#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vhc s ILE 2 N 0.00 5.02 0.04 3.17 -4.36 -1.26 -5.11 121.20 118.71 2vhc s ILE 2 Ca 0.00 0.04 0.05 0.00 -0.26 0.00 0.00 60.65 60.48 2vhc s ILE 2 Cb 0.00 -3.74 -0.02 0.00 1.25 0.00 0.00 42.46 39.95 2vhc s ILE 2 CO 0.00 -0.33 -0.15 -1.00 0.24 0.00 0.00 174.94 173.70 2vhc s HIS 3 N -2.10 1.28 -0.01 1.37 3.76 -1.26 -4.81 115.29 113.52 2vhc s HIS 3 Ca 0.44 -0.36 0.01 0.00 -0.15 0.00 0.00 55.06 55.00 2vhc s HIS 3 Cb -0.11 -0.76 -0.04 0.00 1.11 0.00 0.00 32.58 32.79 2vhc s HIS 3 CO 0.30 0.04 0.01 -0.51 -0.85 0.00 0.00 174.74 173.74 2vhc s LEU 4 N -1.18 3.58 0.02 0.89 1.43 -1.26 -5.12 118.68 117.04 2vhc s LEU 4 Ca 0.02 0.03 -0.00 0.00 -1.03 0.00 0.00 54.13 53.15 2vhc s LEU 4 Cb -0.08 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 2vhc s LEU 4 CO 0.01 0.29 -0.02 -0.31 0.23 0.00 0.00 176.35 176.55 2vhc s TYR 5 N -1.08 0.24 0.54 0.29 2.02 -1.26 -4.98 117.35 113.12 2vhc s TYR 5 Ca 0.19 -0.50 0.02 0.00 -0.37 0.00 0.00 57.07 56.42 2vhc s TYR 5 Cb -0.12 -0.18 0.02 0.00 -0.40 0.00 0.00 41.96 41.28 2vhc s TYR 5 CO 0.10 -0.19 0.16 0.16 -1.57 0.00 0.00 175.55 174.21 2vhc s ASP 6 N -1.41 4.33 0.26 2.29 1.47 -1.26 -4.96 116.67 117.40 2vhc s ASP 6 Ca -0.15 -1.54 -0.04 0.00 1.18 0.00 0.00 52.55 52.00 2vhc s ASP 6 Cb -0.10 0.60 0.52 0.00 -0.34 0.00 0.00 42.92 43.61 2vhc s ASP 6 CO -0.01 -1.00 1.65 0.00 0.68 0.00 0.00 175.17 176.48 2vhc h ALA 7 N 1.07 0.96 -0.01 2.11 0.00 -2.01 -0.68 119.26 120.70 2vhc h ALA 7 Ca -0.41 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2vhc h ALA 7 Cb 1.32 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 2vhc h ALA 7 CO 0.67 -0.42 -0.00 0.87 0.00 0.00 0.00 179.25 180.37 2vhc h LYS 8 N 0.16 0.02 0.00 0.00 1.57 -1.99 -1.48 116.57 114.84 2vhc h LYS 8 Ca 0.46 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 59.15 2vhc h LYS 8 Cb 0.84 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 2vhc h LYS 8 CO -0.64 0.36 -0.39 0.66 -0.57 0.00 0.00 179.45 178.88 2vhc h SER 9 N -0.33 0.00 -0.23 0.86 4.64 -1.89 -2.18 113.55 114.42 2vhc h SER 9 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 2vhc h SER 9 Cb 0.36 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2vhc h SER 9 CO 0.00 0.39 -0.37 0.15 -0.87 0.00 0.00 176.83 176.13 2vhc h PHE 10 N 0.00 0.82 -0.82 4.77 3.57 -1.00 -1.40 116.94 122.88 2vhc h PHE 10 Ca -0.00 -0.28 0.06 0.00 3.53 0.00 0.00 57.97 61.28 2vhc h PHE 10 Cb 0.70 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.23 2vhc h PHE 10 CO 0.00 1.04 0.53 0.00 -2.23 0.00 0.00 178.31 177.65 2vhc h ALA 11 N 0.64 1.60 -0.27 2.41 0.00 -1.03 -1.20 119.26 121.40 2vhc h ALA 11 Ca 0.02 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2vhc h ALA 11 Cb 0.96 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2vhc h ALA 11 CO 0.09 0.28 -0.05 0.87 0.00 0.00 0.00 179.25 180.43 2vhc h LYS 12 N 0.90 0.52 0.00 0.00 1.57 -1.12 -1.78 116.57 116.66 2vhc h LYS 12 Ca 0.35 -0.19 0.03 0.00 -1.87 0.00 0.00 60.65 58.97 2vhc h LYS 12 Cb 0.22 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 2vhc h LYS 12 CO -0.12 0.72 -0.24 1.25 -0.57 0.00 0.00 179.45 180.49 2vhc h LEU 13 N 0.28 -0.70 -0.95 2.94 5.85 -0.86 -0.77 115.31 121.10 2vhc h LEU 13 Ca 0.07 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 2vhc h LEU 13 Cb 0.52 0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.79 2vhc h LEU 13 CO 0.02 -0.30 0.58 0.03 -0.34 0.00 0.00 178.44 178.43 2vhc h ARG 14 N -0.37 1.29 -0.62 1.25 2.47 -1.19 0.29 114.38 117.49 2vhc h ARG 14 Ca 0.06 -0.11 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 2vhc h ARG 14 Cb 0.45 -0.27 -0.03 0.00 -1.65 0.00 0.00 29.97 28.47 2vhc h ARG 14 CO -0.21 0.90 0.39 0.00 0.56 0.00 0.00 179.97 181.61 2vhc h ALA 15 N 1.32 0.79 -0.46 0.04 0.00 -1.11 0.20 119.26 120.04 2vhc h ALA 15 Ca 0.34 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 2vhc h ALA 15 Cb -0.06 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2vhc h ALA 15 CO -0.06 0.25 -0.15 0.00 0.00 0.00 0.00 179.25 179.28 2vhc h ALA 16 N 1.20 0.85 -0.39 0.00 0.00 0.27 -1.29 119.26 119.91 2vhc h ALA 16 Ca 0.22 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2vhc h ALA 16 Cb -0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2vhc h ALA 16 CO -0.04 0.64 0.04 1.96 0.00 0.00 0.00 179.25 181.85 2vhc h GLN 17 N 0.78 0.66 -0.32 0.00 4.20 -0.15 -1.56 115.11 118.73 2vhc h GLN 17 Ca 0.12 -0.19 0.04 0.00 0.06 0.00 0.00 58.65 58.68 2vhc h GLN 17 Cb 0.68 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 2vhc h GLN 17 CO 0.05 0.73 0.07 -0.92 -0.67 0.00 0.00 178.83 178.09 2vhc h TYR 18 N 0.49 0.13 -0.66 2.96 5.03 -0.39 -2.10 116.97 122.42 2vhc h TYR 18 Ca 0.11 0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.49 2vhc h TYR 18 Cb 0.41 -0.01 -0.04 0.00 1.55 0.00 0.00 36.73 38.64 2vhc h TYR 18 CO 0.03 0.03 0.44 0.00 -1.32 0.00 0.00 178.16 177.34 2vhc h ALA 19 N 1.23 1.67 0.00 1.82 0.00 -1.12 -0.80 119.26 122.05 2vhc h ALA 19 Ca 0.15 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2vhc h ALA 19 Cb 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2vhc h ALA 19 CO -0.19 0.25 -0.09 0.00 0.00 0.00 0.00 179.25 179.22 2vhc h ALA 20 N 1.62 1.78 0.01 0.00 0.00 -0.56 -0.45 119.26 121.67 2vhc h ALA 20 Ca 0.27 -0.09 -0.40 0.00 0.00 0.00 0.00 54.91 54.70 2vhc h ALA 20 Cb 0.13 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 2vhc h ALA 20 CO -0.08 0.12 -2.30 0.34 0.00 0.00 0.00 179.25 177.33 2vhc n PHE 21 N -4.33 0.27 0.10 0.00 7.35 -1.09 -1.70 117.46 118.05 2vhc n PHE 21 Ca -0.03 0.09 -0.20 0.00 -0.76 0.00 0.00 57.45 56.55 2vhc n PHE 21 Cb 0.17 -1.03 -0.15 0.00 0.35 0.00 0.00 39.48 38.82 2vhc n PHE 21 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2vhc h HIS 22 N -0.55 0.66 0.00 -5.13 3.86 -1.12 -3.41 115.15 109.47 2vhc h HIS 22 Ca -0.59 -0.48 0.00 0.00 -1.16 0.00 0.00 60.37 58.14 2vhc h HIS 22 Cb 1.72 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 30.16 2vhc h HIS 22 CO -0.01 1.47 -0.75 0.25 0.86 0.00 0.00 177.93 179.75 2vhc n THR 23 N -3.57 0.00 -1.62 2.45 -2.24 -0.62 -5.03 114.28 103.65 2vhc n THR 23 Ca -0.17 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.24 2vhc n THR 23 Cb 1.06 -0.40 0.06 0.00 -2.10 0.00 0.00 70.33 68.95 2vhc n THR 23 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2vhc n ASP 24 N -1.48 0.82 -4.74 3.42 9.92 -0.27 -4.92 116.55 119.30 2vhc n ASP 24 Ca 0.00 0.80 -0.41 0.00 -0.53 0.00 0.00 54.79 54.64 2vhc n ASP 24 Cb 0.26 -1.40 -0.03 0.00 -0.64 0.00 0.00 41.12 39.31 2vhc n ASP 24 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2vhc s ALA 25 N -1.52 3.60 0.22 2.24 0.00 -1.26 -4.93 121.76 120.12 2vhc s ALA 25 Ca 0.77 1.25 -0.32 0.00 0.00 0.00 0.00 51.96 53.66 2vhc s ALA 25 Cb -0.41 -3.54 -0.14 0.00 0.00 0.00 0.00 23.12 19.04 2vhc s ALA 25 CO 0.46 -0.68 1.43 -2.30 0.00 0.00 0.00 175.76 174.68 2vhc n PRO 26 N 2.56 2.01 -0.41 0.00 -0.02 -1.26 -1.86 135.00 136.02 2vhc n PRO 26 Ca 0.07 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2vhc n PRO 26 Cb 0.41 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2vhc n PRO 26 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vhc n GLY 27 N 2.39 1.72 0.31 -1.23 0.00 -0.89 -4.83 105.19 102.66 2vhc n GLY 27 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.07 2vhc n GLY 27 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2vhc h SER 28 N 0.00 0.99 -0.54 1.61 4.64 -1.60 -2.14 113.55 116.51 2vhc h SER 28 Ca 0.00 -0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 2vhc h SER 28 Cb 0.00 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 61.80 2vhc h SER 28 CO 0.00 1.02 0.29 -0.25 -0.87 0.00 0.00 176.83 177.02 2vhc h TRP 29 N 0.95 0.76 -0.32 4.77 2.91 -1.84 0.50 115.95 123.68 2vhc h TRP 29 Ca 0.18 -0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.20 2vhc h TRP 29 Cb 0.49 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 28.88 2vhc h TRP 29 CO 0.03 0.56 0.17 0.35 -1.03 0.00 0.00 178.44 178.53 2vhc h PHE 30 N 0.73 0.32 -0.62 2.65 3.57 -1.60 -0.03 116.94 121.95 2vhc h PHE 30 Ca 0.19 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2vhc h PHE 30 Cb 0.06 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2vhc h PHE 30 CO -0.01 0.18 0.39 -0.44 -2.23 0.00 0.00 178.31 176.20 2vhc h ASP 31 N 0.35 0.73 0.54 0.41 3.32 -1.08 0.41 116.42 121.12 2vhc h ASP 31 Ca 0.13 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 2vhc h ASP 31 Cb 0.03 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 2vhc h ASP 31 CO -0.08 0.56 -0.50 -0.74 -1.72 0.00 0.00 179.24 176.76 2vhc h HIS 32 N 0.84 -1.38 0.00 4.55 2.76 -0.60 -1.60 115.15 119.72 2vhc h HIS 32 Ca 0.23 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.38 2vhc h HIS 32 Cb -0.05 0.53 -0.00 0.00 1.55 0.00 0.00 27.41 29.44 2vhc h HIS 32 CO -0.02 -0.68 -0.11 1.79 -1.30 0.00 0.00 177.93 177.61 2vhc h THR 33 N -1.03 1.02 -0.90 6.26 1.35 -0.81 0.56 112.91 119.35 2vhc h THR 33 Ca -0.07 -0.40 0.05 0.00 -0.55 0.00 0.00 66.41 65.44 2vhc h THR 33 Cb 0.88 1.22 -0.06 0.00 -1.73 0.00 0.00 68.15 68.47 2vhc h THR 33 CO -0.04 0.11 0.59 0.28 -0.25 0.00 0.00 175.52 176.21 2vhc h SER 34 N 0.00 0.92 -0.24 5.36 0.02 0.17 -0.87 113.55 118.91 2vhc h SER 34 Ca -0.00 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 2vhc h SER 34 Cb 0.21 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2vhc h SER 34 CO 0.01 0.61 -0.01 1.23 -1.14 0.00 0.00 176.83 177.54 2vhc h GLY 35 N 1.06 0.47 0.89 -3.77 0.00 0.11 -0.55 103.07 101.28 2vhc h GLY 35 Ca 0.37 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.38 2vhc h GLY 35 CO -0.13 0.32 0.36 -2.08 0.00 0.00 0.00 176.54 175.01 2vhc h VAL 36 N 0.20 1.07 -0.62 4.60 2.07 -1.05 -2.42 116.25 120.11 2vhc h VAL 36 Ca 0.07 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 2vhc h VAL 36 Cb 0.43 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2vhc h VAL 36 