#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 4.92 0.03 3.17 -4.36 -1.26 -5.10 121.20 118.59 2vhj s ILE 2 Ca 0.00 0.43 0.07 0.00 -0.26 0.00 0.00 60.65 60.90 2vhj s ILE 2 Cb 0.00 -3.65 -0.02 0.00 1.25 0.00 0.00 42.46 40.04 2vhj s ILE 2 CO 0.00 -0.17 -0.21 -1.00 0.24 0.00 0.00 174.94 173.80 2vhj s HIS 3 N -1.93 1.87 -0.08 1.37 3.76 -1.26 -4.85 115.29 114.16 2vhj s HIS 3 Ca 0.47 -0.37 -0.02 0.00 -0.15 0.00 0.00 55.06 55.00 2vhj s HIS 3 Cb -0.11 -1.14 -0.03 0.00 1.11 0.00 0.00 32.58 32.41 2vhj s HIS 3 CO 0.24 0.06 -0.01 -0.51 -0.85 0.00 0.00 174.74 173.67 2vhj s LEU 4 N -0.99 3.53 0.04 0.89 1.43 -1.26 -5.12 118.68 117.21 2vhj s LEU 4 Ca 0.08 0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.32 2vhj s LEU 4 Cb -0.09 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 2vhj s LEU 4 CO 0.01 0.37 -0.07 -0.31 0.23 0.00 0.00 176.35 176.59 2vhj s TYR 5 N -0.86 0.62 0.47 0.29 2.02 -1.26 -4.98 117.35 113.65 2vhj s TYR 5 Ca 0.13 -0.54 0.02 0.00 -0.37 0.00 0.00 57.07 56.31 2vhj s TYR 5 Cb -0.11 -0.38 0.02 0.00 -0.40 0.00 0.00 41.96 41.08 2vhj s TYR 5 CO 0.02 -0.11 0.13 -0.40 -1.57 0.00 0.00 175.55 173.62 2vhj n ASP 6 N 1.37 3.01 -0.26 2.29 5.68 -1.26 -4.96 116.55 122.42 2vhj n ASP 6 Ca -0.22 -2.88 0.04 0.00 -0.50 0.00 0.00 54.79 51.23 2vhj n ASP 6 Cb 0.55 0.19 0.18 0.00 -1.14 0.00 0.00 41.12 40.90 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 1.04 1.08 -0.16 2.12 0.00 -2.01 -1.20 119.26 120.12 2vhj h ALA 7 Ca -0.35 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2vhj h ALA 7 Cb 1.14 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2vhj h ALA 7 CO 0.58 -0.12 -0.05 0.87 0.00 0.00 0.00 179.25 180.53 2vhj h LYS 8 N 0.55 0.32 0.00 0.00 1.57 -1.99 -1.60 116.57 115.42 2vhj h LYS 8 Ca 0.40 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 58.94 2vhj h LYS 8 Cb 0.53 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 2vhj h LYS 8 CO -0.34 0.60 -0.55 0.66 -0.57 0.00 0.00 179.45 179.26 2vhj h SER 9 N 0.02 0.00 -0.35 0.86 4.64 -1.91 -2.33 113.55 114.48 2vhj h SER 9 Ca 0.04 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.28 2vhj h SER 9 Cb 0.49 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 2vhj h SER 9 CO 0.02 0.55 -0.11 0.15 -0.87 0.00 0.00 176.83 176.56 2vhj h PHE 10 N 0.00 0.79 -0.95 4.77 3.57 -1.17 -0.55 116.94 123.40 2vhj h PHE 10 Ca -0.01 -0.18 0.06 0.00 3.53 0.00 0.00 57.97 61.38 2vhj h PHE 10 Cb 1.01 -0.19 -0.06 0.00 2.79 0.00 0.00 35.95 39.49 2vhj h PHE 10 CO 0.00 0.87 0.62 0.00 -2.23 0.00 0.00 178.31 177.57 2vhj h ALA 11 N 0.81 1.46 -0.43 2.41 0.00 -1.09 -0.75 119.26 121.66 2vhj h ALA 11 Ca 0.09 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2vhj h ALA 11 Cb 0.63 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2vhj h ALA 11 CO 0.04 0.41 -0.03 0.87 0.00 0.00 0.00 179.25 180.54 2vhj h LYS 12 N 1.11 0.78 0.13 0.00 1.57 -1.16 -1.69 116.57 117.30 2vhj h LYS 12 Ca 0.41 -0.26 0.02 0.00 -1.87 0.00 0.00 60.65 58.95 2vhj h LYS 12 Cb 0.17 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 2vhj h LYS 12 CO -0.16 0.86 -0.33 1.25 -0.57 0.00 0.00 179.45 180.51 2vhj h LEU 13 N 0.61 -0.94 -1.19 2.94 5.85 -0.57 0.01 115.31 122.03 2vhj h LEU 13 Ca 0.12 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.97 2vhj h LEU 13 Cb 0.53 0.35 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 2vhj h LEU 13 CO 0.03 -0.41 0.55 0.03 -0.34 0.00 0.00 178.44 178.30 2vhj h ARG 14 N -0.55 1.06 -0.69 1.25 2.47 -1.09 0.13 114.38 116.94 2vhj h ARG 14 Ca 0.03 -0.06 -0.05 0.00 -1.26 0.00 0.00 59.98 58.64 2vhj h ARG 14 Cb 0.58 -0.24 -0.03 0.00 -1.65 0.00 0.00 29.97 28.63 2vhj h ARG 14 CO -0.19 0.70 0.26 0.00 0.56 0.00 0.00 179.97 181.30 2vhj h ALA 15 N 1.49 0.90 -0.44 0.04 0.00 -0.96 0.02 119.26 120.32 2vhj h ALA 15 Ca 0.32 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 2vhj h ALA 15 Cb -0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2vhj h ALA 15 CO -0.08 0.54 -0.25 0.00 0.00 0.00 0.00 179.25 179.47 2vhj h ALA 16 N 1.12 0.62 -0.39 0.00 0.00 0.35 -1.37 119.26 119.58 2vhj h ALA 16 Ca 0.23 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 2vhj h ALA 16 Cb 0.24 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2vhj h ALA 16 CO -0.01 0.63 0.09 1.96 0.00 0.00 0.00 179.25 181.91 2vhj h GLN 17 N 0.78 0.63 -0.37 0.00 4.20 -0.68 -0.54 115.11 119.13 2vhj h GLN 17 Ca 0.09 -0.16 0.06 0.00 0.06 0.00 0.00 58.65 58.71 2vhj h GLN 17 Cb 0.82 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.47 2vhj h GLN 17 CO 0.07 0.66 0.04 -0.92 -0.67 0.00 0.00 178.83 178.01 2vhj h TYR 18 N 0.49 0.05 -0.68 2.96 3.20 -0.92 -2.11 116.97 119.96 2vhj h TYR 18 Ca 0.12 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 2vhj h TYR 18 Cb 0.32 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.59 2vhj h TYR 18 CO 0.02 -0.03 0.32 0.00 -1.64 0.00 0.00 178.16 176.83 2vhj h ALA 19 N 1.30 1.29 -0.36 1.82 0.00 -1.04 -0.67 119.26 121.60 2vhj h ALA 19 Ca 0.18 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.05 2vhj h ALA 19 Cb 0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2vhj h ALA 19 CO -0.27 0.55 0.27 0.00 0.00 0.00 0.00 179.25 179.80 2vhj h ALA 20 N 1.39 2.29 0.00 0.00 0.00 -0.39 -0.95 119.26 121.61 2vhj h ALA 20 Ca 0.24 -0.01 -0.40 0.00 0.00 0.00 0.00 54.91 54.73 2vhj h ALA 20 Cb 0.11 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2vhj h ALA 20 CO -0.03 -0.45 -2.19 0.34 0.00 0.00 0.00 179.25 176.92 2vhj n PHE 21 N -4.34 0.31 0.02 0.00 7.35 -1.02 -1.83 117.46 117.95 2vhj n PHE 21 Ca 0.06 0.13 -0.07 0.00 -0.76 0.00 0.00 57.45 56.81 2vhj n PHE 21 Cb 0.45 -1.03 -0.12 0.00 0.35 0.00 0.00 39.48 39.13 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 -0.90 0.00 0.00 -5.13 3.86 -1.02 -3.41 115.15 108.55 2vhj h HIS 22 Ca -0.60 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.61 2vhj h HIS 22 Cb 1.57 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.04 2vhj h HIS 22 CO -0.03 0.93 -0.47 0.25 0.86 0.00 0.00 177.93 179.47 2vhj n THR 23 N -3.14 0.00 -1.74 2.45 -2.24 -0.78 -5.05 114.28 103.79 2vhj n THR 23 Ca -0.10 -0.04 -0.37 0.00 -2.27 0.00 0.00 64.05 61.27 2vhj n THR 23 Cb 0.98 0.39 0.06 0.00 -2.10 0.00 0.00 70.33 69.66 2vhj n THR 23 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2vhj s ASP 24 N -1.03 4.75 0.18 3.42 1.11 -0.43 -4.94 116.67 119.73 2vhj s ASP 24 Ca 0.00 2.68 -0.32 0.00 0.18 0.00 0.00 52.55 55.10 2vhj s ASP 24 Cb 0.00 -2.62 -0.11 0.00 1.07 0.00 0.00 42.92 41.26 2vhj s ASP 24 CO 0.00 -1.92 1.68 0.00 1.18 0.00 0.00 175.17 176.12 2vhj s ALA 25 N -1.36 3.86 0.20 5.23 0.00 -1.26 -4.91 121.76 123.52 2vhj s ALA 25 Ca 0.80 1.49 -0.32 0.00 0.00 0.00 0.00 51.96 53.93 2vhj s ALA 25 Cb -0.39 -3.68 -0.15 0.00 0.00 0.00 0.00 23.12 18.91 2vhj s ALA 25 CO 0.42 -0.92 1.32 -2.30 0.00 0.00 0.00 175.76 174.28 2vhj n PRO 26 N 4.23 1.63 -0.97 0.00 -0.02 -1.26 -1.47 135.00 137.14 2vhj n PRO 26 Ca 0.15 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 2vhj n PRO 26 Cb 0.37 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 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 2.23 0.91 0.23 -1.23 0.00 -0.57 -4.82 105.19 101.94 2vhj n GLY 27 Ca 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.08 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 0.63 -0.30 1.61 4.64 -1.47 -2.30 113.55 116.36 2vhj h SER 28 Ca 0.00 -0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 2vhj h SER 28 Cb 0.00 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2vhj h SER 28 CO 0.00 0.95 0.14 -0.25 -0.87 0.00 0.00 176.83 176.80 2vhj h TRP 29 N 0.49 0.43 -0.44 4.77 2.91 -1.84 -0.44 115.95 121.85 2vhj h TRP 29 Ca 0.04 -0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.12 2vhj h TRP 29 Cb 0.89 -0.13 -0.06 0.00 -0.51 0.00 0.00 29.16 29.35 2vhj h TRP 29 CO 0.04 0.40 0.06 0.35 -1.03 0.00 0.00 178.44 178.25 2vhj h PHE 30 N 0.34 0.08 -0.63 2.65 3.57 -1.63 -0.70 116.94 120.63 2vhj h PHE 30 Ca 0.10 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 2vhj h PHE 30 Cb 0.13 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 2vhj h PHE 30 CO -0.02 -0.03 0.28 -0.44 -2.23 0.00 0.00 178.31 175.88 2vhj h ASP 31 N 0.18 0.81 0.10 0.41 3.32 -1.00 -0.29 116.42 119.95 2vhj h ASP 31 Ca 0.21 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2vhj h ASP 31 Cb 0.29 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2vhj h ASP 31 CO -0.31 0.70 -0.05 -0.74 -1.72 0.00 0.00 179.24 177.12 2vhj h HIS 32 N 0.89 -0.13 0.00 4.55 2.76 -0.28 -2.69 115.15 120.26 2vhj h HIS 32 Ca 0.22 -0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.30 2vhj h HIS 32 Cb 0.12 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 2vhj h HIS 32 CO 0.01 0.00 -0.42 1.79 -1.30 0.00 0.00 177.93 178.01 2vhj h THR 33 N -0.23 1.19 -0.71 6.26 1.35 -0.80 -1.49 112.91 118.48 2vhj h THR 33 Ca -0.01 -1.49 0.06 0.00 -0.55 0.00 0.00 66.41 64.42 2vhj h THR 33 Cb 0.19 1.83 -0.06 0.00 -1.73 0.00 0.00 68.15 68.38 2vhj h THR 33 CO 0.02 0.41 0.40 0.28 -0.25 0.00 0.00 175.52 176.39 2vhj h SER 34 N 0.00 0.60 -0.40 5.36 0.02 -1.00 0.75 113.55 118.89 2vhj h SER 34 Ca -0.00 0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 2vhj h SER 34 Cb 0.80 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 2vhj h SER 34 CO 0.05 0.38 -0.02 1.23 -1.14 0.00 0.00 176.83 177.34 2vhj h GLY 35 N 0.73 0.77 0.80 -3.77 0.00 -0.95 0.77 103.07 101.42 2vhj h GLY 35 Ca 0.32 -0.58 0.03 0.00 0.00 0.00 0.00 47.33 47.09 2vhj h GLY 35 CO -0.19 0.54 0.12 -2.08 0.00 0.00 0.00 176.54 174.93 2vhj h VAL 36 N 0.54 0.95 -0.73 4.60 2.07 -1.08 -1.91 116.25 120.69 2vhj h VAL 36 Ca 0.11 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 2vhj h VAL 36 Cb 0.51 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2vhj h VAL 36 CO 0.02 0.05 0.29 -0.07 0.02 0.00 0.00 177.57 177.88 2vhj h LEU 37 N 0.26 1.01 -1.28 2.57 3.38 -0.57 -2.72 115.31 117.96 2vhj h LEU 37 Ca 0.13 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2vhj h LEU 37 Cb 0.