#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vhc s TYR 3 N 0.00 2.73 0.73 1.43 2.02 -1.26 -5.04 117.35 117.96 1vhc s TYR 3 Ca 0.00 1.54 -0.10 0.00 -0.37 0.00 0.00 57.07 58.14 1vhc s TYR 3 Cb 0.00 -3.33 0.05 0.00 -0.40 0.00 0.00 41.96 38.28 1vhc s TYR 3 CO 0.00 -1.58 1.08 0.95 -1.57 0.00 0.00 175.55 174.44 1vhc s THR 4 N -1.68 2.71 0.22 -0.71 -4.23 -1.26 -4.88 115.64 105.82 1vhc s THR 4 Ca 0.70 0.08 -0.07 0.00 -1.18 0.00 0.00 61.69 61.22 1vhc s THR 4 Cb -0.26 -3.20 0.17 0.00 1.34 0.00 0.00 72.50 70.55 1vhc s THR 4 CO 0.30 -0.25 1.79 0.74 -0.54 0.00 0.00 174.62 176.66 1vhc h THR 5 N -0.73 0.87 -0.15 3.99 2.02 -1.97 -2.18 112.91 114.78 1vhc h THR 5 Ca -0.45 -0.22 -0.13 0.00 0.77 0.00 0.00 66.41 66.38 1vhc h THR 5 Cb 1.29 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 1vhc h THR 5 CO 0.63 0.12 -0.48 -0.61 0.37 0.00 0.00 175.52 175.55 1vhc h GLN 6 N 0.64 0.37 -0.59 6.66 5.75 -1.99 -0.98 115.11 124.97 1vhc h GLN 6 Ca 0.35 -0.21 -0.05 0.00 -0.15 0.00 0.00 58.65 58.58 1vhc h GLN 6 Cb 0.34 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.87 1vhc h GLN 6 CO -0.25 0.77 0.15 1.96 -2.65 0.00 0.00 178.83 178.81 1vhc h GLN 7 N 0.30 0.92 -0.10 1.69 4.20 -1.84 -0.12 115.11 120.16 1vhc h GLN 7 Ca 0.02 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 1vhc h GLN 7 Cb 0.95 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.59 1vhc h GLN 7 CO 0.08 0.82 0.04 0.82 -0.67 0.00 0.00 178.83 179.91 1vhc h ILE 8 N 0.88 1.15 -0.65 2.54 2.04 -0.97 -0.10 117.51 122.41 1vhc h ILE 8 Ca 0.19 -0.47 0.09 0.00 1.00 0.00 0.00 64.86 65.67 1vhc h ILE 8 Cb 0.31 1.28 -0.07 0.00 -0.74 0.00 0.00 36.82 37.60 1vhc h ILE 8 CO -0.00 0.14 0.29 0.40 0.00 0.00 0.00 178.15 178.98 1vhc h ILE 9 N -0.00 0.83 -0.38 -0.67 1.08 -0.69 0.13 117.51 117.80 1vhc h ILE 9 Ca 0.03 -0.18 -0.11 0.00 -0.39 0.00 0.00 64.86 64.21 1vhc h ILE 9 Cb 0.18 0.27 -0.01 0.00 -3.07 0.00 0.00 36.82 34.19 1vhc h ILE 9 CO -0.00 0.09 -0.23 -0.33 -0.69 0.00 0.00 178.15 176.99 1vhc h GLU 10 N 0.51 0.75 -0.67 2.37 4.39 -0.76 -0.80 114.58 120.36 1vhc h GLU 10 Ca 0.32 -0.30 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 1vhc h GLU 10 Cb 0.35 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.93 1vhc h GLU 10 CO -0.27 0.91 0.31 0.87 -1.16 0.00 0.00 179.01 179.67 1vhc h LYS 11 N 0.65 0.97 -0.40 2.33 1.57 0.02 -2.64 116.57 119.07 1vhc h LYS 11 Ca 0.09 -0.14 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1vhc h LYS 11 Cb 0.74 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1vhc h LYS 11 CO 0.06 0.76 -0.08 -0.07 -0.57 0.00 0.00 179.45 179.55 1vhc h LEU 12 N 0.96 0.66 -1.94 2.94 3.38 -0.13 -2.50 115.31 118.68 1vhc h LEU 12 Ca 0.23 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 58.08 1vhc h LEU 12 Cb 0.13 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1vhc h LEU 12 CO -0.03 0.78 0.16 -0.09 0.09 0.00 0.00 178.44 179.36 1vhc h ARG 13 N 0.63 0.08 -0.01 1.13 2.43 -0.79 0.89 114.38 118.73 1vhc h ARG 13 Ca 0.11 -0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.06 1vhc h ARG 13 Cb 0.51 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1vhc h ARG 13 CO 0.03 0.05 -0.91 0.93 -1.51 0.00 0.00 179.97 178.56 1vhc h GLU 14 N 0.08 0.41 0.02 0.20 5.08 -1.37 -3.36 114.58 115.64 1vhc h GLU 