#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hfw n TRP 5 N 0.00 -1.99 -3.93 -1.84 4.27 -1.26 -5.09 117.44 107.60 2hfw n TRP 5 Ca 0.00 -1.45 0.05 0.00 -3.89 0.00 0.00 57.50 52.21 2hfw n TRP 5 Cb 0.00 0.69 0.01 0.00 -1.36 0.00 0.00 31.31 30.65 2hfw n TRP 5 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 2hfw s GLY 6 N -2.58 -0.28 -0.15 -1.67 0.00 -1.23 -5.03 107.32 96.37 2hfw s GLY 6 Ca 0.13 0.35 0.15 0.00 0.00 0.00 0.00 44.72 45.34 2hfw s GLY 6 CO 0.10 5.41 1.20 -1.72 0.00 0.00 0.00 173.10 178.09 2hfw n TYR 7 N -0.88 0.00 0.00 1.90 4.02 -1.26 -4.01 117.16 116.94 2hfw n TYR 7 Ca 0.03 -1.22 0.00 0.00 -0.01 0.00 0.00 57.90 56.69 2hfw n TYR 7 Cb 0.59 -0.22 0.00 0.00 -0.02 0.00 0.00 39.34 39.69 2hfw n TYR 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2hfw n ALA 8 N -0.69 0.26 -1.42 -0.72 0.00 -1.26 -4.82 120.51 111.86 2hfw n ALA 8 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2hfw n ALA 8 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.26 2hfw n ALA 8 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2hfw n SER 9 N 0.00 0.00 0.00 0.00 3.41 -1.26 -4.59 113.62 111.18 2hfw n SER 9 Ca 0.00 -0.61 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 2hfw n SER 9 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2hfw n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hfw n HIS 10 N 0.00 0.00 -0.16 7.33 -0.00 -1.26 -4.78 115.22 116.35 2hfw n HIS 10 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2hfw n HIS 10 Cb 0.31 0.02 0.00 0.00 -0.00 0.00 0.00 29.99 30.31 2hfw n HIS 10 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.34 176.61 2hfw n ASN 11 N 0.00 0.36 -3.09 4.39 6.94 -1.26 -4.99 115.26 117.60 2hfw n ASN 11 Ca 0.00 -0.68 -0.03 0.00 -0.02 0.00 0.00 54.58 53.84 2hfw n ASN 11 Cb 0.11 0.33 0.03 0.00 -2.36 0.00 0.00 39.78 37.90 2hfw n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2hfw n GLY 12 N 0.33 -1.96 0.12 4.83 0.00 -1.26 -3.52 105.19 103.73 2hfw n GLY 12 Ca 0.00 -0.64 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 2hfw n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2hfw h PRO 13 N 0.00 0.32 -0.00 1.61 0.11 -1.94 -1.55 132.00 130.55 2hfw h PRO 13 Ca -0.04 -0.54 0.00 0.00 0.11 0.00 0.00 66.00 65.53 2hfw h PRO 13 Cb 0.14 0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.45 2hfw h PRO 13 CO 0.02 1.23 0.01 -0.25 -0.21 0.00 0.00 178.00 178.80 2hfw n ASP 14 N -3.54 0.00 0.00 -2.05 9.92 -1.26 -2.18 116.55 117.44 2hfw n ASP 14 Ca -0.13 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.13 2hfw n ASP 14 Cb 1.05 -0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.53 2hfw n ASP 14 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 2hfw n HIS 15 N -0.93 0.00 0.21 1.24 8.25 -0.58 -4.78 115.22 118.63 2hfw n HIS 15 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.51 2hfw n HIS 15 Cb 0.01 0.00 0.50 0.00 1.12 0.00 0.00 29.99 31.62 2hfw n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 2hfw h TRP 16 N 0.00 0.05 0.00 4.41 6.55 -1.46 -0.67 115.95 124.83 2hfw h TRP 16 Ca 0.00 -0.00 -0.02 0.00 0.95 0.00 0.00 58.89 59.82 2hfw h TRP 16 Cb 0.09 -0.01 -0.00 0.00 -0.86 0.00 0.00 29.16 28.37 2hfw h TRP 16 CO 0.00 0.19 -0.07 1.12 -1.05 0.00 0.00 178.44 178.63 2hfw h HIS 17 N 0.05 0.00 0.00 0.49 2.07 -1.76 0.98 115.15 116.98 2hfw h HIS 17 Ca 0.01 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.53 2hfw h HIS 17 Cb 0.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.26 2hfw h HIS 17 CO 0.00 0.07 0.21 0.93 -3.07 0.00 0.00 177.93 176.08 2hfw h GLU 18 N 0.00 0.00 0.00 5.12 5.08 -1.46 -3.02 114.58 120.30 2hfw h GLU 18 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2hfw h GLU 18 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 2hfw h GLU 18 CO 0.01 0.00 -0.13 1.28 -1.00 0.00 0.00 179.01 179.17 2hfw n LEU 19 N -2.45 0.00 -3.64 1.33 4.77 -0.92 -5.03 117.00 111.07 2hfw n LEU 19 Ca -0.02 -0.06 -0.22 0.00 -0.03 0.00 0.00 56.01 55.68 2hfw n LEU 19 Cb 0.25 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.17 2hfw n LEU 19 CO 0.10 0.00 -0.33 -0.36 -1.33 0.00 0.00 177.39 175.48 2hfw s PHE 20 N -0.37 0.09 -0.62 -1.77 0.40 0.29 -5.05 117.98 110.96 2hfw s PHE 20 Ca 0.00 0.02 0.15 0.00 -0.60 0.00 0.00 56.93 56.50 2hfw s PHE 20 Cb 0.00 -0.56 -0.17 0.00 0.51 0.00 0.00 43.02 42.80 2hfw s PHE 20 CO 0.00 -0.35 0.60 -2.30 0.70 0.00 0.00 175.22 173.87 2hfw n PRO 21 N 5.29 1.83 -0.15 0.24 -0.02 -1.25 -2.91 135.00 138.03 2hfw n PRO 21 Ca -0.05 -0.02 0.20 0.00 -2.02 0.00 0.00 63.50 61.61 2hfw n PRO 21 Cb 0.50 -1.23 0.59 0.00 -0.02 0.00 0.00 33.50 33.33 2hfw n PRO 21 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2hfw h ASN 22 N 0.00 0.24 0.00 2.55 2.35 -1.88 -2.97 115.58 115.86 2hfw h ASN 22 Ca 0.00 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2hfw h ASN 22 Cb 0.40 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.74 2hfw h ASN 22 CO 0.00 0.11 0.23 0.00 -1.65 0.00 0.00 177.43 176.12 2hfw n ALA 23 N -2.58 0.40 -1.65 -0.83 0.00 -1.14 -0.24 120.51 114.47 2hfw n ALA 23 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.60 2hfw n ALA 23 Cb 0.67 -0.35 0.01 0.00 0.00 0.00 0.00 19.45 19.78 2hfw n ALA 23 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2hfw n LYS 24 N -1.03 0.18 -0.05 0.00 3.00 -1.12 -4.89 118.16 114.25 2hfw n LYS 24 Ca 0.00 -1.03 -0.02 0.00 -0.00 0.00 0.00 58.31 57.26 2hfw n LYS 24 Cb 0.23 -0.59 0.02 0.00 0.00 0.00 0.00 35.03 34.68 2hfw n LYS 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2hfw n GLY 25 N -0.13 -2.91 0.51 3.14 0.00 0.67 -4.99 105.19 101.48 2hfw n GLY 25 Ca 0.01 -1.38 0.11 0.00 0.00 0.00 0.00 46.02 44.77 2hfw n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hfw n GLU 26 N -1.92 1.27 -2.73 1.61 1.02 -1.26 -4.44 120.64 114.20 2hfw n GLU 26 Ca 0.01 -1.02 -0.19 0.00 -0.02 0.00 0.00 57.16 55.93 2hfw n GLU 26 Cb 0.04 -1.47 -0.00 0.00 -0.02 0.00 0.00 31.44 29.99 2hfw n GLU 26 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2hfw n ASN 27 N 0.02 2.93 -4.87 1.62 3.02 -1.26 -4.71 115.26 112.01 2hfw n ASN 27 Ca 0.09 -3.25 -0.32 0.00 -0.03 0.00 0.00 54.58 51.07 2hfw n ASN 27 Cb 0.47 -0.53 -0.05 0.00 -0.61 0.00 0.00 39.78 39.06 2hfw n ASN 27 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2hfw s GLN 28 N -3.21 3.84 0.17 3.52 -1.52 -1.26 -2.97 119.66 118.22 2hfw s GLN 28 Ca 0.40 0.38 0.11 0.00 -1.95 0.00 0.00 55.36 54.30 2hfw s GLN 28 Cb 0.39 -2.56 -0.04 0.00 -0.22 0.00 0.00 33.01 30.58 2hfw s GLN 28 CO -0.09 0.22 -0.25 -1.12 -0.25 0.00 0.00 175.29 173.81 2hfw s SER 29 N -2.50 3.32 0.69 5.90 0.01 -1.26 -4.62 113.70 115.23 2hfw s SER 29 Ca 0.49 -0.82 0.01 0.00 1.31 0.00 0.00 55.95 56.94 2hfw s SER 29 Cb -0.11 -0.23 0.13 0.00 0.21 0.00 0.00 66.02 66.02 2hfw s SER 29 CO 0.22 0.13 0.88 -0.81 0.41 0.00 0.00 173.24 174.07 2hfw n PRO 30 N 0.52 0.03 -4.28 12.44 -0.04 -1.26 -4.53 135.00 137.87 2hfw n PRO 30 Ca -0.15 -2.47 -0.17 0.00 -0.04 0.00 0.00 63.50 60.67 2hfw n PRO 30 Cb 0.55 -0.56 -0.10 0.00 -0.04 0.00 0.00 33.50 33.34 2hfw n PRO 30 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2hfw s ILE 31 N -2.70 1.44 0.26 0.52 -4.36 -1.26 -1.51 121.20 113.59 2hfw s ILE 31 Ca 0.59 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.68 2hfw s ILE 31 Cb -0.03 -1.82 -0.10 0.00 1.25 0.00 0.00 42.46 41.76 2hfw s ILE 31 CO 0.39 -0.58 1.33 -1.61 0.24 0.00 0.00 174.94 174.71 2hfw s GLU 32 N -3.34 4.37 -0.31 0.37 2.02 -1.26 -3.27 118.70 117.28 2hfw s GLU 32 Ca 0.16 2.15 -0.04 0.00 0.02 0.00 0.00 54.97 57.26 2hfw s GLU 32 Cb -0.01 -3.13 0.04 0.00 0.10 0.00 0.00 34.13 31.12 2hfw s GLU 32 CO 0.04 -0.24 0.03 -0.51 0.02 0.00 0.00 175.26 174.60 2hfw s LEU 33 N -0.79 3.94 -0.50 1.80 1.02 -0.85 -4.96 118.68 118.33 2hfw s LEU 33 Ca 0.54 -1.13 -0.13 0.00 0.02 0.00 0.00 54.13 53.43 2hfw s LEU 33 Cb -0.38 -1.77 0.12 0.00 0.02 0.00 0.00 46.19 44.18 2hfw s LEU 33 CO 0.44 -0.26 0.42 -1.00 0.02 0.00 0.00 176.35 175.98 2hfw s HIS 34 N 1.33 3.33 0.51 0.29 3.76 -1.26 -1.59 115.29 121.66 2hfw s HIS 34 Ca -0.03 -1.56 0.41 0.00 -0.15 0.00 0.00 55.06 53.73 2hfw s HIS 34 Cb -0.19 -3.63 2.21 0.00 1.11 0.00 0.00 32.58 32.07 2hfw s HIS 34 CO 0.00 -1.00 2.25 1.79 -0.85 0.00 0.00 174.74 176.92 2hfw h THR 35 N 6.00 0.00 -0.00 1.30 1.35 -1.96 1.01 112.91 120.61 2hfw h THR 35 Ca -0.26 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 2hfw h THR 35 Cb 1.09 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 2hfw h THR 35 CO 0.95 0.00 -0.33 2.29 -0.25 0.00 0.00 175.52 178.18 2hfw n LYS 36 N -2.93 0.00 -0.17 4.72 0.00 -1.26 -2.91 118.16 115.61 2hfw n LYS 36 Ca -0.03 -0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.40 2hfw n LYS 36 Cb 0.06 -1.50 0.24 0.00 -0.00 0.00 0.00 35.03 33.83 