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2vhj h LEU 37 CO -0.11 0.91 -0.16 -0.33 0.09 0.00 0.00 178.44 178.83 2vhj h GLU 38 N 1.05 0.29 -0.00 1.13 5.08 -0.66 -2.89 114.58 118.57 2vhj h GLU 38 Ca 0.24 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2vhj h GLU 38 Cb 0.22 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2vhj h GLU 38 CO -0.02 0.45 -0.12 -1.13 -1.00 0.00 0.00 179.01 177.20 2vhj n SER 39 N -4.23 0.20 -4.75 1.42 3.41 -0.74 -4.87 113.62 104.06 2vhj n SER 39 Ca -0.00 0.02 -0.41 0.00 -0.26 0.00 0.00 58.87 58.21 2vhj n SER 39 Cb 0.30 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.01 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 -2.81 2.07 0.73 -3.33 1.01 -1.10 -4.95 120.40 112.03 2vhj s VAL 40 Ca 0.19 0.06 -0.16 0.00 0.00 0.00 0.00 61.98 62.08 2vhj s VAL 40 Cb 0.19 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.54 2vhj s VAL 40 CO 0.54 0.01 0.93 -0.62 0.00 0.00 0.00 175.10 175.96 2vhj n GLU 41 N 1.99 0.44 -2.01 2.72 1.02 -1.26 -4.88 120.64 118.66 2vhj n GLU 41 Ca 0.07 0.21 -0.42 0.00 -0.02 0.00 0.00 57.16 57.00 2vhj n GLU 41 Cb 0.38 -2.19 -0.03 0.00 -0.02 0.00 0.00 31.44 29.58 2vhj n GLU 41 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2vhj s ASP 42 N -1.67 6.66 0.00 1.62 1.01 -1.26 -2.50 116.67 120.53 2vhj s ASP 42 Ca 0.72 2.59 0.00 0.00 0.71 0.00 0.00 52.55 56.57 2vhj s ASP 42 Cb -0.34 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 40.99 2vhj s ASP 42 CO 0.52 -0.74 0.00 0.61 0.21 0.00 0.00 175.17 175.76 2vhj n GLY 43 N 3.05 1.40 3.70 0.21 0.00 -1.26 -5.03 105.19 107.25 2vhj n GLY 43 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.96 3.48 0.21 2.61 2.01 -1.04 -4.96 115.64 114.99 2vhj s THR 44 Ca 0.00 0.95 -0.32 0.00 0.31 0.00 0.00 61.69 62.63 2vhj s THR 44 Cb 0.00 -3.61 -0.13 0.00 0.01 0.00 0.00 72.50 68.77 2vhj s THR 44 CO 0.00 0.02 1.57 -2.65 -0.69 0.00 0.00 174.62 172.87 2vhj n PRO 45 N 4.97 2.34 0.00 4.92 -0.02 -1.26 -4.31 135.00 141.64 2vhj n PRO 45 Ca 0.13 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 2vhj n PRO 45 Cb 0.43 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 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 2.98 0.00 -3.72 -1.45 0.24 -0.27 -4.55 118.33 111.56 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 0.32 -0.18 -0.12 0.00 -1.47 0.00 0.00 33.84 32.39 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 -3.43 0.32 -0.08 1.34 2.96 -1.11 -0.19 118.68 118.49 2vhj s LEU 47 Ca 0.00 0.63 0.05 0.00 -0.22 0.00 0.00 54.13 54.58 2vhj s LEU 47 Cb 0.00 0.92 -0.00 0.00 0.50 0.00 0.00 46.19 47.61 2vhj s LEU 47 CO 0.00 -0.17 -0.23 0.00 -1.32 0.00 0.00 176.35 174.63 2vhj s ALA 48 N 1.20 2.07 0.01 5.97 0.00 -0.22 -0.54 121.76 130.26 2vhj s ALA 48 Ca -0.09 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 50.95 2vhj s ALA 48 Cb -0.09 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.29 2vhj s ALA 48 CO -0.09 0.32 -0.05 -1.50 0.00 0.00 0.00 175.76 174.44 2vhj s ILE 49 N 0.18 0.35 0.15 0.00 2.07 -0.51 -0.44 121.20 122.99 2vhj s ILE 49 Ca -0.13 -0.44 -0.30 0.00 -1.41 0.00 0.00 60.65 58.38 2vhj s ILE 49 Cb -0.16 -0.35 -0.07 0.00 0.13 0.00 0.00 42.46 42.01 2vhj s ILE 49 CO 0.06 -0.06 1.15 -0.83 -1.91 0.00 0.00 174.94 173.35 2vhj s GLY 50 N -0.54 2.70 0.77 1.50 0.00 -1.26 -0.98 107.32 109.51 2vhj s GLY 50 Ca -0.02 0.85 -0.03 0.00 0.00 0.00 0.00 44.72 45.52 2vhj s GLY 50 CO -0.00 1.80 1.06 -1.34 0.00 0.00 0.00 173.10 174.63 2vhj s VAL 51 N 0.15 2.06 0.34 1.40 -7.23 0.46 -4.85 120.40 112.74 2vhj s VAL 51 Ca 0.53 -0.51 0.06 0.00 -1.81 0.00 0.00 61.98 60.25 2vhj s VAL 51 Cb -0.30 -2.56 0.31 0.00 0.56 0.00 0.00 36.38 34.39 2vhj s VAL 51 CO 0.34 0.00 1.88 -0.08 -0.31 0.00 0.00 175.10 176.93 2vhj h GLU 52 N -0.75 0.77 0.00 4.82 4.81 -1.88 -0.59 114.58 121.76 2vhj h GLU 52 Ca -0.37 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 2vhj h GLU 52 Cb 1.26 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.46 2vhj h GLU 52 CO 0.38 0.51 0.00 0.66 -0.73 0.00 0.00 179.01 179.83 2vhj h SER 53 N 0.80 0.00 0.00 1.04 4.64 -1.95 -2.31 113.55 115.77 2vhj h SER 53 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2vhj h SER 53 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2vhj h SER 53 CO -0.19 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.38 2vhj n GLY 54 N 0.33 0.19 3.63 -0.77 0.00 -0.23 -4.73 105.19 103.61 2vhj n GLY 54 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.31 2.15 -0.03 1.61 1.01 -1.26 -4.80 116.67 113.04 2vhj s ASP 55 Ca 0.00 1.22 0.04 0.00 0.71 0.00 0.00 52.55 54.52 2vhj s ASP 55 Cb 0.00 -1.91 -0.00 0.00 1.01 0.00 0.00 42.92 42.01 2vhj s ASP 55 CO 0.00 -3.43 -0.16 0.00 0.21 0.00 0.00 175.17 171.79 2vhj s ALA 56 N -2.86 1.38 0.15 5.23 0.00 -1.26 -0.41 121.76 123.99 2vhj s ALA 56 Ca 0.66 -0.63 0.03 0.00 0.00 0.00 0.00 51.96 52.03 2vhj s ALA 56 Cb -0.20 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 2vhj s ALA 56 CO 0.59 0.26 0.23 0.96 0.00 0.00 0.00 175.76 177.81 2vhj s ILE 57 N -0.02 5.04 -0.05 0.00 -4.36 -0.15 -1.38 121.20 120.28 2vhj s ILE 57 Ca -0.02 -0.82 0.05 0.00 -0.26 0.00 0.00 60.65 59.60 2vhj s ILE 57 Cb -0.10 -3.59 -0.01 0.00 1.25 0.00 0.00 42.46 40.02 2vhj s ILE 57 CO 0.01 -0.10 -0.20 -0.69 0.24 0.00 0.00 174.94 174.21 2vhj s VAL 58 N -1.74 1.62 0.12 8.37 1.01 -1.26 -1.42 120.40 127.10 2vhj s VAL 58 Ca 0.33 -0.83 0.11 0.00 0.00 0.00 0.00 61.98 61.59 2vhj s VAL 58 Cb -0.11 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 2vhj s VAL 58 CO 0.27 0.46 -0.26 -0.36 0.00 0.00 0.00 175.10 175.21 2vhj s PHE 59 N -0.05 2.34 0.56 5.22 0.08 0.30 -0.10 117.98 126.33 2vhj s PHE 59 Ca -0.03 -0.37 -0.02 0.00 0.12 0.00 0.00 56.93 56.63 2vhj s PHE 59 Cb -0.12 -1.27 0.11 0.00 -0.57 0.00 0.00 43.02 41.18 2vhj s PHE 59 CO 0.02 0.34 0.76 -0.40 -0.10 0.00 0.00 175.22 175.84 2vhj n ASP 60 N 0.93 0.84 0.28 1.36 5.75 -0.75 -1.11 116.55 123.85 2vhj n ASP 60 Ca -0.18 -1.76 0.14 0.00 -0.01 0.00 0.00 54.79 52.98 2vhj n ASP 60 Cb 0.53 -0.51 0.80 0.00 -1.03 0.00 0.00 41.12 40.91 2vhj n ASP 60 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 2vhj h LYS 61 N 0.00 0.00 -0.45 0.11 2.10 -1.90 -1.60 116.57 114.82 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 0.88 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.21 2vhj h LYS 61 CO 0.25 0.07 0.00 0.09 -2.00 0.00 0.00 179.45 177.87 2vhj n ASN 62 N -3.72 2.41 -1.30 7.07 5.03 -1.26 -4.91 115.26 118.58 2vhj n ASN 62 Ca -0.02 -2.03 -0.13 0.00 0.87 0.00 0.00 54.58 53.27 2vhj n ASN 62 Cb 0.18 -0.31 -0.03 0.00 -1.02 0.00 0.00 39.78 38.60 2vhj n ASN 62 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vhj n ALA 63 N 0.75 -0.31 -2.73 5.41 0.00 -0.60 -5.01 120.51 118.01 2vhj n ALA 63 Ca 0.15 0.15 -0.36 0.00 0.00 0.00 0.00 53.44 53.37 2vhj n ALA 63 Cb 0.39 -1.53 -0.07 0.00 0.00 0.00 0.00 19.45 18.25 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 -4.05 4.05 0.36 0.00 -1.52 -1.26 -4.85 119.66 112.38 2vhj s GLN 64 Ca 0.00 0.00 -0.28 0.00 -1.95 0.00 0.00 55.36 53.13 2vhj s GLN 64 Cb 0.00 -3.36 -0.11 0.00 -0.22 0.00 0.00 33.01 29.32 2vhj s GLN 64 CO 0.00 0.40 1.47 0.54 -0.25 0.00 0.00 175.29 177.46 2vhj n ARG 65 N 3.08 2.59 -3.46 2.91 1.74 -1.26 -1.81 116.66 120.45 2vhj n ARG 65 Ca -0.15 0.91 -0.38 0.00 -0.77 0.00 0.00 57.85 57.47 2vhj n ARG 65 Cb 0.53 -2.63 -0.08 0.00 -1.02 0.00 0.00 32.46 29.26 2vhj n ARG 65 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2vhj s ILE 66 N -0.97 5.24 -0.15 0.55 1.01 0.86 -4.87 121.20 122.87 2vhj s ILE 66 Ca 0.55 0.55 -0.06 0.00 0.00 0.00 0.00 60.65 61.68 2vhj s ILE 66 Cb -0.49 -3.66 -0.24 0.00 0.01 0.00 0.00 42.46 38.07 2vhj s ILE 66 CO 0.62 0.26 0.26 1.33 0.00 0.00 0.00 174.94 177.41 2vhj n VAL 67 N 4.42 1.73 -3.77 2.92 0.24 -1.26 -4.49 118.33 118.11 2vhj n VAL 67 Ca -0.10 -0.61 -0.15 0.00 -2.04 0.00 0.00 64.34 61.44 2vhj n VAL 67 Cb 0.51 -1.70 -0.16 0.00 -1.47 0.00 0.00 33.84 31.02 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 -2.54 0.03 -0.21 2.33 0.00 -1.26 -0.41 121.76 119.70 2vhj s ALA 68 Ca -0.25 0.33 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 2vhj s ALA 68 Cb 0.07 -0.26 0.10 0.00 0.00 0.00 0.00 23.12 23.04 2vhj s ALA 68 CO 0.73 -0.11 0.41 -0.47 0.00 0.00 0.00 175.76 176.33 2vhj s TYR 69 N 1.01 -0.82 0.38 0.00 6.14 0.29 -4.92 117.35 119.42 2vhj s TYR 69 Ca -0.08 1.37 -0.26 0.00 0.64 0.00 0.00 57.07 58.74 2vhj s TYR 69 Cb -0.12 0.24 -0.09 0.00 0.42 0.00 0.00 41.96 42.42 2vhj s TYR 69 CO -0.03 -0.54 1.14 0.15 0.64 0.00 0.00 175.55 176.91 2vhj s LYS 70 N 2.60 4.17 -0.08 4.97 -0.14 -1.26 -1.34 119.74 128.67 2vhj s LYS 70 Ca 0.02 1.79 -0.40 0.00 -1.36 0.00 0.00 55.97 56.01 2vhj s LYS 70 Cb -0.13 -2.74 -0.19 0.00 -1.68 0.00 0.00 37.83 33.09 2vhj s LYS 70 CO -0.14 -0.21 1.25 -1.91 -0.76 0.00 0.00 175.35 173.59 2vhj n GLU 71 N 0.23 0.31 -3.85 1.68 2.13 -1.26 -4.80 120.64 115.09 2vhj n GLU 71 Ca 0.03 0.11 -0.19 0.00 0.66 0.00 0.00 57.16 57.78 2vhj n GLU 71 Cb 0.47 -1.65 -0.17 0.00 0.27 0.00 0.00 31.44 30.35 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 0.78 0.31 0.10 5.31 2.20 -0.61 -5.00 119.74 122.82 2vhj s LYS 72 Ca 0.92 0.14 0.02 0.00 -0.36 0.00 0.00 55.97 56.69 2vhj s LYS 72 Cb -1.23 -0.61 -0.04 0.00 -1.51 0.00 0.00 37.83 34.44 2vhj s LYS 72 CO 0.59 -0.21 0.15 -1.12 -0.36 0.00 0.00 175.35 174.40 2vhj