14 Ca 0.11 -0.42 -0.16 0.00 -1.00 0.00 0.00 59.36 57.89 1vhc h GLU 14 Cb 0.33 0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.71 1vhc h GLU 14 CO -0.01 1.09 -0.62 -0.07 -1.00 0.00 0.00 179.01 178.40 1vhc h LEU 15 N 0.24 0.51 0.00 1.33 3.38 -1.16 -3.47 115.31 116.14 1vhc h LEU 15 Ca -0.07 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.11 1vhc h LEU 15 Cb 1.54 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1vhc h LEU 15 CO 0.16 1.24 0.00 0.29 0.09 0.00 0.00 178.44 180.22 1vhc n LYS 16 N -4.21 0.00 -4.04 1.13 5.02 0.23 -4.88 118.16 111.40 1vhc n LYS 16 Ca -0.11 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.01 1vhc n LYS 16 Cb 0.69 -1.87 -0.16 0.00 -0.02 0.00 0.00 35.03 33.67 1vhc n LYS 16 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1vhc s ILE 17 N -0.28 0.32 -0.18 -0.18 1.10 -1.26 -1.54 121.20 119.18 1vhc s ILE 17 Ca 0.00 -0.03 0.00 0.00 -0.51 0.00 0.00 60.65 60.11 1vhc s ILE 17 Cb 0.00 -0.37 0.01 0.00 0.15 0.00 0.00 42.46 42.25 1vhc s ILE 17 CO 0.00 0.16 -0.16 -0.69 -2.11 0.00 0.00 174.94 172.14 1vhc s VAL 18 N 0.81 2.44 0.20 4.00 1.01 0.57 -4.94 120.40 124.50 1vhc s VAL 18 Ca -0.09 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 1vhc s VAL 18 Cb -0.12 -2.04 -0.09 0.00 0.00 0.00 0.00 36.38 34.12 1vhc s VAL 18 CO -0.01 0.51 1.39 -2.16 0.00 0.00 0.00 175.10 174.83 1vhc s PRO 19 N 1.18 4.32 -0.37 2.72 0.05 -1.26 -1.88 135.00 139.76 1vhc s PRO 19 Ca 0.02 2.16 -0.07 0.00 0.05 0.00 0.00 61.00 63.16 1vhc s PRO 19 Cb -0.14 -3.17 0.05 0.00 0.05 0.00 0.00 34.50 31.29 1vhc s PRO 19 CO -0.07 -0.37 0.16 0.08 0.05 0.00 0.00 177.00 176.85 1vhc s VAL 20 N 0.32 3.94 -0.23 -0.36 1.01 -0.49 -1.63 120.40 122.95 1vhc s VAL 20 Ca 0.60 -1.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.26 1vhc s VAL 20 Cb -0.39 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1vhc s VAL 20 CO 0.38 -0.31 0.06 -0.63 0.00 0.00 0.00 175.10 174.59 1vhc s ILE 21 N 1.40 4.30 -0.22 2.22 1.01 -0.19 -4.55 121.20 125.17 1vhc s ILE 21 Ca 0.01 -0.18 -0.06 0.00 0.00 0.00 0.00 60.65 60.41 1vhc s ILE 21 Cb -0.21 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.25 1vhc s ILE 21 CO 0.02 0.37 0.04 0.00 0.00 0.00 0.00 174.94 175.37 1vhc s ALA 22 N 1.33 3.12 -0.03 9.38 0.00 -1.26 -1.78 121.76 132.52 1vhc s ALA 22 Ca 0.05 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 51.06 1vhc s ALA 22 Cb -0.15 -1.91 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 1vhc s ALA 22 CO 0.03 -0.26 -0.26 -0.51 0.00 0.00 0.00 175.76 174.76 1vhc s LEU 23 N 1.20 2.05 0.06 0.00 1.43 -1.26 -4.79 118.68 117.38 1vhc s LEU 23 Ca 0.04 -0.47 0.17 0.00 -1.03 0.00 0.00 54.13 52.83 1vhc s LEU 23 Cb -0.14 -1.33 -0.14 0.00 0.03 0.00 0.00 46.19 44.60 1vhc s LEU 23 CO 0.02 0.30 0.81 0.47 0.23 0.00 0.00 176.35 178.19 1vhc n ASP 24 N 2.53 0.84 -3.86 2.29 8.00 -1.26 -4.28 116.55 120.81 1vhc n ASP 24 Ca -0.16 0.37 -0.29 0.00 0.71 0.00 0.00 54.79 55.42 1vhc n ASP 24 Cb 0.51 0.19 -0.16 0.00 -0.02 0.00 0.00 41.12 41.65 1vhc n ASP 24 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1vhc s ASN 25 N -5.76 3.43 0.38 -2.24 3.84 -1.26 -4.79 114.94 108.55 1vhc s ASN 25 Ca -0.03 -1.01 0.11 0.00 0.21 0.00 0.00 52.86 52.14 1vhc s ASN 25 Cb 0.09 -0.94 0.88 0.00 -0.55 0.00 0.00 41.25 40.73 