#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 4.78 0.02 3.17 -4.36 -1.26 -5.09 121.20 118.45 2vhc s ILE 2 Ca 0.00 0.73 0.04 0.00 -0.26 0.00 0.00 60.65 61.17 2vhc s ILE 2 Cb 0.00 -3.64 -0.02 0.00 1.25 0.00 0.00 42.46 40.06 2vhc s ILE 2 CO 0.00 -0.22 -0.13 -1.00 0.24 0.00 0.00 174.94 173.82 2vhc s HIS 3 N -2.02 1.18 -0.15 1.37 3.76 -1.26 -4.83 115.29 113.35 2vhc s HIS 3 Ca 0.52 -0.30 -0.06 0.00 -0.15 0.00 0.00 55.06 55.07 2vhc s HIS 3 Cb -0.10 -0.72 -0.04 0.00 1.11 0.00 0.00 32.58 32.82 2vhc s HIS 3 CO 0.21 0.01 0.05 -0.51 -0.85 0.00 0.00 174.74 173.66 2vhc s LEU 4 N -0.80 3.82 0.04 0.89 1.43 -1.26 -5.11 118.68 117.70 2vhc s LEU 4 Ca 0.03 0.15 0.04 0.00 -1.03 0.00 0.00 54.13 53.32 2vhc s LEU 4 Cb -0.07 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.20 2vhc s LEU 4 CO 0.01 0.27 -0.12 -0.31 0.23 0.00 0.00 176.35 176.42 2vhc s TYR 5 N -0.19 1.05 0.49 0.29 2.02 -1.26 -4.97 117.35 114.78 2vhc s TYR 5 Ca 0.07 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.41 2vhc s TYR 5 Cb -0.12 -0.62 0.02 0.00 -0.40 0.00 0.00 41.96 40.84 2vhc s TYR 5 CO 0.01 0.01 0.19 -0.40 -1.57 0.00 0.00 175.55 173.80 2vhc n ASP 6 N 1.74 2.95 -0.24 2.29 5.68 -1.26 -4.96 116.55 122.75 2vhc n ASP 6 Ca -0.19 -2.90 0.05 0.00 -0.50 0.00 0.00 54.79 51.25 2vhc n ASP 6 Cb 0.55 0.14 0.17 0.00 -1.14 0.00 0.00 41.12 40.84 2vhc n ASP 6 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2vhc h ALA 7 N 0.95 0.94 -0.05 2.12 0.00 -2.01 -0.67 119.26 120.54 2vhc h ALA 7 Ca -0.35 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2vhc h ALA 7 Cb 1.18 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 2vhc h ALA 7 CO 0.57 -0.31 -0.07 0.87 0.00 0.00 0.00 179.25 180.32 2vhc h LYS 8 N 0.30 0.14 0.00 0.00 1.57 -1.99 -1.75 116.57 114.83 2vhc h LYS 8 Ca 0.40 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 59.00 2vhc h LYS 8 Cb 0.66 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 2vhc h LYS 8 CO -0.48 0.61 -0.48 0.66 -0.57 0.00 0.00 179.45 179.20 2vhc h SER 9 N -0.33 0.00 -0.24 0.86 4.64 -1.90 -2.17 113.55 114.40 2vhc h SER 9 Ca 0.01 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 2vhc h SER 9 Cb 0.60 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 2vhc h SER 9 CO 0.02 0.48 0.05 0.15 -0.87 0.00 0.00 176.83 176.66 2vhc h PHE 10 N 0.00 0.41 -0.85 4.77 3.57 -1.11 -1.15 116.94 122.58 2vhc h PHE 10 Ca -0.00 -0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.47 2vhc h PHE 10 Cb 0.91 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.49 2vhc h PHE 10 CO 0.00 0.49 0.56 0.00 -2.23 0.00 0.00 178.31 177.13 2vhc h ALA 11 N 0.87 1.45 -0.53 2.41 0.00 -1.14 -0.38 119.26 121.94 2vhc h ALA 11 Ca 0.08 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2vhc h ALA 11 Cb 0.29 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2vhc h ALA 11 CO 0.00 0.47 0.13 0.87 0.00 0.00 0.00 179.25 180.72 2vhc h LYS 12 N 1.08 0.85 -0.10 0.00 1.57 -1.28 -0.96 116.57 117.74 2vhc h LYS 12 Ca 0.33 -0.20 0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2vhc h LYS 12 Cb -0.01 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2vhc h LYS 12 CO -0.09 0.81 -0.01 1.25 -0.57 0.00 0.00 179.45 180.84 2vhc h LEU 13 N 0.74 -0.05 -0.96 2.94 5.85 -0.62 -0.12 115.31 123.09 2vhc h LEU 13 Ca 0.17 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 2vhc h LEU 13 Cb 0.34 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 2vhc h LEU 13 CO 0.00 -0.01 0.33 0.03 -0.34 0.00 0.00 178.44 178.45 2vhc h ARG 14 N 0.03 1.08 -0.29 1.25 2.47 -0.99 0.25 114.38 118.18 2vhc h ARG 14 Ca 0.05 -0.17 0.03 0.00 -1.26 0.00 0.00 59.98 58.63 2vhc h ARG 14 Cb 0.06 -0.19 -0.03 0.00 -1.65 0.00 0.00 29.97 28.16 2vhc h ARG 14 CO -0.09 0.85 0.11 0.00 0.56 0.00 0.00 179.97 181.41 2vhc h ALA 15 N 1.29 0.34 -0.68 0.04 0.00 -0.98 -0.36 119.26 118.92 2vhc h ALA 15 Ca 0.25 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 2vhc h ALA 15 Cb 0.15 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2vhc h ALA 15 CO -0.03 -0.29 0.20 0.00 0.00 0.00 0.00 179.25 179.13 2vhc h ALA 16 N 1.17 1.07 -0.27 0.00 0.00 -0.03 -1.76 119.26 119.45 2vhc h ALA 16 Ca 0.13 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2vhc h ALA 16 Cb 0.08 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 2vhc h ALA 16 CO -0.12 0.63 -0.37 1.96 0.00 0.00 0.00 179.25 181.35 2vhc h GLN 17 N 1.00 0.72 -0.50 0.00 4.20 -0.40 -2.06 115.11 118.08 2vhc h GLN 17 Ca 0.22 -0.42 0.06 0.00 0.06 0.00 0.00 58.65 58.57 2vhc h GLN 17 Cb 0.30 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.07 2vhc h GLN 17 CO -0.01 1.04 0.20 -0.92 -0.67 0.00 0.00 178.83 178.48 2vhc h TYR 18 N 0.46 0.37 -0.86 2.96 5.03 -0.92 -2.65 116.97 121.36 2vhc h TYR 18 Ca 0.03 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.34 2vhc h TYR 18 Cb 0.96 -0.09 -0.04 0.00 1.55 0.00 0.00 36.73 39.11 2vhc h TYR 18 CO 0.08 0.14 0.43 0.00 -1.32 0.00 0.00 178.16 177.49 2vhc h ALA 19 N 1.31 1.15 -0.71 1.82 0.00 -1.22 0.83 119.26 122.44 2vhc h ALA 19 Ca 0.23 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 55.11 2vhc h ALA 19 Cb 0.21 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2vhc h ALA 19 CO -0.21 0.66 0.47 0.00 0.00 0.00 0.00 179.25 180.17 2vhc h ALA 20 N 1.26 2.03 0.00 0.00 0.00 -1.00 -1.00 119.26 120.55 2vhc h ALA 20 Ca 0.30 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 2vhc h ALA 20 Cb 0.09 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2vhc h ALA 20 CO -0.04 -0.20 -0.84 0.35 0.00 0.00 0.00 179.25 178.52 2vhc h PHE 21 N 0.46 0.00 0.00 0.00 3.57 -1.47 -1.85 116.94 117.65 2vhc h PHE 21 Ca 0.34 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.62 2vhc h PHE 21 Cb 0.68 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 2vhc h PHE 21 CO -0.00 0.94 -1.31 0.45 -2.23 0.00 0.00 178.31 176.17 2vhc h HIS 22 N -1.00 0.00 0.00 0.41 3.86 -0.58 -3.41 115.15 114.43 2vhc h HIS 22 Ca -0.19 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.02 2vhc h HIS 22 Cb 0.97 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.44 2vhc h HIS 22 CO 0.03 0.85 -0.65 0.25 0.86 0.00 0.00 177.93 179.27 2vhc n THR 23 N -3.12 0.00 -1.56 2.45 -2.24 -0.66 -5.03 114.28 104.11 2vhc n THR 23 Ca -0.08 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.33 2vhc n THR 23 Cb 0.94 0.16 0.07 0.00 -2.10 0.00 0.00 70.33 69.40 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 -1.06 1.23 -4.74 3.42 9.92 -0.47 -4.92 116.55 119.93 2vhc n ASP 24 Ca 0.00 0.76 -0.42 0.00 -0.53 0.00 0.00 54.79 54.61 2vhc n ASP 24 Cb 0.05 -1.47 -0.03 0.00 -0.64 0.00 0.00 41.12 39.04 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 -1.58 3.65 0.25 2.24 0.00 -1.26 -4.93 121.76 120.13 2vhc s ALA 25 Ca 0.78 1.31 -0.31 0.00 0.00 0.00 0.00 51.96 53.74 2vhc s ALA 25 Cb -0.37 -3.56 -0.13 0.00 0.00 0.00 0.00 23.12 19.05 2vhc s ALA 25 CO 0.45 -0.73 1.41 -2.30 0.00 0.00 0.00 175.76 174.60 2vhc n PRO 26 N 2.75 2.10 -0.99 0.00 -0.02 -1.26 -1.94 135.00 135.63 2vhc n PRO 26 Ca 0.08 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2vhc n PRO 26 Cb 0.40 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 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 2.04 0.87 0.24 -1.23 0.00 -0.80 -4.83 105.19 101.48 2vhc n GLY 27 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 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 0.93 -0.70 1.61 4.64 -1.60 -2.83 113.55 115.60 2vhc h SER 28 Ca 0.00 -0.54 -0.00 0.00 -0.47 0.00 0.00 61.79 60.77 2vhc h SER 28 Cb 0.00 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 61.79 2vhc h SER 28 CO 0.00 1.30 0.43 -0.25 -0.87 0.00 0.00 176.83 177.44 2vhc h TRP 29 N 0.59 0.92 -0.87 4.77 2.91 -1.83 -0.42 115.95 122.01 2vhc h TRP 29 Ca 0.01 0.00 0.11 0.00 1.13 0.00 0.00 58.89 60.14 2vhc h TRP 29 Cb 1.15 -0.30 -0.08 0.00 -0.51 0.00 0.00 29.16 29.42 2vhc h TRP 29 CO 0.08 0.62 0.50 0.35 -1.03 0.00 0.00 178.44 178.96 2vhc h PHE 30 N 0.95 0.91 -0.39 2.65 3.57 -1.63 -0.24 116.94 122.77 2vhc h PHE 30 Ca 0.25 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.65 2vhc h PHE 30 Cb -0.04 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.41 2vhc h PHE 30 CO -0.01 0.35 -0.30 -0.44 -2.23 0.00 0.00 178.31 175.67 2vhc h ASP 31 N 0.81 0.89 0.21 0.41 3.32 -1.10 -0.37 116.42 120.60 2vhc h ASP 31 Ca 0.43 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2vhc h ASP 31 Cb 0.44 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2vhc h ASP 31 CO -0.27 1.13 -0.10 -0.74 -1.72 0.00 0.00 179.24 177.53 2vhc h HIS 32 N 0.72 -0.27 0.00 4.55 -0.00 -0.39 -2.09 115.15 117.68 2vhc h HIS 32 Ca 0.08 -0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.38 2vhc h HIS 32 Cb 0.86 0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 28.35 2vhc h HIS 32 CO 0.05 -0.14 -0.32 1.79 -0.00 0.00 0.00 177.93 179.32 2vhc h THR 33 N -0.32 0.93 -1.00 6.26 1.35 -1.00 0.93 112.91 120.06 2vhc h THR 33 Ca -0.03 -1.22 0.01 0.00 -0.55 0.00 0.00 66.41 64.62 2vhc h THR 33 Cb 0.25 1.72 -0.05 0.00 -1.73 0.00 0.00 68.15 68.34 2vhc h THR 33 CO 0.05 0.31 0.65 0.28 -0.25 0.00 0.00 175.52 176.56 2vhc h SER 34 N 0.00 1.16 -0.49 5.36 0.02 -0.89 -1.62 113.55 117.09 2vhc h SER 34 Ca -0.00 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 60.82 2vhc h SER 34 Cb 0.70 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 2vhc h SER 34 CO 0.04 0.85 -0.01 1.23 -1.14 0.00 0.00 176.83 177.80 2vhc h GLY 35 N 1.36 0.99 1.19 -3.77 0.00 -0.14 0.01 103.07 102.71 2vhc h GLY 35 Ca 0.36 -0.70 -0.10 0.00 0.00 0.00 0.00 47.33 46.89 2vhc h GLY 35 CO -0.08 0.65 -0.07 -2.08 0.00 0.00 0.00 176.54 174.96 2vhc h VAL 36 N 0.85 1.26 -0.15 4.60 2.07 -1.11 -2.63 116.25 121.13 