s SER 73 N 1.47 5.85 -0.02 1.43 0.01 -1.26 -1.64 113.70 119.54 2vhj s SER 73 Ca -0.03 0.07 0.01 0.00 1.31 0.00 0.00 55.95 57.30 2vhj s SER 73 Cb -0.13 -1.66 0.01 0.00 0.21 0.00 0.00 66.02 64.45 2vhj s SER 73 CO -0.03 0.14 -0.03 -0.69 0.41 0.00 0.00 173.24 173.04 2vhj s VAL 74 N -1.53 0.34 -0.18 3.43 1.01 0.13 -4.99 120.40 118.62 2vhj s VAL 74 Ca 0.32 -0.12 -0.14 0.00 0.00 0.00 0.00 61.98 62.04 2vhj s VAL 74 Cb -0.12 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.88 2vhj s VAL 74 CO 0.25 0.13 0.32 -0.75 0.00 0.00 0.00 175.10 175.05 2vhj s LYS 75 N 0.33 4.21 0.65 2.72 2.47 -1.26 -0.55 119.74 128.31 2vhj s LYS 75 Ca -0.03 0.10 -0.03 0.00 -1.56 0.00 0.00 55.97 54.44 2vhj s LYS 75 Cb -0.07 -3.48 0.06 0.00 -1.46 0.00 0.00 37.83 32.88 2vhj s LYS 75 CO -0.00 0.11 0.93 0.00 0.16 0.00 0.00 175.35 176.54 2vhj s ALA 76 N 0.87 3.48 0.37 3.13 0.00 0.64 -4.98 121.76 125.27 2vhj s ALA 76 Ca 0.17 -1.18 0.07 0.00 0.00 0.00 0.00 51.96 51.01 2vhj s ALA 76 Cb -0.14 -2.34 0.73 0.00 0.00 0.00 0.00 23.12 21.38 2vhj s ALA 76 CO 0.06 -1.14 1.94 1.49 0.00 0.00 0.00 175.76 178.11 2vhj h GLU 77 N -0.37 0.44 0.00 0.00 4.81 -1.99 -2.61 114.58 114.86 2vhj h GLU 77 Ca -0.43 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2vhj h GLU 77 Cb 1.30 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2vhj h GLU 77 CO 0.54 0.44 0.00 0.22 -0.73 0.00 0.00 179.01 179.48 2vhj h ASP 78 N 0.43 0.00 0.00 1.04 3.58 -1.94 -3.45 116.42 116.08 2vhj h ASP 78 Ca 0.10 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.55 2vhj h ASP 78 Cb 0.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2vhj h ASP 78 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 2vhj n GLY 79 N -1.04 2.01 3.79 -0.78 0.00 -0.98 -5.02 105.19 103.17 2vhj n GLY 79 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 2vhj n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vhj s SER 80 N -2.44 6.16 -0.13 1.61 1.04 -1.26 -4.74 113.70 113.93 2vhj s SER 80 Ca 0.00 1.96 0.00 0.00 0.48 0.00 0.00 55.95 58.39 2vhj s SER 80 Cb 0.00 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.55 2vhj s SER 80 CO 0.00 -0.91 -0.14 -0.69 0.98 0.00 0.00 173.24 172.48 2vhj s VAL 81 N -2.00 2.92 -0.02 5.02 1.01 -1.26 -0.26 120.40 125.81 2vhj s VAL 81 Ca 0.68 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.92 2vhj s VAL 81 Cb -0.18 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2vhj s VAL 81 CO 0.23 0.52 0.19 -0.94 0.00 0.00 0.00 175.10 175.11 2vhj s SER 82 N 0.46 6.39 0.01 3.32 1.04 0.29 -4.93 113.70 120.28 2vhj s SER 82 Ca -0.10 0.39 0.03 0.00 0.48 0.00 0.00 55.95 56.75 2vhj s SER 82 Cb -0.16 -2.02 -0.01 0.00 0.10 0.00 0.00 66.02 63.93 2vhj s SER 82 CO 0.05 0.27 -0.09 -0.69 0.98 0.00 0.00 173.24 173.76 2vhj s VAL 83 N -1.30 0.71 -0.06 5.02 1.01 -1.26 0.19 120.40 124.71 2vhj s VAL 83 Ca 0.26 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.73 2vhj s VAL 83 Cb -0.13 -0.63 0.01 0.00 0.00 0.00 0.00 36.38 35.63 2vhj s VAL 83 CO 0.17 0.09 -0.14 -0.69 0.00 0.00 0.00 175.10 174.52 2vhj s VAL 84 N -0.44 1.28 -0.07 2.92 1.01 -0.65 -3.00 120.40 121.46 2vhj s VAL 84 Ca 0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.38 2vhj s VAL 84 Cb -0.05 -1.14 0.04 0.00 0.00 0.00 0.00 36.38 35.23 2vhj s VAL 84 CO 0.00 0.38 0.15 -1.58 0.00 0.00 0.00 175.10 174.05 2vhj s GLN 85 N 0.45 0.10 -0.07 2.72 0.74 -0.28 -1.58 119.66 121.74 2vhj s GLN 85 Ca -0.12 0.37 0.05 0.00 0.05 0.00 0.00 55.36 55.71 2vhj s GLN 85 Cb -0.15 -0.16 -0.01 0.00 1.10 0.00 0.00 33.01 33.80 2vhj s GLN 85 CO 0.04 -0.16 -0.23 0.08 -0.55 0.00 0.00 175.29 174.47 2vhj s VAL 86 N 1.11 1.93 -0.07 1.34 1.01 -0.45 0.92 120.40 126.19 2vhj s VAL 86 Ca -0.09 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 60.89 2vhj s VAL 86 Cb -0.11 -1.65 0.04 0.00 0.00 0.00 0.00 36.38 34.66 2vhj s VAL 86 CO -0.06 0.54 0.15 -0.70 0.00 0.00 0.00 175.10 175.03 2vhj s GLU 87 N 0.04 0.09 -1.63 2.72 2.12 0.12 -0.55 118.70 121.62 2vhj s GLU 87 Ca -0.08 0.37 -0.15 0.00 0.36 0.00 0.00 54.97 55.47 2vhj s GLU 87 Cb -0.15 -0.18 0.12 0.00 0.26 0.00 0.00 34.13 34.18 2vhj s GLU 87 CO 0.05 -0.17 0.80 0.09 -0.54 0.00 0.00 175.26 175.50 2vhj n ASN 88 N 4.22 -3.38 0.00 -1.70 5.03 -1.07 -1.37 115.26 116.99 2vhj n ASN 88 Ca -0.26 -0.95 0.00 0.00 0.87 0.00 0.00 54.58 54.24 2vhj n ASN 88 Cb 0.52 -3.11 0.00 0.00 -1.02 0.00 0.00 39.78 36.17 2vhj n ASN 88 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2vhj n GLY 89 N -1.54 0.66 3.19 7.41 0.00 0.46 -5.02 105.19 110.35 2vhj n GLY 89 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.73 1.35 -0.03 1.61 0.40 -0.47 -4.58 117.98 113.53 2vhj s PHE 90 Ca 0.00 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 55.61 2vhj s PHE 90 Cb 0.00 -0.77 -0.06 0.00 0.51 0.00 0.00 43.02 42.70 2vhj s PHE 90 CO 0.00 0.08 1.69 1.41 0.70 0.00 0.00 175.22 179.10 2vhj s MET 91 N -1.59 4.18 -0.18 0.44 -2.45 -0.48 -0.70 119.30 118.52 2vhj s MET 91 Ca 0.01 2.26 -0.13 0.00 -1.25 0.00 0.00 55.69 56.58 2vhj s MET 91 Cb -0.09 -3.97 -0.21 0.00 1.25 0.00 0.00 34.83 31.80 2vhj s MET 91 CO 0.02 -0.85 0.18 1.17 1.05 0.00 0.00 175.02 176.59 2vhj n LYS 92 N 7.04 0.65 -4.39 4.11 3.00 0.26 -4.76 118.16 124.08 2vhj n LYS 92 Ca 0.17 0.38 -0.20 0.00 -0.00 0.00 0.00 58.31 58.67 2vhj n LYS 92 Cb 0.42 -1.69 -0.14 0.00 0.00 0.00 0.00 35.03 33.63 2vhj n LYS 92 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2vhj s GLN 93 N -2.47 0.91 0.00 1.64 -0.21 -0.93 -4.94 119.66 113.66 2vhj s GLN 93 Ca -0.28 -0.65 0.00 0.00 0.02 0.00 0.00 55.36 54.46 2vhj s GLN 93 Cb 0.07 -0.90 0.00 0.00 1.00 0.00 0.00 33.01 33.19 2vhj s GLN 93 CO 0.65 0.23 0.00 0.41 -2.12 0.00 0.00 175.29 174.46 2vhj n GLY 94 N 2.17 0.93 3.25 3.09 0.00 -1.16 -1.13 105.19 112.34 2vhj n GLY 94 Ca -0.17 -1.94 -0.14 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.99 1.26 0.55 1.61 -3.43 -1.26 -5.04 115.29 106.98 2vhj s HIS 95 Ca 0.00 -0.82 -0.19 0.00 -0.80 0.00 0.00 55.06 53.25 2vhj s HIS 95 Cb 0.00 -0.67 -0.05 0.00 -1.43 0.00 0.00 32.58 30.43 2vhj s HIS 95 CO 0.00 0.02 1.11 1.03 -2.00 0.00 0.00 174.74 174.90 2vhj s ARG 96 N -3.78 3.36 0.00 -0.38 0.52 -1.26 -4.65 118.95 112.75 2vhj s ARG 96 Ca 0.18 1.53 0.00 0.00 -0.52 0.00 0.00 55.73 56.93 2vhj s ARG 96 Cb 0.04 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.49 2vhj s ARG 96 CO 0.01 -0.83 0.00 0.41 0.02 0.00 0.00 175.30 174.91 2vhj n GLY 97 N -0.02 -0.62 3.74 -3.53 0.00 0.41 -4.92 105.19 100.25 2vhj n GLY 97 Ca 0.11 -2.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.55 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 3.52 -2.43 1.61 0.52 -1.26 -1.05 118.94 119.84 2vhj s TRP 98 Ca 0.00 1.54 0.20 0.00 0.02 0.00 0.00 56.10 57.86 2vhj s TRP 98 Cb 0.00 -3.34 0.16 0.00 -1.15 0.00 0.00 33.47 29.14 2vhj s TRP 98 CO 0.00 -0.84 1.12 1.28 0.02 0.00 0.00 176.95 178.53 2vhj n LEU 99 N 2.23 2.64 -4.31 2.99 4.77 0.73 -4.91 117.00 121.15 2vhj n LEU 99 Ca 0.03 -1.01 -0.20 0.00 -0.03 0.00 0.00 56.01 54.80 2vhj n LEU 99 Cb 0.45 -0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.43 2vhj n LEU 99 CO 0.55 0.46 -0.46 0.68 -1.33 0.00 0.00 177.39 177.29 2vhj s VAL 100 N -1.62 1.66 -0.39 4.08 -7.23 -1.25 -4.89 120.40 110.75 2vhj s VAL 100 Ca 0.23 -1.94 -0.27 0.00 -1.81 0.00 0.00 61.98 58.19 2vhj s VAL 100 Cb 0.16 -1.81 0.02 0.00 0.56 0.00 0.00 36.38 35.31 2vhj s VAL 100 CO 0.25 -0.42 0.99 -0.62 -0.31 0.00 0.00 175.10 174.98 2vhj s ASP 101 N -2.78 6.69 0.20 4.85 2.15 -1.26 -4.90 116.67 121.61 2vhj s ASP 101 Ca 0.16 0.58 0.23 0.00 0.43 0.00 0.00 52.55 53.94 2vhj s ASP 101 Cb -0.04 -2.49 0.05 0.00 -0.30 0.00 0.00 42.92 40.14 2vhj s ASP 101 CO 0.06 -0.96 1.09 -0.07 -0.17 0.00 0.00 175.17 175.12 2vhj h LEU 102 N 10.35 0.00 0.00 -1.34 3.38 -1.97 -3.43 115.31 122.31 2vhj h LEU 102 Ca -0.23 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2vhj h LEU 102 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2vhj h LEU 102 CO 1.02 0.02 -0.58 0.35 0.09 0.00 0.00 178.44 179.34 2vhj n THR 103 N -2.60 0.00 -0.76 0.22 -2.24 -1.26 -4.55 114.28 103.09 2vhj n THR 103 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2vhj n THR 103 Cb 0.53 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 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 2.38 0.81 0.22 3.38 0.00 -1.26 -4.45 105.19 106.27 2vhj n GLY 104 Ca 0.00 -1.53 0.10 0.00 0.00 0.00 0.00 46.02 44.60 2vhj n GLY 104 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2vhj h GLU 105 N 0.00 0.00 -6.51 1.61 4.81 -2.02 -3.43 114.58 109.05 2vhj h GLU 105 Ca 0.00 0.00 -0.57 0.00 -0.13 0.00 0.00 59.36 58.66 2vhj h GLU 105 Cb 0.00 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 2vhj h GLU 105 CO 0.00 0.22 0.99 -1.17 -0.73 0.00 0.00 179.01 178.32 2vhj s LEU 106 N -6.75 3.71 0.29 1.64 2.96 -1.26 -4.99 118.68 114.28 2vhj s LEU 106 Ca 0.01 0.86 0.04 0.00 -0.22 0.00 0.00 54.13 54.81 2vhj s LEU 106 Cb 0.10 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.19 2vhj s LEU 106 CO 0.63 -1.25 0.04 0.68 -1.32 0.00 0.00 176.35 175.13 2vhj s VAL 107 N 4.75 1.10 -0.70 1.68 -7.23 -1.26 -4.87 120.40 113.86 2vhj s VAL 107 Ca 0.55 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.70 2vhj s VAL 107 Cb -0.13 -2.62 0.00 0.00 0.56 0.00 0.00 36.38 34.19 2vhj s VAL 107 CO 0.28 -0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.57 2vhj n GLY 108 N -0.57 0.53 3.95 2.32 0.00 -1.26 -4.93 105.19 105.23 2vhj n GLY 108 Ca -0.03 -0.65 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.60 3.56 -4.68 0.00 7.64 -1.25 -4.85 113.62 112.45 2vhj n SER 110 Ca -0.07 -3.39 -0.45 0.00 1.01 0.00 0.00 58.87 55.97 2vhj n SER 110 Cb 0.56 -0.69 -0.04 0.00 -1.01 0.00 