CO 0.01 0.13 0.01 -0.07 0.02 0.00 0.00 177.57 177.67 2vhc h LEU 37 N 0.71 1.07 -1.32 2.57 3.38 -0.94 -2.88 115.31 117.89 2vhc h LEU 37 Ca 0.23 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.91 2vhc h LEU 37 Cb 0.01 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 2vhc h LEU 37 CO -0.09 1.11 0.46 -0.33 0.09 0.00 0.00 178.44 179.67 2vhc h GLU 38 N 1.00 0.91 -0.00 1.13 5.08 -0.91 -2.86 114.58 118.92 2vhc h GLU 38 Ca 0.18 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2vhc h GLU 38 Cb 0.55 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2vhc h GLU 38 CO 0.03 0.60 -0.16 -1.13 -1.00 0.00 0.00 179.01 177.35 2vhc n SER 39 N -4.43 0.38 -4.67 1.42 3.41 -0.93 -4.78 113.62 104.02 2vhc n SER 39 Ca 0.07 -0.27 -0.42 0.00 -0.26 0.00 0.00 58.87 57.99 2vhc n SER 39 Cb 0.04 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 63.86 2vhc n SER 39 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2vhc s VAL 40 N -2.69 2.78 -0.03 -3.33 1.01 -1.08 -4.92 120.40 112.13 2vhc s VAL 40 Ca 0.22 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.93 2vhc s VAL 40 Cb 0.19 -3.02 -0.06 0.00 0.00 0.00 0.00 36.38 33.49 2vhc s VAL 40 CO 0.53 -0.00 1.64 -1.83 0.00 0.00 0.00 175.10 175.44 2vhc s GLU 41 N 3.65 4.19 0.54 2.72 -1.05 -1.26 -4.89 118.70 122.60 2vhc s GLU 41 Ca 0.85 2.20 -0.18 0.00 -0.15 0.00 0.00 54.97 57.69 2vhc s GLU 41 Cb -0.44 -3.89 -0.11 0.00 -0.44 0.00 0.00 34.13 29.25 2vhc s GLU 41 CO 0.39 -0.81 0.33 -0.40 0.95 0.00 0.00 175.26 175.73 2vhc n ASP 42 N 6.72 -1.81 0.00 0.83 5.75 -1.26 -2.37 116.55 124.41 2vhc n ASP 42 Ca 0.17 0.72 0.00 0.00 -0.01 0.00 0.00 54.79 55.67 2vhc n ASP 42 Cb 0.42 -1.07 0.00 0.00 -1.03 0.00 0.00 41.12 39.44 2vhc n ASP 42 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vhc n GLY 43 N 2.00 2.77 3.68 6.12 0.00 -1.26 -5.03 105.19 113.47 2vhc n GLY 43 Ca 0.11 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.66 2vhc n GLY 43 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2vhc n THR 44 N -0.32 0.40 -1.72 2.61 -1.04 -1.00 -4.90 114.28 108.31 2vhc n THR 44 Ca 0.00 -0.07 -0.43 0.00 -2.04 0.00 0.00 64.05 61.51 2vhc n THR 44 Cb 0.00 -1.85 -0.02 0.00 -1.82 0.00 0.00 70.33 66.64 2vhc n THR 44 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2vhc n PRO 45 N 5.67 2.51 -0.01 -2.82 -0.02 -1.26 -4.30 135.00 134.76 2vhc n PRO 45 Ca 0.20 0.90 -0.01 0.00 -2.02 0.00 0.00 63.50 62.56 2vhc n PRO 45 Cb 0.31 -2.65 -0.02 0.00 -0.02 0.00 0.00 33.50 31.12 2vhc n PRO 45 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2vhc n VAL 46 N 2.38 0.17 -3.78 -1.45 0.24 -0.08 -4.55 118.33 111.27 2vhc n VAL 46 Ca 0.11 -0.11 -0.13 0.00 -2.04 0.00 0.00 64.34 62.17 2vhc n VAL 46 Cb 0.35 -0.91 -0.12 0.00 -1.47 0.00 0.00 33.84 31.68 2vhc n VAL 46 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2vhc s LEU 47 N -4.17 1.03 -0.04 1.34 2.96 -1.11 0.20 118.68 118.88 2vhc s LEU 47 Ca -0.01 0.42 0.05 0.00 -0.22 0.00 0.00 54.13 54.36 2vhc s LEU 47 Cb 0.01 0.67 -0.01 0.00 0.50 0.00 0.00 46.19 47.36 2vhc s LEU 47 CO 0.11 -0.10 -0.17 0.00 -1.32 0.00 0.00 176.35 174.87 2vhc s ALA 48 N 0.43 1.50 -0.00 5.97 0.00 0.23 -0.46 121.76 129.43 2vhc s ALA 48 Ca -0.03 -0.70 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 2vhc s ALA 48 Cb -0.04 -0.47 -0.00 0.00 0.00 0.00 0.00 23.12 22.61 2vhc s ALA 48 CO -0.02 0.29 0.02 -1.50 0.00 0.00 0.00 175.76 174.55 2vhc s ILE 49 N -0.06 0.03 0.16 0.00 2.07 -0.54 -0.70 121.20 122.16 2vhc s ILE 49 Ca -0.01 -0.24 -0.30 0.00 -1.41 0.00 0.00 60.65 58.68 2vhc s ILE 49 Cb -0.10 -0.11 -0.08 0.00 0.13 0.00 0.00 42.46 42.29 2vhc s ILE 49 CO 0.01 -0.13 1.31 -0.83 -1.91 0.00 0.00 174.94 173.39 2vhc s GLY 50 N -0.39 2.33 0.64 1.50 0.00 -1.26 -1.15 107.32 108.99 2vhc s GLY 50 Ca -0.04 1.08 0.01 0.00 0.00 0.00 0.00 44.72 45.77 2vhc s GLY 50 CO -0.00 2.13 0.89 -1.34 0.00 0.00 0.00 173.10 174.78 2vhc s VAL 51 N 0.47 2.31 0.29 1.40 -7.23 0.10 -4.81 120.40 112.93 2vhc s VAL 51 Ca 0.59 -0.68 0.03 0.00 -1.81 0.00 0.00 61.98 60.11 2vhc s VAL 51 Cb -0.36 -2.63 0.28 0.00 0.56 0.00 0.00 36.38 34.23 2vhc s VAL 51 CO 0.35 0.00 1.75 -0.08 -0.31 0.00 0.00 175.10 176.81 2vhc h GLU 52 N -0.23 0.61 0.00 4.82 4.81 -1.90 -0.23 114.58 122.46 2vhc h GLU 52 Ca -0.37 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 2vhc h GLU 52 Cb 1.28 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2vhc h GLU 52 CO 0.44 0.40 0.00 -1.13 -0.73 0.00 0.00 179.01 177.99 2vhc n SER 53 N -4.87 0.59 0.00 1.04 3.41 -1.26 -2.46 113.62 110.07 2vhc n SER 53 Ca 0.21 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.47 2vhc n SER 53 Cb 0.55 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 2vhc n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vhc n GLY 54 N -0.07 1.70 3.69 5.00 0.00 -0.12 -4.83 105.19 110.57 2vhc n GLY 54 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 2vhc n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vhc s ASP 55 N -1.53 2.81 -0.02 1.61 1.01 -1.26 -4.75 116.67 114.55 2vhc s ASP 55 Ca 0.00 1.22 0.06 0.00 0.71 0.00 0.00 52.55 54.55 2vhc s ASP 55 Cb 0.00 -1.89 -0.02 0.00 1.01 0.00 0.00 42.92 42.03 2vhc s ASP 55 CO 0.00 -3.02 -0.21 0.00 0.21 0.00 0.00 175.17 172.15 2vhc s ALA 56 N -2.98 1.77 0.29 5.23 0.00 -1.26 0.03 121.76 124.84 2vhc s ALA 56 Ca 0.65 -0.91 0.06 0.00 0.00 0.00 0.00 51.96 51.76 2vhc s ALA 56 Cb -0.18 -0.46 -0.02 0.00 0.00 0.00 0.00 23.12 22.45 2vhc s ALA 56 CO 0.57 0.43 0.37 0.96 0.00 0.00 0.00 175.76 178.09 2vhc s ILE 57 N -0.46 4.51 -0.01 0.00 -4.36 -0.30 -1.80 121.20 118.78 2vhc s ILE 57 Ca 0.07 -1.10 0.04 0.00 -0.26 0.00 0.00 60.65 59.41 2vhc s ILE 57 Cb -0.09 -3.55 -0.01 0.00 1.25 0.00 0.00 42.46 40.06 2vhc s ILE 57 CO -0.01 -0.25 -0.13 -0.69 0.24 0.00 0.00 174.94 174.11 2vhc s VAL 58 N -2.11 1.02 0.12 8.37 1.01 -1.26 -1.46 120.40 126.08 2vhc s VAL 58 Ca 0.39 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 61.91 2vhc s VAL 58 Cb -0.09 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 2vhc s VAL 58 CO 0.29 0.29 -0.22 -0.36 0.00 0.00 0.00 175.10 175.09 2vhc s PHE 59 N -0.28 1.93 0.76 5.22 0.40 0.39 -1.21 117.98 125.19 2vhc s PHE 59 Ca 0.05 -0.41 -0.03 0.00 -0.60 0.00 0.00 56.93 55.94 2vhc s PHE 59 Cb -0.05 -1.05 0.16 0.00 0.51 0.00 0.00 43.02 42.59 2vhc s PHE 59 CO -0.00 0.26 1.04 -0.40 0.70 0.00 0.00 175.22 176.81 2vhc n ASP 60 N 0.97 1.12 0.28 1.36 5.68 -0.46 -0.90 116.55 124.59 2vhc n ASP 60 Ca -0.19 -2.01 0.15 0.00 -0.50 0.00 0.00 54.79 52.24 2vhc n ASP 60 Cb 0.54 -0.70 0.79 0.00 -1.14 0.00 0.00 41.12 40.61 2vhc n ASP 60 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2vhc h LYS 61 N 0.00 0.00 -0.64 0.11 2.10 -1.89 -1.72 116.57 114.53 2vhc h LYS 61 Ca -0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 2vhc h LYS 61 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 2vhc h LYS 61 CO 0.34 0.08 0.00 0.09 -2.00 0.00 0.00 179.45 177.97 2vhc n ASN 62 N -3.50 4.36 -0.81 7.07 5.03 -1.26 -4.92 115.26 121.24 2vhc n ASN 62 Ca -0.02 -2.49 -0.11 0.00 0.87 0.00 0.00 54.58 52.84 2vhc n ASN 62 Cb 0.22 -0.57 -0.05 0.00 -1.02 0.00 0.00 39.78 38.37 2vhc n ASN 62 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vhc n ALA 63 N 0.82 -0.16 -2.59 5.41 0.00 -0.65 -5.00 120.51 118.34 2vhc n ALA 63 Ca 0.22 0.17 -0.36 0.00 0.00 0.00 0.00 53.44 53.47 2vhc n ALA 63 Cb 0.85 -1.30 -0.06 0.00 0.00 0.00 0.00 19.45 18.95 2vhc n ALA 63 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2vhc s GLN 64 N -2.85 3.77 0.63 0.00 -1.52 -1.26 -4.87 119.66 113.56 2vhc s GLN 64 Ca 0.00 0.21 -0.17 0.00 -1.95 0.00 0.00 55.36 53.45 2vhc s GLN 64 Cb 0.00 -3.10 -0.01 0.00 -0.22 0.00 0.00 33.01 29.68 2vhc s GLN 64 CO 0.00 0.63 1.14 1.03 -0.25 0.00 0.00 175.29 177.85 2vhc s ARG 65 N -1.53 2.86 -0.21 2.91 0.52 -1.26 -1.36 118.95 120.89 2vhc s ARG 65 Ca 0.28 1.56 -0.05 0.00 -0.52 0.00 0.00 55.73 57.00 2vhc s ARG 65 Cb -0.15 -1.94 -0.02 0.00 0.52 0.00 0.00 34.95 33.36 2vhc s ARG 65 CO 0.15 -1.23 -0.01 0.42 0.02 0.00 0.00 175.30 174.65 2vhc s ILE 66 N -2.05 3.84 -0.10 1.52 1.01 -0.35 -4.80 121.20 120.27 2vhc s ILE 66 Ca 0.71 -0.35 -0.01 0.00 0.00 0.00 0.00 60.65 61.00 2vhc s ILE 66 Cb -0.24 -2.74 -0.25 0.00 0.01 0.00 0.00 42.46 39.24 2vhc s ILE 66 CO 0.37 0.42 0.45 1.33 0.00 0.00 0.00 174.94 177.51 2vhc n VAL 67 N 4.39 1.73 -3.65 2.92 0.24 -1.26 -4.38 118.33 118.32 2vhc n VAL 67 Ca -0.17 -0.70 -0.17 0.00 -2.04 0.00 0.00 64.34 61.26 2vhc n VAL 67 Cb 0.52 -1.52 -0.15 0.00 -1.47 0.00 0.00 33.84 31.21 2vhc n VAL 67 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2vhc s ALA 68 N -2.57 -0.15 -0.18 2.33 0.00 -1.26 0.17 121.76 120.10 2vhc s ALA 68 Ca -0.17 0.52 -0.04 0.00 0.00 0.00 0.00 51.96 52.26 2vhc s ALA 68 Cb 0.07 -0.86 0.09 0.00 0.00 0.00 0.00 23.12 22.42 2vhc s ALA 68 CO 0.79 -0.63 0.28 -0.47 0.00 0.00 0.00 175.76 175.73 2vhc s TYR 69 N 2.29 -0.46 0.52 0.00 6.14 0.13 -4.92 117.35 121.05 2vhc s TYR 69 Ca 0.03 0.73 -0.19 0.00 0.64 0.00 0.00 57.07 58.28 2vhc s TYR 69 Cb -0.12 -0.12 -0.07 0.00 0.42 0.00 0.00 41.96 42.07 2vhc s TYR 69 CO -0.06 -0.51 1.06 0.15 0.64 0.00 0.00 175.55 176.83 2vhc s LYS 70 N 2.42 3.64 -0.23 4.97 -0.14 -1.26 0.45 119.74 129.59 2vhc s LYS 70 Ca 0.05 1.37 -0.43 0.00 -1.36 0.00 0.00 55.97 55.60 2vhc s LYS 70 Cb -0.14 -2.07 -0.20 0.00 -1.68 0.00 0.00 37.83 33.75 2vhc s LYS 70 CO -0.11 -0.57 1.33 -1.91 -0.76 0.00 0.00 175.35 173.33 2vhc n GLU 71 N -1.22 0.07 -4.12 1.68 2.13 -1.26 -4.73 120.64 113.19 2vhc n GLU 71 Ca 0.10 0.03 -0.15 0.00 0.66 0.00 0.00 57.16 57.79 2vhc n GLU 71 Cb 0.52 -1.54 -0.13 0.00 0.27 0.00 0.00 31.44 30.57 2vhc n GLU 71 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2vhc s LYS 72 N 1.45 0.52 0.21 5.31 2.20 -0.55 -5.00 119.74 123.89 2vhc s LYS 72 Ca 0.97 -0.53 0.08 0.00 -0.36 0.00 0.00 55.97 56.13 2vhc s LYS 72 Cb -1.36 -0.39 -0.05 0.00 -1.51 0.00 0.00 37.83 34.53 2vhc s LYS 72 CO 0.68 0.09 -0.14 -1.12 -0.36 0.00 