1vhc s ASN 25 CO 0.81 -0.26 1.89 0.00 -2.79 0.00 0.00 177.10 176.75 1vhc h ALA 26 N 8.07 1.91 0.00 1.71 0.00 -1.85 -2.37 119.26 126.74 1vhc h ALA 26 Ca -0.18 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1vhc h ALA 26 Cb 1.09 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1vhc h ALA 26 CO 0.38 -0.13 -0.00 -0.44 0.00 0.00 0.00 179.25 179.06 1vhc h ASP 27 N 0.61 0.00 0.22 0.00 3.32 -1.96 -1.72 116.42 116.90 1vhc h ASP 27 Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 1vhc h ASP 27 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 1vhc h ASP 27 CO -0.17 0.00 0.00 0.44 -1.72 0.00 0.00 179.24 177.79 1vhc h ASP 28 N 0.00 0.00 0.29 6.45 3.32 -1.84 -3.13 116.42 121.51 1vhc h ASP 28 Ca -0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1vhc h ASP 28 Cb 0.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1vhc h ASP 28 CO 0.00 0.00 -0.18 -0.29 -1.72 0.00 0.00 179.24 177.05 1vhc h ILE 29 N 0.00 0.90 0.17 0.35 6.09 -1.51 -2.16 117.51 121.35 1vhc h ILE 29 Ca 0.00 -0.67 -0.01 0.00 -1.37 0.00 0.00 64.86 62.81 1vhc h ILE 29 Cb 0.11 1.39 0.00 0.00 0.47 0.00 0.00 36.82 38.79 1vhc h ILE 29 CO 0.00 0.18 -0.08 -0.07 -3.07 0.00 0.00 178.15 175.11 1vhc h LEU 30 N 0.00 -0.19 -0.95 2.19 3.38 -1.79 0.14 115.31 118.09 1vhc h LEU 30 Ca -0.00 -0.32 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 1vhc h LEU 30 Cb 0.37 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1vhc h LEU 30 CO 0.02 0.27 -0.42 1.55 0.09 0.00 0.00 178.44 179.95 1vhc h PRO 31 N -0.71 0.21 0.42 1.13 0.13 -1.78 -1.33 132.00 130.06 1vhc h PRO 31 Ca -0.02 -0.10 -0.02 0.00 -0.87 0.00 0.00 66.00 64.99 1vhc h PRO 31 Cb 0.50 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.64 1vhc h PRO 31 CO 0.04 0.60 -0.20 1.25 -0.23 0.00 0.00 178.00 179.46 1vhc h LEU 32 N 0.17 -0.47 -1.29 1.56 5.85 -1.40 -2.24 115.31 117.50 1vhc h LEU 32 Ca 0.01 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1vhc h LEU 32 Cb 0.82 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 1vhc h LEU 32 CO 0.06 -0.30 0.24 0.00 -0.34 0.00 0.00 178.44 178.11 1vhc h ALA 33 N -0.04 1.45 -0.90 1.25 0.00 -0.77 -1.48 119.26 118.77 1vhc h ALA 33 Ca -0.06 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1vhc h ALA 33 Cb 0.46 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1vhc h ALA 33 CO 0.09 0.44 0.60 -0.44 0.00 0.00 0.00 179.25 179.94 1vhc h ASP 34 N 0.73 1.03 -0.60 0.00 3.32 -1.22 -2.02 116.42 117.67 1vhc h ASP 34 Ca 0.18 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 1vhc h ASP 34 Cb 0.09 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 1vhc h ASP 34 CO -0.02 0.74 0.07 0.74 -1.72 0.00 0.00 179.24 179.05 1vhc h THR 35 N 1.21 1.26 -0.26 0.35 2.02 -0.88 -0.66 112.91 115.95 1vhc h THR 35 Ca 0.34 -1.04 -0.05 0.00 0.77 0.00 0.00 66.41 66.42 1vhc h THR 35 Cb -0.12 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1vhc h THR 35 CO -0.08 0.38 -0.05 -0.07 0.37 0.00 0.00 175.52 176.08 1vhc h LEU 36 N 0.96 0.49 -0.46 2.58 3.38 -1.20 -2.83 115.31 118.23 1vhc h LEU 36 Ca 0.19 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 1vhc h LEU 36 Cb 0.45 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1vhc h LEU 36 CO 0.02 0.73 -0.04 0.00 0.09 0.00 0.00 178.44 179.24 1vhc h ALA 37 N 0.78 0.63 -0.99 1.53 0.00 -1.34 0.16 119.26 120.03 1vhc h ALA 37 Ca 0.07 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.72 1vhc h ALA 37 Cb 0.51 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 1vhc h ALA 37 CO 0.02 0.46 0.64 0.87 0.00 0.00 0.00 179.25 181.25 1vhc h LYS 38 N 0.69 1.21 -0.78 0.00 1.57 -1.15 -1.78 116.57 116.34 1vhc h LYS 38 Ca 0.13 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1vhc h LYS 38 Cb 0.56 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1vhc h LYS 38 CO 0.03 0.80 0.00 0.09 -0.57 0.00 0.00 179.45 179.80 1vhc n ASN 39 N -4.46 3.54 0.00 0.86 3.02 -1.07 -4.97 115.26 112.19 1vhc n ASN 39 Ca 0.13 -2.50 0.00 0.00 -0.03 0.00 0.00 54.58 52.19 1vhc n ASN 39 Cb 0.10 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 38.67 1vhc n ASN 39 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vhc n GLY 40 N 0.34 0.49 2.86 7.41 0.00 -0.67 -4.76 105.19 110.86 1vhc n GLY 40 Ca 0.15 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 1vhc n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vhc s LEU 41 N 0.00 3.85 -1.22 0.99 1.43 0.52 -4.98 118.68 119.27 1vhc s LEU 41 Ca 0.00 -3.03 -0.05 0.00 -1.03 0.00 0.00 54.13 50.03 1vhc s LEU 41 Cb 0.00 -1.44 0.19 0.00 0.03 0.00 0.00 46.19 44.98 1vhc s LEU 41 CO 0.00 -0.22 2.10 -1.20 0.23 0.00 0.00 176.35 177.26 1vhc n SER 42 N 3.06 7.36 -3.71 2.29 7.64 -1.26 -3.75 113.62 125.25 1vhc n SER 42 Ca 0.09 -3.31 -0.14 0.00 1.01 0.00 0.00 58.87 56.52 1vhc n SER 42 Cb 0.34 -1.32 -0.08 0.00 -1.01 0.00 0.00 64.21 62.13 1vhc n SER 42 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1vhc s VAL 43 N -1.93 0.03 -0.24 0.44 0.11 -1.26 -2.16 120.40 115.39 1vhc s VAL 43 Ca 0.46 -0.27 -0.19 0.00 -2.93 0.00 0.00 61.98 59.06 1vhc s VAL 43 Cb 0.16 -0.68 0.07 0.00 -1.53 0.00 0.00 36.38 34.40 1vhc s VAL 43 CO -0.07 -0.15 0.62 0.00 -3.33 0.00 0.00 175.10 172.17 1vhc s ALA 44 N -0.89 -1.58 -0.37 1.54 0.00 -0.62 -4.57 121.76 115.26 1vhc s ALA 44 Ca -0.10 1.92 -0.12 0.00 0.00 0.00 0.00 51.96 53.67 1vhc s ALA 44 Cb -0.04 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 21.97 1vhc s ALA 44 CO 0.04 -0.32 0.23 -2.00 0.00 0.00 0.00 175.76 173.71 1vhc s GLU 45 N 0.81 3.00 -0.28 0.00 2.12 -0.65 -1.10 118.70 122.60 1vhc s GLU 45 Ca -0.04 -0.97 -0.15 0.00 0.36 0.00 0.00 54.97 54.17 1vhc s GLU 45 Cb -0.05 -3.78 -0.03 0.00 0.26 0.00 0.00 34.13 30.53 1vhc s GLU 45 CO -0.06 -0.65 0.36 0.42 -0.54 0.00 0.00 175.26 174.79 1vhc s ILE 46 N 1.61 5.18 0.07 -3.70 1.01 0.12 -1.02 121.20 124.46 1vhc s ILE 46 Ca 0.04 0.48 -0.30 0.00 0.00 0.00 0.00 60.65 60.86 1vhc s ILE 46 Cb -0.19 -3.70 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 1vhc s ILE 46 CO 0.08 0.13 1.04 0.28 0.00 0.00 0.00 174.94 176.46 1vhc s THR 47 N 2.05 4.47 -2.00 2.92 -1.32 -0.73 -0.83 115.64 120.19 1vhc s THR 47 Ca 0.14 1.88 0.20 0.00 -1.21 0.00 0.00 61.69 62.70 1vhc s THR 47 Cb -0.16 -4.20 0.56 0.00 -1.51 0.00 0.00 72.50 67.19 1vhc s THR 47 CO 0.10 0.21 1.58 0.49 -2.21 0.00 0.00 174.62 174.79 1vhc n PHE 48 N 3.40 0.00 0.29 9.09 3.01 0.25 -2.86 117.46 130.64 1vhc n PHE 48 Ca 0.05 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.68 1vhc n PHE 48 Cb 0.49 0.00 0.90 0.00 -0.01 0.00 0.00 39.48 40.86 1vhc n PHE 48 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1vhc