0.00 64.21 63.04 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 1.06 2.18 -1.69 1.43 -0.02 -1.26 -4.34 135.00 132.36 2vhj n PRO 111 Ca 0.28 0.78 -0.44 0.00 -2.02 0.00 0.00 63.50 62.11 2vhj n PRO 111 Cb 0.40 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.32 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 3.00 0.29 -0.08 -1.45 3.14 -0.76 -0.87 118.33 121.60 2vhj n VAL 112 Ca 0.15 -0.05 -0.10 0.00 -2.96 0.00 0.00 64.34 61.38 2vhj n VAL 112 Cb 0.30 -1.99 -0.15 0.00 -1.06 0.00 0.00 33.84 30.94 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 4.46 1.46 -3.60 1.55 3.14 0.25 -1.51 118.33 124.08 2vhj n VAL 113 Ca 0.18 -0.84 -0.04 0.00 -2.96 0.00 0.00 64.34 60.68 2vhj n VAL 113 Cb 0.35 -0.64 -0.02 0.00 -1.06 0.00 0.00 33.84 32.47 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 -2.52 -1.94 -0.01 1.55 0.00 -1.23 -3.00 121.76 114.61 2vhj s ALA 114 Ca -0.09 0.95 0.03 0.00 0.00 0.00 0.00 51.96 52.86 2vhj s ALA 114 Cb 0.07 0.29 -0.01 0.00 0.00 0.00 0.00 23.12 23.47 2vhj s ALA 114 CO 0.83 -0.80 -0.10 -2.00 0.00 0.00 0.00 175.76 173.69 2vhj s GLU 115 N -2.81 0.83 -0.26 0.00 2.12 -1.26 -0.75 118.70 116.58 2vhj s GLU 115 Ca 0.09 -0.34 -0.20 0.00 0.36 0.00 0.00 54.97 54.89 2vhj s GLU 115 Cb 0.00 -0.80 0.07 0.00 0.26 0.00 0.00 34.13 33.66 2vhj s GLU 115 CO -0.05 0.19 0.66 0.12 -0.54 0.00 0.00 175.26 175.65 2vhj s PHE 116 N -0.15 -0.85 -1.79 5.30 5.36 -0.25 -4.94 117.98 120.66 2vhj s PHE 116 Ca 0.03 1.88 0.00 0.00 -0.96 0.00 0.00 56.93 57.88 2vhj s PHE 116 Cb -0.05 0.39 0.00 0.00 -0.34 0.00 0.00 43.02 43.03 2vhj s PHE 116 CO -0.00 -0.42 0.00 0.41 -1.46 0.00 0.00 175.22 173.75 2vhj n GLY 117 N 3.42 0.04 1.36 13.12 0.00 -1.26 -1.73 105.19 120.15 2vhj n GLY 117 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.85 0.72 3.08 -0.02 0.00 -1.26 -4.98 105.19 101.88 2vhj n GLY 118 Ca -0.23 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.26 1.20 0.22 1.61 3.76 -0.70 -5.13 115.29 113.98 2vhj s HIS 119 Ca 0.00 -0.26 -0.19 0.00 -0.15 0.00 0.00 55.06 54.46 2vhj s HIS 119 Cb 0.00 -0.79 -0.08 0.00 1.11 0.00 0.00 32.58 32.82 2vhj s HIS 119 CO 0.00 -0.05 0.71 1.03 -0.85 0.00 0.00 174.74 175.58 2vhj s ARG 120 N -0.17 4.22 0.02 1.40 0.52 -1.26 -1.09 118.95 122.59 2vhj s ARG 120 Ca 0.02 0.83 0.09 0.00 -0.52 0.00 0.00 55.73 56.15 2vhj s ARG 120 Cb -0.06 -2.85 -0.03 0.00 0.52 0.00 0.00 34.95 32.53 2vhj s ARG 120 CO -0.00 0.38 -0.26 0.71 0.02 0.00 0.00 175.30 176.15 2vhj s TYR 121 N -1.55 2.33 0.28 -0.53 2.02 0.07 -4.98 117.35 114.99 2vhj s TYR 121 Ca 0.43 -0.42 -0.19 0.00 -0.37 0.00 0.00 57.07 56.53 2vhj s TYR 121 Cb -0.16 -1.44 -0.09 0.00 -0.40 0.00 0.00 41.96 39.87 2vhj s TYR 121 CO 0.21 0.06 0.77 0.00 -1.57 0.00 0.00 175.55 175.01 2vhj s ALA 122 N -0.73 3.33 1.23 3.71 0.00 -1.26 -0.58 121.76 127.46 2vhj s ALA 122 Ca 0.11 0.17 -0.20 0.00 0.00 0.00 0.00 51.96 52.04 2vhj s ALA 122 Cb -0.10 -2.86 0.30 0.00 0.00 0.00 0.00 23.12 20.46 2vhj s ALA 122 CO 0.01 0.30 1.11 -1.54 0.00 0.00 0.00 175.76 175.64 2vhj s SER 123 N -1.91 0.69 0.00 0.00 1.04 -0.05 -4.63 113.70 108.83 2vhj s SER 123 Ca 0.49 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.48 2vhj s SER 123 Cb -0.14 -0.74 0.00 0.00 0.10 0.00 0.00 66.02 65.24 2vhj s SER 123 CO 0.19 -4.26 0.00 0.61 0.98 0.00 0.00 173.24 170.77 2vhj n GLY 124 N -0.93 -1.18 3.75 7.32 0.00 -0.33 -4.72 105.19 109.11 2vhj n GLY 124 Ca 0.14 -2.03 -0.36 0.00 0.00 0.00 0.00 46.02 43.77 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 4.15 -0.23 1.61 -2.45 -1.26 -0.93 119.30 120.19 2vhj s MET 125 Ca 0.00 0.05 0.01 0.00 -1.25 0.00 0.00 55.69 54.50 2vhj s MET 125 Cb 0.00 -3.39 0.03 0.00 1.25 0.00 0.00 34.83 32.73 2vhj s MET 125 CO 0.00 0.33 -0.13 0.08 1.05 0.00 0.00 175.02 176.35 2vhj s VAL 126 N 0.20 2.36 -0.21 10.11 1.01 0.81 -0.08 120.40 134.61 2vhj s VAL 126 Ca 0.16 -1.17 -0.12 0.00 0.00 0.00 0.00 61.98 60.84 2vhj s VAL 126 Cb -0.13 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 2vhj s VAL 126 CO 0.04 0.26 0.24 -0.63 0.00 0.00 0.00 175.10 175.00 2vhj s ILE 127 N 1.25 5.32 -0.34 2.22 1.01 -0.92 -0.48 121.20 129.26 2vhj s ILE 127 Ca -0.01 0.38 -0.10 0.00 0.00 0.00 0.00 60.65 60.92 2vhj s ILE 127 Cb -0.16 -3.57 0.01 0.00 0.01 0.00 0.00 42.46 38.74 2vhj s ILE 127 CO -0.08 0.35 0.17 -0.69 0.00 0.00 0.00 174.94 174.69 2vhj s VAL 128 N 0.87 4.57 0.00 2.92 1.01 0.31 -0.84 120.40 129.25 2vhj s VAL 128 Ca 0.12 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2vhj s VAL 128 Cb -0.13 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.83 2vhj s VAL 128 CO 0.04 -0.05 0.00 1.07 0.00 0.00 0.00 175.10 176.15 2vhj n THR 129 N 4.98 0.00 0.00 3.92 5.66 -0.11 -1.34 114.28 127.40 2vhj n THR 129 Ca -0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 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 -0.12 3.70 1.09 0.00 -1.26 -2.31 105.19 106.29 2vhj n GLY 130 Ca 0.00 -2.28 -0.33 0.00 0.00 0.00 0.00 46.02 43.41 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 -0.56 1.75 0.00 1.61 2.20 -1.26 -4.35 119.74 119.12 2vhj s LYS 131 Ca 0.00 1.72 0.00 0.00 -0.36 0.00 0.00 55.97 57.33 2vhj s LYS 131 Cb 0.00 -1.79 0.00 0.00 -1.51 0.00 0.00 37.83 34.53 2vhj s LYS 131 CO 0.00 -2.13 0.00 0.41 -0.36 0.00 0.00 175.35 173.27 2vhj n GLY 132 N 0.38 0.24 0.57 5.54 0.00 -1.26 -4.84 105.19 105.82 2vhj n GLY 132 Ca 0.13 -1.68 0.06 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.77 3.02 -3.90 1.61 0.23 -1.26 -4.54 115.26 109.64 2vhj n ASN 133 Ca 0.00 -2.38 -0.11 0.00 -0.53 0.00 0.00 54.58 51.57 2vhj n ASN 133 Cb 0.00 -0.30 -0.11 0.00 -2.08 0.00 0.00 39.78 37.29 2vhj n ASN 133 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 2vhj s SER 134 N -1.42 0.07 0.00 0.53 0.15 -1.26 -4.92 113.70 106.85 2vhj s SER 134 Ca 0.26 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.68 2vhj s SER 134 Cb 0.18 0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 2vhj s SER 134 CO 0.10 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.88 2vhj n GLY 135 N 1.84 2.09 0.18 9.45 0.00 -1.26 -4.96 105.19 112.53 2vhj n GLY 135 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.67 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 2.06 0.50 -0.07 1.61 1.57 -1.95 -3.13 116.57 117.15 2vhj h LYS 136 Ca 0.00 -0.48 -0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2vhj h LYS 136 Cb 0.00 0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 2vhj h LYS 136 CO 0.00 1.12 0.04 1.15 -0.57 0.00 0.00 179.45 181.19 2vhj h THR 137 N 0.31 1.07 -0.23 -0.16 2.02 -1.97 -0.55 112.91 113.40 2vhj h THR 137 Ca -0.07 -0.19 -0.04 0.00 0.77 0.00 0.00 66.41 66.88 2vhj h THR 137 Cb 1.50 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.96 2vhj h THR 137 CO 0.16 0.06 -0.02 -0.65 0.37 0.00 0.00 175.52 175.44 2vhj h PRO 138 N 0.04 0.34 -0.08 6.66 0.11 -1.90 -2.55 132.00 134.62 2vhj h PRO 138 Ca 0.03 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 2vhj h PRO 138 Cb 0.06 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 2vhj h PRO 138 CO -0.00 0.38 -0.01 1.25 -0.21 0.00 0.00 178.00 179.41 2vhj h LEU 139 N 0.33 0.15 -0.95 2.35 7.12 -1.41 -1.37 115.31 121.54 2vhj h LEU 139 Ca 0.07 -0.34 0.04 0.00 0.13 0.00 0.00 57.88 57.78 2vhj h LEU 139 Cb 0.25 -0.04 -0.06 0.00 -0.53 0.00 0.00 40.66 40.29 2vhj h LEU 139 CO 0.01 0.46 0.61 -0.37 -0.13 0.00 0.00 178.44 179.02 2vhj h VAL 140 N -0.16 1.14 -0.47 1.05 -1.51 -0.97 0.12 116.25 115.45 2vhj h VAL 140 Ca 0.02 -0.40 -0.11 0.00 -1.23 0.00 0.00 66.70 64.98 2vhj h VAL 140 Cb 0.39 -0.13 -0.02 0.00 -2.13 0.00 0.00 31.29 29.40 2vhj h VAL 140 CO 0.01 0.21 -0.14 0.45 -1.23 0.00 0.00 177.57 176.87 2vhj h HIS 141 N 1.17 0.98 -0.54 5.19 3.86 -1.41 -0.54 115.15 123.87 2vhj h HIS 141 Ca 0.38 -0.20 -0.08 0.00 -1.16 0.00 0.00 60.37 59.32 2vhj h HIS 141 Cb 0.04 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.24 2vhj h HIS 141 CO -0.01 0.96 0.04 0.00 0.86 0.00 0.00 177.93 179.77 2vhj h ALA 142 N 1.05 0.72 -0.57 2.45 0.00 -0.61 -1.72 119.26 120.58 2vhj h ALA 142 Ca 0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2vhj h ALA 142 Cb 0.66 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2vhj h ALA 142 CO 0.05 0.51 0.28 -0.07 0.00 0.00 0.00 179.25 180.02 2vhj h LEU 143 N 0.81 0.74 -0.34 0.00 3.38 -0.86 -1.10 115.31 117.95 2vhj h LEU 143 Ca 0.16 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.04 2vhj h LEU 143 Cb 0.48 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2vhj h LEU 143 CO 0.02 0.65 0.13 1.23 0.09 0.00 0.00 178.44 180.56 2vhj h GLY 144 N 0.77 0.43 0.91 0.83 0.00 -0.89 0.18 103.07 105.31 2vhj h GLY 144 Ca 0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 2vhj h GLY 144 CO -0.03 0.04 0.11 -2.09 0.00 0.00 0.00 176.54 174.58 2vhj h GLU 145 N 0.28 0.44 -0.32 4.80 4.22 -1.17 0.66 114.58 123.49 2vhj h GLU 145 Ca 0.15 -0.09 -0.07 0.00 0.08 0.00 0.00 59.36 59.43 2vhj h GLU 145 Cb 0.11 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2vhj h GLU 145 CO -0.14 0.47 -0.07 0.00 -2.18 0.00 0.00 179.01 177.10 2vhj h ALA 146 N 0.95 0.45 0.00 2.92 0.00 -0.80 -1.98 119.26 120.79 2vhj h ALA 146 Ca 0.10 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 2vhj h ALA 146 Cb 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2vhj h ALA 146 CO -0.01 0.27 -0.62 -0.07 0.00 0.00 0.00 179.25 178.82 2vhj h LEU 147 N 0.40 0.00 -0.61 0.00 3.38 -0.68 -3.03 115.31 114.76 2vhj h LEU 147 Ca 0.08 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.11 2vhj h LEU 147 Cb 0.56 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 2vhj h LEU 147 CO 0.03 0.62 0.34 1.23 0.09 0.00 0.00 178.44 180.75 2vhj h GLY 148 N 2.17 0.89 0.00 0.83 