0.00 175.35 174.50 2vhc s SER 73 N -0.95 2.61 0.02 1.43 0.01 -1.26 -0.54 113.70 115.01 2vhc s SER 73 Ca -0.04 -1.03 0.00 0.00 1.31 0.00 0.00 55.95 56.19 2vhc s SER 73 Cb -0.07 -0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.01 2vhc s SER 73 CO 0.00 -0.17 -0.02 -0.69 0.41 0.00 0.00 173.24 172.76 2vhc s VAL 74 N -2.96 0.11 -0.17 3.43 1.01 0.13 -4.99 120.40 116.96 2vhc s VAL 74 Ca 0.23 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.50 2vhc s VAL 74 Cb -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 2vhc s VAL 74 CO 0.07 -0.34 0.04 -0.75 0.00 0.00 0.00 175.10 174.12 2vhc s LYS 75 N -1.03 3.84 0.61 2.72 2.20 -1.26 -0.80 119.74 126.02 2vhc s LYS 75 Ca -0.11 -0.38 -0.07 0.00 -0.36 0.00 0.00 55.97 55.05 2vhc s LYS 75 Cb -0.07 -3.12 0.13 0.00 -1.51 0.00 0.00 37.83 33.26 2vhc s LYS 75 CO -0.01 0.30 0.83 0.00 -0.36 0.00 0.00 175.35 176.11 2vhc n ALA 76 N 3.42 -0.59 -0.08 3.13 0.00 0.75 -5.00 120.51 122.14 2vhc n ALA 76 Ca -0.17 -1.26 -0.11 0.00 0.00 0.00 0.00 53.44 51.90 2vhc n ALA 76 Cb 0.52 0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 2vhc n ALA 76 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2vhc h GLU 77 N 0.00 0.45 0.00 0.00 4.81 -1.99 -3.23 114.58 114.63 2vhc h GLU 77 Ca -0.27 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2vhc h GLU 77 Cb 0.83 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2vhc h GLU 77 CO 0.22 0.64 0.00 -0.40 -0.73 0.00 0.00 179.01 178.74 2vhc n ASP 78 N -4.61 0.00 0.00 1.04 5.75 -1.26 -4.79 116.55 112.68 2vhc n ASP 78 Ca -0.04 -0.97 0.00 0.00 -0.01 0.00 0.00 54.79 53.77 2vhc n ASP 78 Cb 0.26 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.35 2vhc n ASP 78 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vhc n GLY 79 N 0.22 1.56 3.78 6.12 0.00 -1.22 -5.03 105.19 110.62 2vhc n GLY 79 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 2vhc n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vhc s SER 80 N -2.40 5.29 -0.12 1.61 1.04 -1.26 -4.73 113.70 113.13 2vhc s SER 80 Ca 0.00 1.93 0.03 0.00 0.48 0.00 0.00 55.95 58.39 2vhc s SER 80 Cb 0.00 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2vhc s SER 80 CO 0.00 -1.51 -0.22 -0.69 0.98 0.00 0.00 173.24 171.80 2vhc s VAL 81 N -2.42 2.14 -0.13 5.02 1.01 -1.26 -0.17 120.40 124.59 2vhc s VAL 81 Ca 0.65 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 2vhc s VAL 81 Cb -0.19 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 2vhc s VAL 81 CO 0.41 0.55 0.07 -0.94 0.00 0.00 0.00 175.10 175.19 2vhc s SER 82 N 0.50 5.74 0.03 3.32 1.04 0.02 -4.95 113.70 119.41 2vhc s SER 82 Ca -0.14 0.23 0.08 0.00 0.48 0.00 0.00 55.95 56.59 2vhc s SER 82 Cb -0.17 -1.83 -0.02 0.00 0.10 0.00 0.00 66.02 64.10 2vhc s SER 82 CO 0.05 0.32 -0.23 0.54 0.98 0.00 0.00 173.24 174.90 2vhc s VAL 83 N -0.51 1.84 -0.07 5.02 0.11 -1.26 -0.69 120.40 124.84 2vhc s VAL 83 Ca 0.10 -1.22 0.02 0.00 -2.93 0.00 0.00 61.98 57.95 2vhc s VAL 83 Cb -0.12 -1.57 0.02 0.00 -1.53 0.00 0.00 36.38 33.17 2vhc s VAL 83 CO 0.02 0.31 -0.10 -0.69 -3.33 0.00 0.00 175.10 171.31 2vhc s VAL 84 N -0.75 0.98 -0.07 2.04 1.01 0.30 -3.03 120.40 120.88 2vhc s VAL 84 Ca 0.09 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 2vhc s VAL 84 Cb -0.09 -0.93 0.04 0.00 0.00 0.00 0.00 36.38 35.40 2vhc s VAL 84 CO 0.01 0.33 0.17 -1.58 0.00 0.00 0.00 175.10 174.03 2vhc s GLN 85 N 0.85 0.12 -0.12 2.72 0.74 0.19 -1.48 119.66 122.68 2vhc s GLN 85 Ca -0.11 0.40 0.03 0.00 0.05 0.00 0.00 55.36 55.72 2vhc s GLN 85 Cb -0.15 -0.16 0.01 0.00 1.10 0.00 0.00 33.01 33.81 2vhc s GLN 85 CO 0.02 -0.16 -0.22 0.08 -0.55 0.00 0.00 175.29 174.45 2vhc s VAL 86 N 1.15 2.10 -0.06 1.34 1.01 0.17 0.30 120.40 126.41 2vhc s VAL 86 Ca -0.09 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 60.91 2vhc s VAL 86 Cb -0.11 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.47 2vhc s VAL 86 CO -0.06 0.55 -0.05 -0.70 0.00 0.00 0.00 175.10 174.84 2vhc s GLU 87 N 0.62 0.97 -1.48 2.72 2.12 0.34 0.21 118.70 124.19 2vhc s GLU 87 Ca -0.12 -0.12 -0.10 0.00 0.36 0.00 0.00 54.97 54.99 2vhc s GLU 87 Cb -0.16 -1.02 0.07 0.00 0.26 0.00 0.00 34.13 33.27 2vhc s GLU 87 CO 0.03 -0.13 0.90 -1.71 -0.54 0.00 0.00 175.26 173.80 2vhc n ASN 88 N 4.34 -3.84 -0.56 -1.70 4.05 -0.74 -1.78 115.26 115.04 2vhc n ASN 88 Ca -0.20 -0.80 -0.07 0.00 0.45 0.00 0.00 54.58 53.96 2vhc n ASN 88 Cb 0.51 -3.87 -0.03 0.00 1.23 0.00 0.00 39.78 37.61 2vhc n ASN 88 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2vhc n GLY 89 N -1.67 0.93 3.00 8.20 0.00 0.13 -5.01 105.19 110.76 2vhc n GLY 89 Ca -0.04 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 2vhc n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vhc s PHE 90 N -2.21 0.44 -0.16 1.61 0.40 -0.74 -4.68 117.98 112.64 2vhc s PHE 90 Ca 0.00 -0.41 -0.29 0.00 -0.60 0.00 0.00 56.93 55.62 2vhc s PHE 90 Cb 0.00 -0.28 -0.04 0.00 0.51 0.00 0.00 43.02 43.21 2vhc s PHE 90 CO 0.00 -0.10 1.69 1.41 0.70 0.00 0.00 175.22 178.92 2vhc s MET 91 N -1.21 3.87 -0.11 0.44 -2.45 -0.74 -0.51 119.30 118.58 2vhc s MET 91 Ca -0.10 1.89 -0.08 0.00 -1.25 0.00 0.00 55.69 56.16 2vhc s MET 91 Cb -0.08 -4.05 -0.27 0.00 1.25 0.00 0.00 34.83 31.68 2vhc s MET 91 CO -0.00 -1.21 0.41 -0.22 1.05 0.00 0.00 175.02 175.04 2vhc h LYS 92 N 10.72 0.28 -4.23 4.11 3.64 -0.48 -3.45 116.57 127.17 2vhc h LYS 92 Ca -0.37 -0.48 -0.28 0.00 -1.27 0.00 0.00 60.65 58.25 2vhc h LYS 92 Cb 1.17 0.18 -0.26 0.00 -0.41 0.00 0.00 32.23 32.91 2vhc h LYS 92 CO 0.98 1.23 -0.74 -0.65 -2.27 0.00 0.00 179.45 178.00 2vhc s GLN 93 N -2.56 0.36 0.00 1.90 -0.21 -0.81 -4.95 119.66 113.39 2vhc s GLN 93 Ca -0.22 -0.30 0.00 0.00 0.02 0.00 0.00 55.36 54.86 2vhc s GLN 93 Cb 0.06 -0.27 0.00 0.00 1.00 0.00 0.00 33.01 33.81 2vhc s GLN 93 CO 0.78 0.06 0.00 0.41 -2.12 0.00 0.00 175.29 174.42 2vhc n GLY 94 N 2.56 0.86 3.28 3.09 0.00 -1.17 -0.63 105.19 113.17 2vhc n GLY 94 Ca -0.16 -1.85 -0.15 0.00 0.00 0.00 0.00 46.02 43.86 2vhc n GLY 94 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2vhc s HIS 95 N -2.49 1.36 0.37 1.61 -3.43 -1.26 -5.03 115.29 106.42 2vhc s HIS 95 Ca 0.00 -0.96 -0.26 0.00 -0.80 0.00 0.00 55.06 53.04 2vhc s HIS 95 Cb 0.00 -0.78 -0.09 0.00 -1.43 0.00 0.00 32.58 30.29 2vhc s HIS 95 CO 0.00 -0.12 1.14 1.03 -2.00 0.00 0.00 174.74 174.79 2vhc s ARG 96 N -3.88 4.21 0.00 -0.38 0.52 -1.26 -4.63 118.95 113.53 2vhc s ARG 96 Ca 0.25 1.80 0.00 0.00 -0.52 0.00 0.00 55.73 57.27 2vhc s ARG 96 Cb 0.06 -2.78 0.00 0.00 0.52 0.00 0.00 34.95 32.74 2vhc s ARG 96 CO 0.06 -0.17 0.00 0.41 0.02 0.00 0.00 175.30 175.61 2vhc n GLY 97 N 0.71 0.40 3.73 -3.53 0.00 0.12 -4.94 105.19 101.68 2vhc n GLY 97 Ca 0.03 -2.23 -0.41 0.00 0.00 0.00 0.00 46.02 43.41 2vhc n GLY 97 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2vhc s TRP 98 N 0.00 3.86 -1.62 1.61 0.52 -1.26 -0.60 118.94 121.45 2vhc s TRP 98 Ca 0.00 1.83 0.16 0.00 0.02 0.00 0.00 56.10 58.11 2vhc s TRP 98 Cb 0.00 -3.04 0.34 0.00 -1.15 0.00 0.00 33.47 29.62 2vhc s TRP 98 CO 0.00 0.27 1.25 1.28 0.02 0.00 0.00 176.95 179.77 2vhc n LEU 99 N 2.45 3.02 -4.27 2.99 4.77 0.13 -4.90 117.00 121.19 2vhc n LEU 99 Ca 0.01 -1.65 -0.15 0.00 -0.03 0.00 0.00 56.01 54.20 2vhc n LEU 99 Cb 0.49 -0.22 -0.10 0.00 -2.33 0.00 0.00 43.42 41.25 2vhc n LEU 99 CO 0.51 0.69 -0.36 0.68 -1.33 0.00 0.00 177.39 177.59 2vhc s VAL 100 N -1.13 0.96 -0.35 4.08 -7.23 -1.25 -4.85 120.40 110.62 2vhc s VAL 100 Ca 0.29 -2.02 -0.24 0.00 -1.81 0.00 0.00 61.98 58.20 2vhc s VAL 100 Cb 0.16 -2.11 0.01 0.00 0.56 0.00 0.00 36.38 35.01 2vhc s VAL 100 CO 0.22 -0.51 0.80 -0.62 -0.31 0.00 0.00 175.10 174.68 2vhc s ASP 101 N -3.22 6.60 -0.15 4.85 2.15 -1.26 -4.89 116.67 120.75 2vhc s ASP 101 Ca 0.23 0.47 0.17 0.00 0.43 0.00 0.00 52.55 53.85 2vhc s ASP 101 Cb 0.05 -2.41 -0.25 0.00 -0.30 0.00 0.00 42.92 40.01 2vhc s ASP 101 CO 0.04 -0.72 0.23 0.18 -0.17 0.00 0.00 175.17 174.74 2vhc n LEU 102 N 6.41 0.18 0.00 -1.34 4.77 -1.26 -4.79 117.00 120.96 2vhc n LEU 102 Ca 0.04 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2vhc n LEU 102 Cb 0.48 0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 2vhc n LEU 102 CO 0.53 0.42 0.00 0.35 -1.33 0.00 0.00 177.39 177.37 2vhc n THR 103 N -2.76 0.00 -1.29 -5.08 -2.24 -1.26 -4.83 114.28 96.82 2vhc n THR 103 Ca -0.27 0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2vhc n THR 103 Cb 1.08 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.11 2vhc n THR 103 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vhc n GLY 104 N 1.99 0.70 0.15 3.38 0.00 -1.26 -4.21 105.19 105.95 2vhc n GLY 104 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2vhc n GLY 104 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2vhc n GLU 105 N -0.94 0.00 -2.43 1.61 2.13 -1.26 -4.98 120.64 114.77 2vhc n GLU 105 Ca 0.00 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.43 2vhc n GLU 105 Cb 0.37 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.05 2vhc n GLU 105 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2vhc s LEU 106 N 0.00 3.30 0.33 4.31 2.96 -1.26 -4.97 118.68 123.35 2vhc s LEU 106 Ca 0.00 -0.74 0.07 0.00 -0.22 0.00 0.00 54.13 53.24 2vhc s LEU 106 Cb 0.00 -2.56 -0.06 0.00 0.50 0.00 0.00 46.19 44.07 2vhc s LEU 106 CO 0.00 -1.90 -0.04 0.68 -1.32 0.00 0.00 176.35 173.77 2vhc s VAL 107 N 6.42 1.80 -0.62 1.68 -7.23 -1.26 -4.72 120.40 116.47 2vhc s VAL 107 Ca 0.47 -2.11 0.00 0.00 -1.81 0.00 0.00 61.98 58.54 2vhc s VAL 107 Cb -0.06 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.24 2vhc s VAL 107 CO 0.05 -0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.27 2vhc n GLY 108 N -0.72 0.24 3.96 2.32 0.00 -1.26 -4.94 105.19 104.79 2vhc n GLY 108 Ca -0.05 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.11 2vhc n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vhc n SER 110 N -0.96 3.45 -4.67 0.00 7.64 -1.26 -4.85 113.62 112.97 2vhc n SER 110 Ca -0.08 -3.25 -0.45 0.00 