2hfw n LYS 36 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2hfw n ASP 37 N -1.50 3.13 -4.45 -5.58 10.43 0.35 -4.95 116.55 113.98 2hfw n ASP 37 Ca 0.06 -1.95 -0.33 0.00 2.57 0.00 0.00 54.79 55.14 2hfw n ASP 37 Cb 0.34 -0.22 -0.13 0.00 1.84 0.00 0.00 41.12 42.95 2hfw n ASP 37 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2hfw s ILE 38 N -1.56 3.32 0.12 0.53 1.01 -1.15 -4.88 121.20 118.59 2hfw s ILE 38 Ca 0.37 -0.58 0.08 0.00 0.00 0.00 0.00 60.65 60.52 2hfw s ILE 38 Cb 0.22 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 2hfw s ILE 38 CO 0.31 0.54 -0.12 -0.60 0.00 0.00 0.00 174.94 175.06 2hfw s ARG 39 N 0.00 2.01 0.25 2.79 6.06 -1.25 -4.93 118.95 123.89 2hfw s ARG 39 Ca -0.02 -1.11 -0.31 0.00 -2.50 0.00 0.00 55.73 51.79 2hfw s ARG 39 Cb -0.14 -2.23 -0.12 0.00 0.06 0.00 0.00 34.95 32.52 2hfw s ARG 39 CO 0.04 0.49 1.56 1.58 -2.50 0.00 0.00 175.30 176.46 2hfw n HIS 40 N 0.63 2.58 -4.04 5.12 -0.00 -1.26 -2.30 115.22 115.96 2hfw n HIS 40 Ca -0.14 0.28 -0.32 0.00 -0.00 0.00 0.00 57.72 57.55 2hfw n HIS 40 Cb 0.53 -2.56 -0.15 0.00 -0.00 0.00 0.00 29.99 27.80 2hfw n HIS 40 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2hfw s ASP 41 N 0.57 4.33 0.00 0.26 3.68 -0.97 -4.87 116.67 119.67 2hfw s ASP 41 Ca 0.68 -1.40 0.15 0.00 2.13 0.00 0.00 52.55 54.11 2hfw s ASP 41 Cb -0.56 -1.47 0.89 0.00 -1.45 0.00 0.00 42.92 40.33 2hfw s ASP 41 CO 0.46 -0.21 1.32 -0.81 0.13 0.00 0.00 175.17 176.05 2hfw n PRO 42 N 4.48 0.58 -0.17 4.34 -0.04 -1.26 -1.81 135.00 141.11 2hfw n PRO 42 Ca -0.12 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.45 2hfw n PRO 42 Cb 0.42 -1.40 0.20 0.00 -0.04 0.00 0.00 33.50 32.68 2hfw n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2hfw n SER 43 N -0.90 3.38 -4.65 3.54 3.41 -1.26 -4.89 113.62 112.25 2hfw n SER 43 Ca 0.11 -1.98 -0.42 0.00 -0.26 0.00 0.00 58.87 56.32 2hfw n SER 43 Cb 0.05 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 63.75 2hfw n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2hfw s LEU 44 N -1.50 4.08 0.57 1.04 1.43 -0.75 -5.00 118.68 118.55 2hfw s LEU 44 Ca 0.37 1.15 0.03 0.00 -1.03 0.00 0.00 54.13 54.65 2hfw s LEU 44 Cb 0.22 -3.33 0.06 0.00 0.03 0.00 0.00 46.19 43.17 2hfw s LEU 44 CO 0.31 -0.59 0.79 -1.10 0.23 0.00 0.00 176.35 175.99 2hfw s GLN 45 N 3.01 2.35 0.52 1.70 -1.52 -1.26 -5.01 119.66 119.45 2hfw s GLN 45 Ca 0.39 -1.08 -0.12 0.00 -1.95 0.00 0.00 55.36 52.60 2hfw s GLN 45 Cb -0.15 -2.52 -0.06 0.00 -0.22 0.00 0.00 33.01 30.06 2hfw s GLN 45 CO 0.07 -0.84 0.92 -2.14 -0.25 0.00 0.00 175.29 173.06 2hfw s PRO 46 N -4.77 3.75 0.16 2.91 0.02 -1.26 -3.82 135.00 131.99 2hfw s PRO 46 Ca 0.60 0.68 0.03 0.00 0.02 0.00 0.00 61.00 62.32 2hfw s PRO 46 Cb -0.08 -2.21 -0.03 0.00 0.02 0.00 0.00 34.50 32.19 2hfw s PRO 46 CO 0.39 -0.30 0.30 1.67 -0.33 0.00 0.00 177.00 178.73 2hfw s TRP 47 N -2.76 3.48 0.02 6.54 1.48 -1.26 -2.57 118.94 123.87 2hfw s TRP 47 Ca 0.54 0.12 0.00 0.00 -1.06 0.00 0.00 56.10 55.71 2hfw s TRP 47 Cb -0.10 -1.67 -0.02 0.00 -1.16 0.00 0.00 33.47 30.52 2hfw s TRP 47 CO 0.40 0.50 -0.04 -1.54 -4.06 0.00 0.00 176.95 172.21 2hfw s SER 48 N -3.31 0.36 -0.08 -2.66 1.04 0.21 -4.93 113.70 104.32 2hfw s SER 48 Ca 0.35 -0.47 0.01 0.00 0.48 0.00 0.00 55.95 56.31 2hfw s SER 48 Cb -0.11 0.08 -0.03 0.00 0.10 0.00 0.00 66.02 66.06 2hfw s SER 48 CO 0.29 -0.26 -0.08 0.68 0.98 0.00 0.00 173.24 174.85 2hfw s VAL 49 N -1.33 3.56 -0.44 5.02 -7.23 -1.26 0.10 120.40 118.82 2hfw s VAL 49 Ca -0.14 -0.52 -0.06 0.00 -1.81 0.00 0.00 61.98 59.45 2hfw s VAL 49 Cb -0.09 -2.46 0.11 0.00 0.56 0.00 0.00 36.38 34.50 2hfw s VAL 49 CO -0.01 0.58 0.27 -0.44 -0.31 0.00 0.00 175.10 175.20 2hfw s SER 50 N -0.60 5.48 0.27 4.85 0.01 -0.07 -4.99 113.70 118.65 2hfw s SER 50 Ca 0.09 -1.95 0.08 0.00 1.31 0.00 0.00 55.95 55.48 2hfw s SER 50 Cb -0.12 -1.92 -0.04 0.00 0.21 0.00 0.00 66.02 64.16 2hfw s SER 50 CO 0.02 -0.61 0.13 -0.31 0.41 0.00 0.00 173.24 172.88 2hfw s TYR 51 N 1.26 2.92 -0.16 2.43 4.12 -1.26 -0.13 117.35 126.52 2hfw s TYR 51 Ca 0.07 -0.19 -0.00 0.00 0.02 0.00 0.00 57.07 56.96 2hfw s TYR 51 Cb -0.24 -1.38 0.04 0.00 -1.52 0.00 0.00 41.96 38.85 2hfw s TYR 51 CO -0.02 0.51 -0.06 0.34 0.02 0.00 0.00 175.55 176.34 2hfw s ASP 52 N -3.80 2.80 0.47 2.29 3.68 -1.26 -4.96 116.67 115.89 2hfw s ASP 52 Ca 0.33 -0.64 0.25 0.00 2.13 0.00 0.00 52.55 54.62 2hfw s ASP 52 Cb -0.07 -0.92 1.13 0.00 -1.45 0.00 0.00 42.92 41.62 2hfw s ASP 52 CO 0.23 -0.18 1.92 1.23 0.13 0.00 0.00 175.17 178.51 2hfw h GLY 53 N 8.12 0.00 2.00 2.66 0.00 -1.96 -0.29 103.07 113.59 2hfw h GLY 53 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2hfw h GLY 53 CO 0.40 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.61 2hfw h GLY 54 N 1.55 0.00 1.89 4.60 0.00 -1.92 -1.53 103.07 107.67 2hfw h GLY 54 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2hfw h GLY 54 CO 0.03 0.00 0.05 1.48 0.00 0.00 0.00 176.54 178.10 2hfw h SER 55 N 0.00 0.00 -3.98 0.19 4.64 -1.40 -3.43 113.55 109.57 2hfw h SER 55 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2hfw h SER 55 Cb 0.44 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.58 2hfw h SER 55 CO 0.00 0.00 0.49 0.00 -0.87 0.00 0.00 176.83 176.45 2hfw s ALA 56 N -4.07 3.05 0.10 5.18 0.00 -1.22 -2.03 121.76 122.78 2hfw s ALA 56 Ca -0.04 0.95 0.00 0.00 0.00 0.00 0.00 51.96 52.86 2hfw s ALA 56 Cb 0.12 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2hfw s ALA 56 CO 0.37 -0.60 0.00 1.63 0.00 0.00 0.00 175.76 177.16 2hfw n LYS 57 N -0.25 0.00 -4.21 0.00 5.02 -0.79 -4.30 118.16 113.64 2hfw n LYS 57 Ca 0.06 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.23 2hfw n LYS 57 Cb 0.47 -0.30 -0.10 0.00 -0.02 0.00 0.00 35.03 35.09 2hfw n LYS 57 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2hfw s THR 58 N -1.74 0.62 -0.13 -0.18 -4.23 -1.24 -0.31 115.64 108.44 2hfw s THR 58 Ca 0.00 -1.96 -0.00 0.00 -1.18 0.00 0.00 61.69 58.55 2hfw s THR 58 Cb 0.00 -1.95 0.03 0.00 1.34 0.00 0.00 72.50 71.91 2hfw s THR 58 CO 0.00 -0.62 -0.10 -0.51 -0.54 0.00 0.00 174.62 172.85 2hfw s ILE 59 N -3.69 1.23 0.20 2.99 2.07 -0.88 -1.02 121.20 122.10 2hfw s ILE 59 Ca 0.19 -0.46 0.10 0.00 -1.41 0.00 0.00 60.65 59.07 2hfw s ILE 59 Cb 0.06 -1.24 -0.04 0.00 0.13 0.00 0.00 42.46 41.37 2hfw s ILE 59 CO 0.01 0.36 -0.13 -1.48 -1.91 0.00 0.00 174.94 171.79 2hfw s LEU 60 N 1.62 2.84 -0.49 8.50 0.05 -0.03 -3.08 118.68 128.08 2hfw s LEU 60 Ca 0.04 -0.68 -0.07 0.00 0.05 0.00 0.00 54.13 53.48 2hfw s LEU 60 Cb -0.13 -1.52 0.13 0.00 -2.05 0.00 0.00 46.19 42.62 2hfw s LEU 60 CO -0.09 0.09 0.34 0.21 -0.55 0.00 0.00 176.35 176.35 2hfw s ASN 61 N -2.91 5.55 0.00 1.48 3.84 -1.16 -0.02 114.94 121.72 2hfw s ASN 61 Ca 0.25 -2.13 0.00 0.00 0.21 0.00 0.00 52.86 51.19 2hfw s ASN 61 Cb -0.08 -1.94 0.00 0.00 -0.55 0.00 0.00 41.25 38.68 2hfw s ASN 61 CO 0.14 -0.59 0.98 -0.46 -2.79 0.00 0.00 177.10 174.38 2hfw n ASN 62 N 4.55 0.03 0.00 -4.21 0.23 -0.94 -1.45 115.26 113.48 2hfw n ASN 62 Ca -0.03 -2.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.03 2hfw n ASN 62 Cb 0.41 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 2hfw n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2hfw n GLY 63 N 0.48 3.28 0.12 4.83 0.00 -1.26 -4.70 105.19 107.94 2hfw n GLY 63 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2hfw n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2hfw n HIS 64 N -2.00 0.00 -3.97 1.61 8.25 -1.26 -4.72 115.22 113.13 2hfw n HIS 64 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 2hfw n HIS 64 Cb 0.00 -0.95 -0.04 0.00 1.12 0.00 0.00 29.99 30.12 2hfw n HIS 64 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2hfw s THR 65 N -2.49 0.00 -0.19 1.59 -1.32 -1.26 -4.90 115.64 107.07 2hfw s THR 65 Ca -0.31 -1.33 -0.12 0.00 -1.21 0.00 0.00 61.69 58.72 2hfw s THR 65 Cb 0.08 -2.22 -0.05 0.00 -1.51 0.00 0.00 72.50 68.81 2hfw s THR 65 CO 0.59 0.00 0.21 0.00 -2.21 0.00 0.00 174.62 173.21 2hfw s ASN 67 N 0.54 3.84 -0.21 0.00 -0.87 0.97 -3.91 114.94 115.29 2hfw s ASN 67 Ca 0.12 -0.28 -0.06 0.00 -1.57 0.00 0.00 52.86 51.07 2hfw s ASN 67 Cb -0.12 -0.96 -0.03 0.00 -0.02 0.00 0.00 41.25 40.12 2hfw s ASN 67 CO 0.02 0.30 0.03 -0.69 -2.57 0.00 0.00 177.10 174.18 2hfw s VAL 68 N -0.45 4.15 0.09 1.60 1.01 -0.62 -0.85 120.40 125.33 2hfw s VAL 68 Ca 0.05 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.80 2hfw s VAL 68 Cb -0.12 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 2hfw s VAL 68 CO 0.02 0.40 0.21 -0.69 0.00 0.00 0.00 175.10 175.04 2hfw s VAL 69 N 1.13 5.23 0.38 2.92 1.01 -0.19 -2.51 120.40 128.37 2hfw s VAL 69 Ca 0.03 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.50 2hfw s VAL 69 Cb -0.14 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 