0.00 -0.62 -3.45 103.07 102.89 2vhj h GLY 148 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2vhj h GLY 148 CO 0.08 0.15 0.00 0.61 0.00 0.00 0.00 176.54 177.38 2vhj n GLY 149 N -1.27 1.61 0.11 4.60 0.00 -0.77 -1.22 105.19 108.25 2vhj n GLY 149 Ca 0.07 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.31 2vhj n GLY 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2vhj n LYS 150 N 0.95 0.24 -4.12 1.61 5.02 -1.26 -4.86 118.16 115.73 2vhj n LYS 150 Ca 0.00 0.27 -0.28 0.00 -2.02 0.00 0.00 58.31 56.28 2vhj n LYS 150 Cb 0.00 -1.82 -0.07 0.00 -0.02 0.00 0.00 35.03 33.12 2vhj n LYS 150 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2vhj s ASP 151 N -4.41 5.20 0.50 4.39 1.01 -0.36 -5.11 116.67 117.90 2vhj s ASP 151 Ca 0.09 -0.18 -0.20 0.00 0.71 0.00 0.00 52.55 52.96 2vhj s ASP 151 Cb 0.12 -1.28 -0.07 0.00 1.01 0.00 0.00 42.92 42.70 2vhj s ASP 151 CO 0.54 0.12 1.09 -0.54 0.21 0.00 0.00 175.17 176.60 2vhj s LYS 152 N -2.69 3.61 0.09 8.23 1.02 -1.26 -4.53 119.74 124.21 2vhj s LYS 152 Ca 0.28 1.53 0.01 0.00 0.02 0.00 0.00 55.97 57.81 2vhj s LYS 152 Cb -0.11 -2.11 -0.04 0.00 -0.52 0.00 0.00 37.83 35.05 2vhj s LYS 152 CO 0.20 -0.62 0.21 1.52 -0.92 0.00 0.00 175.35 175.75 2vhj s TYR 153 N -1.82 3.46 -0.09 3.18 1.13 -1.26 -4.76 117.35 117.20 2vhj s TYR 153 Ca 0.69 0.18 -0.12 0.00 -1.41 0.00 0.00 57.07 56.42 2vhj s TYR 153 Cb -0.21 -1.71 -0.05 0.00 -1.10 0.00 0.00 41.96 38.89 2vhj s TYR 153 CO 0.25 0.56 0.28 0.00 -2.51 0.00 0.00 175.55 174.13 2vhj s ALA 154 N -1.57 3.73 -0.21 9.51 0.00 -0.06 -4.98 121.76 128.18 2vhj s ALA 154 Ca 0.34 -0.44 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 2vhj s ALA 154 Cb -0.12 -2.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.75 2vhj s ALA 154 CO 0.27 0.41 -0.07 0.99 0.00 0.00 0.00 175.76 177.37 2vhj s THR 155 N -0.59 3.22 -0.26 0.00 2.01 -1.26 -0.23 115.64 118.53 2vhj s THR 155 Ca 0.18 -0.55 -0.11 0.00 0.31 0.00 0.00 61.69 61.53 2vhj s THR 155 Cb -0.14 -2.45 -0.05 0.00 0.01 0.00 0.00 72.50 69.87 2vhj s THR 155 CO 0.07 0.44 0.18 -0.69 -0.69 0.00 0.00 174.62 173.93 2vhj s VAL 156 N 1.35 5.33 -0.14 3.82 1.01 0.15 -4.97 120.40 126.95 2vhj s VAL 156 Ca 0.04 0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 2vhj s VAL 156 Cb -0.14 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 2vhj s VAL 156 CO -0.04 0.30 -0.06 -0.13 0.00 0.00 0.00 175.10 175.17 2vhj s ARG 157 N 1.41 3.54 -0.19 2.72 0.52 -1.26 -1.02 118.95 124.67 2vhj s ARG 157 Ca 0.07 -0.55 -0.12 0.00 -0.52 0.00 0.00 55.73 54.61 2vhj s ARG 157 Cb -0.15 -2.83 0.06 0.00 0.52 0.00 0.00 34.95 32.55 2vhj s ARG 157 CO 0.08 0.28 0.47 0.12 0.02 0.00 0.00 175.30 176.26 2vhj s PHE 158 N 0.25 -0.66 -0.98 -0.53 5.36 0.35 -3.90 117.98 117.87 2vhj s PHE 158 Ca -0.04 1.43 -0.03 0.00 -0.96 0.00 0.00 56.93 57.32 2vhj s PHE 158 Cb -0.14 0.31 0.00 0.00 -0.34 0.00 0.00 43.02 42.85 2vhj s PHE 158 CO 0.03 -0.35 0.46 0.41 -1.46 0.00 0.00 175.22 174.31 2vhj n GLY 159 N 3.97 -0.08 3.29 13.12 0.00 -0.19 -1.77 105.19 123.54 2vhj n GLY 159 Ca -0.21 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 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 -5.38 1.28 -1.50 1.61 0.41 -1.26 -4.50 118.70 109.36 2vhj s GLU 160 Ca 0.23 -1.10 -0.09 0.00 -0.41 0.00 0.00 54.97 53.59 2vhj s GLU 160 Cb -0.10 -1.51 -0.10 0.00 -1.78 0.00 0.00 34.13 30.64 2vhj s GLU 160 CO 0.28 0.37 2.94 -0.35 -0.49 0.00 0.00 175.26 178.01 2vhj n PRO 161 N 1.36 3.51 -4.28 0.39 -0.04 -1.26 -4.74 135.00 129.93 2vhj n PRO 161 Ca -0.18 -2.09 -0.15 0.00 -0.04 0.00 0.00 63.50 61.03 2vhj n PRO 161 Cb 0.53 -2.74 -0.10 0.00 -0.04 0.00 0.00 33.50 31.16 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 0.16 2.34 0.46 1.53 1.43 -1.26 -5.12 118.68 118.22 2vhj s LEU 162 Ca 0.68 -1.12 -0.25 0.00 -1.03 0.00 0.00 54.13 52.41 2vhj s LEU 162 Cb 0.18 -0.28 -0.08 0.00 0.03 0.00 0.00 46.19 46.04 2vhj s LEU 162 CO -0.06 -0.44 1.41 -0.94 0.23 0.00 0.00 176.35 176.56 2vhj s SER 163 N -3.23 5.80 0.00 2.29 1.04 -1.26 -2.84 113.70 115.51 2vhj s SER 163 Ca 0.23 2.88 0.00 0.00 0.48 0.00 0.00 55.95 59.53 2vhj s SER 163 Cb 0.04 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2vhj s SER 163 CO 0.04 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.65 2vhj n GLY 164 N 0.61 1.10 3.66 7.32 0.00 -1.26 -4.97 105.19 111.65 2vhj n GLY 164 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.99 3.25 0.40 1.61 2.02 -1.13 -5.01 117.35 115.49 2vhj s TYR 165 Ca 0.00 1.38 -0.27 0.00 -0.37 0.00 0.00 57.07 57.81 2vhj s TYR 165 Cb 0.00 -3.31 -0.10 0.00 -0.40 0.00 0.00 41.96 38.14 2vhj s TYR 165 CO 0.00 -0.72 1.48 1.21 -1.57 0.00 0.00 175.55 175.95 2vhj s ASN 166 N 1.35 6.18 -0.01 2.29 2.47 -1.25 -4.76 114.94 121.21 2vhj s ASN 166 Ca 0.46 3.04 0.02 0.00 0.42 0.00 0.00 52.86 56.80 2vhj s ASN 166 Cb -0.16 -2.67 0.03 0.00 -1.45 0.00 0.00 41.25 37.00 2vhj s ASN 166 CO 0.08 -0.98 0.89 0.35 -3.72 0.00 0.00 177.10 173.72 2vhj n THR 167 N 0.25 0.81 -3.53 -5.21 -2.24 -1.26 -1.02 114.28 102.09 2vhj n THR 167 Ca 0.02 -0.85 -0.39 0.00 -2.27 0.00 0.00 64.05 60.57 2vhj n THR 167 Cb 0.40 0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 69.07 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 -0.95 6.09 0.39 3.42 -1.08 -1.26 -4.86 116.67 118.41 2vhj s ASP 168 Ca 0.03 0.01 0.10 0.00 -0.52 0.00 0.00 52.55 52.17 2vhj s ASP 168 Cb 0.03 -2.15 0.87 0.00 -1.46 0.00 0.00 42.92 40.21 2vhj s ASP 168 CO 0.00 -0.11 1.94 0.15 0.52 0.00 0.00 175.17 177.67 2vhj h PHE 169 N 8.34 0.65 0.00 -5.34 3.57 -1.99 -1.78 116.94 120.40 2vhj h PHE 169 Ca -0.34 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.11 2vhj h PHE 169 Cb 1.18 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 2vhj h PHE 169 CO 0.75 0.30 -0.34 -0.91 -2.23 0.00 0.00 178.31 175.88 2vhj h ASN 170 N 0.61 0.00 0.07 0.41 2.35 -1.96 -1.87 115.58 115.19 2vhj h ASN 170 Ca 0.34 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.86 2vhj h ASN 170 Cb 0.51 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.89 2vhj h ASN 170 CO -0.12 0.34 -0.87 0.58 -1.65 0.00 0.00 177.43 175.71 2vhj h VAL 171 N 0.00 1.32 -0.29 2.81 2.07 -1.77 -2.93 116.25 117.46 2vhj h VAL 171 Ca -0.00 -2.18 0.07 0.00 0.82 0.00 0.00 66.70 65.41 2vhj h VAL 171 Cb 0.78 2.20 -0.07 0.00 -1.52 0.00 0.00 31.29 32.68 2vhj h VAL 171 CO 0.04 0.67 -0.20 0.15 0.02 0.00 0.00 177.57 178.25 2vhj h PHE 172 N 0.39 -0.53 -0.45 1.57 3.57 -0.94 0.49 116.94 121.04 2vhj h PHE 172 Ca -0.07 0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.39 2vhj h PHE 172 Cb 1.50 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.50 2vhj h PHE 172 CO 0.08 -0.28 -0.01 -0.39 -2.23 0.00 0.00 178.31 175.48 2vhj h VAL 173 N -0.18 1.24 -0.39 1.41 -1.51 -1.40 -0.44 116.25 114.98 2vhj h VAL 173 Ca 0.15 -0.99 0.03 0.00 -1.23 0.00 0.00 66.70 64.66 2vhj h VAL 173 Cb 0.42 0.90 -0.03 0.00 -2.13 0.00 0.00 31.29 30.45 2vhj h VAL 173 CO -0.40 0.35 0.20 -0.78 -1.23 0.00 0.00 177.57 175.71 2vhj h ASP 174 N 0.70 0.31 -0.58 4.19 1.82 -1.26 -0.26 116.42 121.34 2vhj h ASP 174 Ca 0.14 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.77 2vhj h ASP 174 Cb 0.45 -0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.39 2vhj h ASP 174 CO 0.02 0.22 0.28 0.44 -1.61 0.00 0.00 179.24 178.59 2vhj h ASP 175 N 0.42 0.76 -0.17 2.28 3.32 -0.23 -1.49 116.42 121.31 2vhj h ASP 175 Ca 0.16 -0.13 -0.14 0.00 0.02 0.00 0.00 57.03 56.94 2vhj h ASP 175 Cb 0.06 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2vhj h ASP 175 CO -0.11 0.68 -0.39 0.40 -1.72 0.00 0.00 179.24 178.10 2vhj h ILE 176 N 0.79 1.29 -0.14 0.35 2.04 -0.92 -0.79 117.51 120.13 2vhj h ILE 176 Ca 0.20 -1.56 -0.01 0.00 1.00 0.00 0.00 64.86 64.50 2vhj h ILE 176 Cb 0.12 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 2vhj h ILE 176 CO -0.03 0.50 0.05 0.00 0.00 0.00 0.00 178.15 178.68 2vhj h ALA 177 N 0.99 0.18 -0.58 1.87 0.00 -0.87 -1.06 119.26 119.78 2vhj h ALA 177 Ca 0.05 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2vhj h ALA 177 Cb 0.92 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2vhj h ALA 177 CO 0.08 -0.23 0.38 -0.09 0.00 0.00 0.00 179.25 179.39 2vhj h ARG 178 N 0.06 0.74 -0.13 0.00 2.43 -1.19 -1.22 114.38 115.07 2vhj h ARG 178 Ca 0.05 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2vhj h ARG 178 Cb 0.18 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2vhj h ARG 178 CO -0.00 0.49 0.03 0.00 -1.51 0.00 0.00 179.97 178.98 2vhj h ALA 179 N 1.23 0.13 0.00 2.80 0.00 -0.93 -1.76 119.26 120.73 2vhj h ALA 179 Ca 0.22 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 2vhj h ALA 179 Cb -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2vhj h ALA 179 CO -0.07 -0.41 -0.48 0.52 0.00 0.00 0.00 179.25 178.81 2vhj h MET 180 N 0.09 0.00 0.00 0.00 2.86 -1.06 0.64 114.93 117.47 2vhj h MET 180 Ca 0.06 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.63 2vhj h MET 180 Cb 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2vhj h MET 180 CO -0.07 0.48 -0.32 -0.07 1.06 0.00 0.00 176.91 178.00 2vhj h LEU 181 N 0.00 0.00 0.00 1.22 3.38 -0.92 -3.38 115.31 115.61 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 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2vhj h LEU 181 CO 0.06 0.32 -0.15 0.00 0.09 0.00 0.00 178.44 178.77 2vhj n GLN 182 N -3.46 5.00 -3.89 1.13 6.02 -0.69 -5.03 117.38 116.46 2vhj n GLN 182 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.88 2vhj n GLN 182 Cb 0.49 -0.51 -0.11 0.00 1.02 0.00 0.00 30.24 31.13 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 -0.98 0.05 0.06 1.08 3.76 0.19 -5.05 115.29 114.40 2vhj s HIS 183 Ca 0.00 -0.10 0.08 0.00 -0.15 0.00 0.00 55.06 