh h LEU 738 N 0.64 0.69 -0.44 0.00 5.85 -0.96 0.57 115.31 121.65 2bkh h LEU 738 Ca 0.17 -0.21 -0.16 0.00 0.84 0.00 0.00 57.88 58.52 2bkh h LEU 738 Cb -0.06 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.78 2bkh h LEU 738 CO -0.04 0.72 -0.47 -0.26 -0.34 0.00 0.00 178.44 178.05 2bkh h PHE 739 N 0.63 0.94 0.18 1.25 -1.00 -0.96 -1.87 116.94 116.12 2bkh h PHE 739 Ca 0.15 -0.31 -0.01 0.00 2.81 0.00 0.00 57.97 60.61 2bkh h PHE 739 Cb 0.28 -0.19 0.00 0.00 3.61 0.00 0.00 35.95 39.65 2bkh h PHE 739 CO 0.01 1.09 -0.09 -0.22 -1.61 0.00 0.00 178.31 177.50 2bkh h LYS 740 N 0.61 -0.23 -1.00 1.51 1.63 -1.07 -3.06 116.57 114.95 2bkh h LYS 740 Ca 0.03 0.02 0.21 0.00 -0.85 0.00 0.00 60.65 60.06 2bkh h LYS 740 Cb 1.04 0.05 -0.11 0.00 -0.60 0.00 0.00 32.23 32.62 2bkh h LYS 740 CO 0.10 0.05 0.61 0.00 -3.45 0.00 0.00 179.45 176.76 2bkh h ALA 741 N 0.25 1.76 0.00 5.00 0.00 -0.76 -1.95 119.26 123.55 2bkh h ALA 741 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2bkh h ALA 741 Cb 0.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2bkh h ALA 741 CO 0.04 -0.16 -0.19 -0.07 0.00 0.00 0.00 179.25 178.88 2bkh h LEU 742 N 0.68 0.00 -2.36 0.00 3.38 -1.33 -3.45 115.31 112.24 2bkh h LEU 742 Ca 0.59 -0.06 -0.22 0.00 0.09 0.00 0.00 57.88 58.28 2bkh h LEU 742 Cb 1.03 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.94 2bkh h LEU 742 CO -0.39 0.03 -0.69 0.61 0.09 0.00 0.00 178.44 178.09 2bkh n GLY 743 N 1.31 -0.66 3.78 0.83 0.00 -0.74 -4.97 105.19 104.75 2bkh n GLY 743 Ca 0.05 0.33 -0.39 0.00 0.00 0.00 0.00 46.02 46.01 2bkh n GLY 743 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bkh s LEU 744 N -5.09 4.52 -0.01 0.99 1.43 -1.24 -4.99 118.68 114.29 2bkh s LEU 744 Ca 0.29 1.66 -0.30 0.00 -1.03 0.00 0.00 54.13 54.75 2bkh s LEU 744 Cb -0.04 -3.48 -0.07 0.00 0.03 0.00 0.00 46.19 42.63 2bkh s LEU 744 CO 0.60 0.13 1.66 0.21 0.23 0.00 0.00 176.35 179.19 2bkh s ASN 745 N -1.31 6.65 0.18 2.29 2.47 -1.26 -4.89 114.94 119.07 2bkh s ASN 745 Ca 0.40 2.33 0.19 0.00 0.42 0.00 0.00 52.86 56.19 2bkh s ASN 745 Cb -0.22 -2.54 0.83 0.00 -1.45 0.00 0.00 41.25 37.87 2bkh s ASN 745 CO 0.26 -0.91 1.57 -1.84 -3.72 0.00 0.00 177.10 172.46 2bkh n GLU 746 N 6.61 0.12 0.05 0.43 0.28 -1.26 -2.27 120.64 124.59 2bkh n GLU 746 Ca 0.17 0.43 -0.20 0.00 -0.16 0.00 0.00 57.16 57.39 2bkh n GLU 746 Cb 0.42 -1.76 -0.11 0.00 1.43 0.00 0.00 31.44 31.42 2bkh n GLU 746 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2bkh h ILE 747 N 0.00 1.30 0.00 3.84 2.04 -2.03 -3.37 117.51 119.29 2bkh h ILE 747 Ca 0.00 -2.28 -0.07 