2vhc h VAL 36 Ca 0.16 -1.19 -0.12 0.00 0.82 0.00 0.00 66.70 66.36 2vhc h VAL 36 Cb 0.51 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2vhc h VAL 36 CO 0.03 0.42 -0.37 -0.07 0.02 0.00 0.00 177.57 177.60 2vhc h LEU 37 N 0.87 0.59 -0.83 2.57 3.38 -1.00 -2.90 115.31 118.00 2vhc h LEU 37 Ca 0.15 -0.57 0.17 0.00 0.09 0.00 0.00 57.88 57.72 2vhc h LEU 37 Cb 0.60 -0.17 -0.11 0.00 0.09 0.00 0.00 40.66 41.08 2vhc h LEU 37 CO 0.04 1.06 0.35 -0.33 0.09 0.00 0.00 178.44 179.65 2vhc h GLU 38 N 0.15 0.44 -0.10 1.13 5.08 -1.02 -2.81 114.58 117.44 2vhc h GLU 38 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2vhc h GLU 38 Cb 0.98 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2vhc h GLU 38 CO 0.08 0.29 0.00 -1.13 -1.00 0.00 0.00 179.01 177.25 2vhc n SER 39 N -5.00 1.36 -4.76 1.42 3.41 -0.99 -4.86 113.62 104.18 2vhc n SER 39 Ca 0.18 -1.59 -0.34 0.00 -0.26 0.00 0.00 58.87 56.86 2vhc n SER 39 Cb 0.51 -0.06 0.04 0.00 -0.26 0.00 0.00 64.21 64.44 2vhc n SER 39 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2vhc s VAL 40 N -1.88 3.04 0.46 -3.33 -7.23 -1.06 -4.98 120.40 105.41 2vhc s VAL 40 Ca 0.34 0.54 -0.22 0.00 -1.81 0.00 0.00 61.98 60.83 2vhc s VAL 40 Cb 0.18 -3.11 -0.08 0.00 0.56 0.00 0.00 36.38 33.93 2vhc s VAL 40 CO 0.28 -0.24 1.07 -1.83 -0.31 0.00 0.00 175.10 174.07 2vhc s GLU 41 N -3.78 3.88 0.39 4.82 -1.05 -1.26 -4.93 118.70 116.77 2vhc s GLU 41 Ca 0.70 1.51 -0.28 0.00 -0.15 0.00 0.00 54.97 56.76 2vhc s GLU 41 Cb -0.23 -2.30 -0.11 0.00 -0.44 0.00 0.00 34.13 31.05 2vhc s GLU 41 CO 0.37 -0.39 1.49 -0.51 0.95 0.00 0.00 175.26 177.18 2vhc s ASP 42 N -1.70 6.25 0.00 0.83 1.11 -1.26 -1.80 116.67 120.10 2vhc s ASP 42 Ca 0.64 3.06 0.00 0.00 0.18 0.00 0.00 52.55 56.43 2vhc s ASP 42 Cb -0.21 -2.67 0.00 0.00 1.07 0.00 0.00 42.92 41.11 2vhc s ASP 42 CO 0.26 -0.94 0.00 0.61 1.18 0.00 0.00 175.17 176.28 2vhc n GLY 43 N 0.45 2.14 3.66 0.21 0.00 -1.26 -5.01 105.19 105.39 2vhc n GLY 43 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2vhc n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vhc s THR 44 N -2.76 3.00 0.25 2.61 2.01 -0.74 -4.96 115.64 115.05 2vhc s THR 44 Ca 0.00 0.04 -0.31 0.00 0.31 0.00 0.00 61.69 61.73 2vhc s THR 44 Cb 0.00 -3.03 -0.12 0.00 0.01 0.00 0.00 72.50 69.36 2vhc s THR 44 CO 0.00 -0.00 1.65 -2.65 -0.69 0.00 0.00 174.62 172.92 2vhc n PRO 45 N 7.42 2.70 -0.02 4.92 -0.02 -1.26 -4.31 135.00 144.43 2vhc n PRO 45 Ca 0.20 0.97 -0.00 0.00 -2.02 0.00 0.00 63.50 62.64 2vhc n PRO 45 Cb 0.41 -2.77 -0.04 0.00 -0.02 0.00 0.00 33.50 31.08 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 2.98 0.21 -3.73 -1.45 0.24 -0.12 -4.39 118.33 112.06 2vhc n VAL 46 Ca 0.12 -0.18 -0.12 0.00 -2.04 0.00 0.00 64.34 62.12 2vhc n VAL 46 Cb 0.35 -0.36 -0.12 0.00 -1.47 0.00 0.00 33.84 32.24 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 -3.97 0.40 -0.03 1.34 2.96 -1.12 0.79 118.68 119.06 2vhc s LEU 47 Ca -0.02 0.68 0.06 0.00 -0.22 0.00 0.00 54.13 54.62 2vhc s LEU 47 Cb 0.02 1.06 -0.01 0.00 0.50 0.00 0.00 46.19 47.76 2vhc s LEU 47 CO 0.22 -0.15 -0.20 0.00 -1.32 0.00 0.00 176.35 174.89 2vhc s ALA 48 N 0.88 1.72 -0.03 5.97 0.00 -0.17 -0.84 121.76 129.30 2vhc s ALA 48 Ca -0.06 -0.86 -0.03 0.00 0.00 0.00 0.00 51.96 51.01 2vhc s ALA 48 Cb -0.07 -0.48 0.01 0.00 0.00 0.00 0.00 23.12 22.58 2vhc s ALA 48 CO -0.06 0.38 0.08 -1.50 0.00 0.00 0.00 175.76 174.66 2vhc s ILE 49 N -0.31 0.01 0.11 0.00 2.07 -0.66 -0.87 121.20 121.55 2vhc s ILE 49 Ca 0.04 -0.12 -0.31 0.00 -1.41 0.00 0.00 60.65 58.85 2vhc s ILE 49 Cb -0.10 -0.16 -0.07 0.00 0.13 0.00 0.00 42.46 42.26 2vhc s ILE 49 CO 0.01 -0.07 1.25 -0.83 -1.91 0.00 0.00 174.94 173.39 2vhc s GLY 50 N -0.18 2.38 0.71 1.50 0.00 -1.26 -1.31 107.32 109.16 2vhc s GLY 50 Ca -0.02 0.95 -0.05 0.00 0.00 0.00 0.00 44.72 45.60 2vhc s GLY 50 CO 0.00 2.06 1.00 -1.34 0.00 0.00 0.00 173.10 174.83 2vhc s VAL 51 N 0.74 2.28 0.24 1.40 -7.23 0.38 -4.83 120.40 113.37 2vhc s VAL 51 Ca 0.58 -0.40 -0.05 0.00 -1.81 0.00 0.00 61.98 60.30 2vhc s VAL 51 Cb -0.32 -2.88 0.23 0.00 0.56 0.00 0.00 36.38 33.97 2vhc s VAL 51 CO 0.32 0.00 1.69 -0.08 -0.31 0.00 0.00 175.10 176.72 2vhc h GLU 52 N -0.58 0.29 0.00 4.82 4.81 -1.90 0.92 114.58 122.94 2vhc h GLU 52 Ca -0.42 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 2vhc h GLU 52 Cb 1.29 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2vhc h GLU 52 CO 0.50 0.19 0.00 0.66 -0.73 0.00 0.00 179.01 179.64 2vhc h SER 53 N 0.30 0.00 0.00 1.04 4.64 -1.95 -2.22 113.55 115.36 2vhc h SER 53 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 2vhc h SER 53 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2vhc h SER 53 CO -0.49 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.08 2vhc n GLY 54 N -0.86 0.61 3.77 -0.77 0.00 0.31 -4.78 105.19 103.48 2vhc n GLY 54 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.74 3.49 0.02 1.61 1.01 -1.26 -4.79 116.67 114.01 2vhc s ASP 55 Ca 0.00 1.08 0.08 0.00 0.71 0.00 0.00 52.55 54.42 2vhc s ASP 55 Cb 0.00 -1.70 -0.03 0.00 1.01 0.00 0.00 42.92 42.20 2vhc s ASP 55 CO 0.00 -2.58 -0.24 0.00 0.21 0.00 0.00 175.17 172.56 2vhc s ALA 56 N -3.19 2.30 0.14 5.23 0.00 -1.26 -0.47 121.76 124.51 2vhc s ALA 56 Ca 0.64 -1.20 0.05 0.00 0.00 0.00 0.00 51.96 51.45 2vhc s ALA 56 Cb -0.16 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 2vhc s ALA 56 CO 0.54 0.54 0.07 0.96 0.00 0.00 0.00 175.76 177.87 2vhc s ILE 57 N -0.77 4.22 -0.01 0.00 -4.36 -0.42 -1.60 121.20 118.26 2vhc s ILE 57 Ca 0.12 -1.10 0.06 0.00 -0.26 0.00 0.00 60.65 59.47 2vhc s ILE 57 Cb -0.10 -3.10 -0.01 0.00 1.25 0.00 0.00 42.46 40.50 2vhc s ILE 57 CO 0.02 -0.03 -0.18 -0.69 0.24 0.00 0.00 174.94 174.30 2vhc s VAL 58 N -1.60 1.44 0.13 8.37 1.01 -1.26 -1.66 120.40 126.83 2vhc s VAL 58 Ca 0.29 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.55 2vhc s VAL 58 Cb -0.11 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2vhc s VAL 58 CO 0.21 0.39 -0.18 -0.36 0.00 0.00 0.00 175.10 175.16 2vhc s PHE 59 N -0.44 1.70 0.62 5.22 0.40 -0.02 -1.10 117.98 124.36 2vhc s PHE 59 Ca 0.07 -0.47 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 2vhc s PHE 59 Cb -0.07 -0.88 0.12 0.00 0.51 0.00 0.00 43.02 42.70 2vhc s PHE 59 CO -0.01 0.25 0.85 -0.40 0.70 0.00 0.00 175.22 176.61 2vhc n ASP 60 N 0.60 1.30 0.33 1.36 5.68 -0.37 -0.94 116.55 124.51 2vhc n ASP 60 Ca -0.16 -2.06 0.22 0.00 -0.50 0.00 0.00 54.79 52.29 2vhc n ASP 60 Cb 0.56 -0.54 1.16 0.00 -1.14 0.00 0.00 41.12 41.16 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 -0.65 0.11 2.10 -1.89 -1.58 116.57 114.67 2vhc h LYS 61 Ca -0.28 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.24 2vhc h LYS 61 Cb 1.08 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.33 2vhc h LYS 61 CO 0.32 0.00 0.15 0.09 -2.00 0.00 0.00 179.45 178.01 2vhc n ASN 62 N -3.15 5.04 -3.29 7.07 4.13 -1.26 -4.92 115.26 118.88 2vhc n ASN 62 Ca -0.03 -3.13 -0.24 0.00 1.68 0.00 0.00 54.58 52.86 2vhc n ASN 62 Cb 0.09 -0.71 0.03 0.00 -1.54 0.00 0.00 39.78 37.65 2vhc n ASN 62 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2vhc n ALA 63 N 0.05 -1.08 -2.69 5.41 0.00 -0.59 -4.98 120.51 116.63 2vhc n ALA 63 Ca 0.35 0.24 -0.34 0.00 0.00 0.00 0.00 53.44 53.69 2vhc n ALA 63 Cb 1.29 -3.88 -0.10 0.00 0.00 0.00 0.00 19.45 16.75 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 -5.97 3.03 0.53 0.00 -1.52 -1.26 -4.88 119.66 109.59 2vhc s GLN 64 Ca 0.41 -0.46 -0.22 0.00 -1.95 0.00 0.00 55.36 53.13 2vhc s GLN 64 Cb -0.19 -2.76 -0.05 0.00 -0.22 0.00 0.00 33.01 29.78 2vhc s GLN 64 CO 0.50 0.62 1.38 0.54 -0.25 0.00 0.00 175.29 178.08 2vhc n ARG 65 N 2.39 1.80 -4.21 2.91 5.12 -1.26 -1.24 116.66 122.17 2vhc n ARG 65 Ca -0.18 0.66 -0.34 0.00 -1.93 0.00 0.00 57.85 56.05 2vhc n ARG 65 Cb 0.53 -2.59 -0.13 0.00 -1.16 0.00 0.00 32.46 29.11 2vhc n ARG 65 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2vhc s ILE 66 N -1.27 3.51 -0.06 0.55 1.01 -0.25 -4.82 121.20 119.87 2vhc s ILE 66 Ca 0.70 -0.47 0.17 0.00 0.00 0.00 0.00 60.65 61.05 2vhc s ILE 66 Cb -0.42 -2.56 -0.26 0.00 0.01 0.00 0.00 42.46 39.22 2vhc s ILE 66 CO 0.51 0.46 0.31 1.33 0.00 0.00 0.00 174.94 177.54 2vhc n VAL 67 N 4.20 0.31 -3.75 2.92 0.24 -1.26 -4.51 118.33 116.48 2vhc n VAL 67 Ca -0.18 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.34 61.49 2vhc n VAL 67 Cb 0.52 -0.09 -0.14 0.00 -1.47 0.00 0.00 33.84 32.66 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 -3.03 -0.35 -0.21 2.33 0.00 -1.26 0.13 121.76 119.36 2vhc s ALA 68 Ca -0.07 0.74 -0.06 0.00 0.00 0.00 0.00 51.96 52.57 2vhc s ALA 68 Cb 0.10 -0.48 0.10 0.00 0.00 0.00 0.00 23.12 22.84 2vhc s ALA 68 CO 0.74 -0.16 0.43 -0.47 0.00 0.00 0.00 175.76 176.30 2vhc s TYR 69 N 1.09 -0.86 0.28 0.00 6.14 0.49 -4.90 117.35 119.59 2vhc s TYR 69 Ca -0.08 1.50 -0.29 0.00 0.64 0.00 0.00 57.07 58.84 2vhc s TYR 69 Cb -0.10 0.31 -0.10 0.00 0.42 0.00 0.00 41.96 42.49 2vhc s TYR 69 CO -0.06 -0.53 1.33 0.15 0.64 0.00 0.00 175.55 177.08 2vhc s LYS 70 N 2.63 4.35 -0.35 4.97 1.02 -1.26 -1.84 119.74 129.25 2vhc s LYS 70 Ca 0.00 2.19 -0.42 0.00 0.02 0.00 0.00 55.97 57.76 2vhc s LYS 70 Cb -0.13 -3.11 -0.17 0.00 -0.52 0.00 0.00 37.83 33.91 2vhc s LYS 70 CO -0.14 -0.24 1.72 -1.91 -0.92 0.00 0.00 175.35 173.86 2vhc n GLU 71 N 1.55 0.78 -4.73 1.68 2.13 -1.26 -4.79 120.64 116.00 2vhc n GLU 71 Ca 0.03 0.29 -0.28 0.00 0.66 0.00 0.00 57.16 57.86 2vhc n GLU 71 Cb 0.42 -1.92 -0.17 0.00 0.27 0.00 0.00 31.44 30.04 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 3.50 2.21 0.01 5.31 2.20 -0.80 -4.99 119.74 127.19 2vhc s LYS 72 Ca 1.01 -0.58 0.02 0.00 -0.36 0.00 0.00 55.97 56.06 2vhc s LYS 72 Cb -1.21 -1.78 -0.04 