54.89 2vhj s HIS 183 Cb 0.00 -0.06 -0.22 0.00 1.11 0.00 0.00 32.58 33.41 2vhj s HIS 183 CO 0.00 -0.17 1.05 -0.09 -0.85 0.00 0.00 174.74 174.68 2vhj h ARG 184 N 5.02 0.03 -4.87 1.40 2.43 -1.90 -3.42 114.38 113.07 2vhj h ARG 184 Ca -0.29 -0.04 -0.63 0.00 -0.81 0.00 0.00 59.98 58.21 2vhj h ARG 184 Cb 1.20 0.02 -0.35 0.00 -0.42 0.00 0.00 29.97 30.42 2vhj h ARG 184 CO 0.42 0.85 -0.85 0.08 -1.51 0.00 0.00 179.97 178.97 2vhj s VAL 185 N -2.67 1.76 -0.03 0.20 1.01 -1.26 -0.36 120.40 119.05 2vhj s VAL 185 Ca -0.02 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.22 2vhj s VAL 185 Cb 0.09 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.86 2vhj s VAL 185 CO 0.83 0.49 -0.09 -0.63 0.00 0.00 0.00 175.10 175.69 2vhj s ILE 186 N 1.22 0.83 -0.08 2.22 1.01 -0.10 -0.88 121.20 125.42 2vhj s ILE 186 Ca 0.01 -0.37 0.02 0.00 0.00 0.00 0.00 60.65 60.31 2vhj s ILE 186 Cb -0.14 -0.74 -0.02 0.00 0.01 0.00 0.00 42.46 41.57 2vhj s ILE 186 CO -0.08 0.26 -0.15 -0.69 0.00 0.00 0.00 174.94 174.29 2vhj s VAL 187 N 0.27 2.99 -0.18 2.92 1.01 0.68 -0.04 120.40 128.05 2vhj s VAL 187 Ca -0.05 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2vhj s VAL 187 Cb -0.10 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 34.10 2vhj s VAL 187 CO 0.01 0.57 -0.16 -0.63 0.00 0.00 0.00 175.10 174.88 2vhj s ILE 188 N -0.30 2.42 -0.31 2.22 1.01 0.19 0.30 121.20 126.73 2vhj s ILE 188 Ca 0.02 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.86 2vhj s ILE 188 Cb -0.13 -2.03 0.09 0.00 0.01 0.00 0.00 42.46 40.40 2vhj s ILE 188 CO 0.03 0.51 0.06 -0.62 0.00 0.00 0.00 174.94 174.92 2vhj s ASP 189 N 1.18 4.28 0.16 3.58 2.15 -0.19 -2.13 116.67 125.70 2vhj s ASP 189 Ca 0.02 -1.77 0.02 0.00 0.43 0.00 0.00 52.55 51.25 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 -0.07 -0.38 0.17 -1.54 -0.17 0.00 0.00 175.17 173.18 2vhj n SER 190 N 4.59 -0.45 -0.56 -0.34 3.41 -0.73 -0.50 113.62 119.05 2vhj n SER 190 Ca -0.01 -1.95 0.09 0.00 -0.26 0.00 0.00 58.87 56.74 2vhj n SER 190 Cb 0.42 0.93 0.31 0.00 -0.26 0.00 0.00 64.21 65.62 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 1.65 -0.03 1.04 4.32 -0.38 -4.58 117.00 119.02 2vhj n LEU 191 Ca 0.02 -0.73 -0.09 0.00 -0.02 0.00 0.00 56.01 55.19 2vhj n LEU 191 Cb 0.27 -0.14 -0.03 0.00 -1.62 0.00 0.00 43.42 41.91 2vhj n LEU 191 CO 0.14 0.37 0.67 0.50 -1.22 0.00 0.00 177.39 177.85 2vhj h LYS 192 N 2.07 -0.30 -0.00 3.23 3.64 -1.87 -1.22 116.57 122.11 2vhj h LYS 192 Ca 0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2vhj h LYS 192 Cb 0.46 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2vhj h LYS 192 CO 0.00 -0.20 -0.07 0.09 -2.27 0.00 0.00 179.45 177.00 2vhj n ASN 193 N -5.39 0.15 -0.06 4.20 4.13 -1.26 -3.72 115.26 113.31 2vhj n ASN 193 Ca -0.02 -0.04 -0.04 0.00 1.68 0.00 0.00 54.58 56.16 2vhj n ASN 193 Cb 0.31 -0.26 -0.04 0.00 -1.54 0.00 0.00 39.78 38.25 2vhj n ASN 193 CO 0.00 0.00 0.00 -0.37 0.28 0.00 0.00 177.26 177.17 2vhj h VAL 194 N 0.13 0.55 -1.94 2.41 -1.51 -1.54 -3.49 116.25 110.85 2vhj h VAL 194 Ca 0.00 -1.41 -0.49 0.00 -1.23 0.00 0.00 66.70 63.56 2vhj h VAL 194 Cb 0.39 1.03 -0.05 0.00 -2.13 0.00 0.00 31.29 30.54 2vhj h VAL 194 CO 0.00 0.18 1.24 -0.63 -1.23 0.00 0.00 177.57 177.14 2vhj s ILE 195 N -1.77 3.46 -0.29 7.19 1.09 -0.84 -4.73 121.20 125.31 2vhj s ILE 195 Ca -0.06 0.17 -0.18 0.00 -1.10 0.00 0.00 60.65 59.48 2vhj s ILE 195 Cb -0.01 -4.20 0.17 0.00 -1.06 0.00 0.00 42.46 37.36 2vhj s ILE 195 CO 0.22 -1.16 1.13 -0.63 -0.10 0.00 0.00 174.94 174.40 2vhj s ILE 207 N 8.28 0.00 0.78 2.92 1.01 -1.26 -5.12 121.20 127.82 2vhj s ILE 207 Ca 0.59 0.00 -0.12 0.00 0.00 0.00 0.00 60.65 61.13 2vhj s ILE 207 Cb -0.11 -1.00 0.07 0.00 0.01 0.00 0.00 42.46 41.43 2vhj s ILE 207 CO 0.17 0.00 1.13 -0.94 0.00 0.00 0.00 174.94 175.30 2vhj s SER 208 N 0.93 4.12 0.20 3.58 1.04 -1.26 -4.83 113.70 117.48 2vhj s SER 208 Ca -0.05 2.04 -0.10 0.00 0.48 0.00 0.00 55.95 58.32 2vhj s SER 208 Cb -0.04 -2.55 0.14 0.00 0.10 0.00 0.00 66.02 63.67 2vhj s SER 208 CO -0.12 -2.30 1.82 0.03 0.98 0.00 0.00 173.24 173.65 2vhj h ARG 209 N -0.99 1.01 -0.81 4.02 3.08 -1.86 -0.94 114.38 117.88 2vhj h ARG 209 Ca -0.45 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.50 2vhj h ARG 209 Cb 1.25 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 31.06 2vhj h ARG 209 CO 0.49 0.74 0.52 0.78 -1.07 0.00 0.00 179.97 181.44 2vhj h GLY 210 N 1.00 1.15 1.03 0.04 0.00 -1.41 -0.04 103.07 104.84 2vhj h GLY 210 Ca 0.26 -0.44 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 2vhj h GLY 210 CO -0.04 0.43 0.01 0.00 0.00 0.00 0.00 176.54 176.94 2vhj h ALA 211 N 1.29 0.72 -0.33 3.60 0.00 -1.72 -0.78 119.26 122.05 2vhj h ALA 211 Ca 0.30 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2vhj h ALA 211 Cb -0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2vhj h ALA 211 CO -0.06 0.54 0.04 0.35 0.00 0.00 0.00 179.25 180.11 2vhj h PHE 212 N 0.82 0.60 -0.83 0.00 3.57 -1.00 -2.46 116.94 117.64 2vhj h PHE 212 Ca 0.15 -0.09 0.15 0.00 3.53 0.00 0.00 57.97 61.72 2vhj h PHE 212 Cb 0.52 -0.16 -0.10 0.00 2.79 0.00 0.00 35.95 39.00 2vhj h PHE 212 CO 0.04 0.65 0.40 -0.44 -2.23 0.00 0.00 178.31 176.72 2vhj h ASP 213 N 0.38 0.44 0.12 0.41 3.32 -0.84 -1.54 116.42 118.71 2vhj h ASP 213 Ca 0.10 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 2vhj h ASP 213 Cb 0.38 0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2vhj h ASP 213 CO 0.01 0.16 -0.06 0.25 -1.72 0.00 0.00 179.24 177.89 2vhj h LEU 214 N 0.55 -0.13 -0.91 1.55 5.85 -0.76 0.30 115.31 121.76 2vhj h LEU 214 Ca 0.46 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 59.11 2vhj h LEU 214 Cb 0.70 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.71 2vhj h LEU 214 CO -0.39 0.04 0.58 0.25 -0.34 0.00 0.00 178.44 178.58 2vhj h LEU 215 N -0.30 0.96 -0.89 2.25 5.85 -1.27 -0.40 115.31 121.50 2vhj h LEU 215 Ca -0.02 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 2vhj h LEU 215 Cb 0.24 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2vhj h LEU 215 CO 0.03 0.64 -0.50 0.28 -0.34 0.00 0.00 178.44 178.54 2vhj h SER 216 N 1.11 0.13 0.00 1.25 0.02 -0.97 -3.39 113.55 111.71 2vhj h SER 216 Ca 0.37 -0.06 -0.36 0.00 -0.84 0.00 0.00 61.79 60.90 2vhj h SER 216 Cb 0.07 -0.04 -0.07 0.00 0.14 0.00 0.00 62.40 62.50 2vhj h SER 216 CO -0.14 0.62 -2.36 0.47 -1.14 0.00 0.00 176.83 174.28 2vhj n ASP 217 N -3.95 0.80 -0.18 3.07 8.00 0.10 -4.78 116.55 119.62 2vhj n ASP 217 Ca -0.02 -0.04 -0.10 0.00 0.71 0.00 0.00 54.79 55.34 2vhj n ASP 217 Cb 0.53 0.55 0.01 0.00 -0.02 0.00 0.00 41.12 42.20 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 1.27 -0.16 0.53 2.04 -1.28 -1.28 117.51 118.62 2vhj h ILE 218 Ca -0.53 -1.30 0.04 0.00 1.00 0.00 0.00 64.86 64.07 2vhj h ILE 218 Cb 2.09 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 39.13 2vhj h ILE 218 CO -0.01 0.46 -0.09 1.23 0.00 0.00 0.00 178.15 179.74 2vhj h GLY 219 N 0.92 0.05 0.97 5.37 0.00 -1.83 0.11 103.07 108.66 2vhj h GLY 219 Ca 0.13 0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.53 2vhj h GLY 219 CO 0.05 -0.11 0.13 0.00 0.00 0.00 0.00 176.54 176.62 2vhj h ALA 220 N 1.05 0.64 -0.38 3.60 0.00 -1.81 0.71 119.26 123.08 2vhj h ALA 220 Ca 0.09 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.84 2vhj h ALA 220 Cb 0.22 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2vhj h ALA 220 CO -0.22 0.32 0.17 0.52 0.00 0.00 0.00 179.25 180.04 2vhj h MET 221 N 0.66 0.34 -0.27 0.00 2.07 -0.95 -0.20 114.93 116.58 2vhj h MET 221 Ca 0.15 -0.02 -0.09 0.00 -2.07 0.00 0.00 59.70 57.68 2vhj h MET 221 Cb 0.31 -0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 29.96 2vhj h MET 221 CO -0.00 0.22 -0.18 0.00 1.07 0.00 0.00 176.91 178.03 2vhj h ALA 222 N 1.22 0.38 -0.56 6.32 0.00 -0.51 -2.00 119.26 124.11 2vhj h ALA 222 Ca 0.17 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2vhj h ALA 222 Cb 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2vhj h ALA 222 CO -0.14 0.30 0.25 0.00 0.00 0.00 0.00 179.25 179.66 2vhj h ALA 223 N 0.72 1.38 -0.70 0.00 0.00 -0.75 0.20 119.26 120.11 2vhj h ALA 223 Ca 0.05 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2vhj h ALA 223 Cb 0.71 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2vhj h ALA 223 CO 0.05 0.48 0.17 0.77 0.00 0.00 0.00 179.25 180.72 2vhj h SER 224 N 0.79 1.06 0.70 0.00 0.02 -0.82 -2.84 113.55 112.46 2vhj h SER 224 Ca 0.19 -0.23 -0.15 0.00 -0.84 0.00 0.00 61.79 60.76 2vhj h SER 224 Cb 0.12 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 2vhj h SER 224 CO -0.02 1.02 -0.70 -0.09 -1.14 0.00 0.00 176.83 175.89 2vhj h ARG 225 N 1.05 0.01 0.00 3.45 9.65 -0.90 -3.46 114.38 124.18 2vhj h ARG 225 Ca 0.22 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.09 2vhj h ARG 225 Cb 0.37 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 2vhj h ARG 225 CO 0.00 0.71 0.00 0.41 2.80 0.00 0.00 179.97 183.89 2vhj n GLY 226 N 0.49 0.46 3.90 2.80 0.00 0.62 -3.81 105.19 109.65 2vhj n GLY 226 Ca -0.01 -0.94 -0.25 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.81 3.93 -0.24 0.00 0.11 0.51 -1.18 120.40 121.72 2vhj s VAL 228 Ca 0.33 -0.35 -0.05 0.00 -2.93 0.00 0.00 61.98 58.98 2vhj s VAL 228 Cb -0.10 -2.72 -0.01 0.00 -1.53 0.00 0.00 36.38 32.02 2vhj s VAL 228 CO 0.27 0.50 0.02 -0.69 -3.33 0.00 0.00 175.10 171.87 2vhj s VAL 229 N 0.28 3.78 -0.34 2.04 1.01 -0.11 -0.92 120.40 126.14 2vhj s VAL 229 Ca -0.03 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.46 2vhj s VAL 229 Cb -0.14 -2.78 0.04 0.00 0.00 0.00 0.00 36.38 33.51 2vhj s VAL 229 CO 0.03 0.33 0.10 -0.63 0.00 0.00 0.00 175.10 174.93 2vhj s ILE 230 N 1.53 3.68 -0.10 2.22 1.01 