2hfw s VAL 69 CO 0.02 0.07 0.10 -0.36 0.00 0.00 0.00 175.10 174.93 2hfw s PHE 70 N -1.57 1.83 -0.25 5.22 0.40 -0.63 -1.88 117.98 121.12 2hfw s PHE 70 Ca 0.34 -1.17 -0.11 0.00 -0.60 0.00 0.00 56.93 55.39 2hfw s PHE 70 Cb -0.12 -1.21 -0.05 0.00 0.51 0.00 0.00 43.02 42.15 2hfw s PHE 70 CO 0.27 -0.18 0.18 0.34 0.70 0.00 0.00 175.22 176.52 2hfw s ASP 71 N -3.58 6.12 -0.23 1.36 3.68 -0.86 -4.86 116.67 118.30 2hfw s ASP 71 Ca 0.27 0.11 0.15 0.00 2.13 0.00 0.00 52.55 55.21 2hfw s ASP 71 Cb 0.04 -2.11 0.47 0.00 -1.45 0.00 0.00 42.92 39.87 2hfw s ASP 71 CO 0.14 0.04 1.17 -0.90 0.13 0.00 0.00 175.17 175.75 2hfw n ASP 72 N 4.44 2.80 0.08 -0.34 3.85 -1.26 -4.74 116.55 121.38 2hfw n ASP 72 Ca -0.14 -2.99 0.12 0.00 -0.71 0.00 0.00 54.79 51.07 2hfw n ASP 72 Cb 0.52 -0.41 0.06 0.00 -1.35 0.00 0.00 41.12 39.94 2hfw n ASP 72 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 2hfw h THR 73 N 3.74 0.00 -2.08 2.12 1.35 -1.95 -3.45 112.91 112.64 2hfw h THR 73 Ca 0.07 -0.77 -0.01 0.00 -0.55 0.00 0.00 66.41 65.15 2hfw h THR 73 Cb 1.41 1.28 -0.00 0.00 -1.73 0.00 0.00 68.15 69.11 2hfw h THR 73 CO 0.36 0.00 -0.01 0.00 -0.25 0.00 0.00 175.52 175.62 2hfw n TYR 74 N -2.41 -0.31 -2.60 4.73 0.18 -1.26 -5.08 117.16 110.41 2hfw n TYR 74 Ca 0.01 -0.09 -0.42 0.00 1.88 0.00 0.00 57.90 59.29 2hfw n TYR 74 Cb 0.50 0.02 -0.02 0.00 -0.38 0.00 0.00 39.34 39.45 2hfw n TYR 74 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2hfw s ASP 75 N -1.08 6.58 0.00 9.48 1.01 -1.26 -4.75 116.67 126.65 2hfw s ASP 75 Ca 0.01 -1.70 0.00 0.00 0.71 0.00 0.00 52.55 51.57 2hfw s ASP 75 Cb 0.00 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.37 2hfw s ASP 75 CO 0.01 -1.40 0.00 0.54 0.21 0.00 0.00 175.17 174.53 2hfw n ARG 76 N 8.56 0.00 -3.46 8.23 1.74 -1.26 -4.92 116.66 125.55 2hfw n ARG 76 Ca 0.35 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 57.01 2hfw n ARG 76 Cb 0.50 -0.13 -0.10 0.00 -1.02 0.00 0.00 32.46 31.71 2hfw n ARG 76 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2hfw s SER 77 N -2.16 6.11 -0.09 0.55 0.01 -1.26 -4.65 113.70 112.21 2hfw s SER 77 Ca 0.00 -0.64 0.01 0.00 1.31 0.00 0.00 55.95 56.63 2hfw s SER 77 Cb 0.00 -2.16 -0.02 0.00 0.21 0.00 0.00 66.02 64.04 2hfw s SER 77 CO 0.00 -0.38 -0.12 -0.04 0.41 0.00 0.00 173.24 173.11 2hfw s MET 78 N 1.79 2.94 -0.17 12.44 -1.94 0.81 -1.76 119.30 133.41 2hfw s MET 78 Ca 0.07 -0.65 -0.07 0.00 -1.71 0.00 0.00 55.69 53.33 2hfw s MET 78 Cb -0.18 -2.55 -0.04 0.00 2.01 0.00 0.00 34.83 34.07 2hfw s MET 78 CO 0.11 0.46 0.07 -1.17 -0.01 0.00 0.00 175.02 174.48 2hfw s LEU 79 N -0.30 3.90 0.35 -0.03 2.96 -0.56 -0.89 118.68 124.11 2hfw s LEU 79 Ca 0.03 0.14 0.02 0.00 -0.22 0.00 0.00 54.13 54.10 2hfw s LEU 79 Cb -0.13 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 2hfw s LEU 79 CO 0.03 0.21 0.41 0.00 -1.32 0.00 0.00 176.35 175.67 2hfw s ARG 80 N 0.14 1.88 3.54 1.98 1.70 0.12 -1.43 118.95 126.88 2hfw s ARG 80 Ca 0.05 -1.89 0.00 0.00 -0.47 0.00 0.00 55.73 53.43 2hfw s ARG 80 Cb -0.12 0.40 0.00 0.00 -0.57 0.00 0.00 34.95 34.66 2hfw s ARG 80 CO 0.00 -0.75 0.00 0.41 -1.08 0.00 0.00 175.30 173.88 2hfw n GLY 81 N -0.60 1.01 7.00 3.88 0.00 -1.26 0.63 105.19 115.85 2hfw n GLY 81 Ca 0.04 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2hfw n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hfw n GLY 82 N 0.00 2.35 0.02 -0.02 0.00 -1.06 -3.33 105.19 103.15 2hfw n GLY 82 Ca 0.00 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.70 2hfw n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2hfw n PRO 83 N 13.40 0.07 -1.35 1.61 -0.04 -1.26 -4.37 135.00 143.07 2hfw n PRO 83 Ca 0.00 0.03 -0.31 0.00 -0.04 0.00 0.00 63.50 63.19 2hfw n PRO 83 Cb 0.00 -1.56 0.08 0.00 -0.04 0.00 0.00 33.50 31.99 2hfw n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2hfw s LEU 84 N -3.35 2.97 -0.14 1.53 1.43 -1.21 -4.94 118.68 114.96 2hfw s LEU 84 Ca 0.11 1.71 0.16 0.00 -1.03 0.00 0.00 54.13 55.08 2hfw s LEU 84 Cb 0.17 -4.43 0.61 0.00 0.03 0.00 0.00 46.19 42.57 2hfw s LEU 84 CO 0.64 -1.93 1.53 -0.81 0.23 0.00 0.00 176.35 176.00 2hfw n PRO 85 N -3.45 3.55 0.00 1.29 -0.04 -1.26 -4.80 135.00 130.29 2hfw n PRO 85 Ca 0.08 -2.79 0.00 0.00 -0.04 0.00 0.00 63.50 60.76 2hfw n PRO 85 Cb 0.53 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 2hfw n PRO 85 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hfw n GLY 86 N 0.43 3.84 3.87 0.55 0.00 -1.26 -5.16 105.19 107.46 2hfw n GLY 86 Ca 0.22 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 2hfw n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hfw s PRO 87 N -2.56 3.81 0.07 1.61 0.04 -1.26 -4.68 135.00 132.03 2hfw s PRO 87 Ca 0.00 0.26 0.03 0.00 0.04 0.00 0.00 61.00 61.34 2hfw s PRO 87 Cb 0.00 -2.72 -0.03 0.00 0.04 0.00 0.00 34.50 31.79 2hfw s PRO 87 CO 0.00 0.37 -0.10 0.71 0.04 0.00 0.00 177.00 178.02 2hfw s TYR 88 N -1.73 0.94 -0.14 0.56 4.12 -0.52 -4.23 117.35 116.35 2hfw s TYR 88 Ca 0.45 -0.56 -0.04 0.00 0.02 0.00 0.00 57.07 56.94 2hfw s TYR 88 Cb -0.12 -0.54 -0.03 0.00 -1.52 0.00 0.00 41.96 39.75 2hfw s TYR 88 CO 0.21 -0.03 -0.01 1.03 0.02 0.00 0.00 175.55 176.78 2hfw s ARG 89 N -2.11 3.54 0.18 -0.62 0.52 -0.27 -1.49 118.95 118.70 2hfw s ARG 89 Ca -0.02 -0.45 -0.30 0.00 -0.52 0.00 0.00 55.73 54.44 2hfw s ARG 89 Cb -0.07 -2.94 -0.08 0.00 0.52 0.00 0.00 34.95 32.38 2hfw s ARG 89 CO 0.00 0.38 1.17 -1.17 0.02 0.00 0.00 175.30 175.70 2hfw s LEU 90 N 0.01 4.46 0.00 2.53 2.96 -0.72 -1.92 118.68 126.00 2hfw s LEU 90 Ca 0.02 2.18 0.00 0.00 -0.22 0.00 0.00 54.13 56.12 2hfw s LEU 90 Cb -0.13 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.96 2hfw s LEU 90 CO 0.02 -0.33 0.00 -1.14 -1.32 0.00 0.00 176.35 173.59 2hfw n ARG 91 N 2.48 0.00 -3.55 1.98 0.63 -0.53 -4.50 116.66 113.18 2hfw n ARG 91 Ca 0.04 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.85 2hfw n ARG 91 Cb 0.45 -0.78 -0.05 0.00 0.45 0.00 0.00 32.46 32.54 2hfw n ARG 91 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 2hfw s GLN 92 N -1.72 0.75 0.09 -0.14 1.03 -1.18 -1.60 119.66 116.89 2hfw s GLN 92 Ca 0.00 0.06 0.03 0.00 0.04 0.00 0.00 55.36 55.49 2hfw s GLN 92 Cb 0.00 0.35 -0.04 0.00 0.03 0.00 0.00 33.01 33.36 2hfw s GLN 92 CO 0.00 -0.26 -0.10 -0.59 -2.54 0.00 0.00 175.29 171.80 2hfw s PHE 93 N -1.63 1.03 0.00 9.60 -0.71 -1.05 -0.23 117.98 125.00 2hfw s PHE 93 Ca -0.02 -0.66 0.00 0.00 -1.04 0.00 0.00 56.93 55.20 2hfw s PHE 93 Cb -0.00 -0.57 0.00 0.00 -1.21 0.00 0.00 43.02 41.24 2hfw s PHE 93 CO 0.01 -0.01 0.00 -2.39 -1.34 0.00 0.00 175.22 171.48 2hfw n HIS 94 N 0.56 0.00 -3.97 3.49 1.44 -1.02 -1.59 115.22 114.13 2hfw n HIS 94 Ca -0.16 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.46 2hfw n HIS 94 Cb 0.58 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.64 2hfw n HIS 94 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2hfw s LEU 95 N 0.00 0.22 0.00 2.39 1.02 -1.25 -3.04 118.68 118.02 2hfw s LEU 95 Ca 0.00 -0.89 -0.00 0.00 0.02 0.00 0.00 54.13 53.26 2hfw s LEU 95 Cb 0.00 1.96 -0.00 0.00 0.02 0.00 0.00 46.19 48.17 2hfw s LEU 95 CO 0.00 -1.20 -0.00 -1.00 0.02 0.00 0.00 176.35 174.17 2hfw s HIS 96 N -3.93 0.05 0.16 0.29 3.76 -0.74 -4.77 115.29 110.11 2hfw s HIS 96 Ca 0.20 -0.10 -0.19 0.00 -0.15 0.00 0.00 55.06 54.82 2hfw s HIS 96 Cb -0.02 -0.04 0.05 0.00 1.11 0.00 0.00 32.58 33.68 2hfw s HIS 96 CO 0.09 -0.05 0.51 1.67 -0.85 0.00 0.00 174.74 176.12 2hfw s TRP 97 N -0.32 -0.33 0.00 1.40 -2.14 -1.22 -1.28 118.94 115.04 2hfw s TRP 97 Ca -0.04 0.05 0.00 0.00 2.66 0.00 0.00 56.10 58.78 2hfw s TRP 97 Cb -0.02 0.42 0.00 0.00 -3.10 0.00 0.00 33.47 30.77 2hfw s TRP 97 CO -0.00 -0.81 0.00 0.41 -2.66 0.00 0.00 176.95 173.88 2hfw n GLY 98 N -0.32 5.80 0.55 3.67 0.00 -1.25 -0.15 105.19 113.50 2hfw n GLY 98 Ca -0.15 -2.02 0.09 0.00 0.00 0.00 0.00 46.02 43.94 2hfw n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2hfw n SER 99 N 0.00 2.08 -4.01 1.61 3.41 -1.15 -4.72 113.62 110.85 2hfw n SER 99 Ca 0.00 -1.54 -0.09 0.00 -0.26 0.00 0.00 58.87 56.98 2hfw n SER 99 Cb 0.00 0.23 -0.06 0.00 -0.26 0.00 0.00 64.21 64.12 2hfw n SER 99 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2hfw s SER 100 N -1.70 -0.07 0.48 4.04 1.04 -1.26 -5.03 113.70 111.19 2hfw s SER 100 Ca 0.17 -0.95 0.33 0.00 0.48 0.00 0.00 55.95 55.98 2hfw s SER 100 Cb 0.14 0.57 1.67 0.00 0.10 0.00 0.00 66.02 68.50 2hfw s SER 100 CO 0.32 -1.11 1.99 0.44 0.98 0.00 0.00 173.24 175.85 2hfw h ASP 101 N 2.29 0.00 1.17 7.02 3.45 -1.93 -2.95 116.42 125.47 2hfw h ASP 101 Ca -0.27 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.19 2hfw h ASP 101 Cb 1.25 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.02 2hfw h ASP 101 CO 0.37 0.00 0.00 -0.90 -1.57 0.00 0.00 179.24 177.14 2hfw