1.01 0.00 0.00 58.87 56.10 2vhc n SER 110 Cb 0.55 -0.80 -0.03 0.00 -1.01 0.00 0.00 64.21 62.92 2vhc n SER 110 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2vhc n PRO 111 N 1.79 2.07 -1.80 1.43 -0.02 -1.26 -4.21 135.00 132.99 2vhc n PRO 111 Ca 0.22 0.74 -0.42 0.00 -2.02 0.00 0.00 63.50 62.02 2vhc n PRO 111 Cb 0.36 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.39 2vhc n PRO 111 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2vhc s VAL 112 N 0.16 2.58 -0.11 -1.45 0.11 -0.69 -0.13 120.40 120.87 2vhc s VAL 112 Ca 0.71 0.21 0.16 0.00 -2.93 0.00 0.00 61.98 60.12 2vhc s VAL 112 Cb -0.66 -3.13 -0.23 0.00 -1.53 0.00 0.00 36.38 30.83 2vhc s VAL 112 CO 0.47 0.00 0.47 0.55 -3.33 0.00 0.00 175.10 173.26 2vhc n VAL 113 N 4.49 1.40 -3.59 2.04 3.14 0.60 -2.10 118.33 124.31 2vhc n VAL 113 Ca 0.16 -0.79 -0.04 0.00 -2.96 0.00 0.00 64.34 60.71 2vhc n VAL 113 Cb 0.38 -0.74 -0.02 0.00 -1.06 0.00 0.00 33.84 32.40 2vhc n VAL 113 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2vhc s ALA 114 N -2.65 -2.05 -0.02 1.55 0.00 -1.23 -3.29 121.76 114.07 2vhc s ALA 114 Ca -0.06 1.45 0.03 0.00 0.00 0.00 0.00 51.96 53.38 2vhc s ALA 114 Cb 0.08 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.18 2vhc s ALA 114 CO 0.83 -0.65 -0.12 -2.00 0.00 0.00 0.00 175.76 173.82 2vhc s GLU 115 N -2.50 1.16 -0.28 0.00 2.12 -1.26 -1.21 118.70 116.73 2vhc s GLU 115 Ca 0.09 -0.43 -0.19 0.00 0.36 0.00 0.00 54.97 54.80 2vhc s GLU 115 Cb -0.01 -1.08 0.10 0.00 0.26 0.00 0.00 34.13 33.40 2vhc s GLU 115 CO -0.05 0.21 0.80 0.12 -0.54 0.00 0.00 175.26 175.80 2vhc s PHE 116 N -0.04 -0.83 -1.31 5.30 5.36 0.08 -4.94 117.98 121.60 2vhc s PHE 116 Ca 0.00 1.75 0.00 0.00 -0.96 0.00 0.00 56.93 57.72 2vhc s PHE 116 Cb -0.08 0.46 0.00 0.00 -0.34 0.00 0.00 43.02 43.07 2vhc s PHE 116 CO 0.00 -0.41 0.00 0.41 -1.46 0.00 0.00 175.22 173.77 2vhc n GLY 117 N 3.58 1.32 1.41 13.12 0.00 -1.26 -1.66 105.19 121.71 2vhc n GLY 117 Ca -0.17 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2vhc n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vhc n GLY 118 N -1.27 0.60 3.07 -0.02 0.00 -1.26 -4.94 105.19 101.38 2vhc n GLY 118 Ca -0.12 -0.41 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 2vhc n GLY 118 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vhc s HIS 119 N -2.00 1.09 0.16 1.61 3.76 -0.66 -5.14 115.29 114.11 2vhc s HIS 119 Ca 0.00 -0.21 -0.21 0.00 -0.15 0.00 0.00 55.06 54.49 2vhc s HIS 119 Cb 0.00 -0.71 -0.08 0.00 1.11 0.00 0.00 32.58 32.91 2vhc s HIS 119 CO 0.00 -0.03 0.68 1.03 -0.85 0.00 0.00 174.74 175.57 2vhc s ARG 120 N -0.24 4.30 0.01 1.40 0.52 -1.26 -0.74 118.95 122.94 2vhc s ARG 120 Ca 0.04 0.88 0.08 0.00 -0.52 0.00 0.00 55.73 56.21 2vhc s ARG 120 Cb -0.05 -3.08 -0.02 0.00 0.52 0.00 0.00 34.95 32.32 2vhc s ARG 120 CO -0.00 0.51 -0.25 0.71 0.02 0.00 0.00 175.30 176.29 2vhc s TYR 121 N -1.31 2.21 0.42 -0.53 2.02 -0.35 -5.00 117.35 114.82 2vhc s TYR 121 Ca 0.37 -0.41 -0.15 0.00 -0.37 0.00 0.00 57.07 56.51 2vhc s TYR 121 Cb -0.19 -1.38 -0.08 0.00 -0.40 0.00 0.00 41.96 39.91 2vhc s TYR 121 CO 0.22 0.03 0.86 0.00 -1.57 0.00 0.00 175.55 175.09 2vhc s ALA 122 N -0.67 3.20 1.06 3.71 0.00 -1.26 -0.29 121.76 127.51 2vhc s ALA 122 Ca 0.10 0.08 -0.17 0.00 0.00 0.00 0.00 51.96 51.97 2vhc s ALA 122 Cb -0.10 -2.93 0.24 0.00 0.00 0.00 0.00 23.12 20.34 2vhc s ALA 122 CO 0.00 0.02 1.24 -1.54 0.00 0.00 0.00 175.76 175.48 2vhc s SER 123 N -2.76 2.19 0.00 0.00 1.04 0.82 -4.53 113.70 110.46 2vhc s SER 123 Ca 0.56 0.41 0.00 0.00 0.48 0.00 0.00 55.95 57.40 2vhc s SER 123 Cb -0.10 -0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.50 2vhc s SER 123 CO 0.25 -3.32 0.00 0.61 0.98 0.00 0.00 173.24 171.76 2vhc n GLY 124 N -2.62 -0.45 3.49 7.32 0.00 -0.01 -4.69 105.19 108.22 2vhc n GLY 124 Ca 0.15 -1.96 -0.36 0.00 0.00 0.00 0.00 46.02 43.85 2vhc n GLY 124 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2vhc s MET 125 N 0.00 3.72 -0.29 1.61 -2.45 -1.26 -0.69 119.30 119.94 2vhc s MET 125 Ca 0.00 -0.45 -0.08 0.00 -1.25 0.00 0.00 55.69 53.91 2vhc s MET 125 Cb 0.00 -3.27 -0.00 0.00 1.25 0.00 0.00 34.83 32.81 2vhc s MET 125 CO 0.00 -0.07 0.09 0.08 1.05 0.00 0.00 175.02 176.18 2vhc s VAL 126 N 1.28 4.16 -0.24 10.11 1.01 0.69 -0.28 120.40 137.14 2vhc s VAL 126 Ca 0.05 -0.55 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 2vhc s VAL 126 Cb -0.15 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 2vhc s VAL 126 CO 0.03 0.12 0.17 -0.63 0.00 0.00 0.00 175.10 174.79 2vhc s ILE 127 N 1.54 5.35 -0.27 2.22 1.01 -0.65 -0.49 121.20 129.91 2vhc s ILE 127 Ca 0.04 0.20 -0.10 0.00 0.00 0.00 0.00 60.65 60.79 2vhc s ILE 127 Cb -0.17 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 2vhc s ILE 127 CO 0.03 0.33 0.16 -0.69 0.00 0.00 0.00 174.94 174.77 2vhc s VAL 128 N 1.13 4.99 0.17 2.92 1.01 -0.38 -0.32 120.40 129.92 2vhc s VAL 128 Ca 0.08 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 2vhc s VAL 128 Cb -0.14 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 2vhc s VAL 128 CO 0.05 0.26 0.11 0.28 0.00 0.00 0.00 175.10 175.80 2vhc s THR 129 N 1.71 0.04 -5.00 3.92 -1.32 -0.39 -2.03 115.64 112.57 2vhc s THR 129 Ca 0.07 -1.95 0.00 0.00 -1.21 0.00 0.00 61.69 58.60 2vhc s THR 129 Cb -0.16 -2.32 0.00 0.00 -1.51 0.00 0.00 72.50 68.52 2vhc s THR 129 CO 0.09 -0.18 0.00 0.61 -2.21 0.00 0.00 174.62 172.93 2vhc n GLY 130 N -0.20 -0.61 3.73 6.08 0.00 -1.26 -2.97 105.19 109.96 2vhc n GLY 130 Ca -0.01 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 2vhc n GLY 130 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2vhc n LYS 131 N 0.00 2.64 -1.29 1.61 4.81 -1.26 -4.81 118.16 119.86 2vhc n LYS 131 Ca 0.00 0.94 -0.43 0.00 -0.87 0.00 0.00 58.31 57.95 2vhc n LYS 131 Cb 0.00 -2.72 -0.02 0.00 0.02 0.00 0.00 35.03 32.31 2vhc n LYS 131 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2vhc n GLY 132 N 2.36 -1.96 4.11 3.14 0.00 -1.26 -1.30 105.19 110.28 2vhc n GLY 132 Ca 0.10 0.21 -0.32 0.00 0.00 0.00 0.00 46.02 46.01 2vhc n GLY 132 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vhc n ASN 133 N 1.99 -2.12 0.22 1.61 3.02 -1.26 -4.86 115.26 113.86 2vhc n ASN 133 Ca 0.15 -1.00 0.15 0.00 -0.03 0.00 0.00 54.58 53.85 2vhc n ASN 133 Cb 0.28 -2.90 0.63 0.00 -0.61 0.00 0.00 39.78 37.18 2vhc n ASN 133 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2vhc h SER 134 N -1.68 0.00 -0.81 6.41 4.64 -1.52 -3.46 113.55 117.12 2vhc h SER 134 Ca -0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.71 2vhc h SER 134 Cb 1.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 2vhc h SER 134 CO 0.71 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.28 2vhc n GLY 135 N -0.05 0.86 0.05 -0.77 0.00 -1.26 -4.93 105.19 99.10 2vhc n GLY 135 Ca 0.01 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 2vhc n GLY 135 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vhc h LYS 136 N 0.00 0.01 -0.07 1.61 1.57 -1.95 -2.64 116.57 115.10 2vhc h LYS 136 Ca 0.00 -0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2vhc h LYS 136 Cb 0.67 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.92 2vhc h LYS 136 CO 0.00 0.45 -0.26 1.15 -0.57 0.00 0.00 179.45 180.22 2vhc h THR 137 N -0.44 0.39 -0.59 -0.16 2.02 -1.99 -0.77 112.91 111.38 2vhc h THR 137 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.25 2vhc h THR 137 Cb 0.45 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 2vhc h THR 137 CO 0.00 0.00 0.40 -0.65 0.37 0.00 0.00 175.52 175.64 2vhc h PRO 138 N -0.37 0.51 -0.25 6.66 0.11 -1.88 -2.80 132.00 133.98 2vhc h PRO 138 Ca 0.08 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.97 2vhc h PRO 138 Cb 0.49 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.48 2vhc h PRO 138 CO -0.28 0.34 -0.60 1.25 -0.21 0.00 0.00 178.00 178.50 2vhc h LEU 139 N 0.53 0.94 -0.96 2.35 7.12 -0.95 -2.07 115.31 122.27 2vhc h LEU 139 Ca 0.26 -0.53 -0.07 0.00 0.13 0.00 0.00 57.88 57.67 2vhc h LEU 139 Cb 0.35 -0.27 -0.02 0.00 -0.53 0.00 0.00 40.66 40.18 2vhc h LEU 139 CO -0.08 1.33 0.03 -0.37 -0.13 0.00 0.00 178.44 179.22 2vhc h VAL 140 N 0.63 1.24 -0.24 1.05 -1.51 -0.92 -0.66 116.25 115.83 2vhc h VAL 140 Ca -0.00 -0.95 -0.11 0.00 -1.23 0.00 0.00 66.70 64.41 2vhc h VAL 140 Cb 1.21 0.84 -0.00 0.00 -2.13 0.00 0.00 31.29 31.20 2vhc h VAL 140 CO 0.13 0.34 -0.27 0.45 -1.23 0.00 0.00 177.57 176.99 2vhc h HIS 141 N 0.74 0.72 -0.52 5.19 3.86 -1.47 0.28 115.15 123.95 2vhc h HIS 141 Ca 0.15 -0.22 0.01 0.00 -1.16 0.00 0.00 60.37 59.14 2vhc h HIS 141 Cb 0.41 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.70 2vhc h HIS 141 CO 0.02 0.94 0.34 0.00 0.86 0.00 0.00 177.93 180.09 2vhc h ALA 142 N 0.66 0.67 -0.86 2.45 0.00 -1.25 -1.74 119.26 119.19 2vhc h ALA 142 Ca 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2vhc h ALA 142 Cb 0.83 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2vhc h ALA 142 CO 0.06 0.09 0.43 -0.07 0.00 0.00 0.00 179.25 179.76 2vhc h LEU 143 N 0.69 1.11 -0.16 0.00 3.38 -1.02 -1.87 115.31 117.45 2vhc h LEU 143 Ca 0.20 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.09 2vhc h LEU 143 Cb -0.06 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 40.35 2vhc h LEU 143 CO -0.05 0.93 -0.25 1.23 0.09 0.00 0.00 178.44 180.38 2vhc h GLY 144 N 1.22 -0.24 1.72 0.83 0.00 0.14 -1.44 103.07 105.29 2vhc h GLY 144 Ca 0.30 0.30 -0.20 0.00 0.00 0.00 0.00 47.33 47.73 2vhc h GLY 144 CO -0.04 -0.20 -0.85 1.05 0.00 0.00 0.00 176.54 176.49 2vhc h GLU 145 N -0.29 0.26 -0.41 4.80 -0.00 -1.23 -0.70 114.58 117.00 2vhc h GLU 145 Ca 0.11 -0.27 -0.02 0.00 -0.00 0.00 0.00 59.36 59.19 2vhc h GLU 145 Cb 0.46 0.07 -0.02 0.00 -0.00 0.00 0.00 28.75 29.27 2vhc h GLU 145 CO -0.33 0.97 0.19 0.00 -0.00 0.00 0.00 179.01 179.83 2vhc h ALA 146 N 0.94 0.53 0.00 1.06 0.00 -1.23 -0.43 119.26 120.13 2vhc h ALA 146 Ca -0.05 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 2vhc h ALA 146 