0.00 1.00 0.00 0.00 64.86 63.51 2bkh h ILE 747 Cb 0.24 2.50 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 2bkh h ILE 747 CO 0.00 0.70 -1.20 0.47 0.00 0.00 0.00 178.15 178.11 2bkh n ASP 748 N -3.90 0.83 -3.99 1.72 8.00 -0.96 -4.84 116.55 113.41 2bkh n ASP 748 Ca -0.12 0.34 -0.26 0.00 0.71 0.00 0.00 54.79 55.46 2bkh n ASP 748 Cb 0.88 0.37 -0.17 0.00 -0.02 0.00 0.00 41.12 42.18 2bkh n ASP 748 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2bkh s TYR 749 N -3.19 1.61 -0.13 1.24 1.51 -1.07 -2.09 117.35 115.23 2bkh s TYR 749 Ca -0.02 -0.72 0.00 0.00 -1.01 0.00 0.00 57.07 55.32 2bkh s TYR 749 Cb 0.09 -1.23 0.02 0.00 -0.11 0.00 0.00 41.96 40.74 2bkh s TYR 749 CO 0.80 -0.42 -0.12 0.15 -1.11 0.00 0.00 175.55 174.85 2bkh s LYS 750 N 1.14 1.99 -0.55 -0.62 3.01 -0.54 -4.63 119.74 119.54 2bkh s LYS 750 Ca -0.05 -0.45 -0.19 0.00 -1.01 0.00 0.00 55.97 54.27 2bkh s LYS 750 Cb -0.14 -1.86 0.08 0.00 -1.01 0.00 0.00 37.83 34.89 2bkh s LYS 750 CO -0.02 -0.21 0.68 0.12 0.51 0.00 0.00 175.35 176.43 2bkh s PHE 751 N 1.45 3.00 0.00 3.18 5.36 -1.26 -0.84 117.98 128.87 2bkh s PHE 751 Ca 0.02 -0.72 0.00 0.00 -0.96 0.00 0.00 56.93 55.28 2bkh s PHE 751 Cb -0.13 -3.79 0.00 0.00 -0.34 0.00 0.00 43.02 38.76 2bkh s PHE 751 CO -0.08 -1.18 0.00 0.41 -1.46 0.00 0.00 175.22 172.91 2bkh n GLY 752 N 5.23 0.14 0.13 13.12 0.00 -0.28 -4.88 105.19 118.65 2bkh n GLY 752 Ca -0.08 -1.79 -0.22 0.00 0.00 0.00 0.00 46.02 43.94 2bkh n GLY 752 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bkh h LEU 753 N 0.00 0.58 0.00 0.99 3.38 -1.71 -3.41 115.31 115.14 2bkh h LEU 753 Ca 0.00 -0.92 -0.02 0.00 0.09 0.00 0.00 57.88 57.03 2bkh h LEU 753 Cb 0.00 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2bkh h LEU 753 CO 0.00 1.58 -1.36 0.35 0.09 0.00 0.00 178.44 179.11 2bkh n THR 754 N -3.90 0.06 -3.96 0.22 -2.24 -1.26 -5.06 114.28 98.14 2bkh n THR 754 Ca -0.19 -0.19 -0.08 0.00 -2.27 0.00 0.00 64.05 61.33 2bkh n THR 754 Cb 0.95 0.18 -0.09 0.00 -2.10 0.00 0.00 70.33 69.27 2bkh n THR 754 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2bkh s LYS 755 N -2.47 0.68 -0.12 -0.78 1.02 -1.26 -2.99 119.74 113.83 2bkh s LYS 755 Ca -0.03 -0.99 -0.20 0.00 0.02 0.00 0.00 55.97 54.77 2bkh s LYS 755 Cb 0.04 0.26 -0.04 0.00 -0.52 0.00 0.00 37.83 37.58 2bkh s LYS 755 CO 0.30 -0.17 0.57 0.08 -0.92 0.00 0.00 175.35 175.21 2bkh s VAL 756 N -3.50 5.12 -0.07 3.17 1.01 -0.60 -1.13 120.40 124.40 2bkh s VAL 756 Ca 0.03 1.14 -0.04 0.00 0.00 0.00 0.00 61.98 63.11 2bkh s VAL 756 Cb 0.04 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 