0.00 -1.51 0.00 0.00 37.83 33.30 2vhc s LYS 72 CO 0.71 0.05 -0.00 -1.12 -0.36 0.00 0.00 175.35 174.62 2vhc s SER 73 N 0.66 5.08 -0.01 1.43 0.01 -1.26 -1.40 113.70 118.20 2vhc s SER 73 Ca -0.14 -0.04 0.02 0.00 1.31 0.00 0.00 55.95 57.10 2vhc s SER 73 Cb -0.16 -1.30 -0.00 0.00 0.21 0.00 0.00 66.02 64.77 2vhc s SER 73 CO 0.04 0.26 -0.08 -0.69 0.41 0.00 0.00 173.24 173.18 2vhc s VAL 74 N -1.12 0.67 -0.31 3.43 1.01 0.11 -4.97 120.40 119.22 2vhc s VAL 74 Ca 0.20 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.74 2vhc s VAL 74 Cb -0.12 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 2vhc s VAL 74 CO 0.11 0.20 0.19 -0.75 0.00 0.00 0.00 175.10 174.85 2vhc s LYS 75 N -0.01 3.55 1.05 2.72 2.20 -1.26 0.59 119.74 128.58 2vhc s LYS 75 Ca 0.00 -0.59 -0.16 0.00 -0.36 0.00 0.00 55.97 54.87 2vhc s LYS 75 Cb -0.05 -3.65 0.22 0.00 -1.51 0.00 0.00 37.83 32.83 2vhc s LYS 75 CO -0.00 -0.36 1.15 0.00 -0.36 0.00 0.00 175.35 175.78 2vhc s ALA 76 N 1.68 1.26 0.19 3.13 0.00 0.20 -4.97 121.76 123.26 2vhc s ALA 76 Ca 0.06 -0.79 -0.09 0.00 0.00 0.00 0.00 51.96 51.13 2vhc s ALA 76 Cb -0.17 -2.94 0.11 0.00 0.00 0.00 0.00 23.12 20.12 2vhc s ALA 76 CO 0.09 -2.92 1.72 1.49 0.00 0.00 0.00 175.76 176.14 2vhc h GLU 77 N -2.02 1.10 -0.25 0.00 4.22 -1.98 -3.07 114.58 112.57 2vhc h GLU 77 Ca -0.48 -0.25 0.00 0.00 0.08 0.00 0.00 59.36 58.71 2vhc h GLU 77 Cb 1.30 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2vhc h GLU 77 CO 0.46 0.95 0.00 -0.40 -2.18 0.00 0.00 179.01 177.85 2vhc n ASP 78 N -4.28 0.25 0.00 1.04 5.75 -1.26 -4.80 116.55 113.24 2vhc n ASP 78 Ca 0.05 -1.88 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 2vhc n ASP 78 Cb 0.24 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 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 0.33 2.15 3.76 6.12 0.00 -1.16 -5.00 105.19 111.40 2vhc n GLY 79 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.43 5.97 -0.13 1.61 1.04 -1.26 -4.75 113.70 113.75 2vhc s SER 80 Ca 0.00 2.57 -0.01 0.00 0.48 0.00 0.00 55.95 58.99 2vhc s SER 80 Cb 0.00 -2.63 -0.02 0.00 0.10 0.00 0.00 66.02 63.47 2vhc s SER 80 CO 0.00 -1.07 -0.10 -0.69 0.98 0.00 0.00 173.24 172.36 2vhc s VAL 81 N -1.37 3.35 -0.14 5.02 1.01 -1.26 0.61 120.40 127.62 2vhc s VAL 81 Ca 0.63 -0.56 -0.04 0.00 0.00 0.00 0.00 61.98 62.01 2vhc s VAL 81 Cb -0.35 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 2vhc s VAL 81 CO 0.44 0.53 0.01 -0.55 0.00 0.00 0.00 175.10 175.52 2vhc s SER 82 N 0.17 5.19 -0.06 3.32 0.15 0.20 -4.94 113.70 117.73 2vhc s SER 82 Ca -0.05 0.02 0.05 0.00 0.70 0.00 0.00 55.95 56.67 2vhc s SER 82 Cb -0.15 -1.75 -0.01 0.00 -1.71 0.00 0.00 66.02 62.41 2vhc s SER 82 CO 0.04 0.23 -0.22 -0.69 1.20 0.00 0.00 173.24 173.80 2vhc s VAL 83 N -0.02 1.84 -0.10 4.45 1.01 -1.26 0.10 120.40 126.42 2vhc s VAL 83 Ca 0.03 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2vhc s VAL 83 Cb -0.13 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.71 2vhc s VAL 83 CO 0.02 0.51 -0.10 -0.69 0.00 0.00 0.00 175.10 174.84 2vhc s VAL 84 N -0.02 1.15 -0.01 2.92 1.01 -0.49 -3.09 120.40 121.87 2vhc s VAL 84 Ca -0.06 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2vhc s VAL 84 Cb -0.14 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 35.14 2vhc s VAL 84 CO 0.04 0.38 -0.01 -1.58 0.00 0.00 0.00 175.10 173.92 2vhc s GLN 85 N 1.25 0.18 -0.07 2.72 0.74 0.32 -1.90 119.66 122.91 2vhc s GLN 85 Ca -0.03 -0.03 0.04 0.00 0.05 0.00 0.00 55.36 55.39 2vhc s GLN 85 Cb -0.14 -0.23 0.00 0.00 1.10 0.00 0.00 33.01 33.74 2vhc s GLN 85 CO -0.04 -0.00 -0.18 0.08 -0.55 0.00 0.00 175.29 174.60 2vhc s VAL 86 N 0.23 1.52 -0.03 1.34 1.01 -0.77 -0.00 120.40 123.69 2vhc s VAL 86 Ca -0.02 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 2vhc s VAL 86 Cb -0.04 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 35.04 2vhc s VAL 86 CO -0.01 0.44 0.07 -0.70 0.00 0.00 0.00 175.10 174.90 2vhc s GLU 87 N 0.32 0.04 -1.57 2.72 2.12 -0.15 -0.38 118.70 121.80 2vhc s GLU 87 Ca -0.11 0.20 -0.14 0.00 0.36 0.00 0.00 54.97 55.29 2vhc s GLU 87 Cb -0.15 -0.13 0.10 0.00 0.26 0.00 0.00 34.13 34.21 2vhc s GLU 87 CO 0.04 -0.11 0.87 0.09 -0.54 0.00 0.00 175.26 175.61 2vhc n ASN 88 N 3.79 -3.81 0.00 -1.70 3.02 -1.03 -1.55 115.26 113.99 2vhc n ASN 88 Ca -0.22 -0.87 0.00 0.00 -0.03 0.00 0.00 54.58 53.46 2vhc n ASN 88 Cb 0.54 -3.48 0.00 0.00 -0.61 0.00 0.00 39.78 36.23 2vhc n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vhc n GLY 89 N -1.61 1.82 3.23 7.41 0.00 0.12 -5.01 105.19 111.15 2vhc n GLY 89 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.51 1.94 0.10 1.61 0.40 -0.59 -4.56 117.98 113.38 2vhc s PHE 90 Ca 0.00 -0.40 -0.34 0.00 -0.60 0.00 0.00 56.93 55.59 2vhc s PHE 90 Cb 0.00 -1.26 -0.13 0.00 0.51 0.00 0.00 43.02 42.14 2vhc s PHE 90 CO 0.00 -0.06 1.66 -0.12 0.70 0.00 0.00 175.22 177.40 2vhc n MET 91 N 2.64 2.20 -0.07 0.44 0.00 -0.62 -0.97 117.12 120.73 2vhc n MET 91 Ca -0.16 0.80 -0.09 0.00 -0.00 0.00 0.00 57.70 58.25 2vhc n MET 91 Cb 0.53 -2.59 -0.08 0.00 0.00 0.00 0.00 33.22 31.07 2vhc n MET 91 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2vhc n LYS 92 N 4.25 1.03 -4.34 2.12 3.00 1.00 -4.72 118.16 120.51 2vhc n LYS 92 Ca 0.18 0.05 -0.20 0.00 -0.00 0.00 0.00 58.31 58.34 2vhc n LYS 92 Cb 0.29 -1.32 -0.16 0.00 0.00 0.00 0.00 35.03 33.85 2vhc n LYS 92 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2vhc s GLN 93 N -2.31 0.99 0.00 1.64 -0.21 -0.67 -4.93 119.66 114.17 2vhc s GLN 93 Ca -0.15 -0.25 0.00 0.00 0.02 0.00 0.00 55.36 54.98 2vhc s GLN 93 Cb 0.05 -0.92 0.00 0.00 1.00 0.00 0.00 33.01 33.14 2vhc s GLN 93 CO 0.42 0.04 0.00 0.41 -2.12 0.00 0.00 175.29 174.05 2vhc n GLY 94 N 3.56 0.05 3.19 3.09 0.00 -1.18 -0.52 105.19 113.39 2vhc n GLY 94 Ca -0.21 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 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 -3.67 0.56 0.52 1.61 -3.43 -1.26 -5.03 115.29 104.58 2vhc s HIS 95 Ca 0.00 -0.98 -0.20 0.00 -0.80 0.00 0.00 55.06 53.09 2vhc s HIS 95 Cb 0.00 -0.29 -0.07 0.00 -1.43 0.00 0.00 32.58 30.79 2vhc s HIS 95 CO 0.00 -0.54 1.09 1.03 -2.00 0.00 0.00 174.74 174.31 2vhc s ARG 96 N -3.97 3.56 0.00 -0.38 0.52 -1.26 -4.60 118.95 112.82 2vhc s ARG 96 Ca 0.16 1.49 0.00 0.00 -0.52 0.00 0.00 55.73 56.86 2vhc s ARG 96 Cb 0.06 -2.05 0.00 0.00 0.52 0.00 0.00 34.95 33.48 2vhc s ARG 96 CO -0.03 -0.66 0.00 0.41 0.02 0.00 0.00 175.30 175.04 2vhc n GLY 97 N -0.04 -1.12 3.72 -3.53 0.00 -0.05 -4.93 105.19 99.24 2vhc n GLY 97 Ca 0.11 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 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 3.37 -1.63 1.61 0.52 -1.26 -1.00 118.94 120.55 2vhc s TRP 98 Ca 0.00 1.23 0.23 0.00 0.02 0.00 0.00 56.10 57.58 2vhc s TRP 98 Cb 0.00 -3.51 0.09 0.00 -1.15 0.00 0.00 33.47 28.90 2vhc s TRP 98 CO 0.00 -1.62 1.14 1.28 0.02 0.00 0.00 176.95 177.77 2vhc n LEU 99 N 3.49 1.47 -4.42 2.99 4.77 0.24 -4.84 117.00 120.69 2vhc n LEU 99 Ca 0.08 -0.55 -0.26 0.00 -0.03 0.00 0.00 56.01 55.25 2vhc n LEU 99 Cb 0.44 -0.04 -0.12 0.00 -2.33 0.00 0.00 43.42 41.38 2vhc n LEU 99 CO 0.57 0.29 -0.52 0.68 -1.33 0.00 0.00 177.39 177.08 2vhc s VAL 100 N -2.67 2.33 -0.55 4.08 -7.23 -1.24 -4.87 120.40 110.26 2vhc s VAL 100 Ca 0.16 -2.07 -0.27 0.00 -1.81 0.00 0.00 61.98 57.99 2vhc s VAL 100 Cb 0.18 -2.13 0.03 0.00 0.56 0.00 0.00 36.38 35.02 2vhc s VAL 100 CO 0.66 -0.16 1.10 -0.62 -0.31 0.00 0.00 175.10 175.77 2vhc s ASP 101 N -2.76 6.45 0.13 4.85 2.15 -1.26 -4.89 116.67 121.34 2vhc s ASP 101 Ca 0.21 0.04 0.25 0.00 0.43 0.00 0.00 52.55 53.49 2vhc s ASP 101 Cb -0.07 -2.52 0.58 0.00 -0.30 0.00 0.00 42.92 40.61 2vhc s ASP 101 CO 0.10 -1.36 1.52 0.18 -0.17 0.00 0.00 175.17 175.45 2vhc n LEU 102 N 8.02 0.66 0.00 -1.34 4.77 -1.26 -4.66 117.00 123.19 2vhc n LEU 102 Ca 0.07 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 2vhc n LEU 102 Cb 0.49 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2vhc n LEU 102 CO 0.69 -0.07 -0.45 0.35 -1.33 0.00 0.00 177.39 176.58 2vhc n THR 103 N -2.05 0.00 -2.80 -5.08 -2.24 -1.26 -4.90 114.28 95.95 2vhc n THR 103 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2vhc n THR 103 Cb 0.42 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 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 3.19 1.44 0.25 3.38 0.00 -1.26 -2.01 105.19 110.18 2vhc n GLY 104 Ca 0.00 -0.63 0.13 0.00 0.00 0.00 0.00 46.02 45.53 2vhc n GLY 104 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2vhc h GLU 105 N 0.00 0.00 -5.73 1.61 5.08 -2.01 -3.41 114.58 110.11 2vhc h GLU 105 Ca 0.00 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.71 2vhc h GLU 105 Cb 0.00 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.13 2vhc h GLU 105 CO 0.00 0.11 1.50 -1.17 -1.00 0.00 0.00 179.01 178.45 2vhc s LEU 106 N -6.49 4.00 0.27 1.33 2.96 -0.85 -4.95 118.68 114.95 2vhc s LEU 106 Ca 0.01 -1.90 0.05 0.00 -0.22 0.00 0.00 54.13 52.07 2vhc s LEU 106 Cb 0.09 -2.52 -0.06 0.00 0.50 0.00 0.00 46.19 44.20 2vhc s LEU 106 CO 0.60 -1.29 -0.02 0.68 -1.32 0.00 0.00 176.35 175.00 2vhc s VAL 107 N 4.10 1.32 -0.20 1.68 -7.23 -1.26 -4.77 120.40 114.03 2vhc s VAL 107 Ca 0.45 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 2vhc s VAL 107 Cb -0.00 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2vhc s VAL 107 CO -0.05 -0.26 0.00 0.61 -0.31 0.00 0.00 175.10 175.09 2vhc n GLY 108 N -0.53 0.41 3.98 2.32 0.00 -1.26 -4.94 105.19 105.16 2vhc n GLY 108 Ca -0.05 -0.89 -0.20 0.00 0.00 0.00 0.00 46.02 44.88 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 -1.48 2.94 -4.65 0.00 7.64 -1.26 -4.87 113.62 111.94 2vhc n SER 110 Ca -0.06 -3.26 -0.46 0.00 1.01 0.00 0.00 