#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vhj s ILE 2 N 0.00 4.94 -0.00 3.17 -4.36 -1.26 -5.10 121.20 118.58 2vhj s ILE 2 Ca 0.00 0.31 0.03 0.00 -0.26 0.00 0.00 60.65 60.73 2vhj s ILE 2 Cb 0.00 -3.70 -0.01 0.00 1.25 0.00 0.00 42.46 40.00 2vhj s ILE 2 CO 0.00 -0.30 -0.10 -1.00 0.24 0.00 0.00 174.94 173.78 2vhj s HIS 3 N -2.08 0.91 -0.11 1.37 3.76 -1.26 -4.84 115.29 113.04 2vhj s HIS 3 Ca 0.47 -0.18 -0.05 0.00 -0.15 0.00 0.00 55.06 55.14 2vhj s HIS 3 Cb -0.11 -0.58 -0.04 0.00 1.11 0.00 0.00 32.58 32.96 2vhj s HIS 3 CO 0.28 -0.01 0.11 -0.51 -0.85 0.00 0.00 174.74 173.75 2vhj s LEU 4 N -0.31 4.18 0.05 0.89 1.43 -1.26 -5.11 118.68 118.55 2vhj s LEU 4 Ca 0.03 0.38 0.02 0.00 -1.03 0.00 0.00 54.13 53.54 2vhj s LEU 4 Cb -0.04 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2vhj s LEU 4 CO -0.00 0.40 -0.08 -0.31 0.23 0.00 0.00 176.35 176.58 2vhj s TYR 5 N -1.01 0.72 0.38 0.29 2.02 -1.26 -4.97 117.35 113.53 2vhj s TYR 5 Ca 0.15 -0.50 0.01 0.00 -0.37 0.00 0.00 57.07 56.36 2vhj s TYR 5 Cb -0.12 -0.43 0.01 0.00 -0.40 0.00 0.00 41.96 41.03 2vhj s TYR 5 CO 0.04 -0.07 0.10 -0.40 -1.57 0.00 0.00 175.55 173.65 2vhj n ASP 6 N 1.43 2.78 -0.24 2.29 5.68 -1.26 -4.95 116.55 122.28 2vhj n ASP 6 Ca -0.23 -2.54 0.01 0.00 -0.50 0.00 0.00 54.79 51.53 2vhj n ASP 6 Cb 0.55 0.17 0.14 0.00 -1.14 0.00 0.00 41.12 40.83 2vhj n ASP 6 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2vhj h ALA 7 N 1.03 0.96 -0.05 2.12 0.00 -2.01 -0.19 119.26 121.12 2vhj h ALA 7 Ca -0.29 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2vhj h ALA 7 Cb 0.93 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2vhj h ALA 7 CO 0.47 -0.07 -0.01 0.87 0.00 0.00 0.00 179.25 180.51 2vhj h LYS 8 N 0.57 0.10 0.00 0.00 1.57 -1.99 -1.43 116.57 115.38 2vhj h LYS 8 Ca 0.35 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 59.00 2vhj h LYS 8 Cb 0.38 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2vhj h LYS 8 CO -0.28 0.41 -0.42 0.66 -0.57 0.00 0.00 179.45 179.25 2vhj h SER 9 N -0.23 0.00 -0.30 0.86 4.64 -1.93 -2.49 113.55 114.10 2vhj h SER 9 Ca 0.01 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 2vhj h SER 9 Cb 0.37 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2vhj h SER 9 CO 0.00 0.42 -0.06 0.15 -0.87 0.00 0.00 176.83 176.48 2vhj h PHE 10 N 0.00 0.64 -0.90 4.77 3.57 -0.97 -1.72 116.94 122.34 2vhj h PHE 10 Ca -0.00 -0.13 0.06 0.00 3.53 0.00 0.00 57.97 61.42 2vhj h PHE 10 Cb 0.91 -0.16 -0.06 0.00 2.79 0.00 0.00 35.95 39.44 2vhj h PHE 10 CO 0.00 0.76 0.58 0.00 -2.23 0.00 0.00 178.31 177.42 2vhj h ALA 11 N 0.80 1.51 -0.48 2.41 0.00 -1.11 -0.94 119.26 121.45 2vhj h ALA 11 Ca 0.08 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2vhj h ALA 11 Cb 0.54 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2vhj h ALA 11 CO 0.03 0.36 0.06 0.87 0.00 0.00 0.00 179.25 180.57 2vhj h LYS 12 N 1.02 0.81 -0.24 0.00 1.57 -1.34 -1.92 116.57 116.48 2vhj h LYS 12 Ca 0.38 -0.23 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2vhj h LYS 12 Cb 0.19 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2vhj h LYS 12 CO -0.14 0.82 0.13 1.25 -0.57 0.00 0.00 179.45 180.94 2vhj h LEU 13 N 0.68 0.20 -1.12 2.94 5.85 -0.58 -0.91 115.31 122.37 2vhj h LEU 13 Ca 0.14 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 2vhj h LEU 13 Cb 0.41 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 2vhj h LEU 13 CO 0.01 0.15 -0.03 0.03 -0.34 0.00 0.00 178.44 178.26 2vhj h ARG 14 N 0.27 0.58 -0.49 1.25 2.47 -1.07 0.14 114.38 117.53 2vhj h ARG 14 Ca 0.09 -0.14 -0.04 0.00 -1.26 0.00 0.00 59.98 58.64 2vhj h ARG 14 Cb 0.01 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.24 2vhj h ARG 14 CO -0.06 0.63 0.17 0.00 0.56 0.00 0.00 179.97 181.27 2vhj h ALA 15 N 1.42 0.64 -0.47 0.04 0.00 -1.10 -0.13 119.26 119.66 2vhj h ALA 15 Ca 0.11 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2vhj h ALA 15 Cb 0.40 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2vhj h ALA 15 CO 0.02 0.28 -0.03 0.00 0.00 0.00 0.00 179.25 179.52 2vhj h ALA 16 N 1.02 0.64 -0.38 0.00 0.00 -0.43 -1.00 119.26 119.11 2vhj h ALA 16 Ca 0.16 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2vhj h ALA 16 Cb 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2vhj h ALA 16 CO -0.01 0.46 0.14 1.96 0.00 0.00 0.00 179.25 181.80 2vhj h GLN 17 N 0.70 0.58 -0.41 0.00 4.20 -0.67 -1.07 115.11 118.43 2vhj h GLN 17 Ca 0.13 -0.11 0.05 0.00 0.06 0.00 0.00 58.65 58.78 2vhj h GLN 17 Cb 0.54 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 2vhj h GLN 17 CO 0.03 0.57 0.14 -0.92 -0.67 0.00 0.00 178.83 177.97 2vhj h TYR 18 N 0.47 0.24 -0.58 2.96 5.03 -0.90 -2.16 116.97 122.03 2vhj h TYR 18 Ca 0.13 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.44 2vhj h TYR 18 Cb 0.21 -0.05 -0.03 0.00 1.55 0.00 0.00 36.73 38.42 2vhj h TYR 18 CO 0.00 0.09 0.29 0.00 -1.32 0.00 0.00 178.16 177.22 2vhj h ALA 19 N 1.27 1.43 -0.07 1.82 0.00 -0.95 0.13 119.26 122.88 2vhj h ALA 19 Ca 0.19 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2vhj h ALA 19 Cb 0.19 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2vhj h ALA 19 CO -0.20 0.46 0.05 0.00 0.00 0.00 0.00 179.25 179.56 2vhj h ALA 20 N 1.52 2.04 0.00 0.00 0.00 -0.52 -0.67 119.26 121.63 2vhj h ALA 20 Ca 0.20 -0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.73 2vhj h ALA 20 Cb 0.06 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 2vhj h ALA 20 CO -0.03 -0.09 -2.10 0.34 0.00 0.00 0.00 179.25 177.37 2vhj n PHE 21 N -4.47 0.38 0.02 0.00 7.35 -0.99 -1.55 117.46 118.20 2vhj n PHE 21 Ca -0.01 0.16 -0.09 0.00 -0.76 0.00 0.00 57.45 56.75 2vhj n PHE 21 Cb 0.16 -1.04 -0.13 0.00 0.35 0.00 0.00 39.48 38.82 2vhj n PHE 21 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2vhj h HIS 22 N -0.92 0.06 0.00 -5.13 3.86 -0.84 -3.41 115.15 108.76 2vhj h HIS 22 Ca -0.57 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 58.60 2vhj h HIS 22 Cb 1.54 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.01 2vhj h HIS 22 CO -0.02 1.05 -0.71 0.25 0.86 0.00 0.00 177.93 179.37 2vhj n THR 23 N -3.22 0.00 -1.65 2.45 -2.24 -0.76 -5.04 114.28 103.82 2vhj n THR 23 Ca -0.10 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.30 2vhj n THR 23 Cb 1.01 0.09 0.06 0.00 -2.10 0.00 0.00 70.33 69.38 2vhj n THR 23 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2vhj n ASP 24 N -1.19 1.24 -4.72 3.42 9.92 -0.33 -4.90 116.55 119.99 2vhj n ASP 24 Ca 0.00 0.82 -0.42 0.00 -0.53 0.00 0.00 54.79 54.66 2vhj n ASP 24 Cb 0.09 -1.45 -0.03 0.00 -0.64 0.00 0.00 41.12 39.09 2vhj n ASP 24 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2vhj s ALA 25 N -1.46 3.91 0.23 2.24 0.00 -1.26 -4.90 121.76 120.52 2vhj s ALA 25 Ca 0.77 1.56 -0.32 0.00 0.00 0.00 0.00 51.96 53.97 2vhj s ALA 25 Cb -0.41 -3.70 -0.13 0.00 0.00 0.00 0.00 23.12 18.88 2vhj s ALA 25 CO 0.45 -0.94 1.47 -2.30 0.00 0.00 0.00 175.76 174.44 2vhj n PRO 26 N 4.16 2.15 -0.84 0.00 -0.02 -1.26 -1.44 135.00 137.74 2vhj n PRO 26 Ca 0.16 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 2vhj n PRO 26 Cb 0.36 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 2vhj n PRO 26 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vhj n GLY 27 N 2.45 1.27 0.20 -1.23 0.00 -0.54 -4.82 105.19 102.51 2vhj n GLY 27 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 2vhj n GLY 27 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2vhj h SER 28 N 0.00 0.21 -0.45 1.61 4.64 -1.45 -2.88 113.55 115.22 2vhj h SER 28 Ca 0.00 -0.08 -0.10 0.00 -0.47 0.00 0.00 61.79 61.14 2vhj h SER 28 Cb 0.00 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 2vhj h SER 28 CO 0.00 0.59 -0.09 -0.25 -0.87 0.00 0.00 176.83 176.21 2vhj h TRP 29 N 0.17 0.96 -0.61 4.77 2.91 -1.83 -1.19 115.95 121.13 2vhj h TRP 29 Ca 0.02 -0.20 0.09 0.00 1.13 0.00 0.00 58.89 59.93 2vhj h TRP 29 Cb 0.77 -0.24 -0.07 0.00 -0.51 0.00 0.00 29.16 29.12 2vhj h TRP 29 CO 0.01 0.95 0.24 0.35 -1.03 0.00 0.00 178.44 178.96 2vhj h PHE 30 N 0.69 0.41 -0.43 2.65 3.57 -1.60 0.11 116.94 122.34 2vhj h PHE 30 Ca 0.12 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 2vhj h PHE 30 Cb 0.63 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 2vhj h PHE 30 CO 0.05 0.12 -0.03 -0.44 -2.23 0.00 0.00 178.31 175.78 2vhj h ASP 31 N 0.42 0.69 -0.12 0.41 3.32 -1.27 -0.08 116.42 119.80 2vhj h ASP 31 Ca 0.30 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 2vhj h ASP 31 Cb 0.36 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 2vhj h ASP 31 CO -0.29 0.78 0.03 -0.74 -1.72 0.00 0.00 179.24 177.30 2vhj h HIS 32 N 0.67 0.19 0.00 4.55 2.76 -0.09 -2.45 115.15 120.79 2vhj h HIS 32 Ca 0.13 -0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.19 2vhj h HIS 32 Cb 0.46 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.35 2vhj h HIS 32 CO 0.02 0.33 -0.44 1.79 -1.30 0.00 0.00 177.93 178.33 2vhj h THR 33 N -0.00 1.18 -0.98 6.26 1.35 -0.57 -0.85 112.91 119.30 2vhj h THR 33 Ca 0.04 -1.58 0.03 0.00 -0.55 0.00 0.00 66.41 64.35 2vhj h THR 33 Cb 0.23 1.88 -0.06 0.00 -1.73 0.00 0.00 68.15 68.48 2vhj h THR 33 CO -0.00 0.43 0.64 0.28 -0.25 0.00 0.00 175.52 176.62 2vhj h SER 34 N 0.00 1.08 -0.54 5.36 0.02 -0.94 -0.02 113.55 118.52 2vhj h SER 34 Ca -0.00 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.86 2vhj h SER 34 Cb 0.85 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.11 2vhj h SER 34 CO 0.06 0.75 0.05 1.23 -1.14 0.00 0.00 176.83 177.78 2vhj h GLY 35 N 1.26 0.98 0.97 -3.77 0.00 -0.74 -0.38 103.07 101.40 2vhj h GLY 35 Ca 0.38 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 2vhj h GLY 35 CO -0.11 0.63 0.10 -2.08 0.00 0.00 0.00 176.54 175.08 2vhj h VAL 36 N 0.79 1.07 -0.80 4.60 2.07 -0.83 -2.53 116.25 120.62 2vhj h VAL 36 Ca 0.16 -0.16 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 2vhj h VAL 36 Cb 0.46 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 2vhj h VAL 36 CO 0.02 0.06 0.31 -0.07 0.02 0.00 0.00 