2bkh s VAL 756 CO -0.09 0.27 0.09 -0.36 0.00 0.00 0.00 175.10 175.01 2bkh s PHE 757 N 0.91 3.40 -0.02 5.22 0.08 -0.02 -2.26 117.98 125.28 2bkh s PHE 757 Ca 0.30 0.34 0.04 0.00 0.12 0.00 0.00 56.93 57.73 2bkh s PHE 757 Cb -0.16 -1.84 -0.01 0.00 -0.57 0.00 0.00 43.02 40.44 2bkh s PHE 757 CO 0.13 0.61 -0.14 -0.06 -0.10 0.00 0.00 175.22 175.65 2bkh s PHE 758 N -1.06 1.36 0.95 0.36 0.08 0.19 -1.47 117.98 118.40 2bkh s PHE 758 Ca 0.18 -0.30 -0.12 0.00 0.12 0.00 0.00 56.93 56.81 2bkh s PHE 758 Cb -0.12 -0.90 0.16 0.00 -0.57 0.00 0.00 43.02 41.59 2bkh s PHE 758 CO 0.07 -0.07 1.09 1.03 -0.10 0.00 0.00 175.22 177.24 2bkh s ARG 759 N -0.18 0.79 0.15 0.44 1.81 -0.89 -3.23 118.95 117.84 2bkh s ARG 759 Ca 0.02 0.86 -0.34 0.00 -1.72 0.00 0.00 55.73 54.56 2bkh s ARG 759 Cb -0.07 -1.75 -0.16 0.00 -0.45 0.00 0.00 34.95 32.52 2bkh s ARG 759 CO 0.00 -2.58 1.29 -2.30 -0.68 0.00 0.00 175.30 171.03 2bkh n PRO 760 N -4.12 1.36 -0.54 3.54 -0.02 -1.26 -1.95 135.00 132.01 2bkh n PRO 760 Ca 0.07 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2bkh n PRO 760 Cb 0.55 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 2bkh n PRO 760 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bkh n GLY 761 N 2.32 1.69 0.11 -1.23 0.00 -1.26 -4.89 105.19 101.93 2bkh n GLY 761 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 2bkh n GLY 761 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bkh n LYS 762 N -2.00 0.61 -0.04 1.61 4.76 -0.82 -2.30 118.16 119.98 2bkh n LYS 762 Ca 0.00 0.10 -0.16 0.00 -2.87 0.00 0.00 58.31 55.38 2bkh n LYS 762 Cb 0.00 -1.81 -0.05 0.00 -1.84 0.00 0.00 35.03 31.33 2bkh n LYS 762 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 2bkh h PHE 763 N 0.00 1.07 -0.81 2.13 3.57 -1.82 -0.51 116.94 120.58 2bkh h PHE 763 Ca 0.00 -0.43 -0.01 0.00 3.53 0.00 0.00 57.97 61.06 2bkh h PHE 763 Cb 1.00 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.52 2bkh h PHE 763 CO 0.00 1.26 0.48 0.00 -2.23 0.00 0.00 178.31 177.82 2bkh h ALA 764 N 0.63 1.03 -0.45 2.41 0.00 -1.73 -0.78 119.26 120.37 2bkh h ALA 764 Ca -0.02 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 2bkh h ALA 764 Cb 1.29 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2bkh h ALA 764 CO 0.14 0.50 -0.21 1.49 0.00 0.00 0.00 179.25 181.18 2bkh h GLU 765 N 1.11 0.93 -0.82 0.00 4.81 -1.35 -1.61 114.58 117.65 2bkh h GLU 765 Ca 0.29 -0.40 0.01 0.00 -0.13 0.00 0.00 59.36 59.13 2bkh h GLU 765 Cb -0.03 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.28 2bkh h GLU 765 CO -0.05 1.06 0.54 0.35 -0.73 