Cb 1.47 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2vhc h ALA 146 CO 0.14 0.10 -0.57 -0.07 0.00 0.00 0.00 179.25 178.85 2vhc h LEU 147 N 0.52 0.00 -0.54 0.00 3.38 -1.28 -3.15 115.31 114.24 2vhc h LEU 147 Ca 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2vhc h LEU 147 Cb 0.14 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2vhc h LEU 147 CO -0.02 0.56 0.32 1.23 0.09 0.00 0.00 178.44 180.62 2vhc h GLY 148 N 3.45 0.79 0.00 0.83 0.00 -0.66 -3.45 103.07 104.03 2vhc h GLY 148 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2vhc h GLY 148 CO 0.07 0.33 0.00 0.61 0.00 0.00 0.00 176.54 177.55 2vhc n GLY 149 N -1.10 1.38 0.18 4.60 0.00 -0.21 -1.51 105.19 108.53 2vhc n GLY 149 Ca 0.03 0.15 0.10 0.00 0.00 0.00 0.00 46.02 46.30 2vhc n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vhc h LYS 150 N 0.00 0.00 -6.23 1.61 1.57 -1.90 -3.46 116.57 108.16 2vhc h LYS 150 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2vhc h LYS 150 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2vhc h LYS 150 CO 0.00 0.09 -0.33 -0.51 -0.57 0.00 0.00 179.45 178.13 2vhc s ASP 151 N -6.07 6.39 0.52 0.86 1.01 -0.57 -5.09 116.67 113.72 2vhc s ASP 151 Ca 0.05 0.41 -0.20 0.00 0.71 0.00 0.00 52.55 53.52 2vhc s ASP 151 Cb 0.06 -2.01 -0.07 0.00 1.01 0.00 0.00 42.92 41.91 2vhc s ASP 151 CO 0.71 -0.05 1.10 -0.54 0.21 0.00 0.00 175.17 176.60 2vhc s LYS 152 N -3.34 3.52 0.06 8.23 1.02 -1.26 -4.55 119.74 123.41 2vhc s LYS 152 Ca 0.39 1.53 -0.04 0.00 0.02 0.00 0.00 55.97 57.87 2vhc s LYS 152 Cb -0.11 -2.04 -0.05 0.00 -0.52 0.00 0.00 37.83 35.11 2vhc s LYS 152 CO 0.29 -0.70 0.27 1.52 -0.92 0.00 0.00 175.35 175.81 2vhc s TYR 153 N -1.84 3.53 -0.03 3.18 1.13 -1.26 -4.76 117.35 117.30 2vhc s TYR 153 Ca 0.71 0.45 -0.15 0.00 -1.41 0.00 0.00 57.07 56.66 2vhc s TYR 153 Cb -0.21 -1.91 -0.05 0.00 -1.10 0.00 0.00 41.96 38.69 2vhc s TYR 153 CO 0.25 0.56 0.42 0.00 -2.51 0.00 0.00 175.55 174.26 2vhc s ALA 154 N -1.46 3.65 -0.21 9.51 0.00 0.18 -4.98 121.76 128.44 2vhc s ALA 154 Ca 0.33 -0.23 -0.03 0.00 0.00 0.00 0.00 51.96 52.04 2vhc s ALA 154 Cb -0.13 -2.44 -0.00 0.00 0.00 0.00 0.00 23.12 20.55 2vhc s ALA 154 CO 0.22 0.36 -0.07 0.99 0.00 0.00 0.00 175.76 177.26 2vhc s THR 155 N -0.64 3.11 -0.26 0.00 2.01 -1.26 0.55 115.64 119.16 2vhc s THR 155 Ca 0.24 -0.59 -0.10 0.00 0.31 0.00 0.00 61.69 61.54 2vhc s THR 155 Cb -0.16 -2.41 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 2vhc s THR 155 CO 0.12 0.44 0.16 -0.69 -0.69 0.00 0.00 174.62 173.96 2vhc s VAL 156 N 1.44 5.17 -0.11 3.82 1.01 0.16 -4.95 120.40 126.94 2vhc s VAL 156 Ca 0.05 0.12 -0.03 0.00 0.00 0.00 0.00 61.98 62.12 2vhc s VAL 156 Cb -0.14 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2vhc s VAL 156 CO -0.05 0.31 0.01 -0.13 0.00 0.00 0.00 175.10 175.23 2vhc s ARG 157 N 1.42 3.24 -0.22 2.72 0.52 -1.26 -1.48 118.95 123.89 2vhc s ARG 157 Ca 0.07 -0.41 -0.15 0.00 -0.52 0.00 0.00 55.73 54.72 2vhc s ARG 157 Cb -0.15 -2.88 0.06 0.00 0.52 0.00 0.00 34.95 32.51 2vhc s ARG 157 CO 0.07 0.58 0.55 0.12 0.02 0.00 0.00 175.30 176.64 2vhc s PHE 158 N -0.52 -0.76 -1.29 -0.53 5.36 0.67 -4.02 117.98 116.87 2vhc s PHE 158 Ca 0.09 1.64 -0.05 0.00 -0.96 0.00 0.00 56.93 57.65 2vhc s PHE 158 Cb -0.12 0.37 0.01 0.00 -0.34 0.00 0.00 43.02 42.94 2vhc s PHE 158 CO 0.02 -0.39 0.65 0.41 -1.46 0.00 0.00 175.22 174.45 2vhc n GLY 159 N 3.84 -0.34 3.34 13.12 0.00 -0.48 -0.86 105.19 123.80 2vhc n GLY 159 Ca -0.19 0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 2vhc n GLY 159 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vhc s GLU 160 N -5.69 1.28 -0.70 1.61 0.41 -1.26 -4.68 118.70 109.66 2vhc s GLU 160 Ca 0.32 -1.27 -0.07 0.00 -0.41 0.00 0.00 54.97 53.54 2vhc s GLU 160 Cb -0.14 -1.66 -0.15 0.00 -1.78 0.00 0.00 34.13 30.40 2vhc s GLU 160 CO 0.40 0.39 3.23 -0.35 -0.49 0.00 0.00 175.26 178.44 2vhc n PRO 161 N 0.96 2.82 -4.41 0.39 -0.04 -1.26 -4.75 135.00 128.71 2vhc n PRO 161 Ca -0.18 -1.72 -0.20 0.00 -0.04 0.00 0.00 63.50 61.35 2vhc n PRO 161 Cb 0.53 -2.34 -0.10 0.00 -0.04 0.00 0.00 33.50 31.55 2vhc n PRO 161 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2vhc s LEU 162 N -0.31 2.32 0.32 1.53 1.43 -1.26 -5.11 118.68 117.60 2vhc s LEU 162 Ca 0.66 -1.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.22 2vhc s LEU 162 Cb 0.27 -0.47 -0.10 0.00 0.03 0.00 0.00 46.19 45.92 2vhc s LEU 162 CO -0.05 -0.47 1.33 -0.94 0.23 0.00 0.00 176.35 176.45 2vhc s SER 163 N -3.42 6.75 0.00 2.29 1.04 -1.26 -3.20 113.70 115.90 2vhc s SER 163 Ca 0.31 2.69 0.00 0.00 0.48 0.00 0.00 55.95 59.43 2vhc s SER 163 Cb 0.06 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2vhc s SER 163 CO 0.12 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.39 2vhc n GLY 164 N 1.03 0.30 3.68 7.32 0.00 -1.26 -4.99 105.19 111.27 2vhc n GLY 164 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2vhc n GLY 164 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vhc s TYR 165 N -1.66 3.45 0.37 1.61 2.02 -1.19 -5.03 117.35 116.92 2vhc s TYR 165 Ca 0.00 1.41 -0.28 0.00 -0.37 0.00 0.00 57.07 57.83 2vhc s TYR 165 Cb 0.00 -3.10 -0.11 0.00 -0.40 0.00 0.00 41.96 38.35 2vhc s TYR 165 CO 0.00 -0.25 1.51 -1.71 -1.57 0.00 0.00 175.55 173.53 2vhc n ASN 166 N 5.21 3.86 -0.02 2.29 5.15 -1.26 -4.81 115.26 125.68 2vhc n ASN 166 Ca 0.07 1.22 0.01 0.00 -0.60 0.00 0.00 54.58 55.27 2vhc n ASN 166 Cb 0.49 -1.63 0.01 0.00 -0.53 0.00 0.00 39.78 38.12 2vhc n ASN 166 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2vhc n THR 167 N 0.60 0.68 -3.34 -0.44 -2.24 -1.26 -1.38 114.28 106.90 2vhc n THR 167 Ca 0.02 -0.70 -0.40 0.00 -2.27 0.00 0.00 64.05 60.70 2vhc n THR 167 Cb 0.39 0.62 -0.09 0.00 -2.10 0.00 0.00 70.33 69.16 2vhc n THR 167 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2vhc s ASP 168 N -0.78 6.28 0.43 3.42 -1.08 -1.26 -4.90 116.67 118.78 2vhc s ASP 168 Ca 0.02 0.21 0.08 0.00 -0.52 0.00 0.00 52.55 52.34 2vhc s ASP 168 Cb 0.02 -2.23 0.92 0.00 -1.46 0.00 0.00 42.92 40.17 2vhc s ASP 168 CO 0.00 -0.27 2.07 0.15 0.52 0.00 0.00 175.17 177.64 2vhc h PHE 169 N 8.23 0.43 -0.24 -5.34 3.57 -1.99 -1.97 116.94 119.62 2vhc h PHE 169 Ca -0.30 0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.05 2vhc h PHE 169 Cb 1.15 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.74 2vhc h PHE 169 CO 0.74 0.28 -0.50 -0.91 -2.23 0.00 0.00 178.31 175.69 2vhc h ASN 170 N 0.46 0.73 -0.55 0.41 4.21 -1.96 -1.89 115.58 116.99 2vhc h ASN 170 Ca 0.12 -0.37 -0.04 0.00 1.21 0.00 0.00 56.30 57.22 2vhc h ASN 170 Cb -0.04 -0.21 -0.03 0.00 -1.12 0.00 0.00 38.32 36.92 2vhc h ASN 170 CO -0.03 1.10 0.21 0.58 -1.29 0.00 0.00 177.43 178.01 2vhc h VAL 171 N 0.53 1.22 0.01 2.81 2.07 -1.89 -2.77 116.25 118.23 2vhc h VAL 171 Ca 0.02 -0.72 0.01 0.00 0.82 0.00 0.00 66.70 66.83 2vhc h VAL 171 Cb 1.05 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2vhc h VAL 171 CO 0.10 0.28 -0.07 0.15 0.02 0.00 0.00 177.57 178.05 2vhc h PHE 172 N 0.86 -0.17 -0.14 1.57 3.57 -0.86 0.46 116.94 122.23 2vhc h PHE 172 Ca 0.20 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 2vhc h PHE 172 Cb 0.21 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2vhc h PHE 172 CO 0.01 -0.11 -0.04 -0.39 -2.23 0.00 0.00 178.31 175.55 2vhc h VAL 173 N -0.13 1.12 -0.34 1.41 -1.51 -1.31 -0.84 116.25 114.66 2vhc h VAL 173 Ca 0.03 -0.49 -0.06 0.00 -1.23 0.00 0.00 66.70 64.95 2vhc h VAL 173 Cb 0.16 1.07 -0.01 0.00 -2.13 0.00 0.00 31.29 30.37 2vhc h VAL 173 CO -0.07 0.16 -0.01 -0.78 -1.23 0.00 0.00 177.57 175.64 2vhc h ASP 174 N 0.20 0.59 -0.48 4.19 1.82 -1.16 -0.62 116.42 120.96 2vhc h ASP 174 Ca 0.05 -0.31 0.04 0.00 -0.39 0.00 0.00 57.03 56.41 2vhc h ASP 174 Cb 0.21 -0.16 -0.04 0.00 0.68 0.00 0.00 39.33 40.02 2vhc h ASP 174 CO 0.01 0.76 0.25 0.44 -1.61 0.00 0.00 179.24 179.10 2vhc h ASP 175 N 0.41 0.38 -0.58 2.28 3.32 -0.05 -1.80 116.42 120.38 2vhc h ASP 175 Ca 0.10 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 2vhc h ASP 175 Cb 0.47 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 2vhc h ASP 175 CO 0.02 0.27 -0.06 0.40 -1.72 0.00 0.00 179.24 178.15 2vhc h ILE 176 N 0.50 1.27 0.13 0.35 2.04 -1.07 0.12 117.51 120.86 2vhc h ILE 176 Ca 0.21 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.84 2vhc h ILE 176 Cb 0.09 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2vhc h ILE 176 CO -0.13 0.44 -0.06 0.00 0.00 0.00 0.00 178.15 178.39 2vhc h ALA 177 N 0.96 -0.18 -0.53 1.87 0.00 -1.01 -1.54 119.26 118.84 2vhc h ALA 177 Ca 0.16 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2vhc h ALA 177 Cb 0.63 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 2vhc h ALA 177 CO 0.04 -0.57 0.25 -0.09 0.00 0.00 0.00 179.25 178.88 2vhc h ARG 178 N -0.23 0.47 -0.14 0.00 2.43 -1.16 -0.06 114.38 115.68 2vhc h ARG 178 Ca -0.02 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2vhc h ARG 178 Cb 0.18 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 2vhc h ARG 178 CO 0.03 0.31 0.05 0.00 -1.51 0.00 0.00 179.97 178.85 2vhc h ALA 179 N 1.31 0.16 0.00 2.80 0.00 -0.79 -1.92 119.26 120.81 2vhc h ALA 179 Ca 0.24 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 2vhc h ALA 179 Cb 0.