177.57 177.91 2vhj h LEU 37 N 0.20 1.10 -1.75 2.57 3.38 -0.84 -2.50 115.31 117.47 2vhj h LEU 37 Ca 0.06 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2vhj h LEU 37 Cb 0.01 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.47 2vhj h LEU 37 CO -0.01 0.98 -0.16 -0.33 0.09 0.00 0.00 178.44 179.00 2vhj h GLU 38 N 1.16 0.00 -0.01 1.13 5.08 -0.94 -2.77 114.58 118.22 2vhj h GLU 38 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 2vhj h GLU 38 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2vhj h GLU 38 CO -0.02 0.16 -0.07 -1.13 -1.00 0.00 0.00 179.01 176.96 2vhj n SER 39 N -3.83 1.47 -4.77 1.42 3.41 -0.95 -4.90 113.62 105.48 2vhj n SER 39 Ca -0.02 -1.38 -0.39 0.00 -0.26 0.00 0.00 58.87 56.83 2vhj n SER 39 Cb 0.26 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 2vhj n SER 39 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2vhj s VAL 40 N -2.13 2.64 0.47 -3.33 1.01 -1.05 -4.97 120.40 113.04 2vhj s VAL 40 Ca 0.34 0.53 -0.24 0.00 0.00 0.00 0.00 61.98 62.61 2vhj s VAL 40 Cb 0.20 -3.30 -0.07 0.00 0.00 0.00 0.00 36.38 33.22 2vhj s VAL 40 CO 0.38 0.05 1.31 -1.61 0.00 0.00 0.00 175.10 175.23 2vhj s GLU 41 N -2.45 3.61 0.23 2.72 2.02 -1.26 -4.91 118.70 118.66 2vhj s GLU 41 Ca 0.61 2.14 -0.30 0.00 0.02 0.00 0.00 54.97 57.43 2vhj s GLU 41 Cb -0.36 -2.50 -0.15 0.00 0.10 0.00 0.00 34.13 31.22 2vhj s GLU 41 CO 0.46 -0.78 1.10 -0.25 0.02 0.00 0.00 175.26 175.81 2vhj n ASP 42 N -0.43 1.38 0.00 -0.19 9.92 -1.26 -1.85 116.55 124.13 2vhj n ASP 42 Ca 0.07 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.49 2vhj n ASP 42 Cb 0.45 -1.26 0.00 0.00 -0.64 0.00 0.00 41.12 39.67 2vhj n ASP 42 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2vhj n GLY 43 N 1.67 1.84 3.70 0.44 0.00 -1.26 -5.01 105.19 106.56 2vhj n GLY 43 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2vhj n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vhj s THR 44 N -3.52 3.62 0.22 2.61 2.01 -0.77 -4.97 115.64 114.83 2vhj s THR 44 Ca 0.00 1.06 -0.32 0.00 0.31 0.00 0.00 61.69 62.74 2vhj s THR 44 Cb 0.00 -3.68 -0.13 0.00 0.01 0.00 0.00 72.50 68.70 2vhj s THR 44 CO 0.00 0.02 1.59 -2.65 -0.69 0.00 0.00 174.62 172.89 2vhj n PRO 45 N 5.01 2.42 0.00 4.92 -0.02 -1.26 -4.27 135.00 141.79 2vhj n PRO 45 Ca 0.13 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 2vhj n PRO 45 Cb 0.43 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 2vhj n PRO 45 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2vhj n VAL 46 N 3.03 0.00 -3.73 -1.45 0.24 -0.29 -4.39 118.33 111.75 2vhj n VAL 46 Ca 0.14 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.32 2vhj n VAL 46 Cb 0.33 0.13 -0.11 0.00 -1.47 0.00 0.00 33.84 32.71 2vhj n VAL 46 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2vhj s LEU 47 N -3.22 0.38 -0.04 1.34 2.96 -1.13 -0.17 118.68 118.79 2vhj s LEU 47 Ca 0.00 0.70 0.05 0.00 -0.22 0.00 0.00 54.13 54.66 2vhj s LEU 47 Cb 0.00 1.09 -0.01 0.00 0.50 0.00 0.00 46.19 47.77 2vhj s LEU 47 CO 0.00 -0.15 -0.19 0.00 -1.32 0.00 0.00 176.35 174.68 2vhj s ALA 48 N 0.88 1.68 0.00 5.97 0.00 -0.04 -0.76 121.76 129.50 2vhj s ALA 48 Ca -0.06 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.10 2vhj s ALA 48 Cb -0.07 -0.50 -0.00 0.00 0.00 0.00 0.00 23.12 22.55 2vhj s ALA 48 CO -0.06 0.35 -0.02 -1.50 0.00 0.00 0.00 175.76 174.52 2vhj s ILE 49 N -0.18 0.17 0.17 0.00 2.07 -0.59 -0.01 121.20 122.83 2vhj s ILE 49 Ca 0.00 -0.24 -0.30 0.00 -1.41 0.00 0.00 60.65 58.71 2vhj s ILE 49 Cb -0.10 -0.17 -0.07 0.00 0.13 0.00 0.00 42.46 42.24 2vhj s ILE 49 CO 0.01 -0.05 1.11 -0.83 -1.91 0.00 0.00 174.94 173.28 2vhj s GLY 50 N -0.30 2.81 0.66 1.50 0.00 -1.26 -1.00 107.32 109.73 2vhj s GLY 50 Ca -0.02 0.83 -0.00 0.00 0.00 0.00 0.00 44.72 45.53 2vhj s GLY 50 CO -0.00 1.70 0.92 -1.34 0.00 0.00 0.00 173.10 174.38 2vhj s VAL 51 N -0.13 2.31 0.33 1.40 -7.23 0.73 -4.85 120.40 112.96 2vhj s VAL 51 Ca 0.50 -0.61 0.09 0.00 -1.81 0.00 0.00 61.98 60.15 2vhj s VAL 51 Cb -0.30 -2.70 0.32 0.00 0.56 0.00 0.00 36.38 34.26 2vhj s VAL 51 CO 0.35 0.00 1.80 -0.08 -0.31 0.00 0.00 175.10 176.85 2vhj h GLU 52 N -0.33 0.67 0.00 4.82 4.81 -1.89 0.18 114.58 122.85 2vhj h GLU 52 Ca -0.38 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2vhj h GLU 52 Cb 1.28 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.51 2vhj h GLU 52 CO 0.45 0.45 0.00 0.66 -0.73 0.00 0.00 179.01 179.83 2vhj h SER 53 N 0.69 0.00 0.00 1.04 4.64 -1.95 -1.81 113.55 116.16 2vhj h SER 53 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 2vhj h SER 53 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2vhj h SER 53 CO -0.33 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.24 2vhj n GLY 54 N 0.75 0.34 3.66 -0.77 0.00 0.63 -4.76 105.19 105.04 2vhj n GLY 54 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2vhj n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vhj s ASP 55 N -2.06 2.59 -0.02 1.61 1.11 -1.26 -4.77 116.67 113.87 2vhj s ASP 55 Ca 0.00 1.35 0.07 0.00 0.18 0.00 0.00 52.55 54.15 2vhj s ASP 55 Cb 0.00 -2.03 -0.02 0.00 1.07 0.00 0.00 42.92 41.94 2vhj s ASP 55 CO 0.00 -3.18 -0.22 0.00 1.18 0.00 0.00 175.17 172.95 2vhj s ALA 56 N -2.87 1.84 0.09 5.23 0.00 -1.26 -0.19 121.76 124.60 2vhj s ALA 56 Ca 0.65 -0.95 0.03 0.00 0.00 0.00 0.00 51.96 51.69 2vhj s ALA 56 Cb -0.20 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 2vhj s ALA 56 CO 0.59 0.45 0.12 0.96 0.00 0.00 0.00 175.76 177.87 2vhj s ILE 57 N -0.50 4.69 -0.03 0.00 -4.36 -0.17 -1.54 121.20 119.29 2vhj s ILE 57 Ca 0.08 -0.76 0.05 0.00 -0.26 0.00 0.00 60.65 59.76 2vhj s ILE 57 Cb -0.09 -3.29 -0.01 0.00 1.25 0.00 0.00 42.46 40.32 2vhj s ILE 57 CO -0.01 0.08 -0.19 -0.69 0.24 0.00 0.00 174.94 174.37 2vhj s VAL 58 N -1.48 1.50 0.15 8.37 1.01 -1.26 -1.55 120.40 127.14 2vhj s VAL 58 Ca 0.31 -0.79 0.10 0.00 0.00 0.00 0.00 61.98 61.60 2vhj s VAL 58 Cb -0.12 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2vhj s VAL 58 CO 0.23 0.43 -0.23 -0.36 0.00 0.00 0.00 175.10 175.17 2vhj s PHE 59 N -0.25 2.11 0.56 5.22 0.40 0.06 0.00 117.98 126.08 2vhj s PHE 59 Ca 0.03 -0.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.96 2vhj s PHE 59 Cb -0.09 -1.09 0.11 0.00 0.51 0.00 0.00 43.02 42.45 2vhj s PHE 59 CO 0.01 0.37 0.77 -0.40 0.70 0.00 0.00 175.22 176.66 2vhj n ASP 60 N 0.61 1.09 0.26 1.36 5.68 -0.02 -1.13 116.55 124.39 2vhj n ASP 60 Ca -0.16 -1.90 0.10 0.00 -0.50 0.00 0.00 54.79 52.33 2vhj n ASP 60 Cb 0.55 -0.49 0.67 0.00 -1.14 0.00 0.00 41.12 40.71 2vhj n ASP 60 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2vhj h LYS 61 N 0.00 0.00 -0.67 0.11 2.10 -1.89 -1.16 116.57 115.06 2vhj h LYS 61 Ca -0.25 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.40 2vhj h LYS 61 Cb 0.95 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.28 2vhj h LYS 61 CO 0.28 0.09 0.00 0.09 -2.00 0.00 0.00 179.45 177.91 2vhj n ASN 62 N -4.10 3.22 -2.55 7.07 4.13 -1.26 -4.90 115.26 116.87 2vhj n ASN 62 Ca -0.03 -2.37 -0.21 0.00 1.68 0.00 0.00 54.58 53.66 2vhj n ASN 62 Cb 0.18 -0.51 0.01 0.00 -1.54 0.00 0.00 39.78 37.91 2vhj n ASN 62 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2vhj n ALA 63 N 0.44 -0.74 -2.80 5.41 0.00 -0.44 -5.00 120.51 117.37 2vhj n ALA 63 Ca 0.15 0.21 -0.36 0.00 0.00 0.00 0.00 53.44 53.44 2vhj n ALA 63 Cb 0.66 -2.85 -0.07 0.00 0.00 0.00 0.00 19.45 17.18 2vhj n ALA 63 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2vhj s GLN 64 N -5.29 3.26 0.32 0.00 -1.52 -1.26 -4.87 119.66 110.31 2vhj s GLN 64 Ca 0.13 -0.25 -0.29 0.00 -1.95 0.00 0.00 55.36 53.00 2vhj s GLN 64 Cb -0.06 -3.03 -0.11 0.00 -0.22 0.00 0.00 33.01 29.59 2vhj s GLN 64 CO 0.16 0.75 1.56 1.03 -0.25 0.00 0.00 175.29 178.53 2vhj s ARG 65 N -1.01 4.11 -0.27 2.91 1.81 -1.26 -0.84 118.95 124.40 2vhj s ARG 65 Ca 0.15 2.58 -0.10 0.00 -1.72 0.00 0.00 55.73 56.63 2vhj s ARG 65 Cb -0.12 -3.00 -0.05 0.00 -0.45 0.00 0.00 34.95 31.34 2vhj s ARG 65 CO 0.04 -0.60 0.17 0.42 -0.68 0.00 0.00 175.30 174.65 2vhj s ILE 66 N -0.42 5.11 -0.19 1.52 1.01 0.10 -4.85 121.20 123.49 2vhj s ILE 66 Ca 0.59 0.10 0.05 0.00 0.00 0.00 0.00 60.65 61.39 2vhj s ILE 66 Cb -0.47 -3.43 -0.21 0.00 0.01 0.00 0.00 42.46 38.35 2vhj s ILE 66 CO 0.54 0.27 0.07 1.33 0.00 0.00 0.00 174.94 177.14 2vhj n VAL 67 N 5.02 1.55 -3.83 2.92 0.24 -1.26 -4.53 118.33 118.44 2vhj n VAL 67 Ca -0.14 -0.68 -0.13 0.00 -2.04 0.00 0.00 64.34 61.35 2vhj n VAL 67 Cb 0.52 -1.24 -0.15 0.00 -1.47 0.00 0.00 33.84 31.50 2vhj n VAL 67 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2vhj s ALA 68 N -2.53 0.03 -0.27 2.33 0.00 -1.26 0.01 121.76 120.07 2vhj s ALA 68 Ca -0.23 0.11 -0.09 0.00 0.00 0.00 0.00 51.96 51.75 2vhj s ALA 68 Cb 0.08 -0.09 0.12 0.00 0.00 0.00 0.00 23.12 23.23 2vhj s ALA 68 CO 0.71 -0.04 0.59 -0.47 0.00 0.00 0.00 175.76 176.55 2vhj s TYR 69 N 0.40 -1.22 0.34 0.00 6.14 0.45 -4.90 117.35 118.56 2vhj s TYR 69 Ca -0.03 2.08 -0.28 0.00 0.64 0.00 0.00 57.07 59.48 2vhj s TYR 69 Cb -0.05 0.66 -0.10 0.00 0.42 0.00 0.00 41.96 42.90 2vhj s TYR 69 CO -0.01 -0.64 1.27 0.21 0.64 0.00 0.00 175.55 177.02 2vhj s LYS 70 N 2.82 4.30 -0.19 4.97 2.20 -1.26 -1.78 119.74 130.80 2vhj s LYS 70 Ca -0.03 2.12 -0.41 0.00 -0.36 0.00 0.00 55.97 57.29 2vhj s LYS 70 Cb -0.12 -3.00 -0.18 0.00 -1.51 0.00 0.00 37.83 33.02 2vhj s LYS 70 CO -0.18 -0.20 1.47 -1.91 -0.36 0.00 0.00 175.35 174.17 2vhj n GLU 71 N 0.67 0.60 -4.27 4.03 2.13 -1.26 -4.79 120.64 117.75 2vhj n GLU 71 Ca 0.01 0.22 -0.19 0.00 0.66 0.00 0.00 57.16 57.86 2vhj n GLU 71 Cb 0.43 -1.81 -0.15 0.00 0.27 0.00 0.00 31.44 30.18 2vhj n GLU 71 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2vhj s LYS 72 N 1.91 0.79 0.06 5.31 2.20 -0.75 -4.99 119.74 124.28 2vhj s LYS 72 Ca 0.95 -0.22 0.06 0.00 -0.36 0.00 0.00 55.97 56.40 2vhj s LYS 72 Cb -1.20 -0.76 -0.04 0.00 -1.51 0.00 0.00 37.83 34.33 2vhj s LYS 72 CO 0.64 0.06 -0.13 -1.12 -0.36 0.00 0.00 175.35 174.44 2vhj s SER 73 N 0.30 4.19 -0.02 1.43 0.01 -1.26 -1.56 