n ASP 102 N -2.69 0.72 -4.06 6.45 5.68 -1.26 -4.35 116.55 117.04 2hfw n ASP 102 Ca -0.01 0.61 -0.10 0.00 -0.50 0.00 0.00 54.79 54.78 2hfw n ASP 102 Cb 0.11 -0.79 -0.07 0.00 -1.14 0.00 0.00 41.12 39.24 2hfw n ASP 102 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 2hfw s HIS 103 N -3.18 0.63 0.00 2.11 -3.43 -1.11 -4.55 115.29 105.76 2hfw s HIS 103 Ca 0.08 -0.95 0.00 0.00 -0.80 0.00 0.00 55.06 53.40 2hfw s HIS 103 Cb 0.11 -0.07 0.00 0.00 -1.43 0.00 0.00 32.58 31.19 2hfw s HIS 103 CO 0.51 -0.86 0.00 0.41 -2.00 0.00 0.00 174.74 172.80 2hfw n GLY 104 N -0.34 0.70 3.76 -1.38 0.00 0.21 -4.00 105.19 104.14 2hfw n GLY 104 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 2hfw n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hfw s SER 105 N 0.00 5.16 -0.06 1.61 1.04 -0.02 -3.42 113.70 118.01 2hfw s SER 105 Ca 0.00 2.20 -0.08 0.00 0.48 0.00 0.00 55.95 58.55 2hfw s SER 105 Cb 0.00 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 2hfw s SER 105 CO 0.00 -1.60 0.34 -0.33 0.98 0.00 0.00 173.24 172.63 2hfw h GLU 106 N 0.51 -0.27 -7.10 4.02 5.08 -1.91 -3.45 114.58 111.46 2hfw h GLU 106 Ca -0.49 0.02 -0.55 0.00 -1.00 0.00 0.00 59.36 57.34 2hfw h GLU 106 Cb 1.27 0.06 0.14 0.00 0.50 0.00 0.00 28.75 30.72 2hfw h GLU 106 CO 0.54 -0.18 0.51 -1.01 -1.00 0.00 0.00 179.01 177.87 2hfw s HIS 107 N -2.45 2.21 0.13 4.33 3.76 -1.26 -4.68 115.29 117.32 2hfw s HIS 107 Ca -0.04 1.49 0.09 0.00 -0.15 0.00 0.00 55.06 56.45 2hfw s HIS 107 Cb 0.00 -3.63 -0.04 0.00 1.11 0.00 0.00 32.58 30.03 2hfw s HIS 107 CO 0.12 -2.67 -0.22 0.95 -0.85 0.00 0.00 174.74 172.07 2hfw s THR 108 N -1.45 1.92 -0.27 1.30 -4.23 -1.20 -4.72 115.64 106.99 2hfw s THR 108 Ca 0.80 -1.70 0.02 0.00 -1.18 0.00 0.00 61.69 59.63 2hfw s THR 108 Cb -0.35 -1.76 0.07 0.00 1.34 0.00 0.00 72.50 71.80 2hfw s THR 108 CO 0.38 -0.07 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.65 2hfw s VAL 109 N -1.32 1.86 -1.25 2.29 1.01 -0.95 -2.01 120.40 120.03 2hfw s VAL 109 Ca 0.11 -1.57 -0.06 0.00 0.00 0.00 0.00 61.98 60.46 2hfw s VAL 109 Cb -0.09 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 2hfw s VAL 109 CO 0.06 -0.19 0.70 0.47 0.00 0.00 0.00 175.10 176.14 2hfw n ASP 110 N 4.52 -2.59 0.00 3.32 10.43 -0.62 -1.40 116.55 130.21 2hfw n ASP 110 Ca -0.10 -0.89 0.00 0.00 2.57 0.00 0.00 54.79 56.38 2hfw n ASP 110 Cb 0.43 -3.86 0.00 0.00 1.84 0.00 0.00 41.12 39.53 2hfw n ASP 110 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2hfw n GLY 111 N -1.63 2.82 3.75 0.44 0.00 -1.26 -4.98 105.19 104.33 2hfw n GLY 111 Ca -0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 2hfw n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hfw s VAL 112 N -1.63 5.25 0.22 1.61 1.01 -0.49 -5.03 120.40 121.33 2hfw s VAL 112 Ca 0.00 0.66 0.09 0.00 0.00 0.00 0.00 61.98 62.73 2hfw s VAL 112 Cb 0.00 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 2hfw s VAL 112 CO 0.00 0.41 -0.01 -0.54 0.00 0.00 0.00 175.10 174.96 2hfw s LYS 113 N 0.20 2.30 0.45 2.72 1.02 -1.26 -2.23 119.74 122.94 2hfw s LYS 113 Ca 0.20 -1.28 0.04 0.00 0.02 0.00 0.00 55.97 54.94 2hfw s LYS 113 Cb -0.14 -2.23 -0.05 0.00 -0.52 0.00 0.00 37.83 34.89 2hfw s LYS 113 CO 0.07 0.41 0.02 0.71 -0.92 0.00 0.00 175.35 175.63 2hfw s TYR 114 N -2.02 2.16 -0.33 3.18 1.51 -1.26 -4.79 117.35 115.81 2hfw s TYR 114 Ca 0.29 -0.85 0.23 0.00 -1.01 0.00 0.00 57.07 55.73 2hfw s TYR 114 Cb -0.08 -1.64 0.03 0.00 -0.11 0.00 0.00 41.96 40.17 2hfw s TYR 114 CO 0.19 0.28 1.04 0.00 -1.11 0.00 0.00 175.55 175.96 2hfw n ALA 115 N -1.07 2.70 -3.45 3.71 0.00 -0.70 -0.62 120.51 121.08 2hfw n ALA 115 Ca -0.11 -0.27 -0.11 0.00 0.00 0.00 0.00 53.44 52.95 2hfw n ALA 115 Cb 0.67 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 19.02 2hfw n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hfw s ALA 116 N -3.33 -1.67 -0.12 0.00 0.00 -1.23 -4.11 121.76 111.30 2hfw s ALA 116 Ca 0.00 0.66 0.02 0.00 0.00 0.00 0.00 51.96 52.65 2hfw s ALA 116 Cb 0.11 0.73 0.01 0.00 0.00 0.00 0.00 23.12 23.97 2hfw s ALA 116 CO 0.79 -0.74 -0.19 -2.00 0.00 0.00 0.00 175.76 173.62 2hfw s GLU 117 N -3.54 2.63 -0.19 0.00 2.12 -0.41 -0.68 118.70 118.64 2hfw s GLU 117 Ca 0.02 -0.71 -0.11 0.00 0.36 0.00 0.00 54.97 54.53 2hfw s GLU 117 Cb -0.01 -2.15 -0.05 0.00 0.26 0.00 0.00 34.13 32.18 2hfw s GLU 117 CO -0.12 -0.02 0.17 -1.17 -0.54 0.00 0.00 175.26 173.59 2hfw s LEU 118 N 0.85 4.22 -0.18 2.70 2.96 0.63 -1.80 118.68 128.06 2hfw s LEU 118 Ca -0.08 0.31 0.00 0.00 -0.22 0.00 0.00 54.13 54.14 2hfw s LEU 118 Cb -0.15 -2.17 0.01 0.00 0.50 0.00 0.00 46.19 44.38 2hfw s LEU 118 CO -0.01 0.17 -0.17 -1.00 -1.32 0.00 0.00 176.35 174.02 2hfw s HIS 119 N 0.35 2.81 -0.38 5.38 3.76 -1.17 -1.34 115.29 124.69 2hfw s HIS 119 Ca 0.10 -1.46 -0.13 0.00 -0.15 0.00 0.00 55.06 53.43 2hfw s HIS 119 Cb -0.12 -1.95 0.02 0.00 1.11 0.00 0.00 32.58 31.65 2hfw s HIS 119 CO -0.00 -0.73 0.24 -0.51 -0.85 0.00 0.00 174.74 172.89 2hfw s LEU 120 N 1.27 4.81 -0.18 0.89 1.02 -0.61 -2.43 118.68 123.45 2hfw s LEU 120 Ca 0.04 -0.88 -0.18 0.00 0.02 0.00 0.00 54.13 53.13 2hfw s LEU 120 Cb -0.14 -2.08 -0.04 0.00 0.02 0.00 0.00 46.19 43.96 2hfw s LEU 120 CO -0.10 -0.38 0.50 -0.69 0.02 0.00 0.00 176.35 175.69 2hfw s VAL 121 N 1.62 5.14 0.22 -1.59 1.01 0.68 -2.09 120.40 125.39 2hfw s VAL 121 Ca 0.04 0.93 0.09 0.00 0.00 0.00 0.00 61.98 63.03 2hfw s VAL 121 Cb -0.19 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 2hfw s VAL 121 CO 0.08 0.22 -0.15 -1.00 0.00 0.00 0.00 175.10 174.25 2hfw s HIS 122 N 1.33 1.84 0.05 5.22 3.76 -0.12 -1.45 115.29 125.92 2hfw s HIS 122 Ca 0.24 -0.53 -0.06 0.00 -0.15 0.00 0.00 55.06 54.57 2hfw s HIS 122 Cb -0.15 -0.84 -0.01 0.00 1.11 0.00 0.00 32.58 32.68 2hfw s HIS 122 CO 0.10 0.43 0.10 1.67 -0.85 0.00 0.00 174.74 176.19 2hfw s TRP 123 N -2.88 0.24 -0.09 1.40 1.48 -0.81 -1.93 118.94 116.35 2hfw s TRP 123 Ca 0.24 -0.61 -0.25 0.00 -1.06 0.00 0.00 56.10 54.43 2hfw s TRP 123 Cb -0.01 -0.16 -0.03 0.00 -1.16 0.00 0.00 33.47 32.11 2hfw s TRP 123 CO 0.09 -0.41 0.77 1.21 -4.06 0.00 0.00 176.95 174.55 2hfw s ASN 124 N -2.43 7.02 0.51 -2.66 3.84 -0.60 -1.12 114.94 119.50 2hfw s ASN 124 Ca -0.01 1.24 0.28 0.00 0.21 0.00 0.00 52.86 54.58 2hfw s ASN 124 Cb 0.02 -2.44 1.35 0.00 -0.55 0.00 0.00 41.25 39.63 2hfw s ASN 124 CO -0.07 -0.22 2.01 -0.65 -2.79 0.00 0.00 177.10 175.37 2hfw h PRO 125 N 6.96 0.00 -0.22 0.43 0.11 -1.93 -3.00 132.00 134.35 2hfw h PRO 125 Ca -0.37 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.80 2hfw h PRO 125 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2hfw h PRO 125 CO 0.78 0.13 0.21 -0.22 -0.21 0.00 0.00 178.00 178.69 2hfw h LYS 127 N 0.00 0.00 -0.66 1.05 3.64 -1.91 -1.00 116.57 117.69 2hfw h LYS 127 Ca -0.00 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 2hfw h LYS 127 Cb 0.46 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.18 2hfw h LYS 127 CO 0.02 0.00 0.20 0.66 -2.27 0.00 0.00 179.45 178.05 2hfw n TYR 128 N -3.95 2.22 0.00 1.91 0.53 -1.13 -4.93 117.16 111.81 2hfw n TYR 128 Ca 0.02 -1.14 0.00 0.00 -1.02 0.00 0.00 57.90 55.77 2hfw n TYR 128 Cb 0.35 -0.63 0.00 0.00 -1.03 0.00 0.00 39.34 38.03 2hfw n TYR 128 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 2hfw n ASN 129 N -0.14 0.00 -3.65 7.72 3.02 -0.38 -4.25 115.26 117.58 2hfw n ASN 129 Ca 0.37 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.94 2hfw n ASN 129 Cb 1.31 -0.04 -0.06 0.00 -0.61 0.00 0.00 39.78 40.38 2hfw n ASN 129 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2hfw s THR 130 N -0.58 0.00 0.37 3.41 -4.23 -1.26 -5.02 115.64 108.33 2hfw s THR 130 Ca 0.00 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 60.67 2hfw s THR 130 Cb 0.00 -1.00 0.37 0.00 1.34 0.00 0.00 72.50 73.21 2hfw s THR 130 CO 0.00 0.00 1.72 0.15 -0.54 0.00 0.00 174.62 175.95 2hfw h PHE 131 N 4.71 0.81 -0.00 3.99 3.04 -1.90 -2.01 116.94 125.57 2hfw h PHE 131 Ca -0.26 0.03 -0.18 0.00 3.98 0.00 0.00 57.97 61.54 2hfw h PHE 131 Cb 1.16 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 39.43 2hfw h PHE 131 CO 0.19 -0.03 -0.81 -0.22 -2.02 0.00 0.00 178.31 175.43 2hfw h LYS 132 N 0.39 0.08 0.00 1.11 3.64 -1.95 -2.95 116.57 116.90 2hfw h LYS 132 Ca 0.67 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.96 2hfw h LYS 132 Cb 1.60 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.44 2hfw h LYS 132 CO -0.43 0.84 -0.04 0.93 -2.27 0.00 0.00 179.45 178.48 2hfw h GLU 133 N 0.05 0.00 0.00 1.90 5.08 -1.63 -3.22 114.58 116.77 2hfw h GLU 133 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2hfw h GLU 133 Cb 1.