0.00 0.00 179.01 180.18 2bkh h PHE 766 N 0.77 1.02 -0.76 0.92 3.57 -0.96 -2.46 116.94 119.04 2bkh h PHE 766 Ca 0.10 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 2bkh h PHE 766 Cb 0.78 -0.34 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 2bkh h PHE 766 CO 0.05 0.63 0.33 0.22 -2.23 0.00 0.00 178.31 177.32 2bkh h ASP 767 N 1.09 1.02 -0.64 0.41 3.58 -0.69 -2.47 116.42 118.72 2bkh h ASP 767 Ca 0.31 -0.16 -0.05 0.00 0.42 0.00 0.00 57.03 57.55 2bkh h ASP 767 Cb -0.10 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 40.66 2bkh h ASP 767 CO -0.08 0.90 0.23 1.56 -2.88 0.00 0.00 179.24 178.97 2bkh h GLN 768 N 1.08 0.98 -0.80 0.28 1.08 -1.05 -2.04 115.11 114.65 2bkh h GLN 768 Ca 0.26 -0.20 0.08 0.00 -1.45 0.00 0.00 58.65 57.34 2bkh h GLN 768 Cb 0.17 -0.15 -0.05 0.00 -0.05 0.00 0.00 27.48 27.40 2bkh h GLN 768 CO -0.03 0.85 0.52 0.82 -0.95 0.00 0.00 178.83 180.04 2bkh h ILE 769 N 0.92 1.00 0.00 2.54 2.04 -1.19 0.10 117.51 122.92 2bkh h ILE 769 Ca 0.21 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2bkh h ILE 769 Cb 0.26 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 2bkh h ILE 769 CO -0.01 0.15 0.00 0.23 0.00 0.00 0.00 178.15 178.52 2bkh n MET 770 N -4.49 0.15 -0.00 2.37 2.81 -0.80 -4.02 117.12 113.13 2bkh n MET 770 Ca 0.13 0.25 0.01 0.00 -1.81 0.00 0.00 57.70 56.27 2bkh n MET 770 Cb 0.26 -1.73 -0.02 0.00 -0.71 0.00 0.00 33.22 31.03 2bkh n MET 770 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2bkh n LYS 771 N -2.00 0.79 0.08 0.03 5.02 -0.56 -4.86 118.16 116.66 2bkh n LYS 771 Ca 0.04 -0.02 0.11 0.00 -2.02 0.00 0.00 58.31 56.43 2bkh n LYS 771 Cb 0.31 -1.05 -0.02 0.00 -0.02 0.00 0.00 35.03 34.24 2bkh n LYS 771 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2bkh n SER 772 N -1.68 0.72 -2.81 4.39 3.41 0.25 -4.72 113.62 113.18 2bkh n SER 772 Ca -0.01 0.26 -0.08 0.00 -0.26 0.00 0.00 58.87 58.79 2bkh n SER 772 Cb 0.16 0.68 0.02 0.00 -0.26 0.00 0.00 64.21 64.81 2bkh n SER 772 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2bkh n ASP 773 N -2.59 -2.92 0.15 4.04 4.64 -1.26 -5.04 116.55 113.57 2bkh n ASP 773 Ca -0.00 -3.03 0.12 0.00 -1.38 0.00 0.00 54.79 50.50 2bkh n ASP 773 Cb 0.55 1.56 0.65 0.00 -1.04 0.00 0.00 41.12 42.83 2bkh n ASP 773 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2bkh h PRO 774 N 4.60 0.03 -0.23 -0.67 0.11 -1.90 -2.03 132.00 131.90 2bkh h PRO 774 Ca -0.01 -0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.94 2bkh h PRO 774 Cb 1.06 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2bkh h PRO 774 CO 0.18 