h ARG 49 N 0.00 0.00 -5.68 -1.08 2.43 -1.82 -3.40 114.38 104.82 1vhc h ARG 49 Ca 0.00 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.50 1vhc h ARG 49 Cb 0.00 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.47 1vhc h ARG 49 CO 0.00 0.05 -0.50 -1.12 -1.51 0.00 0.00 179.97 176.88 1vhc s SER 50 N -5.75 6.20 0.53 -3.80 0.01 -1.14 -5.00 113.70 104.76 1vhc s SER 50 Ca -0.03 0.41 0.28 0.00 1.31 0.00 0.00 55.95 57.93 1vhc s SER 50 Cb 0.13 -1.98 1.50 0.00 0.21 0.00 0.00 66.02 65.88 1vhc s SER 50 CO 0.52 0.40 2.09 -0.08 0.41 0.00 0.00 173.24 176.57 1vhc h GLU 51 N 5.05 0.00 0.00 12.44 4.57 -1.83 -2.63 114.58 132.18 1vhc h GLU 51 Ca -0.54 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 1vhc h GLU 51 Cb 1.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 1vhc h GLU 51 CO 0.58 0.10 0.00 0.00 -1.18 0.00 0.00 179.01 178.51 1vhc n ALA 52 N -2.26 2.60 0.05 2.92 0.00 -1.26 -4.39 120.51 118.17 1vhc n ALA 52 Ca -0.02 -0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.13 1vhc n ALA 52 Cb 0.23 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.18 1vhc n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vhc h ALA 53 N 3.79 -0.44 -0.51 0.00 0.00 -1.71 -1.77 119.26 118.62 1vhc h ALA 53 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1vhc h ALA 53 Cb 0.00 0.56 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1vhc h ALA 53 CO 0.00 -0.82 0.33 0.00 0.00 0.00 0.00 179.25 178.76 1vhc h ALA 54 N 0.29 0.65 -0.69 0.00 0.00 -1.86 -1.62 119.26 116.04 1vhc h ALA 54 Ca 0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1vhc h ALA 54 Cb 0.55 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1vhc h ALA 54 CO -0.27 0.07 0.26 -0.44 0.00 0.00 0.00 179.25 178.88 1vhc h ASP 55 N 0.68 0.94 -0.49 0.00 3.32 -1.83 -2.61 116.42 116.43 1vhc h ASP 55 Ca 0.19 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 1vhc h ASP 55 Cb -0.06 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 1vhc h ASP 55 CO -0.05 0.84 0.19 0.00 -1.72 0.00 0.00 179.24 178.50 1vhc h ALA 56 N 1.29 0.63 -0.56 3.45 0.00 -0.67 -2.18 119.26 121.23 1vhc h ALA 56 Ca 0.23 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1vhc h ALA 56 Cb 0.21 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 1vhc h ALA 56 CO -0.02 0.25 0.23 0.82 0.00 0.00 0.00 179.25 180.53 1vhc h ILE 57 N 0.65 0.84 -0.28 0.00 2.04 -1.19 -1.39 117.51 118.19 1vhc h ILE 57 Ca 0.16 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1vhc h ILE 57 Cb 0.21 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1vhc h ILE 57 CO -0.01 0.08 0.11 -0.09 0.00 0.00 0.00 178.15 178.23 1vhc h ARG 58 N 0.43 0.42 -0.60 2.37 2.43 -1.38 -1.16 114.38 116.88 1vhc h ARG 58 Ca 0.27 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1vhc h ARG 58 Cb 0.28 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 1vhc h ARG 58 CO -0.25 0.45 0.14 -0.07 -1.51 0.00 0.00 179.97 178.74 1vhc h LEU 59 N 0.30 0.87 -0.32 3.80 3.38 -1.26 -2.50 115.31 119.58 1vhc h LEU 59 Ca 0.09 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 1vhc h LEU 59 Cb 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1vhc h LEU 59 CO -0.01 0.85 -0.31 0.25 0.09 0.00 0.00 178.44 179.31 1vhc h LEU 60 N 0.89 0.83 -0.12 1.67 5.85 -1.08 -2.06 