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.66 2hfw h GLU 133 CO 0.11 0.04 -0.33 0.00 -1.00 0.00 0.00 179.01 177.83 2hfw n ALA 134 N -2.11 2.79 0.58 3.43 0.00 -0.84 -3.34 120.51 121.03 2hfw n ALA 134 Ca 0.03 -0.19 0.09 0.00 0.00 0.00 0.00 53.44 53.37 2hfw n ALA 134 Cb 0.49 -1.29 0.38 0.00 0.00 0.00 0.00 19.45 19.04 2hfw n ALA 134 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2hfw n LEU 135 N -1.90 0.08 -0.96 0.00 4.77 -1.13 -2.77 117.00 115.10 2hfw n LEU 135 Ca 0.05 0.52 0.10 0.00 -0.03 0.00 0.00 56.01 56.65 2hfw n LEU 135 Cb 0.40 -0.50 0.16 0.00 -2.33 0.00 0.00 43.42 41.14 2hfw n LEU 135 CO 0.33 -0.23 0.64 0.29 -1.33 0.00 0.00 177.39 177.08 2hfw n LYS 136 N -1.58 2.21 -4.13 3.23 5.02 -1.21 -4.60 118.16 117.10 2hfw n LYS 136 Ca 0.04 -2.03 -0.25 0.00 -2.02 0.00 0.00 58.31 54.05 2hfw n LYS 136 Cb 0.21 -1.43 -0.06 0.00 -0.02 0.00 0.00 35.03 33.73 2hfw n LYS 136 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2hfw s GLN 137 N -1.43 2.76 0.25 1.97 -1.52 -1.11 -5.00 119.66 115.58 2hfw s GLN 137 Ca 0.31 -0.99 0.12 0.00 -1.95 0.00 0.00 55.36 52.85 2hfw s GLN 137 Cb 0.19 -2.54 0.21 0.00 -0.22 0.00 0.00 33.01 30.66 2hfw s GLN 137 CO 0.27 0.45 1.51 0.07 -0.25 0.00 0.00 175.29 177.35 2hfw h ARG 138 N 2.25 0.00 -0.52 2.91 0.11 -1.81 -3.13 114.38 114.19 2hfw h ARG 138 Ca -0.47 0.00 -0.38 0.00 0.10 0.00 0.00 59.98 59.22 2hfw h ARG 138 Cb 1.21 0.00 -0.34 0.00 1.11 0.00 0.00 29.97 31.95 2hfw h ARG 138 CO 0.61 0.66 -0.81 -0.40 0.10 0.00 0.00 179.97 180.13 2hfw n ASP 139 N -3.52 3.65 0.06 0.08 3.85 -1.25 -3.72 116.55 115.70 2hfw n ASP 139 Ca -0.00 -3.45 -0.20 0.00 -0.71 0.00 0.00 54.79 50.42 2hfw n ASP 139 Cb 0.71 -0.40 -0.15 0.00 -1.35 0.00 0.00 41.12 39.94 2hfw n ASP 139 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 2hfw h GLY 140 N 1.96 0.37 -4.47 6.12 0.00 -1.35 -3.45 103.07 102.25 2hfw h GLY 140 Ca 0.20 -0.94 -0.56 0.00 0.00 0.00 0.00 47.33 46.03 2hfw h GLY 140 CO 0.50 0.82 -0.01 -0.42 0.00 0.00 0.00 176.54 177.43 2hfw s ILE 141 N -2.59 4.71 -0.20 2.60 1.09 -0.63 -1.55 121.20 124.62 2hfw s ILE 141 Ca -0.14 1.21 -0.01 0.00 -1.10 0.00 0.00 60.65 60.62 2hfw s ILE 141 Cb 0.06 -3.90 0.01 0.00 -1.06 0.00 0.00 42.46 37.58 2hfw s ILE 141 CO 0.84 0.49 -0.13 0.00 -0.10 0.00 0.00 174.94 176.05 2hfw s ALA 142 N -1.18 2.52 -0.23 9.38 0.00 -0.81 -1.12 121.76 130.32 2hfw s ALA 142 Ca 0.31 -1.25 -0.07 0.00 0.00 0.00 0.00 51.96 50.96 2hfw s ALA 142 Cb -0.19 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.49 2hfw s ALA 142 CO 0.20 -0.45 0.05 0.08 0.00 0.00 0.00 175.76 175.63 2hfw s VAL 143 N 1.35 4.22 -0.23 0.00 1.01 -0.99 -0.95 120.40 124.81 2hfw s VAL 143 Ca 0.04 -0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.52 2hfw s VAL 143 Cb -0.14 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.29 2hfw s VAL 143 CO -0.09 0.37 1.13 -0.63 0.00 0.00 0.00 175.10 175.88 2hfw s ILE 144 N 1.40 4.49 -0.25 2.22 1.01 -0.89 -0.94 121.20 128.25 2hfw s ILE 144 Ca 0.05 1.79 -0.10 0.00 0.00 0.00 0.00 60.65 62.39 2hfw s ILE 144 Cb -0.15 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.06 2hfw s ILE 144 CO 0.03 -0.23 0.16 -0.83 0.00 0.00 0.00 174.94 174.07 2hfw s GLY 145 N 1.61 1.94 -0.09 6.18 0.00 -0.69 -1.57 107.32 114.71 2hfw s GLY 145 Ca 0.48 -0.98 0.04 0.00 0.00 0.00 0.00 44.72 44.26 2hfw s GLY 145 CO 0.11 0.49 -0.22 -0.42 0.00 0.00 0.00 173.10 173.06 2hfw s ILE 146 N 1.35 1.89 0.29 0.90 1.01 -0.45 -1.80 121.20 124.40 2hfw s ILE 146 Ca 0.07 -0.92 -0.19 0.00 0.00 0.00 0.00 60.65 59.60 2hfw s ILE 146 Cb -0.15 -1.64 -0.09 0.00 0.01 0.00 0.00 42.46 40.59 2hfw s ILE 146 CO 0.07 0.52 0.78 -0.36 0.00 0.00 0.00 174.94 175.96 2hfw s PHE 147 N 0.36 3.52 -0.21 3.97 0.08 -1.26 -0.27 117.98 124.18 2hfw s PHE 147 Ca -0.17 1.41 -0.03 0.00 0.12 0.00 0.00 56.93 58.26 2hfw s PHE 147 Cb -0.17 -2.66 -0.00 0.00 -0.57 0.00 0.00 43.02 39.61 2hfw s PHE 147 CO 0.08 0.19 -0.07 -0.51 -0.10 0.00 0.00 175.22 174.80 2hfw s LEU 148 N -2.46 2.77 -0.07 -0.37 1.02 0.15 -1.82 118.68 117.90 2hfw s LEU 148 Ca 0.50 -0.42 0.04 0.00 0.02 0.00 0.00 54.13 54.27 2hfw s LEU 148 Cb -0.14 -1.69 -0.02 0.00 0.02 0.00 0.00 46.19 44.36 2hfw s LEU 148 CO 0.19 -0.00 -0.20 -0.75 0.02 0.00 0.00 176.35 175.61 2hfw s LYS 149 N 1.37 2.69 0.50 1.70 2.20 -1.06 -1.72 119.74 125.42 2hfw s LYS 149 Ca 0.05 -0.82 -0.22 0.00 -0.36 0.00 0.00 55.97 54.62 2hfw s LYS 149 Cb -0.14 -2.30 -0.06 0.00 -1.51 0.00 0.00 37.83 33.82 2hfw s LYS 149 CO -0.04 0.41 1.22 0.42 -0.36 0.00 0.00 175.35 177.00 2hfw s ILE 150 N -0.21 2.76 0.00 5.43 1.09 -1.26 -1.63 121.20 127.38 2hfw s ILE 150 Ca -0.01 0.56 0.00 0.00 -1.10 0.00 0.00 60.65 60.09 2hfw s ILE 150 Cb -0.13 -3.27 0.00 0.00 -1.06 0.00 0.00 42.46 37.99 2hfw s ILE 150 CO 0.03 -0.02 0.00 0.61 -0.10 0.00 0.00 174.94 175.46 2hfw n GLY 151 N 0.52 -0.66 3.76 6.18 0.00 0.41 -4.72 105.19 110.68 2hfw n GLY 151 Ca 0.09 0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2hfw n GLY 151 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2hfw s HIS 152 N -1.31 3.49 0.28 1.61 3.76 -1.26 -3.93 115.29 117.94 2hfw s HIS 152 Ca 0.00 1.62 -0.27 0.00 -0.15 0.00 0.00 55.06 56.26 2hfw s HIS 152 Cb 0.00 -3.36 -0.14 0.00 1.11 0.00 0.00 32.58 30.19 2hfw s HIS 152 CO 0.00 -0.81 0.87 -0.85 -0.85 0.00 0.00 174.74 173.10 2hfw n GLU 153 N 1.38 1.01 -3.68 1.40 0.28 -1.26 -3.65 120.64 116.12 2hfw n GLU 153 Ca -0.00 0.36 -0.38 0.00 -0.16 0.00 0.00 57.16 56.98 2hfw n GLU 153 Cb 0.44 -1.65 -0.12 0.00 1.43 0.00 0.00 31.44 31.55 2hfw n GLU 153 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 2hfw s ASN 154 N -0.69 5.49 0.40 -1.84 3.84 -1.26 -4.91 114.94 115.98 2hfw s ASN 154 Ca 0.60 -0.35 0.15 0.00 0.21 0.00 0.00 52.86 53.47 2hfw s ASN 154 Cb -0.74 -2.00 0.86 0.00 -0.55 0.00 0.00 41.25 38.82 2hfw s ASN 154 CO 0.59 -0.12 1.89 1.23 -2.79 0.00 0.00 177.10 177.90 2hfw h GLY 155 N 8.32 0.00 1.66 1.21 0.00 -1.95 -2.47 103.07 109.84 2hfw h GLY 155 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2hfw h GLY 155 CO 0.59 0.00 -0.27 0.83 0.00 0.00 0.00 176.54 177.69 2hfw h GLU 156 N 0.00 0.00 0.00 4.80 3.07 -1.95 -3.15 114.58 117.36 2hfw h GLU 156 Ca -0.00 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.60 2hfw h GLU 156 Cb 0.55 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.42 2hfw h GLU 156 CO 0.04 0.00 -1.39 0.35 -1.40 0.00 0.00 179.01 176.61 2hfw h PHE 157 N 0.00 0.01 -0.58 4.33 -0.00 -1.93 -3.27 116.94 115.50 2hfw h PHE 157 Ca 0.00 -0.01 0.07 0.00 -0.00 0.00 0.00 57.97 58.03 2hfw h PHE 157 Cb 0.81 -0.00 -0.06 0.00 -0.00 0.00 0.00 35.95 36.70 2hfw h PHE 157 CO 0.00 1.01 0.26 0.37 -0.00 0.00 0.00 178.31 179.95 2hfw h GLN 158 N 0.00 0.47 -0.88 1.11 5.75 -1.39 -2.11 115.11 118.06 2hfw h GLN 158 Ca -0.16 -0.03 0.16 0.00 -0.15 0.00 0.00 58.65 58.47 2hfw h GLN 158 Cb 1.91 -0.11 -0.16 0.00 1.07 0.00 0.00 27.48 30.19 2hfw h GLN 158 CO 0.10 0.31 -0.30 0.82 -2.65 0.00 0.00 178.83 177.12 2hfw h ILE 159 N 0.49 0.08 -0.47 2.39 2.04 -1.61 0.21 117.51 120.63 2hfw h ILE 159 Ca 0.27 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.13 2hfw h ILE 159 Cb 0.26 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 2hfw h ILE 159 CO -0.23 0.00 0.29 0.15 0.00 0.00 0.00 178.15 178.36 2hfw h PHE 160 N -0.03 0.61 -0.33 1.37 3.57 -1.65 -3.18 116.94 117.31 2hfw h PHE 160 Ca 0.37 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.90 2hfw h PHE 160 Cb 0.62 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 2hfw h PHE 160 CO -0.75 0.42 0.22 -0.07 -2.23 0.00 0.00 178.31 175.90 2hfw h LEU 161 N 0.63 0.31 -0.91 0.59 3.38 0.03 -2.56 115.31 116.78 2hfw h LEU 161 Ca 0.17 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 2hfw h LEU 161 Cb -0.02 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2hfw h LEU 161 CO -0.03 0.22 -0.41 0.44 0.09 0.00 0.00 178.44 178.74 2hfw h ASP 162 N 0.36 0.29 0.00 -0.43 3.32 -1.11 -1.73 116.42 117.12 2hfw h ASP 162 Ca 0.13 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2hfw h ASP 162 Cb 0.07 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2hfw h ASP 162 CO -0.03 0.67 0.00 0.00 -1.72 0.00 0.00 179.24 178.17 2hfw n ALA 163 N -2.48 2.38 -0.00 3.45 0.00 -0.96 -3.47 120.51 119.43 2hfw n ALA 163 Ca -0.02 -0.07 -0.07 0.00 0.00 0.00 0.00 53.44 53.29 2hfw n ALA 163 Cb 0.49 -1.17 -0.13 0.00 0.00 0.00 0.00 19.45 18.64 2hfw n ALA 163 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2hfw h LEU 164 N 0.00 0.00 -0.76 0.00 3.38 -1.41 -3.19 115.31 113.33 2hfw h LEU 164 Ca 0.00 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.19 2hfw h LEU 164 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2hfw h LEU 164 CO 0.00 0.95 1.06 0.47 0.09 0.00 0.00 178.44 181.02 2hfw n ASP 165 N -3.08 0.00 -0.36 -0.43 10.43 -1.23 -1.20 116.55 120.68 2hfw n ASP 165 Ca -0.13 0.64 0.10 0.00 2.57 0.00 0.00 54.79 57.97 2hfw n ASP 165 Cb 1.01 -0.19 -0.03 0.00 1.84 0.00 