0.02 -0.52 -0.44 -0.21 0.00 0.00 178.00 177.03 2bkh h ASP 775 N 0.03 0.71 -0.08 -2.05 3.45 -1.99 -0.94 116.42 115.55 2bkh h ASP 775 Ca 0.10 -0.37 -0.01 0.00 0.43 0.00 0.00 57.03 57.18 2bkh h ASP 775 Cb 0.36 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 38.93 2bkh h ASP 775 CO -0.00 1.10 0.02 -0.74 -1.57 0.00 0.00 179.24 178.05 2bkh h HIS 776 N 0.51 0.14 -0.96 4.55 2.76 -1.83 -2.43 115.15 117.89 2bkh h HIS 776 Ca 0.02 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2bkh h HIS 776 Cb 1.07 -0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.94 2bkh h HIS 776 CO 0.05 0.31 0.63 1.25 -1.30 0.00 0.00 177.93 178.87 2bkh h LEU 777 N -0.08 1.11 -0.71 0.26 5.85 -1.35 -1.50 115.31 118.90 2bkh h LEU 777 Ca 0.03 -0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 2bkh h LEU 777 Cb 0.24 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2bkh h LEU 777 CO 0.00 0.82 -0.28 0.00 -0.34 0.00 0.00 178.44 178.63 2bkh h ALA 778 N 1.38 0.89 -0.21 1.25 0.00 -1.08 -1.75 119.26 119.74 2bkh h ALA 778 Ca 0.35 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2bkh h ALA 778 Cb -0.13 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2bkh h ALA 778 CO -0.07 0.63 -0.27 1.49 0.00 0.00 0.00 179.25 181.02 2bkh h GLU 779 N 0.59 0.56 -0.64 0.00 4.57 -1.10 -1.99 114.58 116.56 2bkh h GLU 779 Ca 0.07 -0.32 0.04 0.00 -1.18 0.00 0.00 59.36 57.98 2bkh h GLU 779 Cb 0.78 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.35 2bkh h GLU 779 CO 0.06 0.91 0.42 -0.07 -1.18 0.00 0.00 179.01 179.16 2bkh h LEU 780 N 0.24 0.63 -0.13 1.64 3.38 -1.12 -1.71 115.31 118.24 2bkh h LEU 780 Ca 0.03 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2bkh h LEU 780 Cb 0.84 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2bkh h LEU 780 CO 0.06 0.43 -0.38 0.58 0.09 0.00 0.00 178.44 179.23 2bkh h VAL 781 N 0.73 1.37 -0.90 1.22 2.07 -1.24 -2.94 116.25 116.56 2bkh h VAL 781 Ca 0.26 -1.68 0.09 0.00 0.82 0.00 0.00 66.70 66.19 2bkh h VAL 781 Cb 0.11 2.09 -0.07 0.00 -1.52 0.00 0.00 31.29 31.90 2bkh h VAL 781 CO -0.07 0.50 0.55 0.50 0.02 0.00 0.00 177.57 179.06 2bkh h LYS 782 N 0.08 0.89 0.00 1.57 3.11 -1.05 -2.55 116.57 118.63 2bkh h LYS 782 Ca -0.01 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.78 2bkh h LYS 782 Cb 1.00 -0.20 0.00 0.00 -1.00 0.00 0.00 32.23 32.03 2bkh h LYS 782 CO 0.08 0.59 0.00 0.54 -2.81 0.00 0.00 179.45 177.85 2bkh n ARG 783 N -4.66 0.23 0.00 1.90 1.74 -0.67 -2.49 116.66 112.71 2bkh n ARG 783 Ca 0.15 0.30 0.14 0.00 -0.77 0.00 0.00 57.85 57.66 2bkh n ARG 783 Cb 0.27 -1.82 