115.31 121.29 1vhc h LEU 60 Ca 0.19 -0.47 0.02 0.00 0.84 0.00 0.00 57.88 58.46 1vhc h LEU 60 Cb 0.32 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1vhc h LEU 60 CO -0.00 1.13 0.01 -0.09 -0.34 0.00 0.00 178.44 179.15 1vhc h ARG 61 N 0.55 0.06 -0.27 1.25 9.65 -1.14 0.21 114.38 124.69 1vhc h ARG 61 Ca 0.05 -0.00 0.02 0.00 -1.10 0.00 0.00 59.98 58.95 1vhc h ARG 61 Cb 0.89 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.43 1vhc h ARG 61 CO 0.08 0.04 0.13 0.00 2.80 0.00 0.00 179.97 183.01 1vhc h ALA 62 N 1.09 0.32 -0.20 2.80 0.00 -1.40 -2.97 119.26 118.91 1vhc h ALA 62 Ca 0.06 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.79 1vhc h ALA 62 Cb 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1vhc h ALA 62 CO -0.08 -0.27 -0.63 -0.97 0.00 0.00 0.00 179.25 177.30 1vhc h ASN 63 N 0.27 0.80 -3.21 0.00 -0.73 -1.12 -3.38 115.58 108.21 1vhc h ASN 63 Ca 0.11 -0.46 -0.61 0.00 1.87 0.00 0.00 56.30 57.21 1vhc h ASN 63 Cb 0.04 -0.23 -0.40 0.00 0.27 0.00 0.00 38.32 37.99 1vhc h ASN 63 CO -0.08 1.23 -0.74 -0.13 -0.37 0.00 0.00 177.43 177.34 1vhc s ARG 64 N -3.93 1.54 0.61 6.67 0.52 0.71 -4.99 118.95 120.07 1vhc s ARG 64 Ca -0.09 -2.39 0.31 0.00 -0.52 0.00 0.00 55.73 53.04 1vhc s ARG 64 Cb 0.10 -2.47 1.79 0.00 0.52 0.00 0.00 34.95 34.89 1vhc s ARG 64 CO 0.87 -1.24 2.14 -1.35 0.02 0.00 0.00 175.30 175.74 1vhc h PRO 65 N 6.16 0.00 -0.06 3.54 0.11 -1.72 -1.49 132.00 138.55 1vhc h PRO 65 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1vhc h PRO 65 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1vhc h PRO 65 CO 0.53 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.92 1vhc n ASP 66 N -3.59 2.11 -4.76 -2.05 5.75 -1.26 -4.98 116.55 107.77 1vhc n ASP 66 Ca 0.00 -1.71 -0.41 0.00 -0.01 0.00 0.00 54.79 52.66 1vhc n ASP 66 Cb 0.27 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.30 1vhc n ASP 66 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1vhc s PHE 67 N -1.94 3.26 -0.24 2.11 2.19 -0.56 -4.97 117.98 117.83 1vhc s PHE 67 Ca 0.34 1.50 -0.26 0.00 0.33 0.00 0.00 56.93 58.84 1vhc s PHE 67 Cb 0.20 -3.53 0.00 0.00 -1.31 0.00 0.00 43.02 38.38 1vhc s PHE 67 CO 0.31 -1.39 0.92 -1.17 1.83 0.00 0.00 175.22 175.72 1vhc s LEU 68 N -1.52 4.09 -0.07 6.12 2.96 -0.92 -4.97 118.68 124.37 1vhc s LEU 68 Ca 0.48 1.18 0.03 0.00 -0.22 0.00 0.00 54.13 55.60 1vhc s LEU 68 Cb -0.37 -3.33 0.01 0.00 0.50 0.00 0.00 46.19 43.00 1vhc s LEU 68 CO 0.47 -0.58 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.13 1vhc s ILE 69 N 2.99 1.43 -0.06 6.68 1.01 -1.26 -1.59 121.20 130.40 1vhc s ILE 69 Ca 0.39 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.41 1vhc s ILE 69 Cb -0.15 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 1vhc s ILE 69 CO 0.07 0.42 -0.13 0.00 0.00 0.00 0.00 174.94 175.30 1vhc s ALA 70 N 0.51 2.71 -0.25 9.38 0.00 -0.26 0.14 121.76 133.99 1vhc s ALA 70 Ca -0.15 -0.96 -0.17 0.00 0.00 0.00 0.00 51.96 50.68 1vhc s ALA 70 Cb -0.16 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1vhc s ALA 70 CO 0.05 0.54 0.49 0.00 0.00 0.00 0.00 175.76 176.83 1vhc s ALA 71 N -0.67 3.58 0.39 0.00 0.00 -0.78 0.12 121.76 124.41 1vhc s ALA 71 Ca 0.10 -0.61 0.08 0.00 0.00 0.00 0.00 51.96 51.53 1vhc s ALA 71 Cb -0.11 -2.84 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 