0.00 41.12 43.75 2hfw n ASP 165 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2hfw n LYS 166 N -2.90 1.20 0.00 -1.24 5.02 -1.20 -4.21 118.16 114.82 2hfw n LYS 166 Ca 0.17 -0.74 0.00 0.00 -2.02 0.00 0.00 58.31 55.72 2hfw n LYS 166 Cb 1.29 -1.42 0.00 0.00 -0.02 0.00 0.00 35.03 34.89 2hfw n LYS 166 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2hfw n ILE 167 N -0.36 0.11 0.00 -0.18 -5.35 -0.36 -4.71 119.36 108.51 2hfw n ILE 167 Ca 0.07 -0.29 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 2hfw n ILE 167 Cb 0.40 1.36 0.00 0.00 -1.74 0.00 0.00 39.64 39.66 2hfw n ILE 167 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2hfw n LYS 168 N -0.05 0.00 -3.64 6.28 5.02 -0.34 -4.14 118.16 121.28 2hfw n LYS 168 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.94 2hfw n LYS 168 Cb 0.19 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.15 2hfw n LYS 168 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2hfw s THR 169 N -2.04 5.17 0.34 -0.18 2.01 -1.26 -2.02 115.64 117.67 2hfw s THR 169 Ca 0.00 0.38 -0.20 0.00 0.31 0.00 0.00 61.69 62.18 2hfw s THR 169 Cb 0.00 -3.62 -0.14 0.00 0.01 0.00 0.00 72.50 68.75 2hfw s THR 169 CO 0.00 0.35 0.12 1.17 -0.69 0.00 0.00 174.62 175.57 2hfw n LYS 170 N 1.09 0.00 0.00 4.92 4.81 -1.23 -2.40 118.16 125.35 2hfw n LYS 170 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.34 2hfw n LYS 170 Cb 0.53 -0.90 0.00 0.00 0.02 0.00 0.00 35.03 34.67 2hfw n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2hfw n GLY 171 N 2.07 2.75 3.74 3.14 0.00 -0.53 -4.33 105.19 112.04 2hfw n GLY 171 Ca 0.11 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 2hfw n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hfw s LYS 172 N 0.00 4.72 0.27 1.61 1.02 -1.01 -4.85 119.74 121.51 2hfw s LYS 172 Ca 0.00 1.60 0.09 0.00 0.02 0.00 0.00 55.97 57.68 2hfw s LYS 172 Cb 0.00 -3.28 -0.05 0.00 -0.52 0.00 0.00 37.83 33.97 2hfw s LYS 172 CO 0.00 0.29 -0.13 -2.00 -0.92 0.00 0.00 175.35 172.60 2hfw s GLU 173 N -0.80 1.58 0.05 1.68 2.12 -1.26 -2.99 118.70 119.08 2hfw s GLU 173 Ca 0.45 -1.76 -0.27 0.00 0.36 0.00 0.00 54.97 53.75 2hfw s GLU 173 Cb -0.27 -1.43 0.09 0.00 0.26 0.00 0.00 34.13 32.78 2hfw s GLU 173 CO 0.34 0.18 0.81 0.00 -0.54 0.00 0.00 175.26 176.05 2hfw s ALA 174 N -2.78 -1.75 0.29 6.30 0.00 -1.18 -4.93 121.76 117.71 2hfw s ALA 174 Ca 0.28 0.82 -0.10 0.00 0.00 0.00 0.00 51.96 52.97 2hfw s ALA 174 Cb -0.00 0.55 -0.07 0.00 0.00 0.00 0.00 23.12 23.60 2hfw s ALA 174 CO 0.12 -0.73 0.63 -2.14 0.00 0.00 0.00 175.76 173.65 2hfw s PRO 175 N -3.30 3.82 -0.38 0.00 0.02 -1.26 -2.07 135.00 131.82 2hfw s PRO 175 Ca 0.04 0.36 0.07 0.00 0.02 0.00 0.00 61.00 61.49 2hfw s PRO 175 Cb -0.01 -2.55 0.18 0.00 0.02 0.00 0.00 34.50 32.14 2hfw s PRO 175 CO -0.09 0.20 0.57 0.12 -0.33 0.00 0.00 177.00 177.47 2hfw s PHE 176 N -1.99 -1.45 0.51 6.54 5.36 0.58 -4.70 117.98 122.83 2hfw s PHE 176 Ca 0.49 0.16 0.03 0.00 -0.96 0.00 0.00 56.93 56.65 2hfw s PHE 176 Cb -0.11 0.16 -0.00 0.00 -0.34 0.00 0.00 43.02 42.74 2hfw s PHE 176 CO 0.23 -1.12 0.14 0.95 -1.46 0.00 0.00 175.22 173.96 2hfw s THR 177 N 1.92 1.41 -1.06 0.12 -4.23 -1.26 -2.40 115.64 110.13 2hfw s THR 177 Ca 0.15 -1.82 -0.19 0.00 -1.18 0.00 0.00 61.69 58.65 2hfw s THR 177 Cb -0.07 -2.23 0.01 0.00 1.34 0.00 0.00 72.50 71.55 2hfw s THR 177 CO -0.10 0.00 0.71 0.29 -0.54 0.00 0.00 174.62 174.99 2hfw n LYS 178 N -1.42 -0.98 -3.63 3.99 5.02 -0.87 -4.95 118.16 115.32 2hfw n LYS 178 Ca -0.12 0.48 -0.19 0.00 -2.02 0.00 0.00 58.31 56.46 2hfw n LYS 178 Cb 0.66 -3.35 -0.16 0.00 -0.02 0.00 0.00 35.03 32.16 2hfw n LYS 178 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2hfw s PHE 179 N -3.34 -0.11 -0.37 2.13 2.19 -0.63 -4.93 117.98 112.91 2hfw s PHE 179 Ca 0.34 0.37 -0.17 0.00 0.33 0.00 0.00 56.93 57.80 2hfw s PHE 179 Cb -0.15 -0.37 0.00 0.00 -1.31 0.00 0.00 43.02 41.19 2hfw s PHE 179 CO 0.90 -0.35 0.45 0.34 1.83 0.00 0.00 175.22 178.39 2hfw s ASP 180 N 2.26 6.24 0.00 6.13 -1.08 -1.26 -4.57 116.67 124.39 2hfw s ASP 180 Ca 0.04 -0.31 0.28 0.00 -0.52 0.00 0.00 52.55 52.04 2hfw s ASP 180 Cb -0.13 -2.24 1.05 0.00 -1.46 0.00 0.00 42.92 40.15 2hfw s ASP 180 CO -0.07 -0.49 1.77 -0.81 0.52 0.00 0.00 175.17 176.09 2hfw n PRO 181 N 5.62 0.41 -0.03 4.34 -0.05 -1.26 -2.43 135.00 141.61 2hfw n PRO 181 Ca -0.07 -0.15 0.16 0.00 -0.05 0.00 0.00 63.50 63.39 2hfw n PRO 181 Cb 0.48 -1.50 0.60 0.00 -0.05 0.00 0.00 33.50 33.04 2hfw n PRO 181 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 2hfw h SER 182 N 0.37 0.17 -1.61 3.54 4.64 -1.99 -1.77 113.55 116.90 2hfw h SER 182 Ca 0.00 0.01 0.50 0.00 -0.47 0.00 0.00 61.79 61.83 2hfw h SER 182 Cb 0.42 -0.03 -0.10 0.00 -0.31 0.00 0.00 62.40 62.38 2hfw h SER 182 CO 0.00 0.10 1.11 -1.54 -0.87 0.00 0.00 176.83 175.63 2hfw n SER 183 N -4.44 0.09 0.18 4.97 3.41 -1.02 -1.70 113.62 115.12 2hfw n SER 183 Ca 0.09 1.12 0.13 0.00 -0.26 0.00 0.00 58.87 59.95 2hfw n SER 183 Cb 0.48 -0.55 0.35 0.00 -0.26 0.00 0.00 64.21 64.22 2hfw n SER 183 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2hfw h LEU 184 N 0.00 0.00-10.05 1.04 3.38 -1.54 -3.47 115.31 104.67 2hfw h LEU 184 Ca 0.86 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 58.32 2hfw h LEU 184 Cb 3.16 0.00 0.09 0.00 0.09 0.00 0.00 40.66 44.00 2hfw h LEU 184 CO -0.21 0.00 0.49 -0.36 0.09 0.00 0.00 178.44 178.44 2hfw s PHE 185 N -3.24 2.61 0.46 1.13 0.40 -0.69 -4.82 117.98 113.83 2hfw s PHE 185 Ca 0.07 1.51 -0.03 0.00 -0.60 0.00 0.00 56.93 57.88 2hfw s PHE 185 Cb 0.09 -3.45 0.10 0.00 0.51 0.00 0.00 43.02 40.26 2hfw s PHE 185 CO 0.60 -1.91 0.63 -0.35 0.70 0.00 0.00 175.22 174.88 2hfw n PRO 186 N -1.04 -0.07 -0.03 0.24 -0.04 -1.26 -4.98 135.00 127.81 2hfw n PRO 186 Ca 0.10 -1.45 -0.15 0.00 -0.04 0.00 0.00 63.50 61.96 2hfw n PRO 186 Cb 0.49 -0.49 -0.10 0.00 -0.04 0.00 0.00 33.50 33.35 2hfw n PRO 186 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hfw h ALA 187 N -0.92 0.10 -2.25 0.55 0.00 -1.94 -3.42 119.26 111.37 2hfw h ALA 187 Ca -0.21 -0.46 -0.45 0.00 0.00 0.00 0.00 54.91 53.79 2hfw h ALA 187 Cb 0.69 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2hfw h ALA 187 CO 0.19 0.17 0.35 0.45 0.00 0.00 0.00 179.25 180.42 2hfw s SER 188 N -6.40 7.04 -0.21 0.00 0.15 -1.26 -4.97 113.70 108.05 2hfw s SER 188 Ca -0.14 1.78 0.13 0.00 0.70 0.00 0.00 55.95 58.41 2hfw s SER 188 Cb 0.03 -2.56 0.43 0.00 -1.71 0.00 0.00 66.02 62.21 2hfw s SER 188 CO 0.77 -0.29 1.29 0.54 1.20 0.00 0.00 173.24 176.76 2hfw n ARG 189 N -0.18 1.73 -1.79 5.44 1.74 -1.26 -4.82 116.66 117.52 2hfw n ARG 189 Ca 0.05 -3.06 -0.40 0.00 -0.77 0.00 0.00 57.85 53.67 2hfw n ARG 189 Cb 0.52 -1.67 0.01 0.00 -1.02 0.00 0.00 32.46 30.30 2hfw n ARG 189 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2hfw s ASP 190 N -2.83 6.03 -0.05 0.55 -0.00 -1.26 -4.85 116.67 114.26 2hfw s ASP 190 Ca 0.39 2.98 -0.05 0.00 -0.00 0.00 0.00 52.55 55.86 2hfw s ASP 190 Cb 0.36 -2.66 0.01 0.00 -0.00 0.00 0.00 42.92 40.63 2hfw s ASP 190 CO -0.01 -1.08 0.14 -0.72 -0.00 0.00 0.00 175.17 173.49 2hfw s TYR 191 N -1.17 -0.12 -0.11 4.23 1.13 -1.26 -1.72 117.35 118.33 2hfw s TYR 191 Ca 0.58 0.30 -0.05 0.00 -1.41 0.00 0.00 57.07 56.49 2hfw s TYR 191 Cb -0.45 0.04 -0.04 0.00 -1.10 0.00 0.00 41.96 40.41 2hfw s TYR 191 CO 0.59 -0.10 0.08 -1.58 -2.51 0.00 0.00 175.55 172.02 2hfw s TRP 192 N -0.13 3.40 -0.06 -3.49 0.51 0.41 -0.64 118.94 118.93 2hfw s TRP 192 Ca -0.02 0.37 0.05 0.00 -2.12 0.00 0.00 56.10 54.37 2hfw s TRP 192 Cb -0.02 -1.88 -0.00 0.00 -0.81 0.00 0.00 33.47 30.75 2hfw s TRP 192 CO 0.00 0.60 -0.20 -0.08 -0.51 0.00 0.00 176.95 176.76 2hfw s THR 193 N -0.89 1.68 0.19 2.01 -1.32 -0.71 0.35 115.64 116.95 2hfw s THR 193 Ca 0.14 -0.84 -0.11 0.00 -1.21 0.00 0.00 61.69 59.67 2hfw s THR 193 Cb -0.12 -1.45 -0.00 0.00 -1.51 0.00 0.00 72.50 69.42 2hfw s THR 193 CO 0.03 0.48 0.35 -0.72 -2.21 0.00 0.00 174.62 172.55 2hfw s TYR 194 N 0.11 0.35 -0.25 9.09 -0.85 -1.19 -3.02 117.35 121.60 2hfw s TYR 194 Ca -0.08 -0.70 -0.16 0.00 -0.52 0.00 0.00 57.07 55.61 2hfw s TYR 194 Cb -0.14 0.04 -0.03 0.00 0.38 0.00 0.00 41.96 42.21 2hfw s TYR 194 CO 0.04 -0.80 0.43 -0.65 -1.52 0.00 0.00 175.55 173.04 2hfw s GLN 195 N -3.97 4.08 0.00 -3.49 -0.21 -1.26 -1.58 119.66 113.23 2hfw s GLN 195 Ca 0.18 0.18 0.00 0.00 0.02 0.00 0.00 55.36 55.75 2hfw s GLN 195 Cb 0.02 -3.62 0.00 0.00 1.00 0.00 0.00 33.01 30.41 2hfw s GLN 195 CO 0.02 -0.23 0.00 0.41 -2.12 0.00 0.00 175.29 173.37 2hfw n GLY 196 N 4.36 4.30 3.43 3.09 0.00 0.01 -4.87 105.19 115.52 2hfw n GLY 196 Ca -0.07 -0.40 -0.21 0.00 0.00 0.00 0.00 46.02 45.35 2hfw n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hfw s SER 197 N 1.56 2.34 0.39 1.61 1.04 -1.16 -2.08 113.70 117.40 2hfw