0.51 0.00 -1.02 0.00 0.00 32.46 30.40 2bkh n ARG 783 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 2bkh n VAL 784 N -2.23 0.00 -0.33 1.55 3.14 -0.96 -4.52 118.33 114.99 2bkh n VAL 784 Ca 0.04 -0.26 0.02 0.00 -2.96 0.00 0.00 64.34 61.19 2bkh n VAL 784 Cb 0.34 0.53 0.20 0.00 -1.06 0.00 0.00 33.84 33.86 2bkh n VAL 784 CO 0.00 0.00 0.00 -1.13 -6.46 0.00 0.00 176.83 169.24 2bkh h ASN 785 N 2.42 0.98 0.81 6.55 -1.24 -1.51 -1.67 115.58 121.92 2bkh h ASN 785 Ca 0.00 -0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.97 2bkh h ASN 785 Cb 0.52 -0.21 0.01 0.00 0.73 0.00 0.00 38.32 39.36 2bkh h ASN 785 CO 0.00 0.65 -0.39 -0.74 -1.29 0.00 0.00 177.43 175.66 2bkh h HIS 786 N 1.12 -1.01 -0.95 0.67 2.76 -1.83 -2.38 115.15 113.53 2bkh h HIS 786 Ca 0.39 -0.02 0.21 0.00 -2.20 0.00 0.00 60.37 58.75 2bkh h HIS 786 Cb 0.12 0.33 -0.08 0.00 1.55 0.00 0.00 27.41 29.33 2bkh h HIS 786 CO -0.00 -0.63 0.61 2.35 -1.30 0.00 0.00 177.93 178.97 2bkh h TRP 787 N -1.16 0.68 -0.13 5.26 7.01 -1.82 -1.43 115.95 124.35 2bkh h TRP 787 Ca -0.11 0.02 -0.20 0.00 2.11 0.00 0.00 58.89 60.71 2bkh h TRP 787 Cb 0.83 -0.20 0.01 0.00 -2.10 0.00 0.00 29.16 27.70 2bkh h TRP 787 CO 0.03 0.16 -0.72 1.25 -2.79 0.00 0.00 178.44 176.37 2bkh h LEU 788 N 0.49 0.86 -0.97 0.65 5.85 -1.30 -1.07 115.31 119.83 2bkh h LEU 788 Ca 0.51 -0.64 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 2bkh h LEU 788 Cb 1.16 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 2bkh h LEU 788 CO -0.24 1.36 -0.06 -0.29 -0.34 0.00 0.00 178.44 178.87 2bkh h ILE 789 N 0.42 1.24 0.48 4.05 6.09 -0.80 -1.75 117.51 127.24 2bkh h ILE 789 Ca -0.05 -1.03 -0.02 0.00 -1.37 0.00 0.00 64.86 62.39 2bkh h ILE 789 Cb 1.35 1.00 0.00 0.00 0.47 0.00 0.00 36.82 39.65 2bkh h ILE 789 CO 0.15 0.35 -0.23 0.00 -3.07 0.00 0.00 178.15 175.35 2bkh h SER 791 N -0.90 0.00 0.92 0.00 0.02 -1.12 -0.14 113.55 112.33 2bkh h SER 791 Ca -0.07 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.67 2bkh h SER 791 Cb 0.59 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.10 2bkh h SER 791 CO 0.11 0.00 -1.00 -0.09 -1.14 0.00 0.00 176.83 174.71 2bkh h ARG 792 N 0.00 0.04 0.21 3.45 2.43 -1.25 -1.26 114.38 117.99 2bkh h ARG 792 Ca 0.18 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 2bkh h ARG 792 Cb 0.81 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 2bkh h ARG 792 CO -0.00 1.00 -0.10 -1.49 -1.51 0.00 0.00 179.97 177.87 2bkh h TRP 793 N 0.01 -0.26 -0.98 2.20 4.06 -0.92 -3.17 115.95 116.89 2bkh h TRP 793 Ca -0.03 -0.01 0.34 0.00 2.06 0.00 0.00 58.89 