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2vhc h ALA 179 CO -0.19 -0.40 -0.39 0.52 0.00 0.00 0.00 179.25 178.79 2vhc h MET 180 N 0.12 0.00 0.00 0.00 2.86 -0.97 -0.08 114.93 116.86 2vhc h MET 180 Ca 0.06 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.60 2vhc h MET 180 Cb 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 2vhc h MET 180 CO -0.06 0.39 -0.48 -0.07 1.06 0.00 0.00 176.91 177.75 2vhc h LEU 181 N 0.00 0.00 0.00 1.22 3.38 -0.73 -3.39 115.31 115.79 2vhc h LEU 181 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vhc h LEU 181 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2vhc h LEU 181 CO 0.05 0.48 -0.08 0.00 0.09 0.00 0.00 178.44 178.98 2vhc n GLN 182 N -3.58 6.46 -3.83 1.13 6.02 -0.75 -5.03 117.38 117.80 2vhc n GLN 182 Ca -0.00 -0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 2vhc n GLN 182 Cb 0.57 -0.55 -0.11 0.00 1.02 0.00 0.00 30.24 31.18 2vhc n GLN 182 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2vhc s HIS 183 N -1.10 -0.10 -0.03 1.08 3.76 -0.08 -5.06 115.29 113.77 2vhc s HIS 183 Ca 0.00 0.20 0.12 0.00 -0.15 0.00 0.00 55.06 55.23 2vhc s HIS 183 Cb 0.00 0.02 -0.15 0.00 1.11 0.00 0.00 32.58 33.56 2vhc s HIS 183 CO 0.02 -0.23 1.03 -0.09 -0.85 0.00 0.00 174.74 174.62 2vhc h ARG 184 N 4.84 0.00 -4.43 1.40 2.43 -1.89 -3.41 114.38 113.32 2vhc h ARG 184 Ca -0.28 0.00 -0.57 0.00 -0.81 0.00 0.00 59.98 58.32 2vhc h ARG 184 Cb 1.19 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 30.38 2vhc h ARG 184 CO 0.39 0.61 -0.82 0.08 -1.51 0.00 0.00 179.97 178.73 2vhc s VAL 185 N -2.77 1.30 -0.02 0.20 1.01 -1.26 -0.66 120.40 118.19 2vhc s VAL 185 Ca -0.01 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.50 2vhc s VAL 185 Cb 0.09 -1.28 0.00 0.00 0.00 0.00 0.00 36.38 35.19 2vhc s VAL 185 CO 0.81 0.38 -0.09 -0.63 0.00 0.00 0.00 175.10 175.58 2vhc s ILE 186 N 1.59 0.74 -0.12 2.22 1.01 -0.50 -0.65 121.20 125.49 2vhc s ILE 186 Ca 0.04 -0.34 0.01 0.00 0.00 0.00 0.00 60.65 60.36 2vhc s ILE 186 Cb -0.13 -0.66 -0.01 0.00 0.01 0.00 0.00 42.46 41.67 2vhc s ILE 186 CO -0.09 0.23 -0.15 -0.69 0.00 0.00 0.00 174.94 174.24 2vhc s VAL 187 N 0.17 2.86 -0.19 2.92 1.01 0.19 -0.12 120.40 127.24 2vhc s VAL 187 Ca -0.03 -0.73 -0.03 0.00 0.00 0.00 0.00 61.98 61.19 2vhc s VAL 187 Cb -0.08 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 2vhc s VAL 187 CO 0.00 0.54 -0.07 -0.63 0.00 0.00 0.00 175.10 174.93 2vhc s ILE 188 N 0.27 3.27 -0.32 2.22 1.01 0.50 0.40 121.20 128.55 2vhc s ILE 188 Ca -0.11 -0.55 -0.01 0.00 0.00 0.00 0.00 60.65 59.98 2vhc s ILE 188 Cb -0.16 -2.45 0.10 0.00 0.01 0.00 0.00 42.46 39.97 2vhc s ILE 188 CO 0.06 0.46 0.12 -0.62 0.00 0.00 0.00 174.94 174.96 2vhc s ASP 189 N 1.04 3.85 0.34 3.58 2.15 -0.55 -1.60 116.67 125.48 2vhc s ASP 189 Ca 0.00 -1.66 -0.03 0.00 0.43 0.00 0.00 52.55 51.29 2vhc s ASP 189 Cb -0.15 -0.74 0.00 0.00 -0.30 0.00 0.00 42.92 41.74 2vhc s ASP 189 CO -0.01 -0.41 0.49 -0.94 -0.17 0.00 0.00 175.17 174.14 2vhc s SER 190 N 1.60 0.85 0.00 -0.34 1.04 -0.04 -0.24 113.70 116.57 2vhc s SER 190 Ca 0.11 -1.46 0.26 0.00 0.48 0.00 0.00 55.95 55.34 2vhc s SER 190 Cb -0.18 0.67 0.75 0.00 0.10 0.00 0.00 66.02 67.36 2vhc s SER 190 CO -0.25 -1.31 1.56 0.18 0.98 0.00 0.00 173.24 174.41 2vhc n LEU 191 N -0.56 0.94 -0.24 2.42 4.32 -0.11 -4.49 117.00 119.28 2vhc n LEU 191 Ca 0.00 -0.22 -0.02 0.00 -0.02 0.00 0.00 56.01 55.76 2vhc n LEU 191 Cb 0.61 -0.14 0.00 0.00 -1.62 0.00 0.00 43.42 42.28 2vhc n LEU 191 CO 0.29 0.18 0.35 1.17 -1.22 0.00 0.00 177.39 178.16 2vhc n LYS 192 N -0.76 -0.18 0.04 3.23 4.81 -1.16 -0.59 118.16 123.55 2vhc n LYS 192 Ca 0.11 0.95 0.13 0.00 -0.87 0.00 0.00 58.31 58.64 2vhc n LYS 192 Cb 0.34 -1.41 0.44 0.00 0.02 0.00 0.00 35.03 34.42 2vhc n LYS 192 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2vhc n ASN 193 N -4.89 0.44 0.09 3.14 4.13 -1.26 -3.31 115.26 113.59 2vhc n ASN 193 Ca 0.05 0.38 -0.17 0.00 1.68 0.00 0.00 54.58 56.52 2vhc n ASN 193 Cb 0.23 -0.42 -0.10 0.00 -1.54 0.00 0.00 39.78 37.95 2vhc n ASN 193 CO 0.00 0.00 0.00 -0.37 0.28 0.00 0.00 177.26 177.17 2vhc h VAL 194 N 0.00 1.39 -2.03 2.41 -1.51 -1.14 -3.50 116.25 111.87 2vhc h VAL 194 Ca 0.00 -2.63 -0.50 0.00 -1.23 0.00 0.00 66.70 62.33 2vhc h VAL 194 Cb 0.61 2.67 -0.03 0.00 -2.13 0.00 0.00 31.29 32.41 2vhc h VAL 194 CO 0.00 0.79 1.38 -0.63 -1.23 0.00 0.00 177.57 177.87 2vhc s ILE 195 N -2.99 3.33 0.00 7.19 1.01 -1.02 -4.78 121.20 123.94 2vhc s ILE 195 Ca -0.06 0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.80 2vhc s ILE 195 Cb 0.07 -3.80 0.00 0.00 0.01 0.00 0.00 42.46 38.74 2vhc s ILE 195 CO 0.89 -0.75 0.00 -0.38 0.00 0.00 0.00 174.94 174.71 2vhc n ILE 207 N 7.32 0.00 -1.04 2.92 5.41 -1.26 -5.00 119.36 127.72 2vhc n ILE 207 Ca 0.23 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.67 2vhc n ILE 207 Cb 0.52 0.00 0.13 0.00 -0.71 0.00 0.00 39.64 39.57 2vhc n ILE 207 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2vhc s SER 208 N 0.00 3.76 0.13 4.38 1.04 -1.26 -4.86 113.70 116.88 2vhc s SER 208 Ca 0.00 1.90 -0.16 0.00 0.48 0.00 0.00 55.95 58.17 2vhc s SER 208 Cb 0.00 -2.50 -0.01 0.00 0.10 0.00 0.00 66.02 63.61 2vhc s SER 208 CO 0.00 -2.52 1.68 0.03 0.98 0.00 0.00 173.24 173.40 2vhc h ARG 209 N -1.47 0.57 -0.66 4.02 3.08 -1.87 -0.66 114.38 117.39 2vhc h ARG 209 Ca -0.45 -0.10 0.12 0.00 0.07 0.00 0.00 59.98 59.62 2vhc h ARG 209 Cb 1.25 -0.09 -0.09 0.00 0.08 0.00 0.00 29.97 31.12 2vhc h ARG 209 CO 0.48 0.54 0.20 0.78 -1.07 0.00 0.00 179.97 180.91 2vhc h GLY 210 N 0.47 0.91 1.17 0.04 0.00 -1.28 0.58 103.07 104.95 2vhc h GLY 210 Ca 0.13 -0.08 -0.14 0.00 0.00 0.00 0.00 47.33 47.23 2vhc h GLY 210 CO -0.01 -0.10 -0.31 0.00 0.00 0.00 0.00 176.54 176.13 2vhc h ALA 211 N 1.49 0.67 -0.54 3.60 0.00 -1.78 -0.29 119.26 122.42 2vhc h ALA 211 Ca 0.35 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2vhc h ALA 211 Cb 0.51 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2vhc h ALA 211 CO -0.39 0.67 -0.03 0.35 0.00 0.00 0.00 179.25 179.85 2vhc h PHE 212 N 0.77 1.07 -0.25 0.00 3.57 -0.44 -2.68 116.94 118.98 2vhc h PHE 212 Ca 0.08 -0.20 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 2vhc h PHE 212 Cb 0.89 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 2vhc h PHE 212 CO 0.06 0.98 0.16 -0.44 -2.23 0.00 0.00 178.31 176.83 2vhc h ASP 213 N 0.84 0.30 0.10 0.41 3.32 0.36 -2.79 116.42 118.96 2vhc h ASP 213 Ca 0.15 -0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.17 2vhc h ASP 213 Cb 0.58 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 2vhc h ASP 213 CO 0.03 0.25 -0.19 0.25 -1.72 0.00 0.00 179.24 177.86 2vhc h LEU 214 N 0.32 -0.54 -0.76 1.55 5.85 -0.95 0.29 115.31 121.07 2vhc h LEU 214 Ca 0.09 0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.93 2vhc h LEU 214 Cb 0.00 0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 2vhc h LEU 214 CO -0.02 -0.27 0.45 -0.07 -0.34 0.00 0.00 178.44 178.19 2vhc h LEU 215 N -0.37 0.70 -0.97 2.25 3.38 -1.54 -1.20 115.31 117.56 2vhc h LEU 215 Ca 0.03 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2vhc h LEU 215 Cb 0.39 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2vhc h LEU 215 CO -0.11 0.45 -0.41 0.28 0.09 0.00 0.00 178.44 178.74 2vhc h SER 216 N 0.83 0.00 0.08 -0.43 0.02 -1.11 -3.37 113.55 109.58 2vhc h SER 216 Ca 0.33 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.93 2vhc h SER 216 Cb 0.17 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.65 2vhc h SER 216 CO -0.17 0.41 -2.28 0.47 -1.14 0.00 0.00 176.83 174.11 2vhc n ASP 217 N -3.64 0.34 -0.11 3.07 8.00 0.96 -4.76 116.55 120.40 2vhc n ASP 217 Ca -0.01 0.06 -0.14 0.00 0.71 0.00 0.00 54.79 55.41 2vhc n ASP 217 Cb 0.51 0.69 -0.03 0.00 -0.02 0.00 0.00 41.12 42.27 2vhc n ASP 217 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2vhc h ILE 218 N 0.00 1.27 -0.45 0.53 2.10 -1.39 -1.80 117.51 117.77 2vhc h ILE 218 Ca -0.51 -1.60 -0.01 0.00 1.08 0.00 0.00 64.86 63.81 2vhc h ILE 218 Cb 2.18 1.45 -0.02 0.00 -1.09 0.00 0.00 36.82 39.34 2vhc h ILE 218 CO 0.03 0.53 0.23 1.23 -1.08 0.00 0.00 178.15 179.09 2vhc h GLY 219 N 0.74 0.69 0.96 8.18 0.00 -1.82 -0.05 103.07 111.77 2vhc h GLY 219 Ca 0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 2vhc h GLY 219 CO 0.10 0.32 0.20 0.00 0.00 0.00 0.00 176.54 177.16 2vhc h ALA 220 N 1.07 0.50 -0.55 3.60 0.00 -1.83 0.83 119.26 122.89 2vhc h ALA 220 Ca 0.16 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.98 2vhc h ALA 220 Cb 0.10 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2vhc h ALA 220 CO -0.02 0.05 0.36 0.52 0.00 0.00 0.00 179.25 180.16 2vhc h MET 221 N 0.49 0.72 -0.09 0.00 2.07 -1.12 -0.88 114.93 116.13 2vhc h MET 221 Ca 0.13 -0.04 -0.03 0.00 -2.07 0.00 0.00 59.70 57.69 2vhc h MET 221 Cb 0.10 -0.16 -0.00 0.00 -1.87 0.00 0.00 31.60 29.66 2vhc h MET 221 CO -0.02 0.48 -0.05 0.00 1.07 0.00 0.00 176.91 178.39 2vhc h ALA 222 N 1.20 0.12 -0.94 6.32 0.00 -0.82 -2.01 119.26 123.13 2vhc h ALA 222 Ca 0.20 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.93 2vhc h ALA 222 Cb -0.08 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2vhc h ALA 222 CO -0.04 -0.10 0.59 0.00 0.00 0.00 0.00 179.25 179.70 2vhc h ALA 223 N 0.61 1.34 -0.59 0.00 0.00 -0.80 0.20 119.26 120.01 2vhc h ALA 223 Ca 0.02 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2vhc h ALA 223 Cb 0.52 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2vhc h ALA 223 CO 0.01 0.30 0.10 0.77 0.00 0.00 0.00 179.25 180.44 2vhc h SER 224 N 1.03 0.90 0.50 0.00 0.02 -1.02 -2.53 113.55 112.46 2vhc h SER 224 Ca 0.43 -0.19 -0.19 0.00 -0.84 0.00 0.00 61.79 61.00 2vhc h SER 224 Cb 0.27 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2vhc h SER 224 CO -0.21 0.90 -0.81 -0.09 -1.14 0.00 0.00 176.83 175.49 2vhc h ARG 225 N 0.90 0.22 0.00 3.45 9.65 -0.81 -3.43 114.38 124.37 2vhc h ARG 225 Ca 0.19 -0.22 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2vhc h ARG 225 Cb 0.38 0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.02 2vhc h ARG 225 CO 0.01 0.92 0.00 0.41 2.80 0.00 0.00 179.97 184.10 2vhc n GLY 226 N 0.71 0.52 3.95 2.80 0.00 0.67 -3.74 105.19 110.11 2vhc n GLY 226 Ca -0.03 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 2vhc n GLY 226 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vhc s VAL 228 N -2.04 3.02 -0.25 0.00 0.11 0.16 -0.83 120.40 120.58 2vhc s VAL 228 Ca 0.36 -0.68 -0.06 0.00 -2.93 0.00 0.00 61.98 58.67 2vhc s VAL 228 Cb -0.10 -2.25 -0.02 0.00 -1.53 0.00 0.00 36.38 32.48 2vhc s VAL 228 CO 0.31 0.53 0.04 -0.69 -3.33 0.00 0.00 175.10 171.96 2vhc s VAL 229 N 0.22 3.99 -0.41 2.04 1.01 