0.94 -0.13 121.20 130.35 2vhj s ILE 230 Ca 0.05 -1.20 0.04 0.00 0.00 0.00 0.00 60.65 59.54 2vhj s ILE 230 Cb -0.15 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.21 2vhj s ILE 230 CO -0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 174.94 174.52 2vhj s ALA 231 N 1.38 2.03 0.26 9.38 0.00 0.36 -0.64 121.76 134.53 2vhj s ALA 231 Ca -0.02 -0.89 -0.23 0.00 0.00 0.00 0.00 51.96 50.83 2vhj s ALA 231 Cb -0.20 -0.78 -0.09 0.00 0.00 0.00 0.00 23.12 22.05 2vhj s ALA 231 CO 0.02 0.24 0.82 -1.54 0.00 0.00 0.00 175.76 175.30 2vhj s SER 232 N 0.43 7.20 -0.23 0.00 1.04 -0.91 -0.53 113.70 120.70 2vhj s SER 232 Ca -0.17 1.61 -0.03 0.00 0.48 0.00 0.00 55.95 57.84 2vhj s SER 232 Cb -0.17 -2.49 0.12 0.00 0.10 0.00 0.00 66.02 63.57 2vhj s SER 232 CO 0.07 -0.00 0.30 -0.22 0.98 0.00 0.00 173.24 174.37 2vhj s LEU 233 N -1.96 -0.36 0.35 2.42 2.96 -0.45 -1.25 118.68 120.39 2vhj s LEU 233 Ca 0.46 -0.06 -0.25 0.00 -0.22 0.00 0.00 54.13 54.06 2vhj s LEU 233 Cb -0.18 0.73 -0.10 0.00 0.50 0.00 0.00 46.19 47.15 2vhj s LEU 233 CO 0.22 -0.32 0.96 0.20 -1.32 0.00 0.00 176.35 176.10 2vhj s ASN 234 N 2.43 7.17 -0.40 3.68 0.01 -1.26 -4.29 114.94 122.28 2vhj s ASN 234 Ca 0.10 1.85 -0.29 0.00 -0.71 0.00 0.00 52.86 53.81 2vhj s ASN 234 Cb -0.15 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 38.93 2vhj s ASN 234 CO -0.15 -0.19 1.53 -2.84 -1.51 0.00 0.00 177.10 173.93 2vhj s PRO 235 N -2.33 3.47 0.42 -0.60 0.02 -1.26 -4.81 135.00 129.91 2vhj s PRO 235 Ca 0.54 1.04 0.19 0.00 0.02 0.00 0.00 61.00 62.78 2vhj s PRO 235 Cb -0.17 -4.09 0.93 0.00 0.02 0.00 0.00 34.50 31.19 2vhj s PRO 235 CO 0.22 -1.70 1.88 0.00 -0.33 0.00 0.00 177.00 177.08 2vhj h THR 236 N 6.57 0.94 -1.11 0.99 1.03 -1.96 -3.42 112.91 115.95 2vhj h THR 236 Ca -0.29 -1.10 0.00 0.00 -0.01 0.00 0.00 66.41 65.00 2vhj h THR 236 Cb 1.12 1.64 0.00 0.00 -1.07 0.00 0.00 68.15 69.85 2vhj h THR 236 CO 1.08 0.29 0.00 -1.20 -0.01 0.00 0.00 175.52 175.67 2vhj n SER 237 N -3.81 -0.33 -3.35 0.00 7.64 -1.26 -5.04 113.62 107.46 2vhj n SER 237 Ca -0.01 -0.30 -0.25 0.00 1.01 0.00 0.00 58.87 59.32 2vhj n SER 237 Cb 0.38 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 63.79 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 -1.41 -2.18 -1.69 6.43 4.13 -1.26 -4.90 115.26 114.38 2vhj n ASN 238 Ca 0.00 -1.01 -0.14 0.00 1.68 0.00 0.00 54.58 55.12 2vhj n ASN 238 Cb 0.00 -0.83 0.10 0.00 -1.54 0.00 0.00 39.78 37.50 2vhj n ASN 238 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2vhj n ASP 239 N -4.66 3.63 -2.02 6.41 8.00 -1.26 -4.55 116.55 122.09 2vhj n ASP 239 Ca 0.12 -2.90 0.00 0.00 0.71 0.00 0.00 54.79 52.72 2vhj n ASP 239 Cb 0.49 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 40.88 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 -0.37 0.00 0.00 -2.24 2.03 -1.26 -4.88 116.55 109.83 2vhj n ASP 240 Ca 0.33 -0.41 0.06 0.00 0.52 0.00 0.00 54.79 55.29 2vhj n ASP 240 Cb 1.11 0.00 0.36 0.00 -0.72 0.00 0.00 41.12 41.87 2vhj n ASP 240 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 2vhj n LYS 241 N -0.41 0.49 0.22 -0.67 2.85 -1.26 -1.78 118.16 117.62 2vhj n LYS 241 Ca 0.00 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.32 2vhj n LYS 241 Cb 0.00 -1.38 0.52 0.00 -0.65 0.00 0.00 35.03 33.52 2vhj n LYS 241 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 177.40 178.17 2vhj h ILE 242 N 0.00 1.05 -0.52 0.58 5.03 -1.92 -2.89 117.51 118.85 2vhj h ILE 242 Ca 0.00 -0.73 0.06 0.00 -0.12 0.00 0.00 64.86 64.07 2vhj h ILE 242 Cb 0.00 1.41 -0.05 0.00 -3.03 0.00 0.00 36.82 35.14 2vhj h ILE 242 CO 0.00 0.20 0.22 0.58 -0.68 0.00 0.00 178.15 178.47 2vhj h VAL 243 N 0.00 0.87 -0.82 1.67 2.07 -1.59 -1.05 116.25 117.40 2vhj h VAL 243 Ca -0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2vhj h VAL 243 Cb 0.39 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 2vhj h VAL 243 CO 0.03 0.08 0.53 -0.08 0.02 0.00 0.00 177.57 178.14 2vhj h GLU 244 N 0.42 1.09 -0.50 1.57 4.57 -1.71 -0.05 114.58 119.97 2vhj h GLU 244 Ca 0.24 -0.08 -0.09 0.00 -1.18 0.00 0.00 59.36 58.26 2vhj h GLU 244 Cb 0.23 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2vhj h GLU 244 CO -0.22 0.74 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.23 2vhj h LEU 245 N 1.12 0.90 -0.45 1.64 3.38 -1.42 0.04 115.31 120.52 2vhj h LEU 245 Ca 0.30 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2vhj h LEU 245 Cb -0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 2vhj h LEU 245 CO -0.06 1.02 0.17 0.58 0.09 0.00 0.00 178.44 180.23 2vhj h VAL 246 N 0.77 1.21 -0.49 1.22 2.07 -0.90 -1.08 116.25 119.04 2vhj h VAL 246 Ca 0.14 -0.66 0.03 0.00 0.82 0.00 0.00 66.70 67.03 2vhj h VAL 246 Cb 0.58 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2vhj h VAL 246 CO 0.03 0.24 0.28 0.50 0.02 0.00 0.00 177.57 178.64 2vhj h LYS 247 N 0.59 0.53 0.26 1.57 3.64 -0.85 0.85 116.57 123.15 2vhj h LYS 247 Ca 0.15 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2vhj h LYS 247 Cb 0.21 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2vhj h LYS 247 CO -0.01 0.35 -0.13 0.93 -2.27 0.00 0.00 179.45 178.32 2vhj h GLU 248 N 0.55 -0.34 -0.81 1.90 5.08 -0.80 0.56 114.58 120.72 2vhj h GLU 248 Ca 0.21 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.56 2vhj h GLU 248 Cb 0.06 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 2vhj h GLU 248 CO -0.12 -0.23 0.39 0.00 -1.00 0.00 0.00 179.01 178.05 2vhj h ALA 249 N 0.39 1.16 -0.05 3.43 0.00 -1.08 -2.29 119.26 120.82 2vhj h ALA 249 Ca -0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2vhj h ALA 249 Cb 0.28 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2vhj h ALA 249 CO 0.05 0.64 0.00 0.77 0.00 0.00 0.00 179.25 180.71 2vhj h SER 250 N 1.15 0.08 -0.73 0.00 0.02 -0.66 -2.91 113.55 110.50 2vhj h SER 250 Ca 0.28 -0.29 0.06 0.00 -0.84 0.00 0.00 61.79 61.01 2vhj h SER 250 Cb 0.12 -0.02 -0.06 0.00 0.14 0.00 0.00 62.40 62.58 2vhj h SER 250 CO -0.03 0.34 0.42 -0.09 -1.14 0.00 0.00 176.83 176.33 2vhj h ARG 251 N -0.19 0.74 -0.17 3.45 2.43 -0.77 -1.56 114.38 118.30 2vhj h ARG 251 Ca 0.01 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 2vhj h ARG 251 Cb 0.30 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2vhj h ARG 251 CO 0.00 0.49 -0.19 0.00 -1.51 0.00 0.00 179.97 178.76 2vhj h ALA 252 N 1.37 1.35 -0.44 2.80 0.00 -1.40 -3.06 119.26 119.89 2vhj h ALA 252 Ca 0.33 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2vhj h ALA 252 Cb 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2vhj h ALA 252 CO -0.19 0.44 0.00 0.09 0.00 0.00 0.00 179.25 179.59 2vhj n ASN 253 N -4.20 3.86 -4.28 0.00 4.13 -1.01 -4.98 115.26 108.79 2vhj n ASN 253 Ca -0.01 -2.44 -0.18 0.00 1.68 0.00 0.00 54.58 53.63 2vhj n ASN 253 Cb 0.33 -0.45 -0.11 0.00 -1.54 0.00 0.00 39.78 38.02 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 -1.23 2.20 0.02 6.41 1.04 -0.62 -4.64 113.70 116.88 2vhj s SER 254 Ca 0.39 -0.89 -0.14 0.00 0.48 0.00 0.00 55.95 55.79 2vhj s SER 254 Cb 0.26 -0.09 -0.34 0.00 0.10 0.00 0.00 66.02 65.95 2vhj s SER 254 CO 0.17 -0.15 0.97 0.74 0.98 0.00 0.00 173.24 175.95 2vhj h THR 255 N 3.19 1.26 -3.95 2.02 2.02 -0.77 -3.47 112.91 113.20 2vhj h THR 255 Ca -0.39 -2.72 -0.37 0.00 0.77 0.00 0.00 66.41 63.70 2vhj h THR 255 Cb 1.20 3.00 -0.21 0.00 -1.74 0.00 0.00 68.15 70.39 2vhj h THR 255 CO 0.55 0.83 -0.76 -0.44 0.37 0.00 0.00 175.52 176.06 2vhj s SER 256 N -7.50 1.39 -0.06 4.18 0.01 -0.75 -1.05 113.70 109.92 2vhj s SER 256 Ca -0.09 -0.59 0.06 0.00 1.31 0.00 0.00 55.95 56.63 2vhj s SER 256 Cb 0.05 -0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.25 2vhj s SER 256 CO 0.93 -0.12 -0.24 -0.22 0.41 0.00 0.00 173.24 174.00 2vhj s LEU 257 N -1.68 2.05 -0.16 2.44 2.96 0.23 -2.17 118.68 122.36 2vhj s LEU 257 Ca -0.05 -0.50 0.01 0.00 -0.22 0.00 0.00 54.13 53.37 2vhj s LEU 257 Cb -0.10 -1.33 0.02 0.00 0.50 0.00 0.00 46.19 45.27 2vhj s LEU 257 CO 0.02 0.22 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.39 2vhj s VAL 258 N -0.06 1.89 0.02 1.68 1.01 -0.02 -0.14 120.40 124.79 2vhj s VAL 258 Ca -0.06 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.13 2vhj s VAL 258 Cb -0.14 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 2vhj s VAL 258 CO 0.04 0.51 -0.17 0.27 0.00 0.00 0.00 175.10 175.76 2vhj s ILE 259 N 1.20 1.35 0.78 2.22 -4.36 -0.15 -0.94 121.20 121.31 2vhj s ILE 259 Ca 0.01 -0.96 -0.12 0.00 -0.26 0.00 0.00 60.65 59.32 2vhj s ILE 259 Cb -0.14 -1.17 0.06 0.00 1.25 0.00 0.00 42.46 42.47 2vhj s ILE 259 CO -0.09 0.19 1.12 -0.94 0.24 0.00 0.00 174.94 175.45 2vhj s SER 260 N -0.91 4.24 0.42 4.36 1.04 -0.98 -0.96 113.70 120.92 2vhj s SER 260 Ca 0.05 1.98 0.04 0.00 0.48 0.00 0.00 55.95 58.50 2vhj s SER 260 Cb -0.08 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.48 2vhj s SER 260 CO 0.01 -2.21 0.14 0.42 0.98 0.00 0.00 173.24 172.58 2vhj s THR 261 N -2.67 0.53 0.52 2.02 -4.23 -1.15 -4.74 115.64 105.91 2vhj s THR 261 Ca 0.64 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.44 2vhj s THR 261 Cb -0.20 -2.29 0.45 0.00 1.34 0.00 0.00 72.50 71.80 2vhj s THR 261 CO 0.53 0.00 1.90 0.44 -0.54 0.00 0.00 174.62 176.95 2vhj h ASP 262 N 1.73 0.06 -3.27 3.99 3.32 -1.97 -3.43 116.42 116.84 2vhj h ASP 262 Ca -0.34 0.01 -0.61 0.00 0.02 0.00 0.00 57.03 56.10 2vhj h ASP 262 Cb 1.28 -0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.67 2vhj h ASP 262 CO 0.55 0.02 -0.55 -0.69 -1.72 0.00 0.00 179.24 176.85 2vhj s VAL 263 N -5.05 4.94 -0.13 -1.35 1.01 -1.26 -5.04 120.40 113.52 2vhj s VAL 263 Ca -0.05 0.02 -0.38 0.00 0.00 0.00 0.00 61.98 61.56 2vhj s VAL 263 Cb 0.21 -3.23 -0.15 0.00 0.00 0.00 0.00 36.38 33.21 2vhj s VAL 263 CO 