1vhc s ALA 71 CO 0.01 -0.67 0.30 0.20 0.00 0.00 0.00 175.76 175.60 1vhc s GLY 72 N 1.49 2.09 -1.44 0.00 0.00 -0.01 -1.58 107.32 107.86 1vhc s GLY 72 Ca 0.20 -1.88 -0.09 0.00 0.00 0.00 0.00 44.72 42.96 1vhc s GLY 72 CO 0.09 -1.72 0.92 2.41 0.00 0.00 0.00 173.10 174.80 1vhc n THR 73 N -1.42 -2.98 -2.62 0.90 -1.04 -0.89 -0.59 114.28 105.64 1vhc n THR 73 Ca 0.01 -0.17 -0.43 0.00 -2.04 0.00 0.00 64.05 61.42 1vhc n THR 73 Cb 0.62 -3.31 -0.02 0.00 -1.82 0.00 0.00 70.33 65.79 1vhc n THR 73 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1vhc s VAL 74 N -3.42 4.45 -0.04 12.58 1.01 -1.18 -4.52 120.40 129.29 1vhc s VAL 74 Ca 0.44 1.66 0.03 0.00 0.00 0.00 0.00 61.98 64.11 1vhc s VAL 74 Cb -0.22 -4.41 -0.04 0.00 0.00 0.00 0.00 36.38 31.71 1vhc s VAL 74 CO 0.81 -0.53 0.08 0.18 0.00 0.00 0.00 175.10 175.64 1vhc n LEU 75 N 7.01 0.04 -4.45 3.92 4.77 -1.26 -4.75 117.00 122.28 1vhc n LEU 75 Ca 0.12 -0.14 -0.22 0.00 -0.03 0.00 0.00 56.01 55.73 1vhc n LEU 75 Cb 0.47 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.46 1vhc n LEU 75 CO 0.61 0.01 -0.41 0.42 -1.33 0.00 0.00 177.39 176.68 1vhc s THR 76 N -1.93 2.00 0.24 -5.08 -4.23 -1.26 -5.01 115.64 100.37 1vhc s THR 76 Ca -0.00 -2.23 -0.03 0.00 -1.18 0.00 0.00 61.69 58.24 1vhc s THR 76 Cb 0.02 -2.37 0.08 0.00 1.34 0.00 0.00 72.50 71.57 1vhc s THR 76 CO 0.12 -0.36 1.71 0.00 -0.54 0.00 0.00 174.62 175.54 1vhc h ALA 77 N 2.28 1.01 -0.85 3.99 0.00 -1.98 -2.38 119.26 121.33 1vhc h ALA 77 Ca -0.40 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.25 1vhc h ALA 77 Cb 1.24 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.80 1vhc h ALA 77 CO 0.65 0.60 0.54 0.93 0.00 0.00 0.00 179.25 181.97 1vhc h GLU 78 N 0.73 1.00 -0.52 0.00 4.39 -1.99 -2.18 114.58 116.00 1vhc h GLU 78 Ca 0.13 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.68 1vhc h GLU 78 Cb 0.55 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 1vhc h GLU 78 CO 0.03 0.66 -0.02 1.96 -1.16 0.00 0.00 179.01 180.49 1vhc h GLN 79 N 1.03 0.92 0.05 2.33 4.20 -1.93 -1.40 115.11 120.31 1vhc h GLN 79 Ca 0.35 -0.30 0.03 0.00 0.06 0.00 0.00 58.65 58.78 1vhc h GLN 79 Cb 0.07 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 1vhc h GLN 79 CO -0.14 0.95 -0.24 0.28 -0.67 0.00 0.00 178.83 179.01 1vhc h VAL 80 N 0.79 0.45 -0.70 -0.54 2.07 -1.20 0.45 116.25 117.57 1vhc h VAL 80 Ca 0.14 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.72 1vhc h VAL 80 Cb 0.55 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 1vhc h VAL 80 CO 0.03 0.00 0.40 0.58 0.02 0.00 0.00 177.57 178.60 1vhc h VAL 81 N -0.41 0.98 -0.04 2.57 2.07 -1.25 -1.38 116.25 118.79 1vhc h VAL 81 Ca 0.05 -0.25 -0.21 0.00 0.82 0.00 0.00 66.70 67.11 1vhc h VAL 81 Cb 0.47 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1vhc h VAL 81 CO -0.19 0.13 -0.84 0.25 0.02 0.00 0.00 177.57 176.95 1vhc h LEU 82 N 0.73 0.51 -0.54 2.57 5.85 -0.99 -2.34 115.31 121.10 1vhc h LEU 82 Ca 0.31 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.69 1vhc h LEU 82 Cb 0.18 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1vhc h LEU 82 CO -0.18 1.14 0.32 0.00 -0.34 0.00 0.00 178.44 179.38 1vhc h ALA 83 N 0.83 0.70 -0.17 1.25 0.00 0.22 -0.61 119.26 121.48 1vhc h ALA 83 Ca -0.05 