58.87 56.10 2vhc n SER 110 Cb 0.57 -0.67 -0.03 0.00 -1.01 0.00 0.00 64.21 63.07 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 1.14 1.86 -1.87 1.43 -0.02 -1.26 -4.31 135.00 131.97 2vhc n PRO 111 Ca 0.27 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.99 2vhc n PRO 111 Cb 0.42 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 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 0.04 2.87 -0.08 -1.45 0.11 -0.69 -0.57 120.40 120.62 2vhc s VAL 112 Ca 0.71 0.37 0.14 0.00 -2.93 0.00 0.00 61.98 60.27 2vhc s VAL 112 Cb -0.70 -3.24 -0.22 0.00 -1.53 0.00 0.00 36.38 30.70 2vhc s VAL 112 CO 0.49 0.00 0.60 0.55 -3.33 0.00 0.00 175.10 173.41 2vhc n VAL 113 N 4.68 1.47 -3.64 2.04 3.14 -0.13 -1.90 118.33 123.99 2vhc n VAL 113 Ca 0.16 -0.78 -0.00 0.00 -2.96 0.00 0.00 64.34 60.76 2vhc n VAL 113 Cb 0.40 -0.87 -0.01 0.00 -1.06 0.00 0.00 33.84 32.29 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 -2.66 -2.10 -0.02 1.55 0.00 -1.23 -3.16 121.76 114.14 2vhc s ALA 114 Ca -0.05 0.73 0.01 0.00 0.00 0.00 0.00 51.96 52.65 2vhc s ALA 114 Cb 0.08 0.34 0.02 0.00 0.00 0.00 0.00 23.12 23.56 2vhc s ALA 114 CO 0.82 -0.98 -0.01 -2.00 0.00 0.00 0.00 175.76 173.59 2vhc s GLU 115 N -2.59 0.30 -0.27 0.00 2.12 -1.26 -1.43 118.70 115.56 2vhc s GLU 115 Ca 0.13 0.00 -0.21 0.00 0.36 0.00 0.00 54.97 55.26 2vhc s GLU 115 Cb 0.03 -0.40 0.07 0.00 0.26 0.00 0.00 34.13 34.09 2vhc s GLU 115 CO -0.03 -0.06 0.71 0.12 -0.54 0.00 0.00 175.26 175.45 2vhc s PHE 116 N 0.62 -0.92 -1.65 5.30 5.36 -0.32 -4.95 117.98 121.42 2vhc s PHE 116 Ca -0.06 2.03 -0.02 0.00 -0.96 0.00 0.00 56.93 57.91 2vhc s PHE 116 Cb -0.09 0.45 0.00 0.00 -0.34 0.00 0.00 43.02 43.04 2vhc s PHE 116 CO -0.01 -0.45 0.31 0.41 -1.46 0.00 0.00 175.22 174.02 2vhc n GLY 117 N 3.47 -0.51 2.14 13.12 0.00 -1.26 -1.64 105.19 120.50 2vhc n GLY 117 Ca -0.17 0.07 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.26 0.45 3.18 -0.02 0.00 -1.26 -4.96 105.19 101.32 2vhc n GLY 118 Ca -0.17 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.89 1.49 0.16 1.61 3.76 -0.65 -5.14 115.29 114.63 2vhc s HIS 119 Ca 0.00 -0.33 -0.20 0.00 -0.15 0.00 0.00 55.06 54.38 2vhc s HIS 119 Cb 0.00 -0.91 -0.08 0.00 1.11 0.00 0.00 32.58 32.71 2vhc s HIS 119 CO 0.00 0.03 0.66 1.03 -0.85 0.00 0.00 174.74 175.62 2vhc s ARG 120 N -0.90 4.25 -0.01 1.40 0.52 -1.26 -1.18 118.95 121.77 2vhc s ARG 120 Ca 0.05 0.83 0.08 0.00 -0.52 0.00 0.00 55.73 56.16 2vhc s ARG 120 Cb -0.08 -3.06 -0.02 0.00 0.52 0.00 0.00 34.95 32.31 2vhc s ARG 120 CO 0.01 0.51 -0.24 0.71 0.02 0.00 0.00 175.30 176.31 2vhc s TYR 121 N -1.33 2.39 0.37 -0.53 2.02 -0.51 -5.00 117.35 114.76 2vhc s TYR 121 Ca 0.37 -0.39 -0.15 0.00 -0.37 0.00 0.00 57.07 56.53 2vhc s TYR 121 Cb -0.18 -1.50 -0.09 0.00 -0.40 0.00 0.00 41.96 39.79 2vhc s TYR 121 CO 0.21 0.03 0.80 0.00 -1.57 0.00 0.00 175.55 175.02 2vhc s ALA 122 N -0.67 3.26 1.00 3.71 0.00 -1.26 -0.96 121.76 126.84 2vhc s ALA 122 Ca 0.11 0.08 -0.14 0.00 0.00 0.00 0.00 51.96 52.00 2vhc s ALA 122 Cb -0.10 -2.85 0.19 0.00 0.00 0.00 0.00 23.12 20.36 2vhc s ALA 122 CO -0.00 0.20 1.15 -1.54 0.00 0.00 0.00 175.76 175.57 2vhc s SER 123 N -2.46 2.72 0.00 0.00 1.04 0.26 -4.57 113.70 110.70 2vhc s SER 123 Ca 0.55 0.81 0.00 0.00 0.48 0.00 0.00 55.95 57.80 2vhc s SER 123 Cb -0.10 -1.25 0.00 0.00 0.10 0.00 0.00 66.02 64.77 2vhc s SER 123 CO 0.20 -3.03 0.00 0.61 0.98 0.00 0.00 173.24 172.00 2vhc n GLY 124 N -1.99 -0.47 3.67 7.32 0.00 -0.33 -4.70 105.19 108.69 2vhc n GLY 124 Ca 0.09 -2.08 -0.35 0.00 0.00 0.00 0.00 46.02 43.68 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 3.96 -0.22 1.61 -2.45 -1.26 -1.06 119.30 119.88 2vhc s MET 125 Ca 0.00 -0.31 -0.04 0.00 -1.25 0.00 0.00 55.69 54.09 2vhc s MET 125 Cb 0.00 -3.24 -0.01 0.00 1.25 0.00 0.00 34.83 32.83 2vhc s MET 125 CO 0.00 0.32 -0.03 0.08 1.05 0.00 0.00 175.02 176.44 2vhc s VAL 126 N 0.25 3.53 -0.20 10.11 1.01 0.73 -0.83 120.40 135.00 2vhc s VAL 126 Ca 0.05 -0.44 -0.10 0.00 0.00 0.00 0.00 61.98 61.49 2vhc s VAL 126 Cb -0.12 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.60 2vhc s VAL 126 CO -0.00 0.41 0.13 -0.63 0.00 0.00 0.00 175.10 175.01 2vhc s ILE 127 N 1.47 5.33 -0.20 2.22 1.01 -0.84 -0.47 121.20 129.72 2vhc s ILE 127 Ca 0.06 0.16 -0.07 0.00 0.00 0.00 0.00 60.65 60.80 2vhc s ILE 127 Cb -0.14 -3.44 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 2vhc s ILE 127 CO -0.02 0.43 0.06 -0.69 0.00 0.00 0.00 174.94 174.71 2vhc s VAL 128 N 0.48 4.58 0.10 2.92 1.01 -0.09 -1.25 120.40 128.15 2vhc s VAL 128 Ca 0.07 -0.10 -0.08 0.00 0.00 0.00 0.00 61.98 61.87 2vhc s VAL 128 Cb -0.12 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 2vhc s VAL 128 CO -0.01 0.43 0.20 0.28 0.00 0.00 0.00 175.10 176.00 2vhc s THR 129 N 0.72 0.13 0.00 3.92 -1.32 -0.60 -2.00 115.64 116.49 2vhc s THR 129 Ca 0.03 -1.27 0.00 0.00 -1.21 0.00 0.00 61.69 59.24 2vhc s THR 129 Cb -0.13 -1.48 0.00 0.00 -1.51 0.00 0.00 72.50 69.38 2vhc s THR 129 CO 0.02 -0.58 0.00 0.61 -2.21 0.00 0.00 174.62 172.46 2vhc n GLY 130 N -0.09 0.92 3.35 6.08 0.00 -1.26 -2.70 105.19 111.49 2vhc n GLY 130 Ca -0.13 -1.18 -0.61 0.00 0.00 0.00 0.00 46.02 44.10 2vhc n GLY 130 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2vhc n LYS 131 N -0.97 0.00 0.00 1.61 2.85 -1.26 -4.65 118.16 115.74 2vhc n LYS 131 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2vhc n LYS 131 Cb 0.00 -1.35 0.00 0.00 -0.65 0.00 0.00 35.03 33.03 2vhc n LYS 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2vhc n GLY 132 N 3.73 2.93 3.31 2.58 0.00 -1.26 -2.46 105.19 114.03 2vhc n GLY 132 Ca 0.29 0.11 -0.44 0.00 0.00 0.00 0.00 46.02 45.97 2vhc n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vhc s ASN 133 N -4.00 7.08 0.00 1.61 4.22 -1.26 -4.94 114.94 117.65 2vhc s ASN 133 Ca 0.00 -3.45 0.24 0.00 -2.14 0.00 0.00 52.86 47.51 2vhc s ASN 133 Cb 0.00 -2.18 1.17 0.00 1.28 0.00 0.00 41.25 41.52 2vhc s ASN 133 CO 0.00 -0.32 1.78 -1.54 -2.04 0.00 0.00 177.10 174.98 2vhc n SER 134 N 2.88 0.79 -0.03 3.54 3.41 -1.03 -4.85 113.62 118.34 2vhc n SER 134 Ca 0.22 -1.43 0.00 0.00 -0.26 0.00 0.00 58.87 57.40 2vhc n SER 134 Cb 0.40 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 2vhc n SER 134 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vhc n GLY 135 N 1.01 1.28 0.11 5.00 0.00 -1.26 -4.99 105.19 106.33 2vhc n GLY 135 Ca 0.18 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 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 0.24 -0.00 1.61 1.57 -1.97 -2.89 116.57 115.13 2vhc h LYS 136 Ca 0.00 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2vhc h LYS 136 Cb 0.42 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 2vhc h LYS 136 CO 0.00 0.42 -0.11 1.15 -0.57 0.00 0.00 179.45 180.34 2vhc h THR 137 N 0.02 0.71 -0.89 -0.16 2.02 -1.99 -0.40 112.91 112.22 2vhc h THR 137 Ca 0.04 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.32 2vhc h THR 137 Cb 0.30 0.71 -0.06 0.00 -1.74 0.00 0.00 68.15 67.36 2vhc h THR 137 CO 0.00 0.00 0.58 -0.65 0.37 0.00 0.00 175.52 175.82 2vhc h PRO 138 N -0.19 0.86 -0.18 6.66 0.11 -1.89 -2.69 132.00 134.67 2vhc h PRO 138 Ca 0.04 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 65.94 2vhc h PRO 138 Cb 0.25 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.17 2vhc h PRO 138 CO -0.12 0.57 -0.51 1.25 -0.21 0.00 0.00 178.00 178.99 2vhc h LEU 139 N 0.89 0.76 -1.19 2.35 5.85 -1.20 -2.25 115.31 120.52 2vhc h LEU 139 Ca 0.41 -0.58 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 2vhc h LEU 139 Cb 0.40 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 2vhc h LEU 139 CO -0.18 1.21 0.31 -0.37 -0.34 0.00 0.00 178.44 179.08 2vhc h VAL 140 N 0.36 1.20 -0.56 1.05 -1.51 -0.95 -0.87 116.25 114.97 2vhc h VAL 140 Ca -0.01 -0.54 -0.10 0.00 -1.23 0.00 0.00 66.70 64.81 2vhc h VAL 140 Cb 1.13 0.38 -0.02 0.00 -2.13 0.00 0.00 31.29 30.65 2vhc h VAL 140 CO 0.11 0.23 -0.06 0.45 -1.23 0.00 0.00 177.57 177.07 2vhc h HIS 141 N 0.88 1.12 -0.17 5.19 3.86 -1.49 -0.13 115.15 124.40 2vhc h HIS 141 Ca 0.22 -0.21 -0.15 0.00 -1.16 0.00 0.00 60.37 59.07 2vhc h HIS 141 Cb 0.07 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.25 2vhc h HIS 141 CO 0.01 1.01 -0.52 0.00 0.86 0.00 0.00 177.93 179.29 2vhc h ALA 142 N 1.01 0.78 -0.04 2.45 0.00 -1.02 -1.88 119.26 120.56 2vhc h ALA 142 Ca 0.15 -0.50 -0.19 0.00 0.00 0.00 0.00 54.91 54.38 2vhc h ALA 142 Cb 0.61 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2vhc h ALA 142 CO 0.04 0.68 -0.79 1.25 0.00 0.00 0.00 179.25 180.43 2vhc h LEU 143 N 0.37 0.38 0.20 0.00 5.85 -1.07 -0.78 115.31 120.27 2vhc h LEU 143 Ca 0.01 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 2vhc h LEU 143 Cb 1.04 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.96 2vhc h LEU 143 CO 0.09 1.03 -0.09 1.23 -0.34 0.00 0.00 178.44 180.36 2vhc h GLY 144 N 1.49 -0.28 0.34 3.75 0.00 -0.84 -1.08 103.07 106.46 2vhc h GLY 144 Ca -0.04 0.10 0.07 0.00 0.00 0.00 0.00 47.33 47.46 2vhc h GLY 144 CO 0.13 -0.10 -0.05 -2.09 0.00 0.00 0.00 176.54 174.43 2vhc h GLU 145 N -0.43 0.04 -0.20 4.80 4.57 -1.34 0.50 114.58 122.52 2vhc h GLU 145 Ca -0.03 -0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 2vhc h GLU 145 Cb 0.33 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 2vhc h GLU 145 CO 0.04 0.03 0.07 0.00 -1.18 0.00 0.00 179.01 177.97 2vhc h ALA 146 N 1.34 0.27 -0.02 2.92 0.00 -1.07 -2.15 119.26 120.55 2vhc h ALA 146 Ca 0.18 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 2vhc h ALA 146 Cb 0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2vhc h ALA 146 CO -0.34 -0.11 -0.72 -0.07 0.00 0.00 0.00 179.25 178.01 2vhc h LEU 147 N 0.16 0.18 -0.64 0.00 3.38 -1.15 -3.07 115.31 114.17 2vhc h LEU 147 Ca 0.07 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 57.98 2vhc h LEU 147 Cb 0.23 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 2vhc h LEU 147 CO -0.00 0.83 0.33 1.23 0.09 0.00 0.00 178.44 180.92 2vhc h GLY 148 N 1.79 0.93 0.00 0.83 0.00 -0.74 -3.45 103.07 102.43 2vhc h GLY 148 Ca -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2vhc h GLY 148 CO 0.10 0.11 0.00 0.61 0.00 0.00 0.00 176.54 177.36 2vhc n GLY 149 N -1.28 1.42 0.25 4.60 0.00 -0.82 -1.11 105.19 108.25 2vhc n GLY 149 Ca 0.08 0.17 0.14 0.00 0.00 0.00 0.00 46.02 46.41 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 -6.06 1.61 1.57 -1.90 -3.45 116.57 108.34 2vhc h LYS 150 Ca 0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.15 2vhc h LYS 150 Cb 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.24 2vhc h LYS 150 CO 0.00 0.06 -0.56 -0.51 -0.57 0.00 0.00 179.45 177.87 2vhc s ASP 151 N -5.94 5.88 0.56 0.86 1.01 -0.27 -5.10 116.67 113.69 2vhc s ASP 151 Ca 0.02 0.12 -0.19 0.00 0.71 0.00 0.00 52.55 53.21 2vhc s ASP 151 Cb 0.08 -1.69 -0.05 0.00 1.01 0.00 0.00 42.92 42.27 2vhc s ASP 151 CO 0.60 0.18 1.18 -0.54 0.21 0.00 0.00 175.17 176.79 2vhc s LYS 152 N -2.40 3.19 0.13 8.23 1.02 -1.26 -4.54 119.74 124.12 2vhc s LYS 152 Ca 0.31 1.75 -0.01 0.00 0.02 0.00 0.00 55.97 58.04 2vhc s LYS 152 Cb -0.13 -2.00 -0.04 0.00 -0.52 0.00 0.00 37.83 35.14 2vhc s LYS 152 CO 0.24 -1.01 0.31 1.52 -0.92 0.00 0.00 175.35 175.49 2vhc s TYR 153 N -1.65 3.49 -0.11 3.18 1.13 -1.26 -4.78 117.35 117.35 2vhc s TYR 153 Ca 0.74 0.30 -0.14 0.00 -1.41 0.00 0.00 57.07 56.57 2vhc s TYR 153 Cb -0.28 -1.81 -0.05 0.00 -1.10 0.00 0.00 41.96 38.72 2vhc s TYR 153 CO 0.31 0.48 0.34 0.00 -2.51 0.00 0.00 175.55 174.17 2vhc s ALA 154 N -1.69 3.62 -0.22 9.51 0.00 -0.05 -4.99 121.76 127.95 2vhc s ALA 154 Ca 0.37 -0.36 -0.04 0.00 0.00 0.00 0.00 51.96 51.93 2vhc s ALA 154 Cb -0.12 -2.40 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 2vhc s ALA 154 CO 0.28 0.22 -0.04 0.99 0.00 0.00 0.00 175.76 177.21 2vhc s THR 155 N -0.04 3.42 -0.29 0.00 2.01 -1.26 0.13 115.64 119.61 2vhc s THR 155 Ca 0.20 -0.48 -0.09 0.00 0.31 0.00 0.00 61.69 61.63 2vhc s THR 155 Cb -0.14 -2.56 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 2vhc s THR 155 CO 0.07 0.42 0.14 -0.69 -0.69 0.00 0.00 174.62 173.88 2vhc s VAL 156 N 1.43 4.70 -0.08 3.82 1.01 0.60 -4.98 120.40 126.90 2vhc s VAL 156 Ca 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.81 2vhc s VAL 156 Cb -0.14 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 2vhc s VAL 156 CO -0.03 0.18 -0.03 -0.13 0.00 0.00 0.00 175.10 175.09 2vhc s ARG 157 N 1.65 2.95 -0.24 2.72 0.52 -1.26 -1.30 118.95 123.99 2vhc s ARG 157 Ca 0.06 -0.48 -0.15 0.00 -0.52 0.00 0.00 55.73 54.64 2vhc s ARG 157 Cb -0.16 -2.71 0.07 0.00 0.52 0.00 0.00 34.95 32.67 2vhc s ARG 157 CO 0.07 0.64 0.60 0.12 0.02 0.00 0.00 175.30 176.74 2vhc s PHE 158 N -0.72 -0.89 -1.05 -0.53 5.36 0.19 -4.12 117.98 116.23 2vhc s PHE 158 Ca 0.11 1.83 -0.07 0.00 -0.96 0.00 0.00 56.93 57.85 2vhc s PHE 158 Cb -0.11 0.48 0.01 0.00 -0.34 0.00 0.00 43.02 43.06 2vhc s PHE 158 CO 0.02 -0.45 0.92 0.41 -1.46 0.00 0.00 175.22 174.66 2vhc n GLY 159 N 4.13 -0.22 3.30 13.12 0.00 -0.16 -1.56 105.19 123.80 2vhc n GLY 159 Ca -0.20 0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 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 -5.97 1.18 -1.41 1.61 0.41 -1.26 -4.65 118.70 108.62 2vhc s GLU 160 Ca 0.43 -1.16 -0.09 0.00 -0.41 0.00 0.00 54.97 53.73 2vhc s GLU 160 Cb -0.19 -1.46 -0.10 0.00 -1.78 0.00 0.00 34.13 30.60 2vhc s GLU 160 CO 0.57 0.34 2.89 -0.35 -0.49 0.00 0.00 175.26 178.22 2vhc n PRO 161 N 1.14 3.35 -4.24 0.39 -0.04 -1.26 -4.76 135.00 129.58 2vhc n PRO 161 Ca -0.19 -2.00 -0.14 0.00 -0.04 0.00 0.00 63.50 61.13 2vhc n PRO 161 Cb 0.53 -2.69 -0.10 0.00 -0.04 0.00 0.00 33.50 31.20 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 0.15 2.52 0.39 1.53 1.43 -1.26 -5.12 118.68 118.32 2vhc s LEU 162 Ca 0.65 -1.00 -0.27 0.00 -1.03 0.00 0.00 54.13 52.48 2vhc s LEU 162 Cb 0.18 -0.33 -0.11 0.00 0.03 0.00 0.00 46.19 45.96 2vhc s LEU 162 CO -0.05 -0.33 1.42 -1.54 0.23 0.00 0.00 176.35 176.07 2vhc n SER 163 N -0.13 3.39 0.00 2.29 3.41 -1.26 -2.94 113.62 118.38 2vhc n SER 163 Ca -0.11 1.20 0.00 0.00 -0.26 0.00 0.00 58.87 59.70 2vhc n SER 163 Cb 0.60 -1.58 0.00 0.00 -0.26 0.00 0.00 64.21 62.98 2vhc n SER 163 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vhc n GLY 164 N 0.57 0.76 3.64 5.00 0.00 -1.26 -4.98 105.19 108.92 2vhc n GLY 164 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.25 3.22 0.42 1.61 2.02 -1.15 -5.02 117.35 115.19 2vhc s TYR 165 Ca 0.00 1.13 -0.26 0.00 -0.37 0.00 0.00 57.07 57.56 2vhc s TYR 165 Cb 0.00 -3.41 -0.10 0.00 -0.40 0.00 0.00 41.96 38.06 2vhc s TYR 165 CO 0.00 -0.62 1.39 -1.71 -1.57 0.00 0.00 175.55 173.04 2vhc n ASN 166 N 6.48 3.15 0.00 2.29 5.15 -1.26 -4.75 115.26 126.33 2vhc n ASN 166 Ca 0.09 1.14 0.00 0.00 -0.60 0.00 0.00 54.58 55.21 2vhc n ASN 166 Cb 0.47 -1.57 0.00 0.00 -0.53 0.00 0.00 39.78 38.15 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 -0.05 0.40 -3.20 -0.44 -2.24 -1.26 -0.98 114.28 106.51 2vhc n THR 167 Ca 0.05 -0.61 -0.40 0.00 -2.27 0.00 0.00 64.05 60.81 2vhc n THR 167 Cb 0.40 0.89 -0.07 0.00 -2.10 0.00 0.00 70.33 69.44 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 -0.40 6.45 0.39 3.42 -1.08 -1.26 -4.87 116.67 119.32 2vhc s ASP 168 Ca 0.00 0.49 0.11 0.00 -0.52 0.00 0.00 52.55 52.63 2vhc s ASP 168 Cb 0.00 -2.30 0.91 0.00 -1.46 0.00 0.00 42.92 40.08 2vhc s ASP 168 CO 0.00 -0.34 1.92 0.15 0.52 0.00 0.00 175.17 177.42 2vhc h PHE 169 N 8.07 0.63 0.00 -5.34 3.57 -1.99 -1.84 116.94 120.04 2vhc h PHE 169 Ca -0.28 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.10 2vhc h PHE 169 Cb 1.13 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 2vhc h PHE 169 CO 0.75 0.27 -0.65 -0.91 -2.23 0.00 0.00 178.31 175.55 2vhc h ASN 170 N 0.57 0.00 -0.33 0.41 2.35 -1.96 -1.75 115.58 114.87 2vhc h ASN 170 Ca 0.36 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.94 2vhc h ASN 170 Cb 0.63 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.99 2vhc h ASN 170 CO -0.13 0.65 -0.47 0.58 -1.65 0.00 0.00 177.43 176.41 2vhc h VAL 171 N 0.00 1.27 -0.39 2.81 2.07 -1.83 -2.98 116.25 117.20 2vhc h VAL 171 Ca -0.01 -1.65 0.08 0.00 0.82 0.00 0.00 66.70 65.95 2vhc h VAL 171 Cb 1.17 1.52 -0.08 0.00 -1.52 0.00 0.00 31.29 32.39 2vhc h VAL 171 CO 0.08 0.54 -0.13 0.15 0.02 0.00 0.00 177.57 178.24 2vhc h PHE 172 N 0.70 -0.30 -0.03 1.57 3.57 -0.91 0.07 116.94 121.61 2vhc h PHE 172 Ca 0.04 0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.44 2vhc h PHE 172 Cb 1.07 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 2vhc h PHE 172 CO 0.07 -0.21 -0.58 -0.39 -2.23 0.00 0.00 178.31 174.97 2vhc h VAL 173 N -0.04 1.40 -0.38 1.41 -1.51 -1.38 -0.95 116.25 114.79 2vhc h VAL 173 Ca 0.19 -1.97 -0.01 0.00 -1.23 0.00 0.00 66.70 63.68 2vhc h VAL 173 Cb 0.34 2.03 -0.02 0.00 -2.13 0.00 0.00 31.29 31.51 2vhc h VAL 173 CO -0.43 0.57 0.22 -0.78 -1.23 0.00 0.00 177.57 175.92 2vhc h ASP 174 N 0.07 0.47 -0.61 4.19 1.82 -1.32 -1.07 116.42 119.96 2vhc h ASP 174 Ca -0.00 -0.07 0.06 0.00 -0.39 0.00 0.00 57.03 56.62 2vhc h ASP 174 Cb 1.05 -0.12 -0.05 0.00 0.68 0.00 0.00 39.33 40.89 2vhc h ASP 174 CO 0.08 0.41 0.32 0.44 -1.61 0.00 0.00 179.24 178.87 2vhc h ASP 175 N 0.49 0.45 -0.43 2.28 3.32 -0.61 -2.52 116.42 119.41 2vhc h ASP 175 Ca 0.13 0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 2vhc h ASP 175 Cb 0.03 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2vhc h ASP 175 CO -0.02 0.29 -0.05 0.40 -1.72 0.00 0.00 179.24 178.14 2vhc h ILE 176 N 0.59 1.27 -0.23 0.35 2.04 -1.00 -0.98 117.51 119.55 2vhc h ILE 176 Ca 0.28 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 2vhc h ILE 176 Cb 0.20 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2vhc h ILE 176 CO -0.19 0.38 0.12 0.00 0.00 0.00 0.00 178.15 178.46 2vhc h ALA 177 N 0.88 0.30 -0.63 1.87 0.00 -1.15 -0.89 119.26 119.63 2vhc h ALA 177 Ca 0.12 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2vhc h ALA 177 Cb 0.56 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2vhc h ALA 177 CO 0.03 -0.16 0.16 -0.09 0.00 0.00 0.00 179.25 179.20 2vhc h ARG 178 N 0.26 1.01 -0.38 0.00 2.43 -1.40 -0.52 114.38 115.78 2vhc h ARG 178 Ca 0.08 -0.24 0.03 0.00 -0.81 0.00 0.00 59.98 59.04 2vhc h ARG 178 Cb 0.09 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 2vhc h ARG 178 CO -0.01 0.91 0.19 0.00 -1.51 0.00 0.00 179.97 179.54 2vhc h ALA 179 N 1.06 0.46 -0.05 2.80 0.00 -0.91 -1.26 119.26 121.35 2vhc h ALA 179 Ca 0.20 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 2vhc h ALA 179 Cb 0.35 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2vhc h ALA 179 CO 0.00 -0.18 -0.67 0.52 0.00 0.00 0.00 179.25 178.92 2vhc h MET 180 N 0.38 0.23 -0.39 0.00 2.86 -1.02 -0.66 114.93 116.32 2vhc h MET 180 Ca 0.16 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 2vhc h MET 180 Cb 0.07 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 2vhc h MET 180 CO -0.11 0.81 0.06 -0.07 1.06 0.00 0.00 176.91 178.66 2vhc h LEU 181 N 0.16 0.55 -0.72 1.22 3.38 -0.85 -3.37 115.31 115.68 2vhc h LEU 181 Ca -0.01 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2vhc h LEU 181 Cb 1.20 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2vhc h LEU 181 CO 0.10 0.58 -0.04 0.00 0.09 0.00 0.00 178.44 179.17 2vhc n GLN 182 N -4.30 1.73 -3.79 1.13 6.02 -0.50 -5.01 117.38 112.65 2vhc n GLN 182 Ca 0.02 -0.43 -0.13 0.00 -0.01 0.00 0.00 57.00 56.45 