113.70 116.79 2vhj s SER 73 Ca -0.04 -0.36 0.04 0.00 1.31 0.00 0.00 55.95 56.89 2vhj s SER 73 Cb -0.09 -0.78 -0.00 0.00 0.21 0.00 0.00 66.02 65.36 2vhj s SER 73 CO 0.00 0.23 -0.12 -0.69 0.41 0.00 0.00 173.24 173.07 2vhj s VAL 74 N -1.06 1.00 -0.31 3.43 1.01 -0.04 -4.99 120.40 119.45 2vhj s VAL 74 Ca 0.18 -0.51 -0.14 0.00 0.00 0.00 0.00 61.98 61.51 2vhj s VAL 74 Cb -0.11 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 2vhj s VAL 74 CO 0.09 0.29 0.30 -0.75 0.00 0.00 0.00 175.10 175.03 2vhj s LYS 75 N -0.10 3.76 0.79 2.72 2.47 -1.26 -1.76 119.74 126.35 2vhj s LYS 75 Ca 0.01 -0.32 -0.09 0.00 -1.56 0.00 0.00 55.97 54.01 2vhj s LYS 75 Cb -0.07 -3.73 0.10 0.00 -1.46 0.00 0.00 37.83 32.67 2vhj s LYS 75 CO 0.00 -0.37 1.12 0.00 0.16 0.00 0.00 175.35 176.27 2vhj s ALA 76 N 1.92 2.89 0.22 3.13 0.00 -0.32 -4.97 121.76 124.63 2vhj s ALA 76 Ca 0.10 -1.01 -0.06 0.00 0.00 0.00 0.00 51.96 51.00 2vhj s ALA 76 Cb -0.16 -2.66 0.21 0.00 0.00 0.00 0.00 23.12 20.51 2vhj s ALA 76 CO 0.11 -1.66 1.73 0.93 0.00 0.00 0.00 175.76 176.86 2vhj h GLU 77 N -0.93 0.98 0.00 0.00 5.08 -1.98 -2.52 114.58 115.20 2vhj h GLU 77 Ca -0.44 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 57.66 2vhj h GLU 77 Cb 1.30 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2vhj h GLU 77 CO 0.54 0.92 0.17 0.22 -1.00 0.00 0.00 179.01 179.87 2vhj h ASP 78 N 0.92 0.00 0.00 1.42 3.58 -1.94 -3.45 116.42 116.96 2vhj h ASP 78 Ca 0.18 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.63 2vhj h ASP 78 Cb 0.43 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.48 2vhj h ASP 78 CO 0.01 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.98 2vhj n GLY 79 N -1.24 3.22 3.75 -0.78 0.00 -0.95 -5.01 105.19 104.17 2vhj n GLY 79 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2vhj n GLY 79 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2vhj n SER 80 N 0.07 2.83 -4.39 1.61 3.41 -1.26 -4.69 113.62 111.19 2vhj n SER 80 Ca 0.00 1.01 -0.33 0.00 -0.26 0.00 0.00 58.87 59.28 2vhj n SER 80 Cb 0.00 -1.58 -0.14 0.00 -0.26 0.00 0.00 64.21 62.23 2vhj n SER 80 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2vhj s VAL 81 N -1.27 3.29 -0.04 -3.33 1.01 -1.26 -1.17 120.40 117.63 2vhj s VAL 81 Ca 0.70 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 62.09 2vhj s VAL 81 Cb -0.42 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2vhj s VAL 81 CO 0.51 0.50 0.10 -0.94 0.00 0.00 0.00 175.10 175.27 2vhj s SER 82 N 0.49 5.88 0.02 3.32 1.04 -0.72 -4.95 113.70 118.78 2vhj s SER 82 Ca -0.07 0.24 0.04 0.00 0.48 0.00 0.00 55.95 56.64 2vhj s SER 82 Cb -0.15 -1.76 -0.02 0.00 0.10 0.00 0.00 66.02 64.19 2vhj s SER 82 CO 0.04 0.31 -0.13 -0.69 0.98 0.00 0.00 173.24 173.75 2vhj s VAL 83 N -1.15 1.03 -0.05 5.02 1.01 -1.26 -0.86 120.40 124.14 2vhj s VAL 83 Ca 0.21 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.41 2vhj s VAL 83 Cb -0.12 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.37 2vhj s VAL 83 CO 0.12 0.11 -0.08 -0.69 0.00 0.00 0.00 175.10 174.55 2vhj s VAL 84 N -0.63 0.80 -0.06 2.92 1.01 -0.60 -2.76 120.40 121.08 2vhj s VAL 84 Ca 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 61.98 61.70 2vhj s VAL 84 Cb -0.07 -0.77 0.04 0.00 0.00 0.00 0.00 36.38 35.58 2vhj s VAL 84 CO 0.00 0.28 0.14 -1.58 0.00 0.00 0.00 175.10 173.94 2vhj s GLN 85 N 0.79 0.08 -0.08 2.72 0.74 -0.59 -1.80 119.66 121.52 2vhj s GLN 85 Ca -0.13 0.37 0.05 0.00 0.05 0.00 0.00 55.36 55.70 2vhj s GLN 85 Cb -0.15 -0.20 -0.01 0.00 1.10 0.00 0.00 33.01 33.75 2vhj s GLN 85 CO 0.02 -0.18 -0.22 0.08 -0.55 0.00 0.00 175.29 174.44 2vhj s VAL 86 N 1.25 2.29 -0.11 1.34 1.01 -0.73 0.41 120.40 125.85 2vhj s VAL 86 Ca -0.08 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 60.87 2vhj s VAL 86 Cb -0.12 -1.86 0.05 0.00 0.00 0.00 0.00 36.38 34.45 2vhj s VAL 86 CO -0.06 0.56 0.26 -0.70 0.00 0.00 0.00 175.10 175.17 2vhj s GLU 87 N -0.03 0.22 -1.42 2.72 2.12 -0.22 -0.41 118.70 121.69 2vhj s GLU 87 Ca -0.07 0.58 -0.08 0.00 0.36 0.00 0.00 54.97 55.76 2vhj s GLU 87 Cb -0.15 -0.10 0.05 0.00 0.26 0.00 0.00 34.13 34.19 2vhj s GLU 87 CO 0.05 -0.18 0.61 0.09 -0.54 0.00 0.00 175.26 175.29 2vhj n ASN 88 N 4.36 -4.80 -0.01 -1.70 3.02 -1.15 -1.94 115.26 113.04 2vhj n ASN 88 Ca -0.23 -0.40 -0.00 0.00 -0.03 0.00 0.00 54.58 53.91 2vhj n ASN 88 Cb 0.53 -3.90 -0.00 0.00 -0.61 0.00 0.00 39.78 35.79 2vhj n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vhj n GLY 89 N -1.39 0.45 3.10 7.41 0.00 0.10 -5.03 105.19 109.85 2vhj n GLY 89 Ca -0.04 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.73 2vhj n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vhj s PHE 90 N -1.91 1.03 0.07 1.61 0.40 -0.82 -4.65 117.98 113.71 2vhj s PHE 90 Ca 0.00 -0.34 -0.31 0.00 -0.60 0.00 0.00 56.93 55.69 2vhj s PHE 90 Cb 0.00 -0.62 -0.09 0.00 0.51 0.00 0.00 43.02 42.83 2vhj s PHE 90 CO 0.00 0.01 1.76 1.41 0.70 0.00 0.00 175.22 179.10 2vhj s MET 91 N -1.04 4.17 -0.23 0.44 -2.45 -0.59 -1.05 119.30 118.54 2vhj s MET 91 Ca -0.00 2.45 0.09 0.00 -1.25 0.00 0.00 55.69 56.98 2vhj s MET 91 Cb -0.07 -3.71 -0.21 0.00 1.25 0.00 0.00 34.83 32.09 2vhj s MET 91 CO 0.01 -0.81 -0.09 1.17 1.05 0.00 0.00 175.02 176.34 2vhj n LYS 92 N 6.05 0.67 -4.32 4.11 4.81 0.17 -4.72 118.16 124.92 2vhj n LYS 92 Ca 0.17 0.08 -0.19 0.00 -0.87 0.00 0.00 58.31 57.50 2vhj n LYS 92 Cb 0.40 -1.52 -0.13 0.00 0.02 0.00 0.00 35.03 33.80 2vhj n LYS 92 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2vhj s GLN 93 N -2.51 0.84 0.00 1.64 -0.21 -0.95 -4.94 119.66 113.54 2vhj s GLN 93 Ca -0.24 -0.68 0.00 0.00 0.02 0.00 0.00 55.36 54.46 2vhj s GLN 93 Cb 0.08 -0.82 0.00 0.00 1.00 0.00 0.00 33.01 33.27 2vhj s GLN 93 CO 0.71 0.20 0.00 0.41 -2.12 0.00 0.00 175.29 174.49 2vhj n GLY 94 N 2.00 0.64 3.14 3.09 0.00 -1.11 -1.54 105.19 111.42 2vhj n GLY 94 Ca -0.18 -2.13 -0.10 0.00 0.00 0.00 0.00 46.02 43.61 2vhj n GLY 94 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2vhj s HIS 95 N -1.06 0.78 0.54 1.61 -3.43 -1.26 -5.04 115.29 107.42 2vhj s HIS 95 Ca 0.00 -0.94 -0.20 0.00 -0.80 0.00 0.00 55.06 53.12 2vhj s HIS 95 Cb 0.00 -0.48 -0.06 0.00 -1.43 0.00 0.00 32.58 30.61 2vhj s HIS 95 CO 0.00 -0.21 1.13 1.03 -2.00 0.00 0.00 174.74 174.69 2vhj s ARG 96 N -3.78 3.39 0.00 -0.38 0.52 -1.26 -4.64 118.95 112.80 2vhj s ARG 96 Ca 0.10 1.62 0.00 0.00 -0.52 0.00 0.00 55.73 56.92 2vhj s ARG 96 Cb 0.05 -2.03 0.00 0.00 0.52 0.00 0.00 34.95 33.50 2vhj s ARG 96 CO -0.06 -0.82 0.00 0.41 0.02 0.00 0.00 175.30 174.85 2vhj n GLY 97 N 0.17 -1.08 3.71 -3.53 0.00 0.99 -4.92 105.19 100.53 2vhj n GLY 97 Ca 0.11 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 2vhj n GLY 97 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2vhj s TRP 98 N 0.00 3.25 -1.10 1.61 0.52 -1.26 -0.86 118.94 121.09 2vhj s TRP 98 Ca 0.00 1.12 0.23 0.00 0.02 0.00 0.00 56.10 57.47 2vhj s TRP 98 Cb 0.00 -3.52 0.21 0.00 -1.15 0.00 0.00 33.47 29.01 2vhj s TRP 98 CO 0.00 -1.75 1.21 1.28 0.02 0.00 0.00 176.95 177.71 2vhj n LEU 99 N 4.38 0.80 -4.58 2.99 4.77 0.76 -4.83 117.00 121.30 2vhj n LEU 99 Ca 0.11 -0.25 -0.28 0.00 -0.03 0.00 0.00 56.01 55.56 2vhj n LEU 99 Cb 0.45 -0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.31 2vhj n LEU 99 CO 0.57 0.19 -0.41 0.68 -1.33 0.00 0.00 177.39 177.09 2vhj s VAL 100 N -2.94 3.30 -0.49 4.08 -7.23 -1.24 -4.89 120.40 110.98 2vhj s VAL 100 Ca 0.11 -1.51 -0.28 0.00 -1.81 0.00 0.00 61.98 58.50 2vhj s VAL 100 Cb 0.17 -2.61 0.03 0.00 0.56 0.00 0.00 36.38 34.54 2vhj s VAL 100 CO 0.75 -0.04 1.07 -0.62 -0.31 0.00 0.00 175.10 175.95 2vhj s ASP 101 N -2.63 6.55 0.06 4.85 -1.08 -1.26 -4.87 116.67 118.28 2vhj s ASP 101 Ca 0.24 0.26 0.23 0.00 -0.52 0.00 0.00 52.55 52.76 2vhj s ASP 101 Cb -0.10 -2.51 0.17 0.00 -1.46 0.00 0.00 42.92 39.02 2vhj s ASP 101 CO 0.15 -1.23 1.15 0.18 0.52 0.00 0.00 175.17 175.94 2vhj n LEU 102 N 7.71 0.63 -0.00 -1.34 4.77 -1.26 -4.67 117.00 122.84 2vhj n LEU 102 Ca 0.09 0.04 -0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2vhj n LEU 102 Cb 0.49 -0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2vhj n LEU 102 CO 0.69 0.03 -0.51 0.35 -1.33 0.00 0.00 177.39 176.62 2vhj n THR 103 N -1.94 0.02 -1.10 -5.08 -2.24 -1.26 -4.90 114.28 97.79 2vhj n THR 103 Ca 0.03 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2vhj n THR 103 Cb 0.42 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 2vhj n THR 103 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vhj n GLY 104 N 3.25 2.91 0.23 3.38 0.00 -1.26 -1.55 105.19 112.15 2vhj n GLY 104 Ca -0.01 -0.27 0.15 0.00 0.00 0.00 0.00 46.02 45.90 2vhj n GLY 104 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2vhj h GLU 105 N 0.00 0.00 -5.34 1.61 5.08 -2.02 -3.41 114.58 110.51 2vhj h GLU 105 Ca 0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 2vhj h GLU 105 Cb 0.00 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.10 2vhj h GLU 105 CO 0.00 0.00 1.30 -1.17 -1.00 0.00 0.00 179.01 178.14 2vhj s LEU 106 N -5.84 4.52 0.32 1.33 2.96 -0.60 -4.96 118.68 116.42 2vhj s LEU 106 Ca 0.04 -2.18 0.09 0.00 -0.22 0.00 0.00 54.13 51.86 2vhj s LEU 106 Cb 0.08 -2.46 -0.06 0.00 0.50 0.00 0.00 46.19 44.25 2vhj s LEU 106 CO 0.56 -1.11 -0.09 0.68 -1.32 0.00 0.00 176.35 175.07 2vhj s VAL 107 N 3.19 2.04 -0.14 1.68 -7.23 -1.26 -4.77 120.40 113.91 2vhj s VAL 107 Ca 0.41 -2.19 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 2vhj s VAL 107 Cb -0.02 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.37 2vhj s VAL 107 CO -0.05 -0.25 0.00 0.61 -0.31 0.00 0.00 175.10 175.10 2vhj n GLY 108 N -0.71 0.42 3.96 2.32 0.00 -1.26 -4.92 105.19 105.00 2vhj n GLY 108 Ca -0.05 -0.95 -0.23 0.00 0.00 0.00 0.00 46.02 44.79 2vhj n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vhj n SER 110 N -1.09 3.81 -4.67 0.00 7.64 -1.26 -4.87 113.62 113.18 2vhj n SER 110 Ca -0.08 -3.39 -0.46 0.00 1.01 0.00 0.00 58.87 55.95 2vhj n SER 110 Cb 0.56 -0.74 -0.04 0.00 -1.01 0.00 0.00 64.21 