61.26 2bkh h TRP 793 Cb 1.74 0.09 -0.18 0.00 -1.00 0.00 0.00 29.16 29.81 2bkh h TRP 793 CO 0.01 -0.16 0.27 1.63 -3.56 0.00 0.00 178.44 176.62 2bkh n LYS 794 N -3.39 -0.07 0.36 0.49 5.02 -0.19 -0.07 118.16 120.31 2bkh n LYS 794 Ca -0.03 1.41 -0.19 0.00 -2.02 0.00 0.00 58.31 57.48 2bkh n LYS 794 Cb 0.11 -2.38 -0.10 0.00 -0.02 0.00 0.00 35.03 32.64 2bkh n LYS 794 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2bkh h LYS 795 N 0.00 -1.06 0.00 1.97 3.64 -1.33 -0.94 116.57 118.86 2bkh h LYS 795 Ca 0.71 0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 60.10 2bkh h LYS 795 Cb 1.70 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 33.76 2bkh h LYS 795 CO -0.84 -0.71 -0.28 -0.39 -2.27 0.00 0.00 179.45 174.96 2bkh h VAL 796 N -1.10 0.98 0.19 2.00 -1.51 -1.05 -2.18 116.25 113.59 2bkh h VAL 796 Ca -0.08 -1.04 -0.01 0.00 -1.23 0.00 0.00 66.70 64.34 2bkh h VAL 796 Cb 0.92 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 2bkh h VAL 796 CO 0.02 0.27 -0.09 1.56 -1.23 0.00 0.00 177.57 178.10 2bkh h GLN 797 N 0.00 -0.25 0.00 5.19 4.20 -0.25 -2.42 115.11 121.58 2bkh h GLN 797 Ca -0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2bkh h GLN 797 Cb 0.57 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.41 2bkh h GLN 797 CO 0.04 0.13 0.00 -1.49 -0.67 0.00 0.00 178.83 176.83 2bkh h TRP 798 N -0.69 0.00 0.13 2.96 4.06 -1.17 -1.99 115.95 119.25 2bkh h TRP 798 Ca -0.03 0.00 -0.28 0.00 2.06 0.00 0.00 58.89 60.64 2bkh h TRP 798 Cb 0.49 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.66 2bkh h TRP 798 CO 0.05 0.00 -1.23 0.00 -3.56 0.00 0.00 178.44 173.70 2bkh h SER 800 N 0.14 0.78 -0.03 0.00 4.64 -1.14 -1.81 113.55 116.12 2bkh h SER 800 Ca -0.15 -0.52 -0.01 0.00 -0.47 0.00 0.00 61.79 60.64 2bkh h SER 800 Cb 1.93 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 63.78 2bkh h SER 800 CO 0.21 1.31 0.01 0.25 -0.87 0.00 0.00 176.83 177.73 2bkh h LEU 801 N 0.44 0.08 -0.05 5.97 5.85 -1.45 -1.06 115.31 125.09 2bkh h LEU 801 Ca -0.05 -0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.42 2bkh h LEU 801 Cb 1.40 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 42.42 2bkh h LEU 801 CO 0.15 0.09 -1.07 0.28 -0.34 0.00 0.00 178.44 177.56 2bkh h SER 802 N 0.09 0.53 0.84 1.25 0.02 -1.14 -2.60 113.55 112.54 2bkh h SER 802 Ca 0.02 -0.47 -0.08 0.00 -0.84 0.00 0.00 61.79 60.42 2bkh h SER 802 Cb 0.06 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2bkh h SER 802 CO -0.00 1.30 -0.39 0.58 -1.14 0.00 0.00 176.83 177.18 2bkh h VAL 803 N 0.18 0.91 -0.10 2.27 2.07 -0.90 -2.52 116.25 118.16 2bkh h VAL 803 Ca -0.11 -1.56 -0.14 0.00 0.82 0.00 0.00 66.70 65.71 2bkh h VAL 803 Cb 1.73 1.95 0.01 0.00 -1.52 0.00 0.00 31.29 33.46 2bkh h VAL 803 CO 0.18 0.38 -0.48 0.40 0.02 0.00 0.00 177.57 178.07 2bkh h ILE 804 N 0.00 1.37 0.00 4.57 2.04 -1.16 -2.86 117.51 121.46 2bkh h ILE 804 Ca -0.00 -1.81 -0.05 0.00 1.00 0.00 0.00 64.86 64.00 2bkh h ILE 804 Cb 0.92 2.20 -0.01 0.00 -0.74 0.00 0.00 36.82 39.19 2bkh h ILE 804 CO 0.05 0.54 -0.22 0.11 0.00 0.00 0.00 178.15 178.63 2bkh h LYS 805 N 0.10 0.00 0.02 2.37 1.57 -1.34 -1.72 116.57 117.56 2bkh h LYS 805 Ca -0.03 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.54 2bkh h LYS 805 Cb 1.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 2bkh h LYS 805 CO 0.10 0.22 -0.94 -0.07 -0.57 0.00 0.00 179.45 178.19 2bkh h LEU 806 N 0.00 0.25 -0.43 2.94 3.38 -1.47 -2.23 115.31 117.75 2bkh h LEU 806 Ca -0.00 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 2bkh h LEU 806 Cb 0.55 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2bkh h LEU 806 CO 0.03 1.06 -0.08 0.50 0.09 0.00 0.00 178.44 180.04 2bkh h LYS 807 N 0.09 0.82 0.00 1.13 3.64 -1.23 -2.91 116.57 118.11 2bkh h LYS 807 Ca -0.05 -0.30 -0.06 0.00 -1.27 0.00 0.00 60.65 58.96 2bkh h LYS 807 Cb 1.60 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.36 2bkh h LYS 807 CO 0.14 0.92 -0.29 -0.91 -2.27 0.00 0.00 179.45 177.05 2bkh h ASN 808 N 0.65 0.00 1.05 4.20 2.35 -1.26 -2.58 115.58 119.99 2bkh h ASN 808 Ca 0.11 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.68 2bkh h ASN 808 Cb 0.60 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.95 2bkh h ASN 808 CO 0.04 0.29 -0.98 0.50 -1.65 0.00 0.00 177.43 175.63 2bkh h LYS 809 N 0.00 0.00 0.00 0.81 3.64 -1.40 -2.85 116.57 116.76 2bkh h LYS 809 Ca -0.00 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 2bkh h LYS 809 Cb 0.65 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2bkh h LYS 809 CO 0.04 0.75 -0.26 0.82 -2.27 0.00 0.00 179.45 178.53 2bkh h ILE 810 N 0.00 0.89 -0.94 2.00 2.04 -1.35 -3.23 117.51 116.92 2bkh h ILE 810 Ca -0.05 -0.99 -0.50 0.00 1.00 0.00 0.00 64.86 64.31 2bkh h ILE 810 Cb 1.68 1.59 -0.15 0.00 -0.74 0.00 0.00 36.82 39.19 2bkh h ILE 810 CO 0.10 0.25 0.68 1.17 0.00 0.00 0.00 178.15 180.35 2bkh n LYS 811 N -3.81 2.72 0.00 2.37 4.81 -0.99 -5.12 118.16 118.15 2bkh n LYS 811 Ca -0.01 -2.36 0.00 0.00 -0.87 0.00 0.00 58.31 55.06 2bkh n LYS 811 Cb 0.35 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.19 2bkh n LYS 811 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55