0.77 0.46 1.66 0.47 0.00 0.00 0.00 175.10 178.46 2vhj n ASP 264 N 3.49 2.44 0.00 3.32 8.00 -1.26 -1.57 116.55 130.96 2vhj n ASP 264 Ca -0.16 1.07 0.00 0.00 0.71 0.00 0.00 54.79 56.40 2vhj n ASP 264 Cb 0.52 -1.21 0.00 0.00 -0.02 0.00 0.00 41.12 40.41 2vhj n ASP 264 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vhj n GLY 265 N 3.79 1.23 3.80 0.44 0.00 -1.26 -4.88 105.19 108.31 2vhj n GLY 265 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.05 3.68 0.05 1.61 2.12 -0.61 -1.89 118.70 123.61 2vhj s GLU 266 Ca 0.00 -0.20 0.05 0.00 0.36 0.00 0.00 54.97 55.19 2vhj s GLU 266 Cb 0.00 -3.23 -0.02 0.00 0.26 0.00 0.00 34.13 31.13 2vhj s GLU 266 CO 0.00 0.58 -0.15 -1.58 -0.54 0.00 0.00 175.26 173.57 2vhj s TRP 267 N -0.47 1.29 -0.20 5.30 0.52 -0.49 -2.95 118.94 121.94 2vhj s TRP 267 Ca 0.12 -0.39 -0.08 0.00 0.02 0.00 0.00 56.10 55.77 2vhj s TRP 267 Cb -0.12 -0.75 -0.04 0.00 -1.15 0.00 0.00 33.47 31.41 2vhj s TRP 267 CO 0.02 0.06 0.08 -0.65 0.02 0.00 0.00 176.95 176.47 2vhj s GLN 268 N -1.37 3.98 -0.20 4.98 -0.21 -0.14 -0.28 119.66 126.42 2vhj s GLN 268 Ca 0.01 -0.34 -0.07 0.00 0.02 0.00 0.00 55.36 54.99 2vhj s GLN 268 Cb -0.09 -3.28 -0.04 0.00 1.00 0.00 0.00 33.01 30.61 2vhj s GLN 268 CO 0.02 0.22 0.05 0.08 -2.12 0.00 0.00 175.29 173.53 2vhj s VAL 269 N 0.54 4.52 -0.22 1.09 1.01 0.87 -0.97 120.40 127.25 2vhj s VAL 269 Ca 0.04 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.91 2vhj s VAL 269 Cb -0.13 -3.05 0.03 0.00 0.00 0.00 0.00 36.38 33.23 2vhj s VAL 269 CO 0.01 0.43 -0.15 -0.76 0.00 0.00 0.00 175.10 174.63 2vhj s LEU 270 N 0.75 2.72 -0.16 3.92 1.43 0.80 -1.50 118.68 126.63 2vhj s LEU 270 Ca 0.03 -0.92 -0.01 0.00 -1.03 0.00 0.00 54.13 52.20 2vhj s LEU 270 Cb -0.14 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 2vhj s LEU 270 CO 0.02 -0.08 -0.11 -0.89 0.23 0.00 0.00 176.35 175.52 2vhj s THR 271 N 1.24 3.11 -0.45 5.49 2.01 0.31 -0.60 115.64 126.74 2vhj s THR 271 Ca -0.00 -0.62 -0.25 0.00 0.31 0.00 0.00 61.69 61.13 2vhj s THR 271 Cb -0.16 -2.34 0.03 0.00 0.01 0.00 0.00 72.50 70.04 2vhj s THR 271 CO -0.09 0.50 0.89 -0.13 -0.69 0.00 0.00 174.62 175.10 2vhj s ARG 272 N 0.67 3.54 0.00 4.92 0.52 -0.21 -1.11 118.95 127.28 2vhj s ARG 272 Ca -0.06 0.14 0.29 0.00 -0.52 0.00 0.00 55.73 55.58 2vhj s ARG 272 Cb -0.15 -3.91 1.18 0.00 0.52 0.00 0.00 34.95 32.58 2vhj s ARG 272 CO 0.02 -1.16 1.88 0.25 0.02 0.00 0.00 175.30 176.31 2vhj n THR 273 N 6.30 0.00 0.00 0.02 -2.24 -1.20 -4.73 114.28 112.43 2vhj n THR 273 Ca 0.05 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2vhj n THR 273 Cb 0.48 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 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 1.48 -0.24 3.64 3.38 0.00 -1.26 -3.84 105.19 108.35 2vhj n GLY 274 Ca 0.07 -1.43 -0.45 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.20 2.30 -0.81 1.61 2.13 0.11 -1.29 120.64 123.49 2vhj n GLU 275 Ca 0.00 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.62 2vhj n GLU 275 Cb 0.00 -2.89 0.00 0.00 0.27 0.00 0.00 31.44 28.82 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 4.93 0.52 3.96 8.31 0.00 -1.26 -4.98 105.19 116.67 2vhj n GLY 276 Ca 0.25 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 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 3.13 0.33 0.99 1.43 -0.41 -5.03 118.68 119.12 2vhj s LEU 277 Ca 0.00 0.10 -0.28 0.00 -1.03 0.00 0.00 54.13 52.92 2vhj s LEU 277 Cb 0.00 -2.90 -0.12 0.00 0.03 0.00 0.00 46.19 43.20 2vhj s LEU 277 CO 0.00 -1.31 1.29 0.00 0.23 0.00 0.00 176.35 176.56 2vhj n GLN 278 N -2.53 2.10 -3.61 1.70 6.02 -1.26 -4.70 117.38 115.10 2vhj n GLN 278 Ca 0.08 0.74 -0.36 0.00 -0.01 0.00 0.00 57.00 57.45 2vhj n GLN 278 Cb 0.60 -2.31 -0.08 0.00 1.02 0.00 0.00 30.24 29.46 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 -1.79 4.15 0.14 -1.09 0.52 -1.26 -3.21 118.95 116.41 2vhj s ARG 279 Ca 0.56 -0.11 0.04 0.00 -0.52 0.00 0.00 55.73 55.70 2vhj s ARG 279 Cb -0.58 -3.49 -0.04 0.00 0.52 0.00 0.00 34.95 31.37 2vhj s ARG 279 CO 0.62 0.13 0.18 -0.51 0.02 0.00 0.00 175.30 175.74 2vhj s LEU 280 N 0.83 4.02 -0.01 2.53 1.43 -0.26 -4.90 118.68 122.32 2vhj s LEU 280 Ca 0.11 0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.26 2vhj s LEU 280 Cb -0.13 -2.63 -0.01 0.00 0.03 0.00 0.00 46.19 43.46 2vhj s LEU 280 CO 0.03 0.08 -0.09 -0.89 0.23 0.00 0.00 176.35 175.72 2vhj s THR 281 N -1.68 0.70 0.16 5.49 2.01 -1.26 -0.53 115.64 120.53 2vhj s THR 281 Ca 0.32 -0.37 -0.14 0.00 0.31 0.00 0.00 61.69 61.81 2vhj s THR 281 Cb -0.11 -0.60 0.02 0.00 0.01 0.00 0.00 72.50 71.82 2vhj s THR 281 CO 0.25 0.20 0.40 -1.38 -0.69 0.00 0.00 174.62 173.40 2vhj s HIS 282 N -0.14 0.02 0.09 4.92 -3.43 -0.57 -5.00 115.29 111.19 2vhj s HIS 282 Ca 0.02 -0.37 0.05 0.00 -0.80 0.00 0.00 55.06 53.96 2vhj s HIS 282 Cb -0.04 0.20 -0.04 0.00 -1.43 0.00 0.00 32.58 31.27 2vhj s HIS 282 CO -0.00 -0.77 0.02 0.95 -2.00 0.00 0.00 174.74 172.93 2vhj s THR 283 N -3.88 4.12 -0.09 -5.38 -4.23 -1.26 -0.09 115.64 104.83 2vhj s THR 283 Ca 0.09 -0.97 0.01 0.00 -1.18 0.00 0.00 61.69 59.65 2vhj s THR 283 Cb 0.01 -2.97 -0.02 0.00 1.34 0.00 0.00 72.50 70.86 2vhj s THR 283 CO -0.05 0.11 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.27 2vhj s LEU 284 N -2.37 2.91 -0.07 4.79 1.02 0.61 -4.95 118.68 120.61 2vhj s LEU 284 Ca 0.27 -0.18 -0.01 0.00 0.02 0.00 0.00 54.13 54.23 2vhj s LEU 284 Cb -0.12 -1.63 -0.03 0.00 0.02 0.00 0.00 46.19 44.43 2vhj s LEU 284 CO 0.19 0.28 -0.01 -1.10 0.02 0.00 0.00 176.35 175.73 2vhj s GLN 285 N -0.32 2.92 0.06 1.70 -1.52 -1.26 -1.40 119.66 119.84 2vhj s GLN 285 Ca 0.04 -0.45 -0.03 0.00 -1.95 0.00 0.00 55.36 52.96 2vhj s GLN 285 Cb -0.13 -2.74 -0.03 0.00 -0.22 0.00 0.00 33.01 29.89 2vhj s GLN 285 CO 0.02 0.69 0.03 0.95 -0.25 0.00 0.00 175.29 176.74 2vhj s THR 286 N -0.89 0.20 0.06 -0.19 -4.23 -0.79 -0.65 115.64 109.13 2vhj s THR 286 Ca 0.14 -1.62 -0.16 0.00 -1.18 0.00 0.00 61.69 58.86 2vhj s THR 286 Cb -0.11 -1.46 0.03 0.00 1.34 0.00 0.00 72.50 72.30 2vhj s THR 286 CO 0.03 -0.90 0.38 -0.94 -0.54 0.00 0.00 174.62 172.65 2vhj s SER 287 N -2.89 -0.22 0.06 3.99 1.04 -0.86 -4.69 113.70 110.13 2vhj s SER 287 Ca 0.06 -0.11 -0.09 0.00 0.48 0.00 0.00 55.95 56.29 2vhj s SER 287 Cb 0.07 0.41 -0.06 0.00 0.10 0.00 0.00 66.02 66.54 2vhj s SER 287 CO -0.10 -0.68 0.37 -0.31 0.98 0.00 0.00 173.24 173.50 2vhj s TYR 288 N -2.70 3.59 0.00 5.02 2.02 -1.26 -1.02 117.35 122.99 2vhj s TYR 288 Ca -0.04 0.75 0.00 0.00 -0.37 0.00 0.00 57.07 57.41 2vhj s TYR 288 Cb -0.00 -2.13 0.00 0.00 -0.40 0.00 0.00 41.96 39.43 2vhj s TYR 288 CO -0.04 0.55 0.00 0.41 -1.57 0.00 0.00 175.55 174.90 2vhj n GLY 289 N 1.01 2.95 3.78 0.71 0.00 0.48 -4.97 105.19 109.15 2vhj n GLY 289 Ca -0.09 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 43.77 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 4.05 3.89 -1.42 1.61 2.12 -1.26 -3.55 118.70 124.14 2vhj s GLU 290 Ca 0.00 1.52 -0.08 0.00 0.36 0.00 0.00 54.97 56.77 2vhj s GLU 290 Cb 0.00 -2.31 0.05 0.00 0.26 0.00 0.00 34.13 32.12 2vhj s GLU 290 CO 0.00 -0.39 0.61 0.72 -0.54 0.00 0.00 175.26 175.66 2vhj n HIS 291 N -0.57 -1.95 -1.82 5.30 8.25 -1.26 -2.29 115.22 120.89 2vhj n HIS 291 Ca 0.08 0.55 -0.20 0.00 -0.26 0.00 0.00 57.72 57.88 2vhj n HIS 291 Cb 0.50 -3.71 -0.07 0.00 1.12 0.00 0.00 29.99 27.84 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 -2.46 -5.57 -4.67 0.41 7.64 -1.23 -4.95 113.62 102.78 2vhj n SER 292 Ca -0.05 0.36 -0.43 0.00 1.01 0.00 0.00 58.87 59.77 2vhj n SER 292 Cb 0.57 -4.80 -0.02 0.00 -1.01 0.00 0.00 64.21 58.95 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 -2.84 4.08 -0.01 0.44 1.01 -0.97 -4.84 120.40 117.27 2vhj s VAL 293 Ca 0.00 1.35 -0.14 0.00 0.00 0.00 0.00 61.98 63.20 2vhj s VAL 293 Cb 0.00 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2vhj s VAL 293 CO 0.00 -0.08 0.37 -0.22 0.00 0.00 0.00 175.10 175.18 2vhj s LEU 294 N 3.14 4.46 -0.05 3.92 2.96 -1.26 -0.39 118.68 131.45 2vhj s LEU 294 Ca 0.59 0.90 0.04 0.00 -0.22 0.00 0.00 54.13 55.44 2vhj s LEU 294 Cb -0.26 -2.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.88 2vhj s LEU 294 CO 0.20 0.33 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.50 2vhj s THR 295 N -1.08 2.77 -0.23 3.68 2.01 -0.19 -4.66 115.64 117.93 2vhj s THR 295 Ca 0.23 -0.82 -0.16 0.00 0.31 0.00 0.00 61.69 61.25 2vhj s THR 295 Cb -0.16 -2.07 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 2vhj s THR 295 CO 0.12 0.58 0.41 -0.63 -0.69 0.00 0.00 174.62 174.41 2vhj s ILE 296 N -0.52 5.17 0.62 1.82 1.01 -1.26 -2.03 121.20 126.01 2vhj s ILE 296 Ca 0.07 0.69 -0.15 0.00 0.00 0.00 0.00 60.65 61.25 2vhj s ILE 296 Cb -0.11 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 2vhj s ILE 296 CO 0.01 0.19 1.08 -1.00 0.00 0.00 0.00 174.94 175.22 2vhj s HIS 297 N 1.72 2.84 0.22 3.97 3.76 0.17 -4.98 115.29 122.99 2vhj s HIS 297 Ca 0.18 1.53 0.00 0.00 -0.15 0.00 0.00 55.06 56.62 2vhj s HIS 297 Cb -0.15 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.46 2vhj s HIS 297 CO 0.09 -1.35 0.00 2.41 -0.85 0.00 0.00 174.74 175.04 2vhj n THR 298 N -2.18 0.10 -0.00 1.30 -1.04 -1.26 -4.66 114.28 106.53 2vhj n THR 298 Ca 0.09 0.03 -0.01 0.00 -2.04 0.00 0.00 64.05 62.13 2vhj n THR 298 Cb 0.52 -0.50 -0.00 0.00 -1.82 0.00 0.00 70.33 68.53 2vhj n THR 298 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2vhj n SER 299 N -3.27 0.11 0.00 8.00 7.64 -1.26 -4.97 113.62 119.87 2vhj n SER 299 Ca 0.00 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.90 2vhj n SER 299 Cb 0.00 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 2vhj n SER 299 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20