62.98 2vhj n SER 110 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2vhj n PRO 111 N 1.14 2.19 -1.70 1.43 -0.02 -1.26 -4.29 135.00 132.48 2vhj n PRO 111 Ca 0.27 0.79 -0.43 0.00 -2.02 0.00 0.00 63.50 62.12 2vhj n PRO 111 Cb 0.39 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.29 2vhj n PRO 111 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2vhj n VAL 112 N 3.35 0.25 -0.07 -1.45 3.14 -0.60 -0.57 118.33 122.37 2vhj n VAL 112 Ca 0.16 -0.04 -0.09 0.00 -2.96 0.00 0.00 64.34 61.41 2vhj n VAL 112 Cb 0.29 -2.05 -0.15 0.00 -1.06 0.00 0.00 33.84 30.87 2vhj n VAL 112 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 2vhj n VAL 113 N 4.44 1.42 -3.62 1.55 3.14 0.14 -1.46 118.33 123.94 2vhj n VAL 113 Ca 0.18 -0.83 -0.04 0.00 -2.96 0.00 0.00 64.34 60.68 2vhj n VAL 113 Cb 0.36 -0.62 -0.01 0.00 -1.06 0.00 0.00 33.84 32.50 2vhj n VAL 113 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2vhj s ALA 114 N -2.55 -1.90 -0.05 1.55 0.00 -1.22 -3.08 121.76 114.52 2vhj s ALA 114 Ca -0.08 0.78 0.02 0.00 0.00 0.00 0.00 51.96 52.67 2vhj s ALA 114 Cb 0.07 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.58 2vhj s ALA 114 CO 0.83 -0.86 -0.10 -2.00 0.00 0.00 0.00 175.76 173.63 2vhj s GLU 115 N -2.90 1.30 -0.16 0.00 2.12 -1.26 -0.74 118.70 117.07 2vhj s GLU 115 Ca 0.10 -0.33 -0.11 0.00 0.36 0.00 0.00 54.97 54.99 2vhj s GLU 115 Cb 0.00 -1.15 0.05 0.00 0.26 0.00 0.00 34.13 33.30 2vhj s GLU 115 CO -0.04 0.05 0.40 0.12 -0.54 0.00 0.00 175.26 175.25 2vhj s PHE 116 N 0.51 -0.53 -1.64 5.30 5.36 -0.06 -4.92 117.98 122.00 2vhj s PHE 116 Ca -0.10 1.18 -0.01 0.00 -0.96 0.00 0.00 56.93 57.05 2vhj s PHE 116 Cb -0.13 0.21 0.00 0.00 -0.34 0.00 0.00 43.02 42.76 2vhj s PHE 116 CO 0.02 -0.29 0.09 0.41 -1.46 0.00 0.00 175.22 173.99 2vhj n GLY 117 N 3.74 -0.50 1.64 13.12 0.00 -1.26 -1.68 105.19 120.24 2vhj n GLY 117 Ca -0.20 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2vhj n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vhj n GLY 118 N -1.06 0.56 3.04 -0.02 0.00 -1.26 -4.89 105.19 101.56 2vhj n GLY 118 Ca -0.21 -0.30 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 2vhj n GLY 118 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vhj s HIS 119 N -2.00 1.10 0.24 1.61 3.76 -0.68 -5.14 115.29 114.19 2vhj s HIS 119 Ca 0.00 -0.27 -0.24 0.00 -0.15 0.00 0.00 55.06 54.40 2vhj s HIS 119 Cb 0.00 -0.76 -0.09 0.00 1.11 0.00 0.00 32.58 32.84 2vhj s HIS 119 CO 0.00 -0.10 0.82 1.03 -0.85 0.00 0.00 174.74 175.64 2vhj s ARG 120 N 0.08 4.47 0.01 1.40 0.52 -1.26 -0.88 118.95 123.29 2vhj s ARG 120 Ca -0.02 1.12 0.07 0.00 -0.52 0.00 0.00 55.73 56.38 2vhj s ARG 120 Cb -0.08 -2.97 -0.03 0.00 0.52 0.00 0.00 34.95 32.39 2vhj s ARG 120 CO 0.01 0.41 -0.20 0.71 0.02 0.00 0.00 175.30 176.24 2vhj s TYR 121 N -1.44 2.50 0.31 -0.53 2.02 0.08 -4.98 117.35 115.31 2vhj s TYR 121 Ca 0.43 -0.30 -0.17 0.00 -0.37 0.00 0.00 57.07 56.67 2vhj s TYR 121 Cb -0.19 -1.50 -0.09 0.00 -0.40 0.00 0.00 41.96 39.78 2vhj s TYR 121 CO 0.24 0.15 0.75 0.00 -1.57 0.00 0.00 175.55 175.12 2vhj s ALA 122 N -0.79 3.32 1.24 3.71 0.00 -1.26 -0.69 121.76 127.29 2vhj s ALA 122 Ca 0.12 0.10 -0.20 0.00 0.00 0.00 0.00 51.96 51.98 2vhj s ALA 122 Cb -0.10 -2.81 0.30 0.00 0.00 0.00 0.00 23.12 20.51 2vhj s ALA 122 CO 0.02 0.31 1.10 -1.54 0.00 0.00 0.00 175.76 175.66 2vhj s SER 123 N -2.13 0.58 0.00 0.00 1.04 0.26 -4.59 113.70 108.87 2vhj s SER 123 Ca 0.52 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.51 2vhj s SER 123 Cb -0.12 -0.74 0.00 0.00 0.10 0.00 0.00 66.02 65.26 2vhj s SER 123 CO 0.18 -4.32 0.00 0.61 0.98 0.00 0.00 173.24 170.69 2vhj n GLY 124 N -0.83 -0.84 3.74 7.32 0.00 -0.01 -4.73 105.19 109.84 2vhj n GLY 124 Ca 0.14 -1.97 -0.35 0.00 0.00 0.00 0.00 46.02 43.84 2vhj n GLY 124 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2vhj s MET 125 N 0.00 4.16 -0.21 1.61 -2.45 -1.26 -0.78 119.30 120.37 2vhj s MET 125 Ca 0.00 -0.13 -0.00 0.00 -1.25 0.00 0.00 55.69 54.31 2vhj s MET 125 Cb 0.00 -3.41 0.02 0.00 1.25 0.00 0.00 34.83 32.69 2vhj s MET 125 CO 0.00 0.31 -0.13 0.08 1.05 0.00 0.00 175.02 176.34 2vhj s VAL 126 N 0.30 2.52 -0.23 10.11 1.01 0.12 -0.38 120.40 133.85 2vhj s VAL 126 Ca 0.11 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 61.03 2vhj s VAL 126 Cb -0.12 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 2vhj s VAL 126 CO -0.00 0.37 0.14 -0.63 0.00 0.00 0.00 175.10 174.98 2vhj s ILE 127 N 1.31 5.27 -0.35 2.22 1.01 -0.89 -0.59 121.20 129.19 2vhj s ILE 127 Ca 0.02 0.15 -0.12 0.00 0.00 0.00 0.00 60.65 60.70 2vhj s ILE 127 Cb -0.15 -3.44 0.00 0.00 0.01 0.00 0.00 42.46 38.88 2vhj s ILE 127 CO -0.08 0.37 0.22 -0.69 0.00 0.00 0.00 174.94 174.75 2vhj s VAL 128 N 0.92 4.88 0.00 2.92 1.01 0.30 -1.03 120.40 129.39 2vhj s VAL 128 Ca 0.07 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2vhj s VAL 128 Cb -0.13 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2vhj s VAL 128 CO 0.03 -0.10 0.00 1.07 0.00 0.00 0.00 175.10 176.10 2vhj n THR 129 N 5.05 0.00 0.00 3.92 5.66 0.07 -0.97 114.28 128.00 2vhj n THR 129 Ca -0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 2vhj n THR 129 Cb 0.48 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.26 2vhj n THR 129 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2vhj n GLY 130 N 0.00 0.88 3.78 1.09 0.00 -1.26 -2.19 105.19 107.49 2vhj n GLY 130 Ca 0.00 -2.27 -0.35 0.00 0.00 0.00 0.00 46.02 43.39 2vhj n GLY 130 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vhj s LYS 131 N -0.98 3.64 0.00 1.61 2.20 -1.26 -4.26 119.74 120.69 2vhj s LYS 131 Ca 0.00 1.55 0.00 0.00 -0.36 0.00 0.00 55.97 57.16 2vhj s LYS 131 Cb 0.00 -2.15 0.00 0.00 -1.51 0.00 0.00 37.83 34.17 2vhj s LYS 131 CO 0.00 -0.60 0.00 0.41 -0.36 0.00 0.00 175.35 174.80 2vhj n GLY 132 N 0.10 2.74 0.00 5.54 0.00 -1.26 -4.84 105.19 107.46 2vhj n GLY 132 Ca 0.10 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2vhj n GLY 132 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2vhj n ASN 133 N 0.00 1.53 -4.02 1.61 2.04 -1.26 -4.47 115.26 110.68 2vhj n ASN 133 Ca 0.00 -1.70 -0.09 0.00 -0.44 0.00 0.00 54.58 52.35 2vhj n ASN 133 Cb 0.00 0.00 -0.09 0.00 -2.53 0.00 0.00 39.78 37.16 2vhj n ASN 133 CO 0.00 0.00 0.00 -0.94 -0.44 0.00 0.00 177.26 175.88 2vhj s SER 134 N -0.70 0.27 0.00 0.53 1.04 -1.26 -4.95 113.70 108.62 2vhj s SER 134 Ca 0.00 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.50 2vhj s SER 134 Cb 0.00 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.42 2vhj s SER 134 CO 0.00 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.11 2vhj n GLY 135 N -0.04 2.11 0.19 7.32 0.00 -1.26 -4.95 105.19 108.56 2vhj n GLY 135 Ca -0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.79 2vhj n GLY 135 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vhj h LYS 136 N 2.54 0.53 -0.01 1.61 1.57 -1.94 -3.11 116.57 117.75 2vhj h LYS 136 Ca 0.00 -0.42 -0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2vhj h LYS 136 Cb 0.00 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2vhj h LYS 136 CO 0.00 1.05 0.00 1.15 -0.57 0.00 0.00 179.45 181.08 2vhj h THR 137 N 0.37 1.16 -0.50 -0.16 2.02 -1.97 -0.40 112.91 113.42 2vhj h THR 137 Ca -0.03 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.67 2vhj h THR 137 Cb 1.31 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.16 2vhj h THR 137 CO 0.13 0.13 0.33 -0.65 0.37 0.00 0.00 175.52 175.83 2vhj h PRO 138 N -0.18 0.66 -0.04 6.66 0.11 -1.89 -2.50 132.00 134.82 2vhj h PRO 138 Ca 0.00 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 2vhj h PRO 138 Cb 0.20 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.16 2vhj h PRO 138 CO -0.00 0.44 0.00 1.25 -0.21 0.00 0.00 178.00 179.48 2vhj h LEU 139 N 0.68 0.06 -1.06 2.35 7.12 -1.37 -1.51 115.31 121.58 2vhj h LEU 139 Ca 0.18 -0.27 0.04 0.00 0.13 0.00 0.00 57.88 57.96 2vhj h LEU 139 Cb -0.08 -0.02 -0.06 0.00 -0.53 0.00 0.00 40.66 39.98 2vhj h LEU 139 CO -0.04 0.31 0.63 -0.37 -0.13 0.00 0.00 178.44 178.85 2vhj h VAL 140 N -0.20 1.16 -0.38 1.05 -1.51 -0.86 0.32 116.25 115.83 2vhj h VAL 140 Ca 0.01 -0.42 -0.11 0.00 -1.23 0.00 0.00 66.70 64.95 2vhj h VAL 140 Cb 0.28 -0.16 -0.01 0.00 -2.13 0.00 0.00 31.29 29.27 2vhj h VAL 140 CO 0.00 0.22 -0.22 0.45 -1.23 0.00 0.00 177.57 176.79 2vhj h HIS 141 N 1.21 0.85 -0.52 5.19 3.86 -1.43 0.12 115.15 124.43 2vhj h HIS 141 Ca 0.39 -0.19 -0.11 0.00 -1.16 0.00 0.00 60.37 59.30 2vhj h HIS 141 Cb 0.02 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 2vhj h HIS 141 CO -0.00 0.90 -0.11 0.00 0.86 0.00 0.00 177.93 179.58 2vhj h ALA 142 N 1.10 0.82 -0.30 2.45 0.00 -0.49 -1.60 119.26 121.25 2vhj h ALA 142 Ca 0.09 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 2vhj h ALA 142 Cb 0.72 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2vhj h ALA 142 CO 0.06 0.66 -0.43 1.25 0.00 0.00 0.00 179.25 180.79 2vhj h LEU 143 N 0.87 0.80 -0.28 0.00 5.85 -0.83 -1.15 115.31 120.56 2vhj h LEU 143 Ca 0.14 -0.37 0.02 0.00 0.84 0.00 0.00 57.88 58.50 2vhj h LEU 143 Cb 0.66 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 2vhj h LEU 143 CO 0.05 1.12 0.14 1.23 -0.34 0.00 0.00 178.44 180.63 2vhj h GLY 144 N 0.92 0.38 0.95 3.75 0.00 -0.76 0.07 103.07 108.38 2vhj h GLY 144 Ca 0.04 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 2vhj h GLY 144 CO 0.09 0.08 -0.06 -2.09 0.00 0.00 0.00 176.54 174.57 2vhj h GLU 145 N 0.30 0.72 -0.29 4.80 4.22 -1.18 0.67 114.58 123.83 2vhj h GLU 145 Ca 0.12 -0.26 -0.04 0.00 0.08 0.00 0.00 59.36 59.26 2vhj h GLU 145 Cb 0.04 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2vhj h GLU 145 CO -0.08 0.84 0.03 0.00 -2.18 0.00 0.00 179.01 177.63 2vhj h ALA 146 N 0.85 0.38 0.00 2.92 0.00 -1.01 -2.23 119.26 120.16 2vhj h ALA 146 Ca 0.10 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2vhj h ALA 146 Cb 0.56 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2vhj h ALA 146 CO 0.03 0.08 -0.65 -0.07 0.00 0.00 0.00 