s SER 197 Ca 0.00 -1.34 -0.26 0.00 0.48 0.00 0.00 55.95 54.83 2hfw s SER 197 Cb 0.00 -0.08 -0.09 0.00 0.10 0.00 0.00 66.02 65.95 2hfw s SER 197 CO 0.00 -0.57 1.26 -0.36 0.98 0.00 0.00 173.24 174.56 2hfw s PHE 198 N -3.28 2.95 -2.12 5.02 0.40 -0.86 -4.36 117.98 115.72 2hfw s PHE 198 Ca 0.35 1.46 0.27 0.00 -0.60 0.00 0.00 56.93 58.41 2hfw s PHE 198 Cb 0.08 -3.59 0.86 0.00 0.51 0.00 0.00 43.02 40.88 2hfw s PHE 198 CO 0.14 -1.80 1.63 0.25 0.70 0.00 0.00 175.22 176.14 2hfw n THR 199 N 0.27 0.00 -4.41 0.64 -2.24 -1.26 -4.34 114.28 102.95 2hfw n THR 199 Ca 0.03 -0.19 -0.25 0.00 -2.27 0.00 0.00 64.05 61.37 2hfw n THR 199 Cb 0.44 0.48 -0.11 0.00 -2.10 0.00 0.00 70.33 69.03 2hfw n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2hfw s THR 200 N -2.27 2.22 0.31 4.28 -4.23 -1.26 -4.84 115.64 109.84 2hfw s THR 200 Ca 0.30 -2.07 -0.29 0.00 -1.18 0.00 0.00 61.69 58.45 2hfw s THR 200 Cb 0.20 -2.08 -0.13 0.00 1.34 0.00 0.00 72.50 71.83 2hfw s THR 200 CO 0.43 -0.23 1.28 -2.65 -0.54 0.00 0.00 174.62 172.91 2hfw n PRO 201 N 0.10 2.00 -0.35 3.99 -0.02 -1.26 -1.68 135.00 137.78 2hfw n PRO 201 Ca -0.11 0.70 0.07 0.00 -2.02 0.00 0.00 63.50 62.14 2hfw n PRO 201 Cb 0.57 -2.28 0.24 0.00 -0.02 0.00 0.00 33.50 32.01 2hfw n PRO 201 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2hfw n PRO 202 N 0.94 2.55 -3.15 0.52 -0.02 -1.26 -4.99 135.00 129.59 2hfw n PRO 202 Ca 0.07 -1.89 -0.14 0.00 -2.02 0.00 0.00 63.50 59.52 2hfw n PRO 202 Cb 0.34 -1.56 0.05 0.00 -0.02 0.00 0.00 33.50 32.32 2hfw n PRO 202 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hfw s GLU 204 N -5.71 4.23 -1.11 0.00 8.01 -1.26 -4.57 118.70 118.28 2hfw s GLU 204 Ca 0.33 2.23 -0.05 0.00 0.01 0.00 0.00 54.97 57.49 2hfw s GLU 204 Cb -0.14 -2.98 0.29 0.00 -4.31 0.00 0.00 34.13 26.99 2hfw s GLU 204 CO 0.45 -0.30 1.54 0.39 0.01 0.00 0.00 175.26 177.34 2hfw n GLU 205 N 0.58 4.33 0.00 1.61 1.02 -1.26 -2.04 120.64 124.88 2hfw n GLU 205 Ca 0.01 -4.40 0.00 0.00 -0.02 0.00 0.00 57.16 52.76 2hfw n GLU 205 Cb 0.42 -2.58 0.00 0.00 -0.02 0.00 0.00 31.44 29.26 2hfw n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2hfw s ILE 207 N -0.69 5.19 -0.53 0.00 1.01 -0.88 -1.61 121.20 123.68 2hfw s ILE 207 Ca 0.00 0.13 -0.27 0.00 0.00 0.00 0.00 60.65 60.50 2hfw s ILE 207 Cb 0.00 -3.46 0.03 0.00 0.01 0.00 0.00 42.46 39.04 2hfw s ILE 207 CO 0.00 0.27 1.10 -0.69 0.00 0.00 0.00 174.94 175.62 2hfw s VAL 208 N 1.66 4.19 0.02 2.92 1.01 -0.27 -0.81 120.40 129.12 2hfw s VAL 208 Ca 0.07 0.86 -0.25 0.00 0.00 0.00 0.00 61.98 62.66 2hfw s VAL 208 Cb -0.16 -4.63 -0.05 0.00 0.00 0.00 0.00 36.38 31.55 2hfw s VAL 208 CO 0.09 -1.15 0.77 0.26 0.00 0.00 0.00 175.10 175.07 2hfw s TRP 209 N 4.49 3.71 -0.43 5.22 0.52 -0.61 -2.34 118.94 129.50 2hfw s TRP 209 Ca 0.41 1.45 0.03 0.00 0.02 0.00 0.00 56.10 58.02 2hfw s TRP 209 Cb -0.09 -2.84 0.12 0.00 -1.15 0.00 0.00 33.47 29.52 2hfw s TRP 209 CO 0.26 0.23 0.17 -0.51 0.02 0.00 0.00 176.95 177.12 2hfw s LEU 210 N 0.14 4.07 -0.16 2.99 1.02 -0.11 -3.15 118.68 123.47 2hfw s LEU 210 Ca 0.39 -2.56 -0.18 0.00 0.02 0.00 0.00 54.13 51.80 2hfw s LEU 210 Cb -0.20 -1.49 -0.04 0.00 0.02 0.00 0.00 46.19 44.48 2hfw s LEU 210 CO 0.22 -0.30 0.49 -0.76 0.02 0.00 0.00 176.35 176.02 2hfw s LEU 211 N 0.35 4.21 -0.13 1.79 1.43 0.16 -1.70 118.68 124.79 2hfw s LEU 211 Ca 0.14 0.73 -0.23 0.00 -1.03 0.00 0.00 54.13 53.75 2hfw s LEU 211 Cb -0.23 -2.69 -0.03 0.00 0.03 0.00 0.00 46.19 43.28 2hfw s LEU 211 CO -0.05 -0.08 0.69 -0.76 0.23 0.00 0.00 176.35 176.38 2hfw s LEU 212 N 1.11 4.23 0.47 1.79 1.43 -0.75 0.15 118.68 127.11 2hfw s LEU 212 Ca 0.25 1.05 0.14 0.00 -1.03 0.00 0.00 54.13 54.53 2hfw s LEU 212 Cb -0.15 -3.03 1.10 0.00 0.03 0.00 0.00 46.19 44.14 2hfw s LEU 212 CO 0.10 -0.22 2.07 0.50 0.23 0.00 0.00 176.35 179.03 2hfw h LYS 213 N 7.11 0.26 -5.16 1.70 3.64 -1.67 -3.43 116.57 119.02 2hfw h LYS 213 Ca -0.35 -0.02 -0.61 0.00 -1.27 0.00 0.00 60.65 58.40 2hfw h LYS 213 Cb 1.16 -0.06 -0.14 0.00 -0.41 0.00 0.00 32.23 32.79 2hfw h LYS 213 CO 0.78 0.17 -0.49 -2.00 -2.27 0.00 0.00 179.45 175.64 2hfw s GLU 214 N -5.27 4.11 0.16 1.90 2.12 -1.26 -5.04 118.70 115.43 2hfw s GLU 214 Ca -0.07 -0.24 -0.24 0.00 0.36 0.00 0.00 54.97 54.79 2hfw s GLU 214 Cb 0.18 -3.50 -0.08 0.00 0.26 0.00 0.00 34.13 30.99 2hfw s GLU 214 CO 0.71 0.14 0.74 -1.25 -0.54 0.00 0.00 175.26 175.07 2hfw s PRO 215 N 0.82 4.48 -0.09 4.30 0.04 -1.26 -4.66 135.00 138.64 2hfw s PRO 215 Ca 0.08 1.07 -0.28 0.00 0.04 0.00 0.00 61.00 61.91 2hfw s PRO 215 Cb -0.13 -3.21 -0.02 0.00 0.04 0.00 0.00 34.50 31.19 2hfw s PRO 215 CO 0.02 0.56 0.93 0.00 0.04 0.00 0.00 177.00 178.55 2hfw s MET 216 N -1.25 4.43 0.33 4.56 0.23 -0.75 -4.88 119.30 121.96 2hfw s MET 216 Ca 0.36 1.27 -0.20 0.00 -1.03 0.00 0.00 55.69 56.08 2hfw s MET 216 Cb -0.22 -3.52 -0.10 0.00 -1.53 0.00 0.00 34.83 29.47 2hfw s MET 216 CO 0.25 -0.22 0.83 0.95 -2.03 0.00 0.00 175.02 174.80 2hfw s THR 217 N 1.68 4.48 0.25 3.16 -4.23 -1.26 -2.55 115.64 117.17 2hfw s THR 217 Ca 0.46 1.35 -0.11 0.00 -1.18 0.00 0.00 61.69 62.21 2hfw s THR 217 Cb -0.18 -3.75 -0.01 0.00 1.34 0.00 0.00 72.50 69.90 2hfw s THR 217 CO 0.19 -0.06 0.45 0.54 -0.54 0.00 0.00 174.62 175.20 2hfw s VAL 218 N -1.85 0.00 0.05 2.29 0.11 -0.64 -4.39 120.40 115.98 2hfw s VAL 218 Ca 0.53 -1.47 -0.00 0.00 -2.93 0.00 0.00 61.98 58.10 2hfw s VAL 218 Cb -0.13 -2.28 -0.04 0.00 -1.53 0.00 0.00 36.38 32.40 2hfw s VAL 218 CO 0.18 0.00 0.19 -0.94 -3.33 0.00 0.00 175.10 171.21 2hfw s SER 219 N -3.05 6.28 0.47 3.54 1.04 -1.25 0.15 113.70 120.89 2hfw s SER 219 Ca 0.25 0.25 0.17 0.00 0.48 0.00 0.00 55.95 57.10 2hfw s SER 219 Cb 0.00 -1.92 1.15 0.00 0.10 0.00 0.00 66.02 65.35 2hfw s SER 219 CO 0.10 0.18 2.02 0.28 0.98 0.00 0.00 173.24 176.80 2hfw h SER 220 N 3.20 0.22 0.98 7.02 0.02 -1.96 0.89 113.55 123.91 2hfw h SER 220 Ca -0.46 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.28 2hfw h SER 220 Cb 1.16 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.63 2hfw h SER 220 CO 0.74 0.13 -1.02 0.44 -1.14 0.00 0.00 176.83 175.99 2hfw h ASP 221 N 0.24 0.01 -0.43 3.07 3.45 -1.95 -2.41 116.42 118.40 2hfw h ASP 221 Ca 0.21 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.65 2hfw h ASP 221 Cb 0.53 -0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.27 2hfw h ASP 221 CO -0.04 1.01 0.24 1.56 -1.57 0.00 0.00 179.24 180.43 2hfw h GLN 222 N 0.00 0.64 0.00 3.56 4.20 -1.32 -2.94 115.11 119.26 2hfw h GLN 222 Ca -0.02 -0.07 -0.15 0.00 0.06 0.00 0.00 58.65 58.48 2hfw h GLN 222 Cb 1.78 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 29.41 2hfw h GLN 222 CO 0.13 0.49 -0.70 0.52 -0.67 0.00 0.00 178.83 178.61 2hfw h MET 223 N 0.65 0.00 0.00 1.46 2.86 -0.68 -3.16 114.93 116.06 2hfw h MET 223 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2hfw h MET 223 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 2hfw h MET 223 CO -0.02 0.70 -0.49 0.00 1.06 0.00 0.00 176.91 178.15 2hfw h ALA 224 N 1.30 0.71 -0.03 6.32 0.00 -1.35 -2.67 119.26 123.54 2hfw h ALA 224 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2hfw h ALA 224 Cb 1.28 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2hfw h ALA 224 CO 0.09 0.00 -0.51 -0.22 0.00 0.00 0.00 179.25 178.61 2hfw h LYS 225 N 0.00 0.09 -0.08 0.00 3.64 -1.49 -3.00 116.57 115.73 2hfw h LYS 225 Ca 0.00 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.20 2hfw h LYS 225 Cb 0.86 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 2hfw h LYS 225 CO 0.00 0.58 -0.55 1.25 -2.27 0.00 0.00 179.45 178.46 2hfw h LEU 226 N 0.07 0.25 0.00 5.20 5.85 -1.52 -3.22 115.31 121.94 2hfw h LEU 226 Ca -0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2hfw h LEU 226 Cb 0.93 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.89 2hfw h LEU 226 CO 0.07 0.75 0.00 -1.14 -0.34 0.00 0.00 178.44 177.78 2hfw n ARG 227 N -3.91 0.99 -0.11 1.25 0.63 -1.02 -3.44 116.66 111.04 2hfw n ARG 227 Ca -0.02 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.75 2hfw n ARG 227 Cb 0.58 -1.06 -0.10 0.00 0.45 0.00 0.00 32.46 32.32 2hfw n ARG 227 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2hfw n SER 228 N -0.56 2.22 -2.92 6.15 3.41 -1.18 -4.60 113.62 116.13 2hfw n SER 228 Ca 0.03 -0.10 -0.27 0.00 -0.26 0.00 0.00 58.87 58.27 2hfw n SER 228 Cb 0.01 -0.37 0.03 0.00 -0.26 0.00 0.00 64.21 63.62 2hfw n SER 228 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2hfw n LEU 229 N -3.21 -4.05 -4.19 1.04 4.77 -1.22 -4.61 117.00 105.53 2hfw n LEU 229 Ca -0.40 0.11 -0.11 0.00 -0.03 0.00 0.00 56.01 55.57 2hfw n LEU 229 Cb 0.92 -0.52 -0.10 0.00 -2.33 0.00 0.00 43.42 41.39 2hfw n LEU 229 CO 0.22 -3.99 -0.33 -0.76 -1.33 0.00 0.00 177.39 171.20 2hfw s LEU 230 N 5.85 2.06 -0.12 2.23 