0.13 -1.41 120.40 125.96 2vhc s VAL 229 Ca -0.09 -0.36 -0.10 0.00 0.00 0.00 0.00 61.98 61.44 2vhc s VAL 229 Cb -0.15 -2.89 0.07 0.00 0.00 0.00 0.00 36.38 33.41 2vhc s VAL 229 CO 0.05 0.31 0.26 -0.63 0.00 0.00 0.00 175.10 175.09 2vhc s ILE 230 N 1.56 4.34 -0.17 2.22 1.01 0.82 -0.22 121.20 130.76 2vhc s ILE 230 Ca 0.06 -1.29 -0.00 0.00 0.00 0.00 0.00 60.65 59.41 2vhc s ILE 230 Cb -0.15 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.71 2vhc s ILE 230 CO 0.01 -0.47 -0.15 0.00 0.00 0.00 0.00 174.94 174.34 2vhc s ALA 231 N 1.46 2.50 0.18 9.38 0.00 0.35 -0.37 121.76 135.26 2vhc s ALA 231 Ca 0.03 -1.09 -0.30 0.00 0.00 0.00 0.00 51.96 50.60 2vhc s ALA 231 Cb -0.22 -1.26 -0.08 0.00 0.00 0.00 0.00 23.12 21.55 2vhc s ALA 231 CO 0.03 -0.12 1.17 0.45 0.00 0.00 0.00 175.76 177.29 2vhc s SER 232 N 0.96 7.13 0.00 0.00 0.15 -0.63 -1.25 113.70 120.06 2vhc s SER 232 Ca -0.03 2.20 0.00 0.00 0.70 0.00 0.00 55.95 58.82 2vhc s SER 232 Cb -0.15 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2vhc s SER 232 CO -0.02 -0.33 0.00 -0.11 1.20 0.00 0.00 173.24 173.98 2vhc n LEU 233 N 2.44 0.00 -0.62 3.45 7.94 -0.86 -0.93 117.00 128.42 2vhc n LEU 233 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 2vhc n LEU 233 Cb 0.45 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.40 2vhc n LEU 233 CO 0.55 0.00 -0.02 0.61 -1.11 0.00 0.00 177.39 177.42 2vhc n GLY 234 N 4.02 -3.63 3.68 -3.96 0.00 -1.26 -2.99 105.19 101.04 2vhc n GLY 234 Ca 0.00 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 2vhc n GLY 234 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2vhc s PRO 235 N -2.79 4.21 0.00 1.61 0.04 -1.26 -4.62 135.00 132.19 2vhc s PRO 235 Ca 0.00 2.18 0.14 0.00 0.04 0.00 0.00 61.00 63.37 2vhc s PRO 235 Cb 0.00 -3.73 0.66 0.00 0.04 0.00 0.00 34.50 31.47 2vhc s PRO 235 CO 0.00 -0.73 1.43 -2.37 0.04 0.00 0.00 177.00 175.37 2vhc n THR 236 N 4.98 0.86 -3.93 1.26 5.66 -1.26 -4.77 114.28 117.09 2vhc n THR 236 Ca 0.16 0.21 -0.09 0.00 -3.05 0.00 0.00 64.05 61.28 2vhc n THR 236 Cb 0.42 -0.97 -0.08 0.00 -1.55 0.00 0.00 70.33 68.15 2vhc n THR 236 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2vhc s SER 237 N -2.84 0.14 0.17 1.09 0.01 -1.26 -5.12 113.70 105.89 2vhc s SER 237 Ca 0.10 -0.79 0.00 0.00 1.31 0.00 0.00 55.95 56.57 2vhc s SER 237 Cb 0.09 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2vhc s SER 237 CO 0.25 -0.77 0.00 0.59 0.41 0.00 0.00 173.24 173.72 2vhc n ASN 238 N -0.10 -7.29 -2.49 2.44 4.13 -1.26 -4.86 115.26 105.84 2vhc n ASN 238 Ca -0.12 1.04 -0.36 0.00 1.68 0.00 0.00 54.58 56.82 2vhc n ASN 238 Cb 0.63 -4.03 0.07 0.00 -1.54 0.00 0.00 39.78 34.90 2vhc n ASN 238 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2vhc n ASP 239 N 1.34 7.54 0.00 6.41 -0.08 -1.26 -4.74 116.55 125.76 2vhc n ASP 239 Ca 0.00 -3.80 0.00 0.00 -1.51 0.00 0.00 54.79 49.48 2vhc n ASP 239 Cb 0.00 -0.98 0.00 0.00 2.34 0.00 0.00 41.12 42.48 2vhc n ASP 239 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2vhc n ASP 240 N -0.80 0.00 -1.61 1.67 2.03 -1.26 -4.98 116.55 111.59 2vhc n ASP 240 Ca 0.60 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.96 2vhc n ASP 240 Cb 0.55 0.00 0.32 0.00 -0.72 0.00 0.00 41.12 41.27 2vhc n ASP 240 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2vhc n LYS 241 N 0.00 4.07 0.08 -0.67 4.81 -1.26 -3.70 118.16 121.49 2vhc n LYS 241 Ca 0.00 -2.49 0.12 0.00 -0.87 0.00 0.00 58.31 55.06 2vhc n LYS 241 Cb 0.00 -2.11 0.45 0.00 0.02 0.00 0.00 35.03 33.39 2vhc n LYS 241 CO 0.00 0.00 0.00 1.51 1.17 0.00 0.00 177.40 180.08 2vhc n ILE 242 N 0.47 0.68 -0.72 3.15 3.06 -1.26 -3.99 119.36 120.76 2vhc n ILE 242 Ca 0.22 0.06 -0.18 0.00 -2.50 0.00 0.00 62.75 60.35 2vhc n ILE 242 Cb 1.01 -0.88 -0.05 0.00 0.54 0.00 0.00 39.64 40.26 2vhc n ILE 242 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 2vhc n VAL 243 N -2.01 2.31 0.00 9.51 0.31 -1.24 -2.61 118.33 124.59 2vhc n VAL 243 Ca 0.04 -1.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.05 2vhc n VAL 243 Cb 0.29 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.18 2vhc n VAL 243 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2vhc n GLU 244 N 3.67 0.00 0.20 5.55 4.07 -1.26 -4.79 120.64 128.08 2vhc n GLU 244 Ca 0.40 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 57.41 2vhc n GLU 244 Cb 0.27 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.61 2vhc n GLU 244 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2vhc h LEU 245 N 0.00 -0.56 -1.46 4.31 5.85 -1.71 0.82 115.31 122.56 2vhc h LEU 245 Ca 0.00 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 2vhc h LEU 245 Cb 0.00 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2vhc h LEU 245 CO 0.00 -0.35 -0.27 -0.37 -0.34 0.00 0.00 178.44 177.11 2vhc h VAL 246 N -0.56 1.05 -0.00 1.05 -1.51 -1.94 0.58 116.25 114.91 2vhc h VAL 246 Ca -0.05 -0.98 0.00 0.00 -1.23 0.00 0.00 66.70 64.44 2vhc h VAL 246 Cb 0.45 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 2vhc h VAL 246 CO 0.06 0.27 -0.01 1.17 -1.23 0.00 0.00 177.57 177.83 2vhc n LYS 247 N -4.00 0.94 -0.03 5.19 4.81 -1.17 0.95 118.16 124.85 2vhc n LYS 247 Ca -0.02 -0.08 -0.02 0.00 -0.87 0.00 0.00 58.31 57.32 2vhc n LYS 247 Cb 0.34 -1.50 -0.07 0.00 0.02 0.00 0.00 35.03 33.83 2vhc n LYS 247 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2vhc n GLU 248 N -0.96 2.12 0.19 1.64 4.71 0.28 -2.65 120.64 125.98 2vhc n GLU 248 Ca 0.22 -0.02 0.06 0.00 -0.01 0.00 0.00 57.16 57.40 2vhc n GLU 248 Cb 0.16 -1.21 0.53 0.00 -1.01 0.00 0.00 31.44 29.91 2vhc n GLU 248 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2vhc h ALA 249 N 0.50 1.80 0.05 0.62 0.00 0.14 -1.24 119.26 121.13 2vhc h ALA 249 Ca -0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 2vhc h ALA 249 Cb 1.26 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2vhc h ALA 249 CO 0.01 0.16 -0.02 0.77 0.00 0.00 0.00 179.25 180.16 2vhc h SER 250 N 0.12 -0.05 -0.52 0.00 0.02 0.41 -2.84 113.55 110.69 2vhc h SER 250 Ca 0.03 -0.45 0.07 0.00 -0.84 0.00 0.00 61.79 60.60 2vhc h SER 250 Cb 0.13 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 2vhc h SER 250 CO 0.00 0.43 0.35 -0.09 -1.14 0.00 0.00 176.83 176.39 2vhc h ARG 251 N -0.56 0.39 0.17 3.45 9.65 -1.35 -2.63 114.38 123.50 2vhc h ARG 251 Ca -0.01 -0.02 -0.34 0.00 -1.10 0.00 0.00 59.98 58.51 2vhc h ARG 251 Cb 0.50 -0.09 0.01 0.00 -1.39 0.00 0.00 29.97 29.00 2vhc h ARG 251 CO 0.01 0.26 -1.67 0.66 2.80 0.00 0.00 179.97 182.04 2vhc h SER 252 N 0.41 0.56 -0.25 -3.80 4.64 -1.27 -3.37 113.55 110.47 2vhc h SER 252 Ca 0.23 -0.80 0.00 0.00 -0.47 0.00 0.00 61.79 60.75 2vhc h SER 252 Cb 0.39 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2vhc h SER 252 CO -0.06 1.67 0.00 0.59 -0.87 0.00 0.00 176.83 178.16 2vhc n ASN 253 N -3.55 3.26 -4.58 4.97 3.02 -1.07 -4.95 115.26 112.35 2vhc n ASN 253 Ca -0.21 -1.98 -0.34 0.00 -0.03 0.00 0.00 54.58 52.02 2vhc n ASN 253 Cb 1.07 -0.15 -0.11 0.00 -0.61 0.00 0.00 39.78 39.97 2vhc n ASN 253 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2vhc s SER 254 N -1.65 4.66 0.11 6.41 1.04 -1.00 -4.49 113.70 118.78 2vhc s SER 254 Ca 0.34 -0.03 -0.13 0.00 0.48 0.00 0.00 55.95 56.62 2vhc s SER 254 Cb 0.21 -1.21 -0.13 0.00 0.10 0.00 0.00 66.02 64.99 2vhc s SER 254 CO 0.30 0.35 1.34 0.74 0.98 0.00 0.00 173.24 176.96 2vhc h THR 255 N 4.30 1.28 -3.75 2.02 2.02 -0.97 -3.46 112.91 114.35 2vhc h THR 255 Ca -0.48 -1.86 -0.29 0.00 0.77 0.00 0.00 66.41 64.56 2vhc h THR 255 Cb 1.17 1.85 -0.17 0.00 -1.74 0.00 0.00 68.15 69.26 2vhc h THR 255 CO 0.53 0.59 -0.72 -0.44 0.37 0.00 0.00 175.52 175.85 2vhc s SER 256 N -7.01 1.33 -0.05 4.18 0.01 -0.68 -1.20 113.70 110.28 2vhc s SER 256 Ca -0.11 -0.86 0.03 0.00 1.31 0.00 0.00 55.95 56.32 2vhc s SER 256 Cb 0.09 0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.36 2vhc s SER 256 CO 0.89 -0.32 -0.11 -0.22 0.41 0.00 0.00 173.24 173.89 2vhc s LEU 257 N -2.58 1.69 -0.17 2.44 2.96 0.16 -1.64 118.68 121.54 2vhc s LEU 257 Ca 0.07 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 2vhc s LEU 257 Cb -0.01 -0.73 0.03 0.00 0.50 0.00 0.00 46.19 45.97 2vhc s LEU 257 CO -0.01 0.05 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.23 2vhc s VAL 258 N 0.47 1.73 -0.02 1.68 1.01 0.56 -0.54 120.40 125.29 2vhc s VAL 258 Ca -0.10 -0.80 0.06 0.00 0.00 0.00 0.00 61.98 61.14 2vhc s VAL 258 Cb -0.13 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 2vhc s VAL 258 CO 0.02 0.42 -0.19 0.27 0.00 0.00 0.00 175.10 175.62 2vhc s ILE 259 N 1.41 1.53 0.67 2.22 -4.36 -0.30 -1.26 121.20 121.11 2vhc s ILE 259 Ca 0.04 -0.83 -0.14 0.00 -0.26 0.00 0.00 60.65 59.45 2vhc s ILE 259 Cb -0.14 -1.27 0.00 0.00 1.25 0.00 0.00 42.46 42.30 2vhc s ILE 259 CO -0.11 0.43 1.10 -0.94 0.24 0.00 0.00 174.94 175.67 2vhc s SER 260 N -0.45 5.10 0.25 4.36 1.04 -1.16 -0.28 113.70 122.57 2vhc s SER 260 Ca 0.07 1.95 0.01 0.00 0.48 0.00 0.00 55.95 58.47 2vhc s SER 260 Cb -0.08 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.51 2vhc s SER 260 CO -0.01 -1.64 0.07 0.35 0.98 0.00 0.00 173.24 173.00 2vhc n THR 261 N -2.53 0.00 0.61 2.02 -2.24 -0.98 -4.82 114.28 106.35 2vhc n THR 261 Ca 0.10 -1.09 0.12 0.00 -2.27 0.00 0.00 64.05 60.91 2vhc n THR 261 Cb 0.52 0.04 0.46 0.00 -2.10 0.00 0.00 70.33 69.25 2vhc n THR 261 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2vhc n ASP 262 N -1.44 0.49 -4.74 3.42 5.68 -1.26 -4.73 116.55 113.97 2vhc n ASP 262 Ca -0.07 0.58 -0.37 0.00 -0.50 0.00 0.00 54.79 54.43 2vhc n ASP 262 Cb 0.30 -0.70 -0.07 0.00 -1.14 0.00 0.00 41.12 39.52 2vhc n ASP 262 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2vhc s VAL 263 N -3.13 5.26 -0.33 2.12 1.01 -1.26 -5.02 120.40 119.04 2vhc s VAL 263 Ca 0.09 0.68 -0.41 0.00 0.00 0.00 0.00 61.98 62.34 2vhc s VAL 263 Cb 0.12 -3.69 -0.16 0.00 0.00 0.00 0.00 36.38 32.65 2vhc s VAL 263 CO 0.47 0.39 1.76 0.47 0.00 0.00 0.00 175.10 178.19 2vhc n