179.25 178.64 2vhj h LEU 147 N 0.29 0.00 -0.98 0.00 3.38 -1.00 -3.05 115.31 113.95 2vhj h LEU 147 Ca 0.09 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.08 2vhj h LEU 147 Cb 0.36 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 2vhj h LEU 147 CO 0.01 0.65 0.65 1.23 0.09 0.00 0.00 178.44 181.06 2vhj h GLY 148 N 2.20 1.41 0.00 0.83 0.00 -0.68 -3.45 103.07 103.38 2vhj h GLY 148 Ca -0.01 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2vhj h GLY 148 CO 0.08 0.46 0.00 0.61 0.00 0.00 0.00 176.54 177.69 2vhj n GLY 149 N -1.37 1.56 0.13 4.60 0.00 -0.86 -0.96 105.19 108.30 2vhj n GLY 149 Ca 0.12 0.28 0.13 0.00 0.00 0.00 0.00 46.02 46.56 2vhj n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vhj h LYS 150 N 0.00 0.00 -6.25 1.61 1.57 -1.90 -3.45 116.57 108.15 2vhj h LYS 150 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 2vhj h LYS 150 Cb 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.22 2vhj h LYS 150 CO 0.00 0.00 -0.61 -0.51 -0.57 0.00 0.00 179.45 177.76 2vhj s ASP 151 N -4.60 5.28 0.55 0.86 1.01 -0.13 -5.11 116.67 114.53 2vhj s ASP 151 Ca 0.08 -0.16 -0.19 0.00 0.71 0.00 0.00 52.55 52.99 2vhj s ASP 151 Cb 0.11 -1.32 -0.05 0.00 1.01 0.00 0.00 42.92 42.66 2vhj s ASP 151 CO 0.54 0.12 1.12 -0.54 0.21 0.00 0.00 175.17 176.62 2vhj s LYS 152 N -2.76 3.33 0.15 8.23 1.02 -1.26 -4.50 119.74 123.94 2vhj s LYS 152 Ca 0.29 1.58 0.03 0.00 0.02 0.00 0.00 55.97 57.90 2vhj s LYS 152 Cb -0.11 -2.00 -0.04 0.00 -0.52 0.00 0.00 37.83 35.16 2vhj s LYS 152 CO 0.21 -0.86 0.21 1.52 -0.92 0.00 0.00 175.35 175.51 2vhj s TYR 153 N -1.83 3.33 -0.15 3.18 1.13 -1.26 -4.75 117.35 117.01 2vhj s TYR 153 Ca 0.72 0.06 -0.09 0.00 -1.41 0.00 0.00 57.07 56.36 2vhj s TYR 153 Cb -0.23 -1.60 -0.04 0.00 -1.10 0.00 0.00 41.96 38.98 2vhj s TYR 153 CO 0.28 0.52 0.16 0.00 -2.51 0.00 0.00 175.55 173.99 2vhj s ALA 154 N -1.72 3.79 -0.19 9.51 0.00 -0.05 -4.98 121.76 128.11 2vhj s ALA 154 Ca 0.33 -0.63 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 2vhj s ALA 154 Cb -0.11 -2.08 -0.01 0.00 0.00 0.00 0.00 23.12 20.92 2vhj s ALA 154 CO 0.26 0.42 -0.07 0.99 0.00 0.00 0.00 175.76 177.35 2vhj s THR 155 N -0.44 3.26 -0.23 0.00 2.01 -1.26 0.10 115.64 119.09 2vhj s THR 155 Ca 0.13 -0.55 -0.08 0.00 0.31 0.00 0.00 61.69 61.50 2vhj s THR 155 Cb -0.12 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.91 2vhj s THR 155 CO 0.02 0.46 0.08 -0.69 -0.69 0.00 0.00 174.62 173.81 2vhj s VAL 156 N 1.10 4.62 -0.13 3.82 1.01 0.12 -4.97 120.40 125.97 2vhj s VAL 156 Ca 0.01 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 2vhj s VAL 156 Cb -0.15 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 2vhj s VAL 156 CO -0.01 0.37 -0.10 -0.13 0.00 0.00 0.00 175.10 175.23 2vhj s ARG 157 N 1.19 3.41 -0.20 2.72 0.52 -1.26 -1.10 118.95 124.23 2vhj s ARG 157 Ca 0.05 -0.62 -0.10 0.00 -0.52 0.00 0.00 55.73 54.54 2vhj s ARG 157 Cb -0.14 -2.72 0.07 0.00 0.52 0.00 0.00 34.95 32.68 2vhj s ARG 157 CO 0.04 0.27 0.47 0.12 0.02 0.00 0.00 175.30 176.22 2vhj s PHE 158 N 0.24 -0.73 -0.55 -0.53 5.36 0.77 -4.03 117.98 118.50 2vhj s PHE 158 Ca -0.06 1.51 -0.02 0.00 -0.96 0.00 0.00 56.93 57.40 2vhj s PHE 158 Cb -0.15 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 42.89 2vhj s PHE 158 CO 0.04 -0.40 0.23 0.41 -1.46 0.00 0.00 175.22 174.04 2vhj n GLY 159 N 4.44 0.26 3.31 13.12 0.00 -0.22 -1.53 105.19 124.57 2vhj n GLY 159 Ca -0.21 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.10 2vhj n GLY 159 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vhj s GLU 160 N -4.96 1.26 -1.53 1.61 0.41 -1.26 -4.54 118.70 109.68 2vhj s GLU 160 Ca 0.11 -1.18 -0.09 0.00 -0.41 0.00 0.00 54.97 53.40 2vhj s GLU 160 Cb -0.05 -1.57 -0.08 0.00 -1.78 0.00 0.00 34.13 30.65 2vhj s GLU 160 CO 0.14 0.37 2.85 -0.35 -0.49 0.00 0.00 175.26 177.78 2vhj n PRO 161 N 1.17 3.49 -4.21 0.39 -0.04 -1.26 -4.73 135.00 129.80 2vhj n PRO 161 Ca -0.19 -2.11 -0.13 0.00 -0.04 0.00 0.00 63.50 61.04 2vhj n PRO 161 Cb 0.53 -2.76 -0.10 0.00 -0.04 0.00 0.00 33.50 31.13 2vhj n PRO 161 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2vhj s LEU 162 N 0.18 2.51 0.36 1.53 1.43 -1.26 -5.12 118.68 118.30 2vhj s LEU 162 Ca 0.66 -0.99 -0.28 0.00 -1.03 0.00 0.00 54.13 52.49 2vhj s LEU 162 Cb 0.17 -0.22 -0.12 0.00 0.03 0.00 0.00 46.19 46.06 2vhj s LEU 162 CO -0.06 -0.38 1.41 -1.54 0.23 0.00 0.00 176.35 176.00 2vhj n SER 163 N -0.04 3.33 0.00 2.29 3.41 -1.26 -2.76 113.62 118.59 2vhj n SER 163 Ca -0.12 1.21 0.00 0.00 -0.26 0.00 0.00 58.87 59.71 2vhj n SER 163 Cb 0.60 -1.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.00 2vhj n SER 163 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vhj n GLY 164 N 0.70 0.52 3.65 5.00 0.00 -1.26 -4.97 105.19 108.84 2vhj n GLY 164 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 2vhj n GLY 164 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vhj s TYR 165 N -2.44 3.31 0.45 1.61 2.02 -1.11 -5.02 117.35 116.17 2vhj s TYR 165 Ca 0.00 1.40 -0.25 0.00 -0.37 0.00 0.00 57.07 57.85 2vhj s TYR 165 Cb 0.00 -3.33 -0.08 0.00 -0.40 0.00 0.00 41.96 38.15 2vhj s TYR 165 CO 0.00 -0.52 1.44 1.21 -1.57 0.00 0.00 175.55 176.11 2vhj s ASN 166 N 1.29 5.87 0.00 2.29 2.47 -1.26 -4.77 114.94 120.83 2vhj s ASN 166 Ca 0.44 2.95 0.00 0.00 0.42 0.00 0.00 52.86 56.67 2vhj s ASN 166 Cb -0.15 -2.66 0.00 0.00 -1.45 0.00 0.00 41.25 37.00 2vhj s ASN 166 CO 0.08 -1.18 0.74 0.35 -3.72 0.00 0.00 177.10 173.36 2vhj n THR 167 N -0.18 0.54 -3.19 -5.21 -2.24 -1.26 -1.06 114.28 101.68 2vhj n THR 167 Ca 0.05 -0.58 -0.41 0.00 -2.27 0.00 0.00 64.05 60.84 2vhj n THR 167 Cb 0.41 0.79 -0.07 0.00 -2.10 0.00 0.00 70.33 69.36 2vhj n THR 167 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2vhj s ASP 168 N -0.54 6.43 0.36 3.42 -1.08 -1.26 -4.87 116.67 119.13 2vhj s ASP 168 Ca 0.00 0.35 0.11 0.00 -0.52 0.00 0.00 52.55 52.49 2vhj s ASP 168 Cb 0.00 -2.30 0.87 0.00 -1.46 0.00 0.00 42.92 40.04 2vhj s ASP 168 CO 0.00 -0.40 1.85 0.15 0.52 0.00 0.00 175.17 177.29 2vhj h PHE 169 N 8.19 0.79 -0.08 -5.34 3.57 -1.98 -1.90 116.94 120.19 2vhj h PHE 169 Ca -0.28 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.15 2vhj h PHE 169 Cb 1.13 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 2vhj h PHE 169 CO 0.75 0.25 -0.37 -0.91 -2.23 0.00 0.00 178.31 175.80 2vhj h ASN 170 N 0.63 0.17 -0.31 0.41 4.21 -1.96 -1.73 115.58 117.00 2vhj h ASN 170 Ca 0.48 -0.06 -0.17 0.00 1.21 0.00 0.00 56.30 57.75 2vhj h ASN 170 Cb 0.87 -0.05 -0.00 0.00 -1.12 0.00 0.00 38.32 38.02 2vhj h ASN 170 CO -0.23 0.54 -0.47 0.58 -1.29 0.00 0.00 177.43 176.56 2vhj h VAL 171 N 0.14 1.28 -0.36 2.81 2.07 -1.79 -2.84 116.25 117.56 2vhj h VAL 171 Ca 0.02 -1.65 0.08 0.00 0.82 0.00 0.00 66.70 65.96 2vhj h VAL 171 Cb 0.73 1.57 -0.08 0.00 -1.52 0.00 0.00 31.29 31.99 2vhj h VAL 171 CO 0.06 0.54 -0.23 0.15 0.02 0.00 0.00 177.57 178.11 2vhj h PHE 172 N 0.66 -0.59 -0.19 1.57 3.57 -0.76 0.80 116.94 121.99 2vhj h PHE 172 Ca 0.03 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.47 2vhj h PHE 172 Cb 1.07 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 40.11 2vhj h PHE 172 CO 0.07 -0.30 -0.32 -0.39 -2.23 0.00 0.00 178.31 175.13 2vhj h VAL 173 N -0.18 1.28 -0.39 1.41 -1.51 -1.37 -0.32 116.25 115.18 2vhj h VAL 173 Ca 0.18 -1.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.28 2vhj h VAL 173 Cb 0.45 1.49 -0.02 0.00 -2.13 0.00 0.00 31.29 31.09 2vhj h VAL 173 CO -0.46 0.42 0.26 -0.78 -1.23 0.00 0.00 177.57 175.78 2vhj h ASP 174 N 0.33 0.45 -0.47 4.19 1.82 -1.20 -0.69 116.42 120.85 2vhj h ASP 174 Ca 0.04 -0.01 0.03 0.00 -0.39 0.00 0.00 57.03 56.69 2vhj h ASP 174 Cb 0.74 -0.11 -0.03 0.00 0.68 0.00 0.00 39.33 40.60 2vhj h ASP 174 CO 0.06 0.33 0.27 0.44 -1.61 0.00 0.00 179.24 178.72 2vhj h ASP 175 N 0.53 0.42 -0.38 2.28 3.32 -0.19 -1.89 116.42 120.51 2vhj h ASP 175 Ca 0.14 0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.05 2vhj h ASP 175 Cb -0.06 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 2vhj h ASP 175 CO -0.03 0.30 -0.37 0.40 -1.72 0.00 0.00 179.24 177.82 2vhj h ILE 176 N 0.54 1.27 -0.04 0.35 2.04 -0.93 -0.77 117.51 119.97 2vhj h ILE 176 Ca 0.19 -1.54 0.01 0.00 1.00 0.00 0.00 64.86 64.53 2vhj h ILE 176 Cb 0.04 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 2vhj h ILE 176 CO -0.10 0.51 -0.03 0.00 0.00 0.00 0.00 178.15 178.53 2vhj h ALA 177 N 0.77 0.01 -0.59 1.87 0.00 -1.01 -1.21 119.26 119.10 2vhj h ALA 177 Ca 0.06 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2vhj h ALA 177 Cb 0.96 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 2vhj h ALA 177 CO 0.09 -0.51 0.38 -0.09 0.00 0.00 0.00 179.25 179.12 2vhj h ARG 178 N -0.03 0.76 -0.31 0.00 2.43 -1.24 -1.36 114.38 114.61 2vhj h ARG 178 Ca 0.03 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 2vhj h ARG 178 Cb 0.07 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2vhj h ARG 178 CO -0.06 0.50 0.17 0.00 -1.51 0.00 0.00 179.97 179.07 2vhj h ALA 179 N 1.22 0.39 -0.01 2.80 0.00 -0.86 -1.72 119.26 121.08 2vhj h ALA 179 Ca 0.22 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 2vhj h ALA 179 Cb -0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2vhj h ALA 179 CO -0.06 -0.20 -0.54 0.52 0.00 0.00 0.00 179.25 178.98 2vhj h MET 180 N 0.36 0.02 0.00 0.00 2.86 -1.06 0.78 114.93 117.89 2vhj h MET 180 Ca 0.13 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.69 2vhj h MET 180 Cb 0.02 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 2vhj h MET 180 CO -0.07 0.55 -0.32 -0.07 1.06 0.00 0.00 176.91 178.06 2vhj h LEU 181 N 0.02 0.00 -0.05 1.22 3.38 -0.88 -3.38 115.31 115.62 2vhj h LEU 181 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vhj h LEU 181 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2vhj h LEU 181 CO 0.07 0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.92 2vhj n GLN 182 N -3.61 5.29 -3.85 1.13 6.02 -0.68 -4.97 117.38 116.70 2vhj n GLN 182 Ca -0.01 -0.03 -0.12 