2vhc n GLN 182 Cb 0.22 -0.90 -0.10 0.00 1.02 0.00 0.00 30.24 30.48 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 -0.57 -0.18 0.09 1.08 3.76 -0.27 -5.05 115.29 114.15 2vhc s HIS 183 Ca 0.02 0.38 0.08 0.00 -0.15 0.00 0.00 55.06 55.39 2vhc s HIS 183 Cb 0.02 0.07 -0.18 0.00 1.11 0.00 0.00 32.58 33.60 2vhc s HIS 183 CO 0.06 -0.26 1.29 -0.09 -0.85 0.00 0.00 174.74 174.88 2vhc h ARG 184 N 4.75 0.00 -4.18 1.40 2.43 -1.90 -3.42 114.38 113.47 2vhc h ARG 184 Ca -0.28 0.00 -0.51 0.00 -0.81 0.00 0.00 59.98 58.38 2vhc h ARG 184 Cb 1.19 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 30.37 2vhc h ARG 184 CO 0.37 0.94 -0.80 0.08 -1.51 0.00 0.00 179.97 179.05 2vhc s VAL 185 N -2.74 0.92 -0.03 0.20 1.01 -1.26 0.08 120.40 118.58 2vhc s VAL 185 Ca 0.01 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 61.77 2vhc s VAL 185 Cb 0.10 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.54 2vhc s VAL 185 CO 0.81 0.34 -0.08 -0.63 0.00 0.00 0.00 175.10 175.55 2vhc s ILE 186 N 1.58 0.70 -0.11 2.22 1.01 -0.25 -0.87 121.20 125.48 2vhc s ILE 186 Ca 0.02 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.37 2vhc s ILE 186 Cb -0.13 -0.63 -0.02 0.00 0.01 0.00 0.00 42.46 41.69 2vhc s ILE 186 CO -0.06 0.23 -0.13 -0.69 0.00 0.00 0.00 174.94 174.29 2vhc s VAL 187 N 0.26 3.11 -0.20 2.92 1.01 0.12 -0.01 120.40 127.62 2vhc s VAL 187 Ca -0.04 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 2vhc s VAL 187 Cb -0.09 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 34.02 2vhc s VAL 187 CO 0.00 0.54 -0.13 -0.63 0.00 0.00 0.00 175.10 174.89 2vhc s ILE 188 N 0.01 2.66 -0.28 2.22 1.01 0.78 -0.29 121.20 127.30 2vhc s ILE 188 Ca -0.04 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 59.86 2vhc s ILE 188 Cb -0.14 -2.16 0.09 0.00 0.01 0.00 0.00 42.46 40.25 2vhc s ILE 188 CO 0.04 0.49 0.08 -0.62 0.00 0.00 0.00 174.94 174.93 2vhc s ASP 189 N 1.34 3.74 0.29 3.58 2.15 -0.42 -1.29 116.67 126.06 2vhc s ASP 189 Ca 0.05 -1.41 0.02 0.00 0.43 0.00 0.00 52.55 51.64 2vhc s ASP 189 Cb -0.14 -0.79 -0.03 0.00 -0.30 0.00 0.00 42.92 41.67 2vhc s ASP 189 CO -0.08 -0.38 0.28 -0.94 -0.17 0.00 0.00 175.17 173.88 2vhc s SER 190 N 1.69 1.03 0.00 -0.34 1.04 -0.60 -0.64 113.70 115.88 2vhc s SER 190 Ca 0.06 -1.57 0.20 0.00 0.48 0.00 0.00 55.95 55.12 2vhc s SER 190 Cb -0.17 0.53 0.62 0.00 0.10 0.00 0.00 66.02 67.09 2vhc s SER 190 CO -0.21 -1.05 1.47 0.18 0.98 0.00 0.00 173.24 174.61 2vhc n LEU 191 N -0.50 2.07 -0.32 2.42 4.32 0.79 -4.53 117.00 121.24 2vhc n LEU 191 Ca 0.04 -0.91 -0.03 0.00 -0.02 0.00 0.00 56.01 55.09 2vhc n LEU 191 Cb 0.63 -0.16 0.09 0.00 -1.62 0.00 0.00 43.42 42.36 2vhc n LEU 191 CO 0.31 0.45 1.24 0.07 -1.22 0.00 0.00 177.39 178.25 2vhc h LYS 192 N 2.63 1.14 0.00 3.23 2.10 -1.76 -1.93 116.57 121.99 2vhc h LYS 192 Ca 0.00 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 58.58 2vhc h LYS 192 Cb 0.58 -0.26 0.00 0.00 -0.90 0.00 0.00 32.23 31.66 2vhc h LYS 192 CO 0.00 0.75 0.00 0.09 -2.00 0.00 0.00 179.45 178.29 2vhc n ASN 193 N -4.48 0.43 -0.01 7.07 4.13 -1.26 -3.26 115.26 117.87 2vhc n ASN 193 Ca 0.10 0.54 -0.16 0.00 1.68 0.00 0.00 54.58 56.74 2vhc n ASN 193 Cb 0.02 -0.66 -0.11 0.00 -1.54 0.00 0.00 39.78 37.49 2vhc n ASN 193 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 2vhc h VAL 194 N 0.00 1.49 -1.97 2.41 2.07 -1.66 -3.50 116.25 115.09 2vhc h VAL 194 Ca 0.00 -1.99 -0.50 0.00 0.82 0.00 0.00 66.70 65.03 2vhc h VAL 194 Cb 0.61 2.66 -0.03 0.00 -1.52 0.00 0.00 31.29 33.02 2vhc h VAL 194 CO 0.00 0.56 1.39 -0.63 0.02 0.00 0.00 177.57 178.91 2vhc s ILE 195 N -3.20 3.31 -0.14 4.57 1.01 -1.01 -4.77 121.20 120.98 2vhc s ILE 195 Ca -0.15 0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.40 2vhc s ILE 195 Cb 0.02 -3.80 0.11 0.00 0.01 0.00 0.00 42.46 38.80 2vhc s ILE 195 CO 0.78 -0.77 0.90 -0.63 0.00 0.00 0.00 174.94 175.22 2vhc s ILE 207 N 9.39 0.00 1.00 2.92 1.01 -1.26 -4.96 121.20 129.30 2vhc s ILE 207 Ca 0.72 0.00 -0.12 0.00 0.00 0.00 0.00 60.65 61.24 2vhc s ILE 207 Cb -0.14 -1.00 0.19 0.00 0.01 0.00 0.00 42.46 41.52 2vhc s ILE 207 CO 0.22 0.00 1.09 -0.94 0.00 0.00 0.00 174.94 175.31 2vhc s SER 208 N -0.94 2.60 0.10 3.58 1.04 -1.26 -4.87 113.70 113.94 2vhc s SER 208 Ca -0.04 1.20 -0.16 0.00 0.48 0.00 0.00 55.95 57.43 2vhc s SER 208 Cb -0.01 -1.87 -0.07 0.00 0.10 0.00 0.00 66.02 64.18 2vhc s SER 208 CO 0.03 -3.15 1.47 -0.09 0.98 0.00 0.00 173.24 172.48 2vhc h ARG 209 N -1.91 0.63 -0.64 4.02 2.43 -1.87 -2.19 114.38 114.85 2vhc h ARG 209 Ca -0.55 -0.27 -0.03 0.00 -0.81 0.00 0.00 59.98 58.33 2vhc h ARG 209 Cb 1.33 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.83 2vhc h ARG 209 CO 0.57 0.84 0.29 0.78 -1.51 0.00 0.00 179.97 180.94 2vhc h GLY 210 N 0.38 0.98 0.79 2.80 0.00 -1.39 -1.65 103.07 104.99 2vhc h GLY 210 Ca 0.07 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 2vhc h GLY 210 CO 0.04 0.46 -0.21 0.00 0.00 0.00 0.00 176.54 176.82 2vhc h ALA 211 N 1.40 0.25 -0.79 3.60 0.00 -1.82 -0.04 119.26 121.87 2vhc h ALA 211 Ca 0.22 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2vhc h ALA 211 Cb 0.13 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 2vhc h ALA 211 CO -0.03 0.20 0.48 0.35 0.00 0.00 0.00 179.25 180.25 2vhc h PHE 212 N 0.08 0.89 -0.24 0.00 3.57 -1.36 -2.40 116.94 117.48 2vhc h PHE 212 Ca 0.02 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 2vhc h PHE 212 Cb 0.77 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 2vhc h PHE 212 CO 0.09 0.46 0.13 -0.44 -2.23 0.00 0.00 178.31 176.32 2vhc h ASP 213 N 0.89 0.30 0.01 0.41 3.32 -1.10 -2.30 116.42 117.94 2vhc h ASP 213 Ca 0.34 -0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.34 2vhc h ASP 213 Cb 0.14 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 2vhc h ASP 213 CO -0.16 0.29 -0.18 0.25 -1.72 0.00 0.00 179.24 177.72 2vhc h LEU 214 N 0.28 -0.54 -0.89 1.55 5.85 -0.83 0.22 115.31 120.95 2vhc h LEU 214 Ca 0.08 0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.98 2vhc h LEU 214 Cb 0.06 0.22 -0.08 0.00 0.37 0.00 0.00 40.66 41.24 2vhc h LEU 214 CO -0.01 -0.25 0.53 -0.07 -0.34 0.00 0.00 178.44 178.30 2vhc h LEU 215 N -0.30 0.77 -0.69 2.25 4.07 -1.44 -0.67 115.31 119.30 2vhc h LEU 215 Ca 0.05 0.05 -0.14 0.00 0.08 0.00 0.00 57.88 57.92 2vhc h LEU 215 Cb 0.37 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 2vhc h LEU 215 CO -0.17 0.43 -0.60 0.28 -1.08 0.00 0.00 178.44 177.30 2vhc h SER 216 N 0.87 0.20 0.14 -0.43 0.02 -0.87 -3.38 113.55 110.10 2vhc h SER 216 Ca 0.43 -0.12 -0.36 0.00 -0.84 0.00 0.00 61.79 60.91 2vhc h SER 216 Cb 0.40 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.83 2vhc h SER 216 CO -0.25 0.76 -2.17 0.47 -1.14 0.00 0.00 176.83 174.50 2vhc n ASP 217 N -3.86 1.26 -0.14 3.07 8.00 0.72 -4.72 116.55 120.88 2vhc n ASP 217 Ca -0.02 0.10 -0.06 0.00 0.71 0.00 0.00 54.79 55.52 2vhc n ASP 217 Cb 0.61 -0.08 0.11 0.00 -0.02 0.00 0.00 41.12 41.74 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 0.02 1.26 0.23 0.53 2.10 -1.34 -1.77 117.51 118.54 2vhc h ILE 218 Ca -0.47 -1.10 -0.01 0.00 1.08 0.00 0.00 64.86 64.36 2vhc h ILE 218 Cb 2.05 0.89 0.00 0.00 -1.09 0.00 0.00 36.82 38.67 2vhc h ILE 218 CO 0.02 0.39 -0.11 1.23 -1.08 0.00 0.00 178.15 178.60 2vhc h GLY 219 N 0.99 -0.33 1.10 8.18 0.00 -1.83 -0.60 103.07 110.58 2vhc h GLY 219 Ca 0.15 0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.58 2vhc h GLY 219 CO 0.03 -0.12 0.46 0.00 0.00 0.00 0.00 176.54 176.91 2vhc h ALA 220 N 0.46 1.23 -0.59 3.60 0.00 -1.79 0.12 119.26 122.29 2vhc h ALA 220 Ca -0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2vhc h ALA 220 Cb 0.24 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2vhc h ALA 220 CO 0.05 0.63 0.25 0.52 0.00 0.00 0.00 179.25 180.70 2vhc h MET 221 N 1.18 0.88 -0.20 0.00 2.07 -1.17 -0.96 114.93 116.73 2vhc h MET 221 Ca 0.30 -0.15 -0.09 0.00 -2.07 0.00 0.00 59.70 57.68 2vhc h MET 221 Cb 0.02 -0.15 -0.00 0.00 -1.87 0.00 0.00 31.60 29.61 2vhc h MET 221 CO -0.05 0.74 -0.24 0.00 1.07 0.00 0.00 176.91 178.43 2vhc h ALA 222 N 1.09 0.29 -0.87 6.32 0.00 -0.76 -2.62 119.26 122.71 2vhc h ALA 222 Ca 0.20 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2vhc h ALA 222 Cb 0.18 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2vhc h ALA 222 CO -0.02 0.26 0.47 0.00 0.00 0.00 0.00 179.25 179.97 2vhc h ALA 223 N 0.63 1.12 -0.47 0.00 0.00 -0.68 -0.24 119.26 119.62 2vhc h ALA 223 Ca 0.03 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2vhc h ALA 223 Cb 0.80 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2vhc h ALA 223 CO 0.06 0.64 -0.02 0.77 0.00 0.00 0.00 179.25 180.69 2vhc h SER 224 N 1.22 0.76 0.70 0.00 0.02 -1.17 -2.90 113.55 112.18 2vhc h SER 224 Ca 0.31 -0.19 -0.17 0.00 -0.84 0.00 0.00 61.79 60.90 2vhc h SER 224 Cb 0.04 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 2vhc h SER 224 CO -0.05 0.84 -0.78 -0.09 -1.14 0.00 0.00 176.83 175.61 2vhc h ARG 225 N 0.73 0.05 0.00 3.45 9.65 -1.05 -3.46 114.38 123.75 2vhc h ARG 225 Ca 0.14 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 2vhc h ARG 225 Cb 0.48 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.07 2vhc h ARG 225 CO 0.02 0.80 0.00 0.41 2.80 0.00 0.00 179.97 184.00 2vhc n GLY 226 N 0.68 0.65 3.97 2.80 0.00 -0.16 -3.73 105.19 109.41 2vhc n GLY 226 Ca -0.01 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.22 2.06 -0.29 0.00 0.11 0.11 -1.19 120.40 118.98 2vhc s VAL 228 Ca 0.42 -1.00 -0.08 0.00 -2.93 0.00 0.00 61.98 58.39 2vhc s VAL 228 Cb -0.09 -1.80 -0.01 0.00 -1.53 0.00 0.00 36.38 32.95 2vhc s VAL 228 CO 0.33 0.55 0.11 -0.69 -3.33 0.00 0.00 175.10 172.07 2vhc s VAL 229 N 0.57 4.29 -0.42 