1.43 -0.85 -2.16 118.68 127.11 2hfw s LEU 230 Ca 0.29 -1.16 0.18 0.00 -1.03 0.00 0.00 54.13 52.41 2hfw s LEU 230 Cb -0.10 0.09 0.27 0.00 0.03 0.00 0.00 46.19 46.49 2hfw s LEU 230 CO 0.59 -0.62 1.14 -1.54 0.23 0.00 0.00 176.35 176.15 2hfw n SER 231 N -0.14 2.28 -4.33 2.29 3.41 0.29 -3.49 113.62 113.93 2hfw n SER 231 Ca -0.07 -3.02 -0.33 0.00 -0.26 0.00 0.00 58.87 55.19 2hfw n SER 231 Cb 0.63 -0.41 -0.15 0.00 -0.26 0.00 0.00 64.21 64.02 2hfw n SER 231 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2hfw s SER 232 N -2.76 3.71 0.53 4.04 1.04 -1.25 -4.79 113.70 114.22 2hfw s SER 232 Ca 0.30 -0.39 -0.03 0.00 0.48 0.00 0.00 55.95 56.31 2hfw s SER 232 Cb 0.26 -1.46 0.05 0.00 0.10 0.00 0.00 66.02 64.97 2hfw s SER 232 CO 0.03 0.18 0.11 0.00 0.98 0.00 0.00 173.24 174.54 2hfw n ALA 233 N 3.41 -0.65 -0.01 5.32 0.00 -1.26 -4.16 120.51 123.16 2hfw n ALA 233 Ca -0.18 -0.19 -0.02 0.00 0.00 0.00 0.00 53.44 53.05 2hfw n ALA 233 Cb 0.53 -0.02 -0.01 0.00 0.00 0.00 0.00 19.45 19.95 2hfw n ALA 233 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2hfw h GLU 234 N 0.00 -0.10 0.00 0.00 5.08 -1.96 -3.17 114.58 114.44 2hfw h GLU 234 Ca -0.05 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2hfw h GLU 234 Cb 0.16 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2hfw h GLU 234 CO 0.03 -0.01 0.00 0.27 -1.00 0.00 0.00 179.01 178.30 2hfw n ASN 235 N -4.84 0.00 -4.60 1.42 6.94 -1.26 -4.68 115.26 108.25 2hfw n ASN 235 Ca -0.02 -0.01 -0.29 0.00 -0.02 0.00 0.00 54.58 54.24 2hfw n ASN 235 Cb 0.06 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 37.39 2hfw n ASN 235 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2hfw s GLU 236 N -2.00 2.04 -0.22 -3.83 2.02 -1.20 -5.08 118.70 110.43 2hfw s GLU 236 Ca 0.00 -2.24 -0.29 0.00 0.02 0.00 0.00 54.97 52.46 2hfw s GLU 236 Cb 0.00 -1.36 -0.03 0.00 0.10 0.00 0.00 34.13 32.85 2hfw s GLU 236 CO 0.00 -0.27 1.58 -2.14 0.02 0.00 0.00 175.26 174.44 2hfw s PRO 237 N -3.81 3.85 0.00 0.39 0.02 -1.26 -4.83 135.00 129.35 2hfw s PRO 237 Ca 0.20 1.66 0.00 0.00 0.02 0.00 0.00 61.00 62.87 2hfw s PRO 237 Cb 0.05 -4.01 0.00 0.00 0.02 0.00 0.00 34.50 30.56 2hfw s PRO 237 CO 0.10 -1.23 0.00 -0.35 -0.33 0.00 0.00 177.00 175.19 2hfw n PRO 238 N 7.56 0.00 -3.65 5.54 -0.04 -1.26 -4.59 135.00 138.56 2hfw n PRO 238 Ca 0.18 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.64 2hfw n PRO 238 Cb 0.45 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.85 2hfw n PRO 238 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2hfw s VAL 239 N 0.00 0.00 0.53 0.52 1.01 -1.26 -4.85 120.40 116.34 2hfw s VAL 239 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 61.98 61.78 2hfw s VAL 239 Cb 0.00 -1.00 -0.07 0.00 0.00 0.00 0.00 36.38 35.31 2hfw s VAL 239 CO 0.00 0.00 1.09 -2.16 0.00 0.00 0.00 175.10 174.03 2hfw s PRO 240 N 1.16 3.51 -0.62 2.72 0.04 -1.26 0.11 135.00 140.66 2hfw s PRO 240 Ca -0.08 1.50 -0.16 0.00 0.04 0.00 0.00 61.00 62.30 2hfw s PRO 240 Cb -0.03 -2.04 0.15 0.00 0.04 0.00 0.00 34.50 32.62 2hfw s PRO 240 CO -0.12 -0.70 0.60 -1.17 0.04 0.00 0.00 177.00 175.64 2hfw s LEU 241 N -3.72 6.21 -0.06 -3.56 2.96 -0.92 -4.63 118.68 114.95 2hfw s LEU 241 Ca 0.70 -1.96 0.12 0.00 -0.22 0.00 0.00 54.13 52.77 2hfw s LEU 241 Cb -0.21 -2.22 -0.17 0.00 0.50 0.00 0.00 46.19 44.09 2hfw s LEU 241 CO 0.25 -0.83 0.17 1.33 -1.32 0.00 0.00 176.35 175.95 2hfw n VAL 242 N 5.00 0.36 -3.82 1.68 0.24 -1.26 -4.71 118.33 115.82 2hfw n VAL 242 Ca -0.06 -0.38 -0.12 0.00 -2.04 0.00 0.00 64.34 61.73 2hfw n VAL 242 Cb 0.42 -0.20 -0.10 0.00 -1.47 0.00 0.00 33.84 32.49 2hfw n VAL 242 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2hfw s SER 243 N -3.89 -0.12 -0.20 -1.34 1.04 -1.26 -2.93 113.70 105.00 2hfw s SER 243 Ca -0.05 0.11 0.15 0.00 0.48 0.00 0.00 55.95 56.64 2hfw s SER 243 Cb 0.06 0.33 0.36 0.00 0.10 0.00 0.00 66.02 66.87 2hfw s SER 243 CO 0.50 -0.27 1.26 -0.46 0.98 0.00 0.00 173.24 175.25 2hfw n ASN 244 N 2.01 -0.17 -4.76 7.02 6.94 0.79 -4.85 115.26 122.25 2hfw n ASN 244 Ca -0.19 -2.09 -0.29 0.00 -0.02 0.00 0.00 54.58 52.00 2hfw n ASN 244 Cb 0.57 0.14 -0.07 0.00 -2.36 0.00 0.00 39.78 38.06 2hfw n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 2hfw s TRP 245 N -1.01 3.12 0.13 -2.53 1.48 -1.26 -4.56 118.94 114.31 2hfw s TRP 245 Ca 0.16 0.02 0.07 0.00 -1.06 0.00 0.00 56.10 55.29 2hfw s TRP 245 Cb 0.32 -1.56 -0.04 0.00 -1.16 0.00 0.00 33.47 31.03 2hfw s TRP 245 CO -0.08 0.51 -0.08 0.50 -4.06 0.00 0.00 176.95 173.74 2hfw s ARG 246 N -2.59 2.18 0.30 3.25 3.52 -1.26 -5.04 118.95 119.31 2hfw s ARG 246 Ca 0.29 -1.09 0.05 0.00 -0.13 0.00 0.00 55.73 54.85 2hfw s ARG 246 Cb -0.11 -2.29 -0.02 0.00 -1.56 0.00 0.00 34.95 30.96 2hfw s ARG 246 CO 0.21 0.48 0.44 -2.14 -0.81 0.00 0.00 175.30 173.48 2hfw s PRO 247 N -2.49 3.29 0.32 5.12 0.02 -1.26 -4.64 135.00 135.35 2hfw s PRO 247 Ca 0.23 -0.82 -0.29 0.00 0.02 0.00 0.00 61.00 60.15 2hfw s PRO 247 Cb -0.10 -2.83 -0.10 0.00 0.02 0.00 0.00 34.50 31.49 2hfw s PRO 247 CO 0.15 0.22 1.23 -2.14 -0.33 0.00 0.00 177.00 176.13 2hfw s PRO 248 N -4.12 4.45 0.35 5.54 0.02 -1.26 -4.49 135.00 135.49 2hfw s PRO 248 Ca 0.40 2.06 0.04 0.00 0.02 0.00 0.00 61.00 63.52 2hfw s PRO 248 Cb -0.09 -3.10 0.04 0.00 0.02 0.00 0.00 34.50 31.37 2hfw s PRO 248 CO 0.31 -0.05 0.37 1.04 -0.33 0.00 0.00 177.00 178.34 2hfw n GLN 249 N 0.91 0.88 -2.88 5.54 1.13 -0.57 -4.96 117.38 117.43 2hfw n GLN 249 Ca -0.00 -2.07 -0.41 0.00 -1.94 0.00 0.00 57.00 52.58 2hfw n GLN 249 Cb 0.43 0.06 -0.04 0.00 0.11 0.00 0.00 30.24 30.80 2hfw n GLN 249 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2hfw s PRO 250 N -3.53 4.45 0.53 -1.09 0.04 -1.26 -4.67 135.00 129.47 2hfw s PRO 250 Ca 0.28 1.11 0.28 0.00 0.04 0.00 0.00 61.00 62.71 2hfw s PRO 250 Cb -0.02 -3.48 1.48 0.00 0.04 0.00 0.00 34.50 32.51 2hfw s PRO 250 CO 0.18 -0.08 2.08 0.82 0.04 0.00 0.00 177.00 180.04 2hfw h ILE 251 N 4.88 0.54 0.00 0.56 2.04 -1.92 -3.42 117.51 120.19 2hfw h ILE 251 Ca -0.38 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 64.98 2hfw h ILE 251 Cb 1.19 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 2hfw h ILE 251 CO 0.78 0.11 0.00 0.59 0.00 0.00 0.00 178.15 179.62 2hfw n ASN 252 N -3.62 0.00 -2.42 1.72 5.03 -1.26 -2.09 115.26 112.62 2hfw n ASN 252 Ca -0.02 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.13 2hfw n ASN 252 Cb 0.23 0.00 0.03 0.00 -1.02 0.00 0.00 39.78 39.02 2hfw n ASN 252 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2hfw n ASN 253 N 1.39 7.12 -4.76 6.41 5.03 -1.26 -5.02 115.26 124.17 2hfw n ASN 253 Ca 0.00 -3.51 -0.36 0.00 0.87 0.00 0.00 54.58 51.57 2hfw n ASN 253 Cb 0.00 -1.08 -0.07 0.00 -1.02 0.00 0.00 39.78 37.61 2hfw n ASN 253 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2hfw s ARG 254 N -2.97 4.09 -0.41 3.52 0.52 -0.89 -5.05 118.95 117.76 2hfw s ARG 254 Ca 0.53 0.03 -0.21 0.00 -0.52 0.00 0.00 55.73 55.56 2hfw s ARG 254 Cb 0.41 -3.37 0.02 0.00 0.52 0.00 0.00 34.95 32.52 2hfw s ARG 254 CO -0.16 0.37 0.68 0.08 0.02 0.00 0.00 175.30 176.29 2hfw s VAL 255 N 0.08 4.80 -0.32 3.52 1.01 -1.26 -5.04 120.40 123.19 2hfw s VAL 255 Ca 0.15 0.38 -0.22 0.00 0.00 0.00 0.00 61.98 62.29 2hfw s VAL 255 Cb -0.13 -4.19 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 2hfw s VAL 255 CO 0.04 -0.52 0.72 -0.69 0.00 0.00 0.00 175.10 174.64 2hfw s VAL 256 N 2.91 4.84 0.02 2.92 1.01 -1.26 -4.75 120.40 126.09 2hfw s VAL 256 Ca 0.25 0.97 0.00 0.00 0.00 0.00 0.00 61.98 63.21 2hfw s VAL 256 Cb -0.14 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 2hfw s VAL 256 CO 0.18 -0.25 0.10 -0.13 0.00 0.00 0.00 175.10 175.00 2hfw s ARG 257 N 2.84 3.07 0.05 2.72 0.52 -1.17 -3.89 118.95 123.09 2hfw s ARG 257 Ca 0.29 -0.53 0.05 0.00 -0.52 0.00 0.00 55.73 55.02 2hfw s ARG 257 Cb -0.14 -2.85 -0.04 0.00 0.52 0.00 0.00 34.95 32.44 2hfw s ARG 257 CO 0.13 0.62 -0.07 0.00 0.02 0.00 0.00 175.30 176.00 2hfw s ALA 258 N -1.28 3.03 -0.89 2.13 0.00 -0.97 -1.74 121.76 122.03 2hfw s ALA 258 Ca 0.26 -1.11 0.26 0.00 0.00 0.00 0.00 51.96 51.37 2hfw s ALA 258 Cb -0.12 -1.06 1.02 0.00 0.00 0.00 0.00 23.12 22.96 2hfw s ALA 258 CO 0.18 0.64 1.81 -1.13 0.00 0.00 0.00 175.76 177.25 2hfw n SER 259 N 1.13 0.28 -3.98 0.00 3.41 0.19 -2.29 113.62 112.36 2hfw n SER 259 Ca -0.14 0.53 -0.11 0.00 -0.26 0.00 0.00 58.87 58.89 2hfw n SER 259 Cb 0.52 -0.61 -0.12 0.00 -0.26 0.00 0.00 64.21 63.75 2hfw n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2hfw s PHE 260 N -3.05 0.34 -2.17 7.33 -0.71 -1.26 -4.85 117.98 113.61 2hfw s PHE 260 Ca 0.11 -0.39 0.31 0.00 -1.04 0.00 0.00 56.93 55.92 2hfw s PHE 260 Cb 0.15 -0.22 1.62 0.00 -1.21 0.00 0.00 43.02 43.36 2hfw s PHE 260 CO 0.50 -0.11 2.07 1.63 -1.34 0.00 0.00 175.22 177.97