0.00 -0.01 0.00 0.00 57.00 56.84 2vhj n GLN 182 Cb 0.45 -0.44 -0.11 0.00 1.02 0.00 0.00 30.24 31.15 2vhj n GLN 182 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2vhj s HIS 183 N -0.76 -0.05 0.12 1.08 3.76 0.23 -5.05 115.29 114.63 2vhj s HIS 183 Ca 0.00 0.11 0.07 0.00 -0.15 0.00 0.00 55.06 55.09 2vhj s HIS 183 Cb 0.00 -0.00 -0.17 0.00 1.11 0.00 0.00 32.58 33.52 2vhj s HIS 183 CO 0.00 -0.17 1.30 -0.09 -0.85 0.00 0.00 174.74 174.94 2vhj h ARG 184 N 5.19 0.00 -4.64 1.40 2.43 -1.90 -3.42 114.38 113.45 2vhj h ARG 184 Ca -0.28 0.00 -0.58 0.00 -0.81 0.00 0.00 59.98 58.32 2vhj h ARG 184 Cb 1.20 0.00 -0.35 0.00 -0.42 0.00 0.00 29.97 30.40 2vhj h ARG 184 CO 0.41 0.97 -0.83 0.08 -1.51 0.00 0.00 179.97 179.09 2vhj s VAL 185 N -2.77 1.43 -0.03 0.20 1.01 -1.26 -0.44 120.40 118.54 2vhj s VAL 185 Ca 0.01 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2vhj s VAL 185 Cb 0.10 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 35.16 2vhj s VAL 185 CO 0.81 0.43 -0.06 -0.63 0.00 0.00 0.00 175.10 175.65 2vhj s ILE 186 N 1.21 0.60 -0.09 2.22 1.01 -0.25 -0.87 121.20 125.02 2vhj s ILE 186 Ca -0.02 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.41 2vhj s ILE 186 Cb -0.14 -0.56 -0.02 0.00 0.01 0.00 0.00 42.46 41.75 2vhj s ILE 186 CO -0.05 0.21 -0.12 -0.69 0.00 0.00 0.00 174.94 174.29 2vhj s VAL 187 N 0.42 3.19 -0.19 2.92 1.01 0.11 -0.15 120.40 127.71 2vhj s VAL 187 Ca -0.06 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 2vhj s VAL 187 Cb -0.10 -2.31 -0.00 0.00 0.00 0.00 0.00 36.38 33.97 2vhj s VAL 187 CO 0.00 0.56 -0.10 -0.63 0.00 0.00 0.00 175.10 174.93 2vhj s ILE 188 N -0.18 2.98 -0.31 2.22 1.01 0.56 0.11 121.20 127.58 2vhj s ILE 188 Ca 0.00 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.03 2vhj s ILE 188 Cb -0.13 -2.31 0.10 0.00 0.01 0.00 0.00 42.46 40.12 2vhj s ILE 188 CO 0.03 0.47 0.06 -0.62 0.00 0.00 0.00 174.94 174.89 2vhj s ASP 189 N 1.22 4.30 0.16 3.58 2.15 -0.26 -1.84 116.67 125.99 2vhj s ASP 189 Ca 0.02 -1.80 0.02 0.00 0.43 0.00 0.00 52.55 51.22 2vhj s ASP 189 Cb -0.14 -1.20 -0.01 0.00 -0.30 0.00 0.00 42.92 41.27 2vhj s ASP 189 CO -0.04 -0.38 0.18 -1.54 -0.17 0.00 0.00 175.17 173.22 2vhj n SER 190 N 4.59 -0.49 -0.91 -0.34 3.41 -0.58 -0.16 113.62 119.14 2vhj n SER 190 Ca -0.01 -1.98 0.08 0.00 -0.26 0.00 0.00 58.87 56.70 2vhj n SER 190 Cb 0.42 1.00 0.22 0.00 -0.26 0.00 0.00 64.21 65.59 2vhj n SER 190 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2vhj n LEU 191 N 0.00 2.65 0.06 1.04 4.77 -0.26 -4.58 117.00 120.69 2vhj n LEU 191 Ca 0.02 -1.32 -0.12 0.00 -0.03 0.00 0.00 56.01 54.56 2vhj n LEU 191 Cb 0.29 -0.33 -0.05 0.00 -2.33 0.00 0.00 43.42 41.00 2vhj n LEU 191 CO 0.14 0.66 0.68 0.50 -1.33 0.00 0.00 177.39 178.05 2vhj h LYS 192 N 2.90 -0.40 -0.00 3.23 3.64 -1.87 -2.25 116.57 121.82 2vhj h LYS 192 Ca 0.00 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2vhj h LYS 192 Cb 0.66 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2vhj h LYS 192 CO 0.00 -0.27 -0.10 0.09 -2.27 0.00 0.00 179.45 176.90 2vhj n ASN 193 N -5.38 0.16 0.00 4.20 4.13 -1.26 -3.78 115.26 113.33 2vhj n ASN 193 Ca -0.05 0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.28 2vhj n ASN 193 Cb 0.30 -0.26 0.00 0.00 -1.54 0.00 0.00 39.78 38.27 2vhj n ASN 193 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2vhj n VAL 194 N -1.36 0.00 -2.23 2.41 0.31 -0.89 -5.00 118.33 111.57 2vhj n VAL 194 Ca 0.09 0.77 -0.40 0.00 -0.01 0.00 0.00 64.34 64.79 2vhj n VAL 194 Cb 0.31 -1.58 -0.03 0.00 -0.91 0.00 0.00 33.84 31.63 2vhj n VAL 194 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2vhj s ILE 195 N -1.39 3.56 -0.30 2.52 1.01 -0.98 -4.74 121.20 120.89 2vhj s ILE 195 Ca 0.00 0.41 -0.20 0.00 0.00 0.00 0.00 60.65 60.86 2vhj s ILE 195 Cb 0.00 -4.23 0.19 0.00 0.01 0.00 0.00 42.46 38.43 2vhj s ILE 195 CO 0.00 -1.11 1.29 -0.63 0.00 0.00 0.00 174.94 174.50 2vhj s ILE 207 N 7.38 0.00 0.74 2.92 1.01 -1.26 -5.10 121.20 126.89 2vhj s ILE 207 Ca 0.58 0.00 -0.11 0.00 0.00 0.00 0.00 60.65 61.12 2vhj s ILE 207 Cb -0.12 -1.00 0.04 0.00 0.01 0.00 0.00 42.46 41.39 2vhj s ILE 207 CO 0.22 0.00 1.09 -0.94 0.00 0.00 0.00 174.94 175.31 2vhj s SER 208 N 0.66 4.77 0.16 3.58 1.04 -1.26 -4.86 113.70 117.79 2vhj s SER 208 Ca -0.02 1.81 -0.15 0.00 0.48 0.00 0.00 55.95 58.07 2vhj s SER 208 Cb -0.03 -2.52 0.07 0.00 0.10 0.00 0.00 66.02 63.64 2vhj s SER 208 CO -0.12 -1.86 1.79 0.03 0.98 0.00 0.00 173.24 174.06 2vhj h ARG 209 N -0.87 0.44 -0.73 4.02 3.08 -1.87 -1.12 114.38 117.33 2vhj h ARG 209 Ca -0.44 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.55 2vhj h ARG 209 Cb 1.23 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.15 2vhj h ARG 209 CO 0.53 0.29 0.34 0.78 -1.07 0.00 0.00 179.97 180.84 2vhj h GLY 210 N 0.45 1.12 1.08 0.04 0.00 -1.38 0.35 103.07 104.73 2vhj h GLY 210 Ca 0.18 -0.55 -0.12 0.00 0.00 0.00 0.00 47.33 46.84 2vhj h GLY 210 CO -0.11 0.53 -0.18 0.00 0.00 0.00 0.00 176.54 176.77 2vhj h ALA 211 N 1.33 0.66 -0.46 3.60 0.00 -1.73 -0.88 119.26 121.78 2vhj h ALA 211 Ca 0.25 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2vhj h ALA 211 Cb 0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2vhj h ALA 211 CO -0.03 0.61 -0.12 0.35 0.00 0.00 0.00 179.25 180.06 2vhj h PHE 212 N 0.80 1.00 -0.50 0.00 3.57 -0.97 -2.80 116.94 118.03 2vhj h PHE 212 Ca 0.11 -0.22 0.09 0.00 3.53 0.00 0.00 57.97 61.48 2vhj h PHE 212 Cb 0.75 -0.24 -0.07 0.00 2.79 0.00 0.00 35.95 39.17 2vhj h PHE 212 CO 0.05 0.99 0.09 -0.44 -2.23 0.00 0.00 178.31 176.77 2vhj h ASP 213 N 0.73 -0.03 0.03 0.41 3.32 -0.79 -2.32 116.42 117.76 2vhj h ASP 213 Ca 0.11 0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.28 2vhj h ASP 213 Cb 0.67 0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 2vhj h ASP 213 CO 0.05 0.01 -0.15 0.25 -1.72 0.00 0.00 179.24 177.68 2vhj h LEU 214 N 0.22 -0.44 -1.19 1.55 5.85 -0.91 0.74 115.31 121.14 2vhj h LEU 214 Ca 0.25 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.95 2vhj h LEU 214 Cb 0.35 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2vhj h LEU 214 CO -0.35 -0.21 -0.33 0.25 -0.34 0.00 0.00 178.44 177.46 2vhj h LEU 215 N -0.27 0.14 -1.16 2.25 5.85 -1.42 -0.32 115.31 120.38 2vhj h LEU 215 Ca 0.04 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 2vhj h LEU 215 Cb 0.32 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2vhj h LEU 215 CO -0.13 0.46 -0.41 0.28 -0.34 0.00 0.00 178.44 178.30 2vhj h SER 216 N 0.12 0.01 0.00 1.25 0.02 -0.90 -3.38 113.55 110.66 2vhj h SER 216 Ca 0.02 -0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.66 2vhj h SER 216 Cb 0.64 -0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.12 2vhj h SER 216 CO 0.05 0.42 -2.14 0.47 -1.14 0.00 0.00 176.83 174.49 2vhj n ASP 217 N -4.05 1.93 -0.20 3.07 8.00 0.21 -4.79 116.55 120.72 2vhj n ASP 217 Ca -0.02 -0.07 -0.08 0.00 0.71 0.00 0.00 54.79 55.33 2vhj n ASP 217 Cb 0.44 0.10 0.02 0.00 -0.02 0.00 0.00 41.12 41.67 2vhj n ASP 217 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2vhj h ILE 218 N 0.00 1.23 -0.31 0.53 2.04 -1.26 -1.13 117.51 118.61 2vhj h ILE 218 Ca -0.45 -0.76 0.06 0.00 1.00 0.00 0.00 64.86 64.71 2vhj h ILE 218 Cb 1.81 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 2vhj h ILE 218 CO -0.04 0.29 -0.03 1.23 0.00 0.00 0.00 178.15 179.60 2vhj h GLY 219 N 0.78 0.27 0.99 5.37 0.00 -1.83 0.40 103.07 109.05 2vhj h GLY 219 Ca 0.18 0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.53 2vhj h GLY 219 CO -0.01 -0.09 0.17 0.00 0.00 0.00 0.00 176.54 176.61 2vhj h ALA 220 N 1.29 0.71 -0.27 3.60 0.00 -1.78 0.11 119.26 122.93 2vhj h ALA 220 Ca 0.15 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2vhj h ALA 220 Cb 0.22 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2vhj h ALA 220 CO -0.28 0.38 0.15 0.52 0.00 0.00 0.00 179.25 180.02 2vhj h MET 221 N 0.75 0.31 -0.30 0.00 2.07 -0.86 -0.52 114.93 116.38 2vhj h MET 221 Ca 0.18 -0.02 -0.05 0.00 -2.07 0.00 0.00 59.70 57.73 2vhj h MET 221 Cb 0.28 -0.07 -0.01 0.00 -1.87 0.00 0.00 31.60 29.93 2vhj h MET 221 CO -0.01 0.21 -0.01 0.00 1.07 0.00 0.00 176.91 178.17 2vhj h ALA 222 N 1.12 0.41 -0.92 6.32 0.00 -0.77 -2.17 119.26 123.25 2vhj h ALA 222 Ca 0.10 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2vhj h ALA 222 Cb -0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 2vhj h ALA 222 CO -0.05 0.18 0.60 0.00 0.00 0.00 0.00 179.25 179.98 2vhj h ALA 223 N 0.83 1.17 -0.87 0.00 0.00 -0.87 0.15 119.26 119.66 2vhj h ALA 223 Ca 0.08 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2vhj h ALA 223 Cb 0.46 -0.37 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2vhj h ALA 223 CO 0.02 0.58 0.57 0.77 0.00 0.00 0.00 179.25 181.18 2vhj h SER 224 N 1.25 0.96 0.77 0.00 0.02 -0.93 -2.70 113.55 112.91 2vhj h SER 224 Ca 0.34 -0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 61.12 2vhj h SER 224 Cb -0.13 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.16 2vhj h SER 224 CO -0.07 0.67 -0.71 -0.09 -1.14 0.00 0.00 176.83 175.49 2vhj h ARG 225 N 1.13 0.00 0.00 3.45 9.65 -0.83 -3.45 114.38 124.32 2vhj h ARG 225 Ca 0.34 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.22 2vhj h ARG 225 Cb -0.05 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.53 2vhj h ARG 225 CO -0.10 0.71 0.00 0.41 2.80 0.00 0.00 179.97 183.80 2vhj n GLY 226 N 0.60 0.51 3.97 2.80 0.00 0.46 -3.65 105.19 109.88 2vhj n GLY 226 Ca -0.01 -0.68 -0.21 0.00 0.00 0.00 0.00 46.02 45.12 2vhj n GLY 226 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vhj s VAL 228 N -2.10 2.89 -0.24 0.00 0.11 0.42 -0.83 120.40 120.66 2vhj s VAL 228 Ca 0.37 -0.75 -0.03 0.00 -2.93 0.00 0.00 61.98 58.65 2vhj s VAL 228 Cb -0.09 -2.16 0.01 0.00 -1.53 0.00 0.00 36.38 32.61 2vhj s VAL 228 CO 0.31 0.56 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.89 2vhj s VAL 229 N -0.12 3.06 -0.36 2.04 1.01 0.04 -1.09 120.40 124.97 2vhj s VAL 229 Ca -0.02 