2.04 1.01 -0.22 -1.09 120.40 126.58 2vhc s VAL 229 Ca -0.13 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.26 2vhc s VAL 229 Cb -0.17 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.12 2vhc s VAL 229 CO 0.04 0.13 0.28 -0.63 0.00 0.00 0.00 175.10 174.91 2vhc s ILE 230 N 1.57 4.56 -0.18 2.22 1.01 0.99 -0.19 121.20 131.17 2vhc s ILE 230 Ca 0.04 -1.17 -0.01 0.00 0.00 0.00 0.00 60.65 59.51 2vhc s ILE 230 Cb -0.17 -3.70 -0.00 0.00 0.01 0.00 0.00 42.46 38.60 2vhc s ILE 230 CO 0.04 -0.45 -0.12 0.00 0.00 0.00 0.00 174.94 174.42 2vhc s ALA 231 N 1.51 2.61 0.14 9.38 0.00 0.38 -0.16 121.76 135.62 2vhc s ALA 231 Ca 0.03 -1.11 -0.30 0.00 0.00 0.00 0.00 51.96 50.58 2vhc s ALA 231 Cb -0.22 -1.41 -0.07 0.00 0.00 0.00 0.00 23.12 21.42 2vhc s ALA 231 CO 0.04 -0.22 1.21 0.45 0.00 0.00 0.00 175.76 177.24 2vhc s SER 232 N 1.12 7.08 0.00 0.00 0.15 -0.41 -0.91 113.70 120.72 2vhc s SER 232 Ca 0.01 2.16 0.00 0.00 0.70 0.00 0.00 55.95 58.81 2vhc s SER 232 Cb -0.14 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 2vhc s SER 232 CO -0.03 -0.42 0.00 -0.11 1.20 0.00 0.00 173.24 173.88 2vhc n LEU 233 N 3.09 0.00 0.00 3.45 7.94 -0.85 -0.15 117.00 130.49 2vhc n LEU 233 Ca 0.06 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.96 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 0.56 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.45 2vhc n GLY 234 N 5.00 2.75 3.79 -3.96 0.00 -1.26 -4.11 105.19 107.40 2vhc n GLY 234 Ca 0.00 -1.09 -0.35 0.00 0.00 0.00 0.00 46.02 44.58 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 -4.22 4.09 -0.08 1.61 0.04 -1.26 -4.59 135.00 130.58 2vhc s PRO 235 Ca 0.00 1.39 -0.21 0.00 0.04 0.00 0.00 61.00 62.22 2vhc s PRO 235 Cb 0.00 -2.37 -0.17 0.00 0.04 0.00 0.00 34.50 32.00 2vhc s PRO 235 CO 0.00 -0.18 0.77 1.79 0.04 0.00 0.00 177.00 179.42 2vhc h THR 236 N 1.98 1.10 -1.33 1.26 1.35 -1.97 -3.48 112.91 111.82 2vhc h THR 236 Ca -0.49 -1.50 -0.44 0.00 -0.55 0.00 0.00 66.41 63.44 2vhc h THR 236 Cb 1.21 1.94 0.02 0.00 -1.73 0.00 0.00 68.15 69.59 2vhc h THR 236 CO 0.61 0.32 -0.24 -0.94 -0.25 0.00 0.00 175.52 175.02 2vhc s SER 237 N -5.74 5.52 0.41 5.36 1.04 -1.26 -5.03 113.70 114.00 2vhc s SER 237 Ca -0.13 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 55.78 2vhc s SER 237 Cb -0.01 -0.49 0.00 0.00 0.10 0.00 0.00 66.02 65.63 2vhc s SER 237 CO 0.50 -0.85 0.00 0.59 0.98 0.00 0.00 173.24 174.46 2vhc n ASN 238 N -1.89 -8.82 -0.81 7.02 5.03 -1.26 -4.90 115.26 109.63 2vhc n ASN 238 Ca 0.09 1.25 0.07 0.00 0.87 0.00 0.00 54.58 56.86 2vhc n ASN 238 Cb 0.60 -4.67 0.20 0.00 -1.02 0.00 0.00 39.78 34.89 2vhc n ASN 238 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2vhc n ASP 239 N 0.00 3.32 0.00 6.41 8.00 -1.26 -4.78 116.55 128.25 2vhc n ASP 239 Ca 0.00 -2.22 0.00 0.00 0.71 0.00 0.00 54.79 53.28 2vhc n ASP 239 Cb 0.00 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 2vhc n ASP 239 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2vhc n ASP 240 N 0.46 0.00 -0.94 -2.24 2.03 -1.26 -4.77 116.55 109.84 2vhc n ASP 240 Ca 0.15 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.46 2vhc n ASP 240 Cb 0.56 0.00 0.20 0.00 -0.72 0.00 0.00 41.12 41.16 2vhc n ASP 240 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2vhc n LYS 241 N 0.00 1.80 0.17 -0.67 4.76 -1.26 -4.14 118.16 118.83 2vhc n LYS 241 Ca 0.00 -3.18 0.13 0.00 -2.87 0.00 0.00 58.31 52.39 2vhc n LYS 241 Cb 0.00 -1.75 0.28 0.00 -1.84 0.00 0.00 35.03 31.73 2vhc n LYS 241 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2vhc h ILE 242 N 1.00 0.00 0.00 -0.18 2.10 -1.89 -3.17 117.51 115.37 2vhc h ILE 242 Ca 0.14 -0.77 0.00 0.00 1.08 0.00 0.00 64.86 65.31 2vhc h ILE 242 Cb 1.43 1.76 0.00 0.00 -1.09 0.00 0.00 36.82 38.92 2vhc h ILE 242 CO 0.25 0.00 0.00 1.33 -1.08 0.00 0.00 178.15 178.65 2vhc n VAL 243 N -2.76 0.00 0.00 2.19 0.24 -1.26 -0.52 118.33 116.22 2vhc n VAL 243 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2vhc n VAL 243 Cb 0.48 -0.38 0.00 0.00 -1.47 0.00 0.00 33.84 32.47 2vhc n VAL 243 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2vhc n GLU 244 N -0.56 1.74 -0.04 7.34 4.71 -1.20 -4.57 120.64 128.07 2vhc n GLU 244 Ca 0.01 0.00 -0.14 0.00 -0.01 0.00 0.00 57.16 57.02 2vhc n GLU 244 Cb 0.00 -0.86 -0.09 0.00 -1.01 0.00 0.00 31.44 29.49 2vhc n GLU 244 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 2vhc h LEU 245 N 0.00 0.31 -0.10 -4.62 6.46 -0.88 -3.21 115.31 113.27 2vhc h LEU 245 Ca 0.00 -0.60 -0.24 0.00 -0.12 0.00 0.00 57.88 56.91 2vhc h LEU 245 Cb 0.00 -0.09 0.01 0.00 -0.73 0.00 0.00 40.66 39.85 2vhc h LEU 245 CO 0.00 0.86 -0.96 -0.37 -0.62 0.00 0.00 178.44 177.34 2vhc h VAL 246 N -0.23 1.32 -3.87 1.05 -1.51 -1.76 -3.36 116.25 107.89 2vhc h VAL 246 Ca -0.01 -2.27 -0.45 0.00 -1.23 0.00 0.00 66.70 62.75 2vhc h VAL 246 Cb 0.83 2.32 0.16 0.00 -2.13 0.00 0.00 31.29 32.47 2vhc h VAL 246 CO 0.04 0.69 0.20 -0.75 -1.23 0.00 0.00 177.57 176.53 2vhc s LYS 247 N -3.38 0.27 0.00 5.19 2.20 -1.21 -2.48 119.74 120.34 2vhc s LYS 247 Ca -0.08 0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.91 2vhc s LYS 247 Cb 0.08 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.67 2vhc s LYS 247 CO 0.90 -2.81 0.00 0.39 -0.36 0.00 0.00 175.35 173.47 2vhc n GLU 248 N -4.21 0.00 0.00 4.03 -0.58 -1.25 -3.91 120.64 114.73 2vhc n GLU 248 Ca 0.06 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.84 2vhc n GLU 248 Cb 0.58 -0.96 0.20 0.00 -0.57 0.00 0.00 31.44 30.69 2vhc n GLU 248 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2vhc n ALA 249 N 0.00 1.45 -0.09 0.62 0.00 -1.21 -2.57 120.51 118.71 2vhc n ALA 249 Ca 0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 53.44 53.23 2vhc n ALA 249 Cb 0.00 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.24 2vhc n ALA 249 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2vhc n SER 250 N -1.44 1.69 0.00 0.00 7.64 -1.03 -3.95 113.62 116.53 2vhc n SER 250 Ca 0.03 0.13 0.06 0.00 1.01 0.00 0.00 58.87 60.09 2vhc n SER 250 Cb 0.09 -0.46 0.28 0.00 -1.01 0.00 0.00 64.21 63.11 2vhc n SER 250 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2vhc n ARG 251 N -3.57 0.08 -0.08 1.43 0.63 -1.23 -1.34 116.66 112.57 2vhc n ARG 251 Ca -0.34 0.24 -0.10 0.00 -0.92 0.00 0.00 57.85 56.73 2vhc n ARG 251 Cb 0.77 -1.50 -0.09 0.00 0.45 0.00 0.00 32.46 32.09 2vhc n ARG 251 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2vhc n SER 252 N -1.41 2.24 -0.07 6.15 3.41 -1.06 -4.50 113.62 118.38 2vhc n SER 252 Ca 0.04 -0.06 0.13 0.00 -0.26 0.00 0.00 58.87 58.72 2vhc n SER 252 Cb 0.12 0.17 0.39 0.00 -0.26 0.00 0.00 64.21 64.62 2vhc n SER 252 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2vhc n ASN 253 N -2.81 0.54 -4.68 4.04 3.02 -1.18 -4.94 115.26 109.25 2vhc n ASN 253 Ca -0.27 -0.34 -0.34 0.00 -0.03 0.00 0.00 54.58 53.59 2vhc n ASN 253 Cb 0.87 0.07 -0.09 0.00 -0.61 0.00 0.00 39.78 40.02 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 -2.80 5.20 0.07 6.41 1.04 -0.45 -4.54 113.70 118.63 2vhc s SER 254 Ca 0.17 0.11 -0.15 0.00 0.48 0.00 0.00 55.95 56.56 2vhc s SER 254 Cb 0.18 -1.44 -0.19 0.00 0.10 0.00 0.00 66.02 64.68 2vhc s SER 254 CO 0.60 0.36 1.24 0.74 0.98 0.00 0.00 173.24 177.16 2vhc h THR 255 N 4.02 1.31 -3.78 2.02 2.02 -1.30 -3.46 112.91 113.74 2vhc h THR 255 Ca -0.50 -2.01 -0.33 0.00 0.77 0.00 0.00 66.41 64.33 2vhc h THR 255 Cb 1.19 2.18 -0.19 0.00 -1.74 0.00 0.00 68.15 69.60 2vhc h THR 255 CO 0.55 0.62 -0.74 -0.44 0.37 0.00 0.00 175.52 175.88 2vhc s SER 256 N -7.01 1.45 -0.04 4.18 0.01 -0.83 -1.29 113.70 110.17 2vhc s SER 256 Ca -0.11 -0.76 0.06 0.00 1.31 0.00 0.00 55.95 56.45 2vhc s SER 256 Cb 0.07 -0.00 -0.01 0.00 0.21 0.00 0.00 66.02 66.29 2vhc s SER 256 CO 0.88 -0.22 -0.23 -0.76 0.41 0.00 0.00 173.24 173.32 2vhc s LEU 257 N -2.25 2.03 -0.15 2.44 1.43 0.23 -1.99 118.68 120.42 2vhc s LEU 257 Ca 0.03 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 2vhc s LEU 257 Cb -0.05 -1.23 0.02 0.00 0.03 0.00 0.00 46.19 44.96 2vhc s LEU 257 CO 0.01 0.24 -0.19 -0.69 0.23 0.00 0.00 176.35 175.94 2vhc s VAL 258 N -0.25 1.92 -0.01 -1.59 1.01 -0.38 -0.22 120.40 120.88 2vhc s VAL 258 Ca 0.01 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.17 2vhc s VAL 258 Cb -0.12 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 2vhc s VAL 258 CO 0.02 0.52 -0.17 -0.63 0.00 0.00 0.00 175.10 174.84 2vhc s ILE 259 N 1.08 1.35 0.61 2.22 1.01 -0.42 -1.56 121.20 125.50 2vhc s ILE 259 Ca -0.01 -0.73 -0.16 0.00 0.00 0.00 0.00 60.65 59.75 2vhc s ILE 259 Cb -0.14 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.18 2vhc s ILE 259 CO -0.07 0.38 1.08 -0.94 0.00 0.00 0.00 174.94 175.39 2vhc s SER 260 N -0.40 5.54 0.31 3.58 1.04 -1.10 -0.51 113.70 122.17 2vhc s SER 260 Ca 0.06 1.90 0.02 0.00 0.48 0.00 0.00 55.95 58.41 2vhc s SER 260 Cb -0.07 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.53 2vhc s SER 260 CO -0.01 -1.33 0.17 0.35 0.98 0.00 0.00 173.24 173.41 2vhc n THR 261 N -2.14 0.00 0.72 2.02 -2.24 -1.00 -4.83 114.28 106.83 2vhc n THR 261 Ca 0.09 -1.27 0.12 0.00 -2.27 0.00 0.00 64.05 60.72 2vhc n THR 261 Cb 0.52 -0.10 0.49 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.72 0.30 -4.71 3.42 5.68 -1.26 -4.76 116.55 113.49 2vhc n ASP 262 Ca -0.04 0.54 -0.37 0.00 -0.50 0.00 0.00 54.79 54.42 2vhc n ASP 262 Cb 0.36 -0.62 -0.07 0.00 -1.14 0.00 0.00 41.12 39.65 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 -3.07 5.25 0.27 2.12 1.01 -1.26 -5.03 120.40 119.69 2vhc s VAL 263 Ca 0.10 0.68 -0.30 0.00 0.00 0.00 0.00 61.98 62.46 2vhc s VAL 263 Cb 0.14 -3.70 -0.11 0.00 0.00 0.00 0.00 36.38 32.71 2vhc s VAL 263 CO 0.48 0.34 1.57 -1.81 