ASP 264 N 3.44 2.14 0.00 3.32 9.92 -1.26 -1.98 116.55 132.13 2vhc n ASP 264 Ca -0.11 1.05 0.00 0.00 -0.53 0.00 0.00 54.79 55.20 2vhc n ASP 264 Cb 0.52 -1.09 0.00 0.00 -0.64 0.00 0.00 41.12 39.91 2vhc n ASP 264 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2vhc n GLY 265 N 4.39 0.84 3.72 0.44 0.00 -1.26 -4.87 105.19 108.44 2vhc n GLY 265 Ca 0.29 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.96 2vhc n GLY 265 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vhc s GLU 266 N -0.04 3.30 0.05 1.61 2.12 -0.84 -1.87 118.70 123.03 2vhc s GLU 266 Ca 0.00 -0.33 0.04 0.00 0.36 0.00 0.00 54.97 55.04 2vhc s GLU 266 Cb 0.00 -2.97 -0.02 0.00 0.26 0.00 0.00 34.13 31.39 2vhc s GLU 266 CO 0.00 0.63 -0.11 -1.58 -0.54 0.00 0.00 175.26 173.66 2vhc s TRP 267 N -0.65 0.94 -0.15 5.30 0.52 -0.50 -2.31 118.94 122.10 2vhc s TRP 267 Ca 0.11 -0.42 -0.06 0.00 0.02 0.00 0.00 56.10 55.75 2vhc s TRP 267 Cb -0.12 -0.55 -0.04 0.00 -1.15 0.00 0.00 33.47 31.62 2vhc s TRP 267 CO 0.02 -0.01 0.04 -0.65 0.02 0.00 0.00 176.95 176.37 2vhc s GLN 268 N -1.42 3.68 -0.26 4.98 -0.21 0.62 -0.98 119.66 126.08 2vhc s GLN 268 Ca -0.04 -0.37 -0.07 0.00 0.02 0.00 0.00 55.36 54.90 2vhc s GLN 268 Cb -0.09 -3.07 -0.02 0.00 1.00 0.00 0.00 33.01 30.83 2vhc s GLN 268 CO 0.01 0.40 0.06 0.08 -2.12 0.00 0.00 175.29 173.72 2vhc s VAL 269 N -0.00 4.14 -0.17 1.09 1.01 0.63 -1.15 120.40 125.96 2vhc s VAL 269 Ca 0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.70 2vhc s VAL 269 Cb -0.12 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 2vhc s VAL 269 CO 0.01 0.29 -0.10 -0.76 0.00 0.00 0.00 175.10 174.55 2vhc s LEU 270 N 1.58 2.76 -0.09 3.92 1.02 0.30 -1.34 118.68 126.84 2vhc s LEU 270 Ca 0.06 -0.37 0.03 0.00 0.02 0.00 0.00 54.13 53.86 2vhc s LEU 270 Cb -0.15 -1.66 0.01 0.00 0.02 0.00 0.00 46.19 44.41 2vhc s LEU 270 CO 0.03 0.07 -0.16 -0.89 0.02 0.00 0.00 176.35 175.42 2vhc s THR 271 N 0.90 1.51 -0.18 5.49 2.01 -0.01 -0.66 115.64 124.69 2vhc s THR 271 Ca -0.02 -0.68 -0.27 0.00 0.31 0.00 0.00 61.69 61.03 2vhc s THR 271 Cb -0.15 -1.35 -0.01 0.00 0.01 0.00 0.00 72.50 71.00 2vhc s THR 271 CO 0.00 0.44 0.90 -0.13 -0.69 0.00 0.00 174.62 175.14 2vhc s ARG 272 N 0.67 4.29 0.00 4.92 0.52 -0.34 -1.49 118.95 127.53 2vhc s ARG 272 Ca -0.13 1.13 0.23 0.00 -0.52 0.00 0.00 55.73 56.43 2vhc s ARG 272 Cb -0.16 -3.59 0.09 0.00 0.52 0.00 0.00 34.95 31.81 2vhc s ARG 272 CO 0.04 -0.41 1.13 0.25 0.02 0.00 0.00 175.30 176.33 2vhc n THR 273 N 4.88 0.00 -3.20 0.02 -2.24 -1.25 -4.80 114.28 107.69 2vhc n THR 273 Ca 0.07 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2vhc n THR 273 Cb 0.48 0.84 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 2vhc n THR 273 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vhc n GLY 274 N 1.46 -1.68 3.63 3.38 0.00 -1.26 -4.04 105.19 106.68 2vhc n GLY 274 Ca 0.07 -1.25 -0.43 0.00 0.00 0.00 0.00 46.02 44.41 2vhc n GLY 274 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vhc s GLU 275 N -2.00 3.74 0.00 1.61 2.12 0.84 -2.15 118.70 122.86 2vhc s GLU 275 Ca 0.00 2.14 0.00 0.00 0.36 0.00 0.00 54.97 57.47 2vhc s GLU 275 Cb 0.00 -4.18 0.00 0.00 0.26 0.00 0.00 34.13 30.21 2vhc s GLU 275 CO 0.00 -1.39 0.00 0.41 -0.54 0.00 0.00 175.26 173.74 2vhc n GLY 276 N 4.92 0.51 3.96 -1.50 0.00 -1.26 -4.99 105.19 106.82 2vhc n GLY 276 Ca 0.22 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 2vhc n GLY 276 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vhc s LEU 277 N 0.00 2.95 0.31 0.99 1.43 -0.91 -5.04 118.68 118.41 2vhc s LEU 277 Ca 0.00 0.11 -0.28 0.00 -1.03 0.00 0.00 54.13 52.93 2vhc s LEU 277 Cb 0.00 -2.66 -0.09 0.00 0.03 0.00 0.00 46.19 43.47 2vhc s LEU 277 CO 0.00 -1.70 1.10 -1.58 0.23 0.00 0.00 176.35 174.40 2vhc s GLN 278 N -5.18 4.50 -0.09 1.70 2.00 -1.26 -4.74 119.66 116.59 2vhc s GLN 278 Ca 0.63 1.76 -0.21 0.00 -2.00 0.00 0.00 55.36 55.54 2vhc s GLN 278 Cb -0.08 -3.03 -0.04 0.00 0.80 0.00 0.00 33.01 30.66 2vhc s GLN 278 CO 0.44 0.10 0.60 1.03 -0.50 0.00 0.00 175.29 176.96 2vhc s ARG 279 N -1.71 4.39 0.17 1.67 0.52 -1.26 -3.77 118.95 118.96 2vhc s ARG 279 Ca 0.48 0.68 0.02 0.00 -0.52 0.00 0.00 55.73 56.40 2vhc s ARG 279 Cb -0.30 -3.44 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 2vhc s ARG 279 CO 0.39 0.10 0.31 -0.51 0.02 0.00 0.00 175.30 175.60 2vhc s LEU 280 N 0.74 4.32 -0.00 2.53 1.43 -0.55 -4.93 118.68 122.22 2vhc s LEU 280 Ca 0.32 0.19 0.03 0.00 -1.03 0.00 0.00 54.13 53.64 2vhc s LEU 280 Cb -0.17 -2.94 -0.01 0.00 0.03 0.00 0.00 46.19 43.11 2vhc s LEU 280 CO 0.14 0.02 -0.09 0.28 0.23 0.00 0.00 176.35 176.93 2vhc s THR 281 N -1.79 0.73 0.19 5.49 -1.32 -1.26 -0.83 115.64 116.85 2vhc s THR 281 Ca 0.35 -0.45 -0.14 0.00 -1.21 0.00 0.00 61.69 60.24 2vhc s THR 281 Cb -0.11 -0.62 0.01 0.00 -1.51 0.00 0.00 72.50 70.27 2vhc s THR 281 CO 0.29 0.16 0.43 -1.38 -2.21 0.00 0.00 174.62 171.91 2vhc s HIS 282 N -0.30 0.10 0.13 9.09 -3.43 -0.45 -5.00 115.29 115.44 2vhc s HIS 282 Ca 0.03 -0.46 0.06 0.00 -0.80 0.00 0.00 55.06 53.89 2vhc s HIS 282 Cb -0.04 0.21 -0.04 0.00 -1.43 0.00 0.00 32.58 31.28 2vhc s HIS 282 CO -0.00 -0.85 -0.01 0.95 -2.00 0.00 0.00 174.74 172.84 2vhc s THR 283 N -3.92 3.83 -0.07 -5.38 -4.23 -1.26 -0.27 115.64 104.35 2vhc s THR 283 Ca 0.13 -1.22 0.05 0.00 -1.18 0.00 0.00 61.69 59.48 2vhc s THR 283 Cb 0.01 -2.87 -0.01 0.00 1.34 0.00 0.00 72.50 70.97 2vhc s THR 283 CO -0.01 0.01 -0.24 -0.76 -0.54 0.00 0.00 174.62 173.08 2vhc s LEU 284 N -2.61 2.14 -0.06 4.79 1.02 -0.15 -4.95 118.68 118.86 2vhc s LEU 284 Ca 0.26 -0.50 0.01 0.00 0.02 0.00 0.00 54.13 53.92 2vhc s LEU 284 Cb -0.10 -1.40 -0.03 0.00 0.02 0.00 0.00 46.19 44.67 2vhc s LEU 284 CO 0.18 0.23 -0.05 -1.10 0.02 0.00 0.00 176.35 175.63 2vhc s GLN 285 N -0.08 2.77 0.05 1.70 -1.52 -1.26 -1.41 119.66 119.91 2vhc s GLN 285 Ca -0.06 -0.55 -0.02 0.00 -1.95 0.00 0.00 55.36 52.78 2vhc s GLN 285 Cb -0.14 -2.62 -0.03 0.00 -0.22 0.00 0.00 33.01 29.99 2vhc s GLN 285 CO 0.05 0.66 0.01 0.95 -0.25 0.00 0.00 175.29 176.71 2vhc s THR 286 N -0.87 0.20 0.09 -0.19 -4.23 -0.78 -0.25 115.64 109.61 2vhc s THR 286 Ca 0.14 -1.63 -0.17 0.00 -1.18 0.00 0.00 61.69 58.85 2vhc s THR 286 Cb -0.11 -1.39 0.03 0.00 1.34 0.00 0.00 72.50 72.37 2vhc s THR 286 CO 0.03 -0.90 0.40 -0.94 -0.54 0.00 0.00 174.62 172.67 2vhc s SER 287 N -2.79 -0.25 -0.06 3.99 1.04 -0.65 -4.73 113.70 110.25 2vhc s SER 287 Ca 0.05 -0.18 -0.11 0.00 0.48 0.00 0.00 55.95 56.19 2vhc s SER 287 Cb 0.06 0.45 -0.05 0.00 0.10 0.00 0.00 66.02 66.58 2vhc s SER 287 CO -0.09 -0.76 0.28 -0.31 0.98 0.00 0.00 173.24 173.34 2vhc s TYR 288 N -3.18 3.65 0.00 5.02 2.02 -1.26 -1.03 117.35 122.57 2vhc s TYR 288 Ca -0.01 0.76 0.00 0.00 -0.37 0.00 0.00 57.07 57.45 2vhc s TYR 288 Cb 0.01 -2.14 0.00 0.00 -0.40 0.00 0.00 41.96 39.42 2vhc s TYR 288 CO -0.07 0.65 0.00 0.41 -1.57 0.00 0.00 175.55 174.97 2vhc n GLY 289 N 2.02 3.12 3.77 0.71 0.00 0.01 -4.99 105.19 109.82 2vhc n GLY 289 Ca -0.16 -1.91 -0.41 0.00 0.00 0.00 0.00 46.02 43.54 2vhc n GLY 289 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vhc s GLU 290 N 3.12 4.35 -1.37 1.61 2.12 -1.26 -3.55 118.70 123.72 2vhc s GLU 290 Ca 0.00 2.21 -0.04 0.00 0.36 0.00 0.00 54.97 57.50 2vhc s GLU 290 Cb 0.00 -3.08 0.00 0.00 0.26 0.00 0.00 34.13 31.31 2vhc s GLU 290 CO 0.00 -0.20 0.51 0.72 -0.54 0.00 0.00 175.26 175.75 2vhc n HIS 291 N 1.02 -1.69 -1.83 5.30 8.25 -1.26 -2.96 115.22 122.04 2vhc n HIS 291 Ca 0.01 0.44 -0.19 0.00 -0.26 0.00 0.00 57.72 57.72 2vhc n HIS 291 Cb 0.42 -4.05 -0.06 0.00 1.12 0.00 0.00 29.99 27.42 2vhc n HIS 291 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2vhc n SER 292 N -1.95 -5.38 -4.67 0.41 7.64 -1.23 -4.97 113.62 103.47 2vhc n SER 292 Ca -0.10 0.31 -0.43 0.00 1.01 0.00 0.00 58.87 59.65 2vhc n SER 292 Cb 0.61 -4.52 -0.02 0.00 -1.01 0.00 0.00 64.21 59.27 2vhc n SER 292 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2vhc s VAL 293 N -2.80 4.39 -0.04 0.44 1.01 -1.16 -4.84 120.40 117.41 2vhc s VAL 293 Ca 0.00 1.69 -0.08 0.00 0.00 0.00 0.00 61.98 63.58 2vhc s VAL 293 Cb 0.00 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 2vhc s VAL 293 CO 0.00 -0.09 0.25 -0.22 0.00 0.00 0.00 175.10 175.04 2vhc s LEU 294 N 2.94 4.40 -0.07 3.92 2.96 -1.26 -0.81 118.68 130.76 2vhc s LEU 294 Ca 0.53 0.61 0.05 0.00 -0.22 0.00 0.00 54.13 55.10 2vhc s LEU 294 Cb -0.21 -2.44 -0.01 0.00 0.50 0.00 0.00 46.19 44.03 2vhc s LEU 294 CO 0.16 0.32 -0.24 -0.89 -1.32 0.00 0.00 176.35 174.38 2vhc s THR 295 N -1.16 2.12 -0.14 3.68 2.01 -0.19 -4.63 115.64 117.33 2vhc s THR 295 Ca 0.22 -1.03 -0.22 0.00 0.31 0.00 0.00 61.69 60.97 2vhc s THR 295 Cb -0.13 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.56 2vhc s THR 295 CO 0.11 0.57 0.65 -0.63 -0.69 0.00 0.00 174.62 174.63 2vhc s ILE 296 N -0.05 5.04 0.28 1.82 1.01 -1.26 -1.63 121.20 126.40 2vhc s ILE 296 Ca -0.07 1.27 -0.29 0.00 0.00 0.00 0.00 60.65 61.56 2vhc s ILE 296 Cb -0.15 -3.97 -0.09 0.00 0.01 0.00 0.00 42.46 38.26 2vhc s ILE 296 CO 0.05 0.19 1.06 -1.00 0.00 0.00 0.00 174.94 175.23 2vhc s HIS 297 N 1.35 3.66 0.00 3.97 3.76 0.66 -4.98 115.29 123.70 2vhc s HIS 297 Ca 0.32 1.75 0.00 0.00 -0.15 0.00 0.00 55.06 56.98 2vhc s HIS 297 Cb -0.16 -3.20 0.00 0.00 1.11 0.00 0.00 32.58 30.33 2vhc s HIS 297 CO 0.13 -0.31 0.00 0.25 -0.85 0.00 0.00 174.74 173.96 2vhc n THR 298 N 1.18 0.00 -2.52 1.30 -2.24 -1.26 -4.65 114.28 106.08 2vhc n THR 298 Ca -0.01 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.37 2vhc n THR 298 Cb 0.46 -0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 2vhc n THR 298 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2vhc s SER 299 N 1.00 6.35 0.00 3.42 0.15 -1.26 -5.04 113.70 118.32 2vhc s SER 299 Ca 0.00 -1.20 0.00 0.00 0.70 0.00 0.00 55.95 55.45 2vhc s SER 299 Cb 0.00 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2vhc s SER 299 CO 0.00 -1.65 0.00 2.29 1.20 0.00 0.00 173.24 175.08