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.07 2vhj s VAL 229 Cb -0.14 -2.48 0.05 0.00 0.00 0.00 0.00 36.38 33.81 2vhj s VAL 229 CO 0.04 0.30 0.16 -0.63 0.00 0.00 0.00 175.10 174.96 2vhj s ILE 230 N 1.39 4.04 -0.10 2.22 1.01 0.79 0.14 121.20 130.69 2vhj s ILE 230 Ca 0.03 -1.14 0.04 0.00 0.00 0.00 0.00 60.65 59.57 2vhj s ILE 230 Cb -0.16 -3.33 -0.00 0.00 0.01 0.00 0.00 42.46 38.98 2vhj s ILE 230 CO -0.04 -0.27 -0.22 0.00 0.00 0.00 0.00 174.94 174.41 2vhj s ALA 231 N 1.44 2.25 0.22 9.38 0.00 0.25 -0.32 121.76 134.97 2vhj s ALA 231 Ca 0.00 -0.97 -0.27 0.00 0.00 0.00 0.00 51.96 50.72 2vhj s ALA 231 Cb -0.20 -0.85 -0.09 0.00 0.00 0.00 0.00 23.12 21.98 2vhj s ALA 231 CO 0.03 0.31 0.87 0.45 0.00 0.00 0.00 175.76 177.42 2vhj s SER 232 N 0.23 7.48 -0.17 0.00 0.15 -0.76 -0.54 113.70 120.08 2vhj s SER 232 Ca -0.14 1.79 -0.04 0.00 0.70 0.00 0.00 55.95 58.25 2vhj s SER 232 Cb -0.17 -2.55 0.08 0.00 -1.71 0.00 0.00 66.02 61.67 2vhj s SER 232 CO 0.07 0.14 0.20 -0.22 1.20 0.00 0.00 173.24 174.64 2vhj s LEU 233 N -1.33 -0.08 0.21 3.45 2.96 -0.15 -1.10 118.68 122.65 2vhj s LEU 233 Ca 0.40 -0.08 -0.25 0.00 -0.22 0.00 0.00 54.13 53.98 2vhj s LEU 233 Cb -0.23 0.33 -0.08 0.00 0.50 0.00 0.00 46.19 46.70 2vhj s LEU 233 CO 0.28 -0.31 0.81 0.20 -1.32 0.00 0.00 176.35 176.01 2vhj s ASN 234 N 2.31 7.34 -0.41 3.68 0.01 -1.26 -4.27 114.94 122.33 2vhj s ASN 234 Ca 0.05 1.66 -0.28 0.00 -0.71 0.00 0.00 52.86 53.58 2vhj s ASN 234 Cb -0.15 -2.50 -0.03 0.00 0.41 0.00 0.00 41.25 38.98 2vhj s ASN 234 CO -0.10 0.13 1.92 -2.16 -1.51 0.00 0.00 177.10 175.37 2vhj s PRO 235 N -1.46 3.00 0.31 -0.60 0.04 -1.26 -4.75 135.00 130.28 2vhj s PRO 235 Ca 0.40 1.27 0.14 0.00 0.04 0.00 0.00 61.00 62.84 2vhj s PRO 235 Cb -0.21 -4.30 0.46 0.00 0.04 0.00 0.00 34.50 30.49 2vhj s PRO 235 CO 0.25 -2.26 1.65 0.00 0.04 0.00 0.00 177.00 176.68 2vhj h THR 236 N 6.95 1.21 -1.41 1.26 1.03 -1.94 -3.43 112.91 116.57 2vhj h THR 236 Ca -0.31 -1.91 -0.01 0.00 -0.01 0.00 0.00 66.41 64.17 2vhj h THR 236 Cb 1.18 2.08 0.00 0.00 -1.07 0.00 0.00 68.15 70.35 2vhj h THR 236 CO 1.09 0.52 0.00 -1.20 -0.01 0.00 0.00 175.52 175.91 2vhj n SER 237 N -3.66 -1.29 -3.07 0.00 7.64 -1.26 -5.02 113.62 106.96 2vhj n SER 237 Ca -0.01 -0.39 -0.13 0.00 1.01 0.00 0.00 58.87 59.35 2vhj n SER 237 Cb 0.58 -0.02 0.13 0.00 -1.01 0.00 0.00 64.21 63.89 2vhj n SER 237 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2vhj n ASN 238 N -3.05 -2.74 -1.89 6.43 3.02 -1.26 -4.88 115.26 110.89 2vhj n ASN 238 Ca 0.00 -0.44 -0.04 0.00 -0.03 0.00 0.00 54.58 54.07 2vhj n ASN 238 Cb 0.01 -0.43 0.29 0.00 -0.61 0.00 0.00 39.78 39.04 2vhj n ASN 238 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2vhj n ASP 239 N -4.18 4.70 0.00 6.41 8.00 -1.26 -4.66 116.55 125.56 2vhj n ASP 239 Ca 0.06 -3.06 0.00 0.00 0.71 0.00 0.00 54.79 52.50 2vhj n ASP 239 Cb 0.26 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 2vhj n ASP 239 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2vhj n ASP 240 N -0.00 0.00 0.00 -2.24 2.03 -1.26 -4.85 116.55 110.23 2vhj n ASP 240 Ca 0.36 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.67 2vhj n ASP 240 Cb 1.28 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.68 2vhj n ASP 240 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2vhj n LYS 241 N 0.00 0.00 0.00 -0.67 3.00 -1.26 -4.34 118.16 114.88 2vhj n LYS 241 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2vhj n LYS 241 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2vhj n LYS 241 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2vhj n ILE 242 N 0.00 0.00 -0.12 3.15 2.08 -1.26 -3.36 119.36 119.84 2vhj n ILE 242 Ca 0.00 0.00 -0.04 0.00 0.56 0.00 0.00 62.75 63.27 2vhj n ILE 242 Cb 0.00 0.00 0.03 0.00 -0.75 0.00 0.00 39.64 38.92 2vhj n ILE 242 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2vhj h VAL 243 N 0.00 0.74 -0.37 1.39 2.07 -1.83 -0.97 116.25 117.29 2vhj h VAL 243 Ca 0.00 -0.06 -0.08 0.00 0.82 0.00 0.00 66.70 67.39 2vhj h VAL 243 Cb 0.00 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 2vhj h VAL 243 CO 0.00 0.03 -0.10 -0.33 0.02 0.00 0.00 177.57 177.19 2vhj h GLU 244 N 0.16 0.63 -0.62 1.57 4.39 -1.86 -0.36 114.58 118.49 2vhj h GLU 244 Ca 0.20 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 2vhj h GLU 244 Cb 0.27 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 2vhj h GLU 244 CO -0.30 0.72 0.35 -0.07 -1.16 0.00 0.00 179.01 178.55 2vhj h LEU 245 N 0.58 0.77 -0.47 1.33 4.07 -1.46 -0.58 115.31 119.54 2vhj h LEU 245 Ca 0.11 -0.09 -0.04 0.00 0.08 0.00 0.00 57.88 57.94 2vhj h LEU 245 Cb 0.52 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 2vhj h LEU 245 CO 0.03 0.63 0.15 0.58 -1.08 0.00 0.00 178.44 178.75 2vhj h VAL 246 N 0.84 1.22 -0.35 1.22 2.07 -0.77 -1.34 116.25 119.15 2vhj h VAL 246 Ca 0.22 -0.74 0.04 0.00 0.82 0.00 0.00 66.70 67.04 2vhj h VAL 246 Cb 0.03 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2vhj h VAL 246 CO -0.04 0.27 0.13 0.11 0.02 0.00 0.00 177.57 178.06 2vhj h LYS 247 N 0.62 0.28 0.07 1.57 1.57 -0.82 0.11 116.57 119.97 2vhj h LYS 247 Ca 0.15 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2vhj h LYS 247 Cb 0.26 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2vhj h LYS 247 CO -0.01 0.18 -0.03 0.93 -0.57 0.00 0.00 179.45 179.95 2vhj h GLU 248 N 0.29 -0.09 -0.75 3.15 5.08 -0.97 0.21 114.58 121.50 2vhj h GLU 248 Ca 0.16 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2vhj h GLU 248 Cb 0.12 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 2vhj h GLU 248 CO -0.15 -0.04 0.40 0.00 -1.00 0.00 0.00 179.01 178.22 2vhj h ALA 249 N 0.81 0.96 -0.17 3.43 0.00 -1.11 -1.94 119.26 121.23 2vhj h ALA 249 Ca -0.01 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2vhj h ALA 249 Cb 0.09 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2vhj h ALA 249 CO 0.02 0.49 -0.06 0.77 0.00 0.00 0.00 179.25 180.46 2vhj h SER 250 N 1.04 0.35 -0.26 0.00 0.02 -0.53 -2.87 113.55 111.31 2vhj h SER 250 Ca 0.26 -0.39 0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2vhj h SER 250 Cb 0.05 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 2vhj h SER 250 CO -0.04 0.66 0.05 -0.09 -1.14 0.00 0.00 176.83 176.27 2vhj h ARG 251 N 0.04 0.15 0.00 3.45 2.43 -0.45 -1.35 114.38 118.66 2vhj h ARG 251 Ca 0.04 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 2vhj h ARG 251 Cb 0.51 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 2vhj h ARG 251 CO 0.02 0.10 -0.24 0.00 -1.51 0.00 0.00 179.97 178.33 2vhj h ALA 252 N 1.18 1.53 -0.39 2.80 0.00 -1.39 -2.99 119.26 120.00 2vhj h ALA 252 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2vhj h ALA 252 Cb 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2vhj h ALA 252 CO -0.15 0.31 0.00 0.09 0.00 0.00 0.00 179.25 179.50 2vhj n ASN 253 N -4.15 3.96 -4.26 0.00 4.13 -0.94 -4.96 115.26 109.04 2vhj n ASN 253 Ca -0.02 -2.61 -0.15 0.00 1.68 0.00 0.00 54.58 53.48 2vhj n ASN 253 Cb 0.30 -0.48 -0.10 0.00 -1.54 0.00 0.00 39.78 37.97 2vhj n ASN 253 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2vhj s SER 254 N -1.37 1.83 -0.01 6.41 1.04 -0.55 -4.68 113.70 116.36 2vhj s SER 254 Ca 0.40 -1.04 -0.16 0.00 0.48 0.00 0.00 55.95 55.63 2vhj s SER 254 Cb 0.28 -0.01 -0.33 0.00 0.10 0.00 0.00 66.02 66.06 2vhj s SER 254 CO 0.15 -0.35 0.87 0.74 0.98 0.00 0.00 173.24 175.63 2vhj h THR 255 N 2.73 1.23 -3.95 2.02 2.02 -0.99 -3.47 112.91 112.51 2vhj h THR 255 Ca -0.37 -2.60 -0.39 0.00 0.77 0.00 0.00 66.41 63.83 2vhj h THR 255 Cb 1.20 2.99 -0.21 0.00 -1.74 0.00 0.00 68.15 70.38 2vhj h THR 255 CO 0.64 0.79 -0.77 -0.44 0.37 0.00 0.00 175.52 176.11 2vhj s SER 256 N -7.36 1.53 -0.05 4.18 0.01 -0.87 -1.23 113.70 109.91 2vhj s SER 256 Ca -0.12 -0.61 0.05 0.00 1.31 0.00 0.00 55.95 56.58 2vhj s SER 256 Cb 0.04 -0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.23 2vhj s SER 256 CO 0.89 -0.10 -0.21 -0.22 0.41 0.00 0.00 173.24 174.01 2vhj s LEU 257 N -1.72 1.98 -0.15 2.44 2.96 0.17 -2.09 118.68 122.27 2vhj s LEU 257 Ca -0.03 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.46 2vhj s LEU 257 Cb -0.10 -1.15 0.02 0.00 0.50 0.00 0.00 46.19 45.46 2vhj s LEU 257 CO 0.02 0.19 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.37 2vhj s VAL 258 N -0.03 1.80 0.01 1.68 1.01 -0.20 -0.03 120.40 124.64 2vhj s VAL 258 Ca -0.04 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.20 2vhj s VAL 258 Cb -0.13 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 2vhj s VAL 258 CO 0.03 0.50 -0.17 0.27 0.00 0.00 0.00 175.10 175.73 2vhj s ILE 259 N 1.23 1.37 0.82 2.22 -4.36 -0.29 -0.75 121.20 121.44 2vhj s ILE 259 Ca 0.01 -0.88 -0.11 0.00 -0.26 0.00 0.00 60.65 59.41 2vhj s ILE 259 Cb -0.14 -1.17 0.08 0.00 1.25 0.00 0.00 42.46 42.49 2vhj s ILE 259 CO -0.09 0.27 1.09 -0.94 0.24 0.00 0.00 174.94 175.51 2vhj s SER 260 N -0.72 4.11 0.40 4.36 1.04 -0.93 -1.28 113.70 120.69 2vhj s SER 260 Ca 0.06 1.68 0.05 0.00 0.48 0.00 0.00 55.95 58.22 2vhj s SER 260 Cb -0.07 -2.38 -0.02 0.00 0.10 0.00 0.00 66.02 63.65 2vhj s SER 260 CO 0.00 -2.26 0.17 0.42 0.98 0.00 0.00 173.24 172.55 2vhj s THR 261 N -2.92 0.42 -1.14 2.02 -4.23 -1.15 -4.75 115.64 103.88 2vhj s THR 261 Ca 0.62 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.38 2vhj s THR 261 Cb -0.17 -2.34 0.28 0.00 1.34 0.00 0.00 72.50 71.61 2vhj s THR 261 CO 0.56 0.00 1.82 0.47 -0.54 0.00 0.00 174.62 176.93 2vhj n ASP 262 N -1.44 0.00 -4.65 3.99 8.00 -1.26 -4.69 116.55 116.50 2vhj n ASP 262 Ca -0.03 0.31 -0.39 0.00 0.71 0.00 0.00 54.79 55.39 2vhj n ASP 262 Cb 0.64 -0.43 -0.07 0.00 -0.02 0.00 0.00 41.12 41.24 2vhj n ASP 262 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2vhj s VAL 263 N -2.86 5.11 -0.12 2.53 1.01 -1.26 -5.00 120.40 119.80 2vhj s VAL 263 Ca 0.16 0.87 -0.38 0.00 0.00 0.00 0.00 61.98 62.62 2vhj s VAL 263 Cb 0.17 -3.81 -0.16 0.00 0.00 0.00 0.00 36.38 32.58 2vhj s VAL 263 CO 0.43 0.16 1.61 0.47 0.00 0.00 0.00 175.10 177.77 