0.00 0.00 0.00 175.10 175.68 2vhc s ASP 264 N 0.65 6.45 0.00 3.32 1.01 -1.26 -1.45 116.67 125.39 2vhc s ASP 264 Ca 0.19 2.86 0.00 0.00 0.71 0.00 0.00 52.55 56.31 2vhc s ASP 264 Cb -0.14 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.16 2vhc s ASP 264 CO 0.06 -0.87 0.00 0.61 0.21 0.00 0.00 175.17 175.19 2vhc n GLY 265 N 2.41 0.94 3.81 0.21 0.00 -1.26 -4.88 105.19 106.42 2vhc n GLY 265 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.26 3.60 0.09 1.61 2.12 -0.53 -2.07 118.70 123.27 2vhc s GLU 266 Ca 0.00 -0.19 0.04 0.00 0.36 0.00 0.00 54.97 55.19 2vhc s GLU 266 Cb 0.00 -3.21 -0.03 0.00 0.26 0.00 0.00 34.13 31.15 2vhc s GLU 266 CO 0.00 0.64 -0.12 -1.58 -0.54 0.00 0.00 175.26 173.66 2vhc s TRP 267 N -0.62 1.13 -0.10 5.30 0.52 -0.44 -2.36 118.94 122.36 2vhc s TRP 267 Ca 0.13 -0.57 0.01 0.00 0.02 0.00 0.00 56.10 55.68 2vhc s TRP 267 Cb -0.12 -0.62 -0.02 0.00 -1.15 0.00 0.00 33.47 31.57 2vhc s TRP 267 CO 0.02 0.03 -0.13 -1.14 0.02 0.00 0.00 176.95 175.76 2vhc s GLN 268 N -2.38 3.12 -0.22 4.98 0.74 0.33 -0.68 119.66 125.54 2vhc s GLN 268 Ca 0.03 -0.67 -0.07 0.00 0.05 0.00 0.00 55.36 54.70 2vhc s GLN 268 Cb -0.06 -2.57 -0.03 0.00 1.10 0.00 0.00 33.01 31.45 2vhc s GLN 268 CO 0.01 0.35 0.05 0.08 -0.55 0.00 0.00 175.29 175.23 2vhc s VAL 269 N -0.02 4.30 -0.23 1.34 1.01 0.17 -1.30 120.40 125.67 2vhc s VAL 269 Ca -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 2vhc s VAL 269 Cb -0.14 -2.97 0.02 0.00 0.00 0.00 0.00 36.38 33.29 2vhc s VAL 269 CO 0.04 0.39 -0.09 -0.76 0.00 0.00 0.00 175.10 174.68 2vhc s LEU 270 N 1.13 2.90 -0.13 3.92 1.02 0.70 -1.28 118.68 126.94 2vhc s LEU 270 Ca 0.04 -0.75 0.02 0.00 0.02 0.00 0.00 54.13 53.46 2vhc s LEU 270 Cb -0.14 -1.63 0.00 0.00 0.02 0.00 0.00 46.19 44.44 2vhc s LEU 270 CO 0.03 -0.08 -0.19 -0.89 0.02 0.00 0.00 176.35 175.23 2vhc s THR 271 N 1.34 2.37 -0.47 5.49 2.01 0.33 -0.60 115.64 126.10 2vhc s THR 271 Ca 0.02 -0.89 -0.26 0.00 0.31 0.00 0.00 61.69 60.87 2vhc s THR 271 Cb -0.15 -1.96 0.03 0.00 0.01 0.00 0.00 72.50 70.43 2vhc s THR 271 CO -0.06 0.54 0.95 -0.13 -0.69 0.00 0.00 174.62 175.23 2vhc s ARG 272 N 0.61 3.53 0.00 4.92 0.52 -0.41 -0.86 118.95 127.26 2vhc s ARG 272 Ca -0.11 0.16 0.28 0.00 -0.52 0.00 0.00 55.73 55.54 2vhc s ARG 272 Cb -0.16 -3.94 1.04 0.00 0.52 0.00 0.00 34.95 32.41 2vhc s ARG 272 CO 0.03 -1.27 1.76 0.25 0.02 0.00 0.00 175.30 176.09 2vhc n THR 273 N 6.45 0.00 0.00 0.02 -2.24 -1.24 -4.77 114.28 112.51 2vhc n THR 273 Ca 0.06 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2vhc n THR 273 Cb 0.48 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 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 1.40 1.55 3.64 3.38 0.00 -1.26 -4.07 105.19 109.84 2vhc n GLY 274 Ca 0.10 -1.14 -0.43 0.00 0.00 0.00 0.00 46.02 44.55 2vhc n GLY 274 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2vhc n GLU 275 N -0.99 2.60 -0.96 1.61 2.13 0.24 -1.65 120.64 123.61 2vhc n GLU 275 Ca 0.00 0.91 0.00 0.00 0.66 0.00 0.00 57.16 58.73 2vhc n GLU 275 Cb 0.00 -3.05 0.00 0.00 0.27 0.00 0.00 31.44 28.66 2vhc n GLU 275 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2vhc n GLY 276 N 4.87 0.22 3.98 8.31 0.00 -1.26 -4.98 105.19 116.33 2vhc n GLY 276 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 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 3.48 0.37 0.99 1.43 -0.66 -5.05 118.68 119.24 2vhc s LEU 277 Ca 0.00 -0.04 -0.28 0.00 -1.03 0.00 0.00 54.13 52.78 2vhc s LEU 277 Cb 0.00 -2.88 -0.10 0.00 0.03 0.00 0.00 46.19 43.23 2vhc s LEU 277 CO 0.00 -0.92 1.40 -1.10 0.23 0.00 0.00 176.35 175.96 2vhc s GLN 278 N -4.59 4.16 -0.13 1.70 -0.21 -1.26 -4.73 119.66 114.61 2vhc s GLN 278 Ca 0.54 2.39 -0.22 0.00 0.02 0.00 0.00 55.36 58.09 2vhc s GLN 278 Cb -0.10 -2.97 -0.03 0.00 1.00 0.00 0.00 33.01 30.91 2vhc s GLN 278 CO 0.37 -0.42 0.64 1.03 -2.12 0.00 0.00 175.29 174.79 2vhc s ARG 279 N -2.02 4.33 0.18 2.91 0.52 -1.26 -3.63 118.95 119.98 2vhc s ARG 279 Ca 0.52 0.71 0.04 0.00 -0.52 0.00 0.00 55.73 56.48 2vhc s ARG 279 Cb -0.43 -3.50 -0.03 0.00 0.52 0.00 0.00 34.95 31.51 2vhc s ARG 279 CO 0.58 -0.05 0.28 -0.51 0.02 0.00 0.00 175.30 175.61 2vhc s LEU 280 N 1.24 4.23 -0.02 2.53 1.43 -0.04 -4.90 118.68 123.16 2vhc s LEU 280 Ca 0.32 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2vhc s LEU 280 Cb -0.16 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.26 2vhc s LEU 280 CO 0.13 0.02 -0.07 0.28 0.23 0.00 0.00 176.35 176.94 2vhc s THR 281 N -1.82 0.64 0.21 5.49 -1.32 -1.26 -0.51 115.64 117.07 2vhc s THR 281 Ca 0.34 -0.29 -0.10 0.00 -1.21 0.00 0.00 61.69 60.42 2vhc s THR 281 Cb -0.10 -0.57 -0.01 0.00 -1.51 0.00 0.00 72.50 70.31 2vhc s THR 281 CO 0.28 0.20 0.38 -1.38 -2.21 0.00 0.00 174.62 171.89 2vhc s HIS 282 N 0.17 0.44 0.05 9.09 -3.43 -0.40 -5.00 115.29 116.22 2vhc s HIS 282 Ca -0.02 -0.78 0.08 0.00 -0.80 0.00 0.00 55.06 53.54 2vhc s HIS 282 Cb -0.07 0.03 -0.03 0.00 -1.43 0.00 0.00 32.58 31.08 2vhc s HIS 282 CO 0.00 -0.86 -0.21 -0.08 -2.00 0.00 0.00 174.74 171.59 2vhc s THR 283 N -4.01 2.53 -0.05 -5.38 -1.32 -1.26 0.41 115.64 106.56 2vhc s THR 283 Ca 0.22 -1.29 0.06 0.00 -1.21 0.00 0.00 61.69 59.46 2vhc s THR 283 Cb 0.02 -2.05 -0.02 0.00 -1.51 0.00 0.00 72.50 68.94 2vhc s THR 283 CO 0.06 0.33 -0.23 -0.76 -2.21 0.00 0.00 174.62 171.81 2vhc s LEU 284 N -1.41 2.19 -0.07 9.08 1.02 0.14 -4.95 118.68 124.67 2vhc s LEU 284 Ca 0.14 -0.45 0.01 0.00 0.02 0.00 0.00 54.13 53.85 2vhc s LEU 284 Cb -0.10 -1.40 -0.03 0.00 0.02 0.00 0.00 46.19 44.68 2vhc s LEU 284 CO 0.04 0.27 -0.08 -1.10 0.02 0.00 0.00 176.35 175.51 2vhc s GLN 285 N -0.33 2.78 0.03 1.70 -1.52 -1.26 -1.32 119.66 119.74 2vhc s GLN 285 Ca 0.02 -0.57 -0.02 0.00 -1.95 0.00 0.00 55.36 52.84 2vhc s GLN 285 Cb -0.12 -2.58 -0.02 0.00 -0.22 0.00 0.00 33.01 30.06 2vhc s GLN 285 CO 0.02 0.63 -0.00 0.95 -0.25 0.00 0.00 175.29 176.63 2vhc s THR 286 N -0.71 0.15 0.02 -0.19 -4.23 -0.88 -0.24 115.64 109.57 2vhc s THR 286 Ca 0.11 -1.25 -0.11 0.00 -1.18 0.00 0.00 61.69 59.26 2vhc s THR 286 Cb -0.11 -0.81 0.01 0.00 1.34 0.00 0.00 72.50 72.93 2vhc s THR 286 CO 0.01 -0.69 0.22 -0.94 -0.54 0.00 0.00 174.62 172.69 2vhc s SER 287 N -2.08 -0.03 -0.03 3.99 1.04 -0.54 -4.67 113.70 111.37 2vhc s SER 287 Ca -0.06 -0.23 -0.18 0.00 0.48 0.00 0.00 55.95 55.96 2vhc s SER 287 Cb -0.02 0.29 -0.05 0.00 0.10 0.00 0.00 66.02 66.33 2vhc s SER 287 CO -0.05 -0.51 0.50 -0.31 0.98 0.00 0.00 173.24 173.85 2vhc s TYR 288 N -2.13 3.66 0.00 5.02 2.02 -1.26 -1.03 117.35 123.62 2vhc s TYR 288 Ca -0.08 1.05 0.00 0.00 -0.37 0.00 0.00 57.07 57.67 2vhc s TYR 288 Cb -0.03 -2.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.04 2vhc s TYR 288 CO -0.01 0.40 0.00 0.41 -1.57 0.00 0.00 175.55 174.78 2vhc n GLY 289 N 2.44 2.77 3.77 0.71 0.00 0.47 -4.97 105.19 110.38 2vhc n GLY 289 Ca -0.09 -1.92 -0.37 0.00 0.00 0.00 0.00 46.02 43.64 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 3.32 3.78 -1.50 1.61 2.12 -1.26 -3.32 118.70 123.45 2vhc s GLU 290 Ca 0.00 1.75 -0.13 0.00 0.36 0.00 0.00 54.97 56.95 2vhc s GLU 290 Cb 0.00 -2.41 0.07 0.00 0.26 0.00 0.00 34.13 32.05 2vhc s GLU 290 CO 0.00 -0.52 1.02 0.72 -0.54 0.00 0.00 175.26 175.94 2vhc n HIS 291 N -0.47 -2.41 -2.17 5.30 8.25 -1.26 -2.59 115.22 119.87 2vhc n HIS 291 Ca 0.07 0.93 -0.18 0.00 -0.26 0.00 0.00 57.72 58.28 2vhc n HIS 291 Cb 0.48 -4.20 -0.03 0.00 1.12 0.00 0.00 29.99 27.37 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 -2.88 -5.14 -4.66 0.41 7.64 -1.21 -4.94 113.62 102.84 2vhc n SER 292 Ca 0.03 0.16 -0.43 0.00 1.01 0.00 0.00 58.87 59.64 2vhc n SER 292 Cb 0.54 -4.38 -0.03 0.00 -1.01 0.00 0.00 64.21 59.33 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 4.75 0.03 0.44 1.01 -1.07 -4.85 120.40 117.90 2vhc s VAL 293 Ca 0.00 1.91 -0.18 0.00 0.00 0.00 0.00 61.98 63.71 2vhc s VAL 293 Cb 0.00 -4.26 -0.06 0.00 0.00 0.00 0.00 36.38 32.06 2vhc s VAL 293 CO 0.00 -0.11 0.50 -0.22 0.00 0.00 0.00 175.10 175.27 2vhc s LEU 294 N 2.84 4.48 -0.07 3.92 2.96 -1.26 -0.40 118.68 131.15 2vhc s LEU 294 Ca 0.42 1.11 0.04 0.00 -0.22 0.00 0.00 54.13 55.48 2vhc s LEU 294 Cb -0.16 -2.77 -0.02 0.00 0.50 0.00 0.00 46.19 43.75 2vhc s LEU 294 CO 0.09 0.26 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.30 2vhc s THR 295 N -0.90 2.61 -0.26 3.68 2.01 -0.20 -4.64 115.64 117.95 2vhc s THR 295 Ca 0.27 -0.86 -0.17 0.00 0.31 0.00 0.00 61.69 61.24 2vhc s THR 295 Cb -0.18 -2.01 -0.03 0.00 0.01 0.00 0.00 72.50 70.29 2vhc s THR 295 CO 0.16 0.57 0.47 -0.63 -0.69 0.00 0.00 174.62 174.49 2vhc s ILE 296 N -0.24 5.11 0.50 1.82 1.01 -1.26 -1.47 121.20 126.67 2vhc s ILE 296 Ca -0.00 0.78 -0.21 0.00 0.00 0.00 0.00 60.65 61.22 2vhc s ILE 296 Cb -0.13 -3.78 -0.07 0.00 0.01 0.00 0.00 42.46 38.49 2vhc s ILE 296 CO 0.03 0.12 1.14 -1.00 0.00 0.00 0.00 174.94 175.23 2vhc s HIS 297 N 2.13 2.80 0.00 3.97 3.76 0.67 -4.99 115.29 123.62 2vhc s HIS 297 Ca 0.19 1.55 0.00 0.00 -0.15 0.00 0.00 55.06 56.65 2vhc s HIS 297 Cb -0.16 -3.31 0.00 0.00 1.11 0.00 0.00 32.58 30.22 2vhc s HIS 297 CO 0.09 -1.48 0.00 2.41 -0.85 0.00 0.00 174.74 174.92 2vhc n THR 298 N -0.87 0.00 0.38 1.30 -1.04 -1.26 -4.64 114.28 108.16 2vhc n THR 298 Ca 0.09 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.13 2vhc n THR 298 Cb 0.50 -0.43 0.16 0.00 -1.82 0.00 0.00 70.33 68.74 2vhc n THR 298 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2vhc n SER 299 N -1.06 2.67 0.00 8.00 2.88 -1.26 -5.01 113.62 119.83 2vhc n SER 299 Ca 0.00 -2.31 0.00 0.00 -1.33 0.00 0.00 58.87 55.23 2vhc n SER 299 Cb 0.00 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 2vhc n SER 299 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10