2vhj n ASP 264 N 5.01 2.22 0.00 3.32 9.92 -1.26 -1.65 116.55 134.12 2vhj n ASP 264 Ca -0.05 1.08 0.00 0.00 -0.53 0.00 0.00 54.79 55.29 2vhj n ASP 264 Cb 0.50 -1.18 0.00 0.00 -0.64 0.00 0.00 41.12 39.80 2vhj n ASP 264 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2vhj n GLY 265 N 3.60 1.67 3.80 0.44 0.00 -1.26 -4.87 105.19 108.57 2vhj n GLY 265 Ca 0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 2vhj n GLY 265 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vhj s GLU 266 N -0.25 3.91 0.05 1.61 2.12 -0.66 -1.65 118.70 123.84 2vhj s GLU 266 Ca 0.00 0.07 0.05 0.00 0.36 0.00 0.00 54.97 55.45 2vhj s GLU 266 Cb 0.00 -3.30 -0.02 0.00 0.26 0.00 0.00 34.13 31.07 2vhj s GLU 266 CO 0.00 0.53 -0.14 -1.58 -0.54 0.00 0.00 175.26 173.53 2vhj s TRP 267 N -0.40 1.20 -0.17 5.30 0.52 -0.27 -2.95 118.94 122.17 2vhj s TRP 267 Ca 0.17 -0.40 -0.06 0.00 0.02 0.00 0.00 56.10 55.83 2vhj s TRP 267 Cb -0.13 -0.70 -0.04 0.00 -1.15 0.00 0.00 33.47 31.45 2vhj s TRP 267 CO 0.06 0.04 0.03 -1.14 0.02 0.00 0.00 176.95 175.96 2vhj s GLN 268 N -1.40 3.87 -0.20 4.98 0.74 -0.40 0.40 119.66 127.65 2vhj s GLN 268 Ca -0.00 -0.39 -0.06 0.00 0.05 0.00 0.00 55.36 54.96 2vhj s GLN 268 Cb -0.09 -3.12 -0.03 0.00 1.10 0.00 0.00 33.01 30.87 2vhj s GLN 268 CO 0.02 0.29 0.03 0.08 -0.55 0.00 0.00 175.29 175.15 2vhj s VAL 269 N 0.31 4.28 -0.24 1.34 1.01 0.11 -1.14 120.40 126.06 2vhj s VAL 269 Ca 0.01 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2vhj s VAL 269 Cb -0.13 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 33.35 2vhj s VAL 269 CO 0.01 0.42 -0.10 -0.76 0.00 0.00 0.00 175.10 174.67 2vhj s LEU 270 N 0.87 3.12 -0.17 3.92 1.02 0.95 -1.47 118.68 126.93 2vhj s LEU 270 Ca 0.02 -1.04 -0.02 0.00 0.02 0.00 0.00 54.13 53.11 2vhj s LEU 270 Cb -0.14 -1.59 -0.01 0.00 0.02 0.00 0.00 46.19 44.46 2vhj s LEU 270 CO 0.02 -0.13 -0.08 -0.89 0.02 0.00 0.00 176.35 175.29 2vhj s THR 271 N 1.24 3.34 -0.53 5.49 2.01 0.45 -0.65 115.64 126.99 2vhj s THR 271 Ca -0.02 -0.53 -0.26 0.00 0.31 0.00 0.00 61.69 61.18 2vhj s THR 271 Cb -0.17 -2.47 0.03 0.00 0.01 0.00 0.00 72.50 69.90 2vhj s THR 271 CO -0.06 0.48 1.04 -0.13 -0.69 0.00 0.00 174.62 175.26 2vhj s ARG 272 N 0.85 3.49 0.00 4.92 0.52 -0.36 -0.78 118.95 127.59 2vhj s ARG 272 Ca -0.02 0.12 0.29 0.00 -0.52 0.00 0.00 55.73 55.60 2vhj s ARG 272 Cb -0.15 -3.99 1.24 0.00 0.52 0.00 0.00 34.95 32.57 2vhj s ARG 272 CO 0.01 -1.46 1.90 0.25 0.02 0.00 0.00 175.30 176.02 2vhj n THR 273 N 6.49 0.00 0.00 0.02 -2.24 -1.19 -4.74 114.28 112.62 2vhj n THR 273 Ca 0.06 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2vhj n THR 273 Cb 0.48 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 2vhj n THR 273 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vhj n GLY 274 N 1.43 0.03 3.63 3.38 0.00 -1.26 -3.98 105.19 108.41 2vhj n GLY 274 Ca 0.09 -1.33 -0.46 0.00 0.00 0.00 0.00 46.02 44.32 2vhj n GLY 274 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2vhj n GLU 275 N -1.11 2.17 -0.84 1.61 2.13 0.15 -1.52 120.64 123.23 2vhj n GLU 275 Ca 0.00 0.74 0.00 0.00 0.66 0.00 0.00 57.16 58.56 2vhj n GLU 275 Cb 0.00 -2.85 0.00 0.00 0.27 0.00 0.00 31.44 28.86 2vhj n GLU 275 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2vhj n GLY 276 N 5.00 0.52 3.97 8.31 0.00 -1.26 -4.98 105.19 116.75 2vhj n GLY 276 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 2vhj n GLY 276 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vhj s LEU 277 N 0.00 3.24 0.46 0.99 1.43 -0.58 -5.03 118.68 119.20 2vhj s LEU 277 Ca 0.00 0.01 -0.24 0.00 -1.03 0.00 0.00 54.13 52.87 2vhj s LEU 277 Cb 0.00 -2.87 -0.09 0.00 0.03 0.00 0.00 46.19 43.26 2vhj s LEU 277 CO 0.00 -1.18 1.17 0.00 0.23 0.00 0.00 176.35 176.57 2vhj n GLN 278 N -2.38 1.59 -3.69 1.70 6.02 -1.26 -4.69 117.38 114.66 2vhj n GLN 278 Ca 0.08 0.57 -0.37 0.00 -0.01 0.00 0.00 57.00 57.28 2vhj n GLN 278 Cb 0.60 -2.28 -0.10 0.00 1.02 0.00 0.00 30.24 29.47 2vhj n GLN 278 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2vhj s ARG 279 N -2.33 3.97 0.13 -1.09 0.52 -1.26 -3.16 118.95 115.73 2vhj s ARG 279 Ca 0.65 -0.32 0.03 0.00 -0.52 0.00 0.00 55.73 55.57 2vhj s ARG 279 Cb -0.49 -3.51 -0.04 0.00 0.52 0.00 0.00 34.95 31.43 2vhj s ARG 279 CO 0.55 -0.02 0.23 -0.51 0.02 0.00 0.00 175.30 175.57 2vhj s LEU 280 N 1.25 4.20 0.00 2.53 1.43 0.04 -4.88 118.68 123.26 2vhj s LEU 280 Ca 0.07 0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.32 2vhj s LEU 280 Cb -0.14 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.27 2vhj s LEU 280 CO 0.06 0.08 -0.11 0.42 0.23 0.00 0.00 176.35 177.03 2vhj s THR 281 N -1.68 0.89 0.20 5.49 -4.23 -1.26 -0.41 115.64 114.65 2vhj s THR 281 Ca 0.34 -0.61 -0.13 0.00 -1.18 0.00 0.00 61.69 60.10 2vhj s THR 281 Cb -0.11 -0.77 0.01 0.00 1.34 0.00 0.00 72.50 72.96 2vhj s THR 281 CO 0.27 0.16 0.43 -1.38 -0.54 0.00 0.00 174.62 173.56 2vhj s HIS 282 N -0.44 0.19 0.03 3.99 -3.43 -0.54 -5.00 115.29 110.10 2vhj s HIS 282 Ca 0.03 -0.55 0.06 0.00 -0.80 0.00 0.00 55.06 53.80 2vhj s HIS 282 Cb -0.05 0.19 -0.03 0.00 -1.43 0.00 0.00 32.58 31.25 2vhj s HIS 282 CO -0.00 -0.88 -0.16 -0.08 -2.00 0.00 0.00 174.74 171.62 2vhj s THR 283 N -3.95 2.94 -0.08 -5.38 -1.32 -1.26 0.07 115.64 106.66 2vhj s THR 283 Ca 0.16 -1.11 -0.00 0.00 -1.21 0.00 0.00 61.69 59.53 2vhj s THR 283 Cb 0.00 -2.25 -0.03 0.00 -1.51 0.00 0.00 72.50 68.72 2vhj s THR 283 CO 0.02 0.35 -0.06 -0.76 -2.21 0.00 0.00 174.62 171.96 2vhj s LEU 284 N -1.42 3.22 -0.08 9.08 1.43 0.16 -4.96 118.68 126.12 2vhj s LEU 284 Ca 0.15 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 2vhj s LEU 284 Cb -0.11 -1.72 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 2vhj s LEU 284 CO 0.06 0.33 -0.06 -1.10 0.23 0.00 0.00 176.35 175.81 2vhj s GLN 285 N -0.63 2.84 0.07 1.70 -1.52 -1.26 -1.12 119.66 119.74 2vhj s GLN 285 Ca 0.10 -0.53 -0.00 0.00 -1.95 0.00 0.00 55.36 52.98 2vhj s GLN 285 Cb -0.12 -2.64 -0.04 0.00 -0.22 0.00 0.00 33.01 29.99 2vhj s GLN 285 CO 0.02 0.64 -0.03 0.95 -0.25 0.00 0.00 175.29 176.62 2vhj s THR 286 N -0.74 0.31 0.05 -0.19 -4.23 -0.66 -0.76 115.64 109.43 2vhj s THR 286 Ca 0.11 -1.85 -0.14 0.00 -1.18 0.00 0.00 61.69 58.63 2vhj s THR 286 Cb -0.11 -1.63 0.02 0.00 1.34 0.00 0.00 72.50 72.12 2vhj s THR 286 CO 0.02 -0.90 0.32 -0.94 -0.54 0.00 0.00 174.62 172.58 2vhj s SER 287 N -2.96 -0.14 0.04 3.99 1.04 -0.79 -4.69 113.70 110.19 2vhj s SER 287 Ca 0.10 -0.20 -0.11 0.00 0.48 0.00 0.00 55.95 56.23 2vhj s SER 287 Cb 0.07 0.38 -0.06 0.00 0.10 0.00 0.00 66.02 66.52 2vhj s SER 287 CO -0.07 -0.65 0.38 -0.31 0.98 0.00 0.00 173.24 173.56 2vhj s TYR 288 N -2.73 3.62 0.00 5.02 2.02 -1.26 -0.82 117.35 123.20 2vhj s TYR 288 Ca -0.04 0.81 0.00 0.00 -0.37 0.00 0.00 57.07 57.47 2vhj s TYR 288 Cb -0.00 -2.17 0.00 0.00 -0.40 0.00 0.00 41.96 39.39 2vhj s TYR 288 CO -0.04 0.57 0.00 0.41 -1.57 0.00 0.00 175.55 174.92 2vhj n GLY 289 N 1.21 3.46 3.77 0.71 0.00 0.05 -4.97 105.19 109.42 2vhj n GLY 289 Ca -0.10 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.73 2vhj n GLY 289 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vhj s GLU 290 N 3.42 3.55 -1.42 1.61 2.12 -1.26 -3.36 118.70 123.36 2vhj s GLU 290 Ca 0.00 1.86 -0.07 0.00 0.36 0.00 0.00 54.97 57.12 2vhj s GLU 290 Cb 0.00 -2.32 0.04 0.00 0.26 0.00 0.00 34.13 32.11 2vhj s GLU 290 CO 0.00 -0.75 0.58 0.72 -0.54 0.00 0.00 175.26 175.27 2vhj n HIS 291 N -0.73 -1.92 -2.08 5.30 8.25 -1.26 -2.28 115.22 120.50 2vhj n HIS 291 Ca 0.09 0.52 -0.18 0.00 -0.26 0.00 0.00 57.72 57.88 2vhj n HIS 291 Cb 0.48 -3.77 -0.04 0.00 1.12 0.00 0.00 29.99 27.78 2vhj n HIS 291 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2vhj n SER 292 N -2.44 -5.12 -4.68 0.41 7.64 -1.21 -4.95 113.62 103.27 2vhj n SER 292 Ca -0.06 0.20 -0.43 0.00 1.01 0.00 0.00 58.87 59.59 2vhj n SER 292 Cb 0.58 -4.39 -0.02 0.00 -1.01 0.00 0.00 64.21 59.36 2vhj n SER 292 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2vhj s VAL 293 N -2.78 4.37 -0.01 0.44 1.01 -0.97 -4.85 120.40 117.61 2vhj s VAL 293 Ca 0.00 1.67 -0.13 0.00 0.00 0.00 0.00 61.98 63.52 2vhj s VAL 293 Cb 0.00 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 2vhj s VAL 293 CO 0.00 -0.07 0.36 -0.22 0.00 0.00 0.00 175.10 175.17 2vhj s LEU 294 N 2.73 4.45 -0.08 3.92 2.96 -1.26 -0.77 118.68 130.64 2vhj s LEU 294 Ca 0.53 0.87 0.03 0.00 -0.22 0.00 0.00 54.13 55.34 2vhj s LEU 294 Cb -0.22 -2.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.92 2vhj s LEU 294 CO 0.17 0.33 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.47 2vhj s THR 295 N -1.10 2.80 -0.26 3.68 2.01 -0.00 -4.67 115.64 118.10 2vhj s THR 295 Ca 0.23 -0.79 -0.17 0.00 0.31 0.00 0.00 61.69 61.27 2vhj s THR 295 Cb -0.16 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2vhj s THR 295 CO 0.12 0.56 0.46 -0.63 -0.69 0.00 0.00 174.62 174.45 2vhj s ILE 296 N -0.25 5.11 0.52 1.82 1.01 -1.26 -1.89 121.20 126.26 2vhj s ILE 296 Ca 0.01 0.76 -0.20 0.00 0.00 0.00 0.00 60.65 61.22 2vhj s ILE 296 Cb -0.13 -3.78 -0.07 0.00 0.01 0.00 0.00 42.46 38.49 2vhj s ILE 296 CO 0.03 0.11 1.10 -1.00 0.00 0.00 0.00 174.94 175.18 2vhj s HIS 297 N 2.22 2.78 0.00 3.97 3.76 0.06 -5.00 115.29 123.09 2vhj s HIS 297 Ca 0.19 1.55 0.00 0.00 -0.15 0.00 0.00 55.06 56.65 2vhj s HIS 297 Cb -0.16 -3.22 0.00 0.00 1.11 0.00 0.00 32.58 30.31 2vhj s HIS 297 CO 0.09 -1.33 0.00 2.41 -0.85 0.00 0.00 174.74 175.06 2vhj n THR 298 N -1.17 0.00 0.00 1.30 -1.04 -1.26 -4.65 114.28 107.46 2vhj n THR 298 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 2vhj n THR 298 Cb 0.51 -0.06 0.00 0.00 -1.82 0.00 0.00 70.33 68.97 2vhj n THR 298 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2vhj n SER 299 N -0.17 0.00 0.00 8.00 2.88 -1.26 -4.98 113.62 118.09 2vhj n SER 299 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2vhj n SER 299 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2vhj n SER 299 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10