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1vhc h ALA 83 Cb 1.45 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1vhc h ALA 83 CO 0.14 0.01 0.05 -0.22 0.00 0.00 0.00 179.25 179.23 1vhc h LYS 84 N 0.62 0.27 0.00 0.00 3.64 -1.16 -2.28 116.57 117.65 1vhc h LYS 84 Ca 0.22 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1vhc h LYS 84 Cb 0.05 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1vhc h LYS 84 CO -0.11 0.40 -0.18 0.66 -2.27 0.00 0.00 179.45 177.94 1vhc h SER 85 N 0.09 0.00 1.07 4.20 4.64 -1.27 -2.80 113.55 119.48 1vhc h SER 85 Ca 0.05 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.31 1vhc h SER 85 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1vhc h SER 85 CO -0.00 0.18 -0.32 0.28 -0.87 0.00 0.00 176.83 176.10 1vhc h SER 86 N 0.00 0.00 0.00 4.97 0.02 -1.07 -3.47 113.55 114.00 1vhc h SER 86 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1vhc h SER 86 Cb 0.61 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1vhc h SER 86 CO 0.02 0.32 0.00 0.61 -1.14 0.00 0.00 176.83 176.64 1vhc n GLY 87 N 0.45 1.50 3.74 -3.77 0.00 -1.06 -3.45 105.19 102.61 1vhc n GLY 87 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1vhc n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vhc s ALA 88 N -2.00 2.22 0.00 4.61 0.00 -0.88 -4.93 121.76 120.78 1vhc s ALA 88 Ca 0.00 0.65 0.11 0.00 0.00 0.00 0.00 51.96 52.72 1vhc s ALA 88 Cb 0.00 -3.38 -0.21 0.00 0.00 0.00 0.00 23.12 19.52 1vhc s ALA 88 CO 0.00 -1.70 0.88 -0.44 0.00 0.00 0.00 175.76 174.50 1vhc h ASP 89 N -0.39 0.00 -5.07 0.00 3.32 0.88 -3.45 116.42 111.72 1vhc h ASP 89 Ca -0.46 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.59 1vhc h ASP 89 Cb 1.27 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.77 1vhc h ASP 89 CO 0.51 0.97 0.17 0.72 -1.72 0.00 0.00 179.24 179.88 1vhc s PHE 90 N -2.66 0.04 -0.00 4.55 -0.71 -1.21 -4.40 117.98 113.59 1vhc s PHE 90 Ca -0.03 -0.53 0.08 0.00 -1.04 0.00 0.00 56.93 55.41 1vhc s PHE 90 Cb 0.09 0.62 -0.02 0.00 -1.21 0.00 0.00 43.02 42.50 1vhc s PHE 90 CO 0.82 -1.28 -0.26 0.08 -1.34 0.00 0.00 175.22 173.24 1vhc s VAL 91 N -3.46 2.10 -0.02 -2.49 1.01 -0.43 -1.86 120.40 115.24 1vhc s VAL 91 Ca 0.15 -1.18 0.07 0.00 0.00 0.00 0.00 61.98 61.02 1vhc s VAL 91 Cb -0.05 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 1vhc s VAL 91 CO 0.09 0.52 -0.23 -0.69 0.00 0.00 0.00 175.10 174.79 1vhc s VAL 92 N -0.67 1.84 0.07 2.92 1.01 -0.62 -0.58 120.40 124.38 1vhc s VAL 92 Ca 0.11 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.12 1vhc s VAL 92 Cb -0.10 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 1vhc s VAL 92 CO -0.00 0.52 -0.08 0.42 0.00 0.00 0.00 175.10 175.96 1vhc s THR 93 N -0.49 0.68 0.11 3.92 -4.23 -1.20 -2.10 115.64 112.33 1vhc s THR 93 Ca 0.07 -1.43 0.03 0.00 -1.18 0.00 0.00 61.69 59.18 1vhc s THR 93 Cb -0.10 -1.07 -0.23 0.00 1.34 0.00 0.00 72.50 72.45 1vhc s THR 93 CO -0.00 -0.55 1.24 1.55 -0.54 0.00 0.00 174.62 176.32 1vhc h PRO 94 N 3.89 0.11 0.00 3.99 0.13 -1.91 -0.80 132.00 137.41 1vhc h PRO 94 Ca -0.36 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 1vhc h PRO 94 Cb 1.19 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1vhc h PRO 94 CO 0.50 1.07 0.00 0.41 -0.23 0.00 0.00 178.00 179.75 1vhc n GLY 95 N 1.36 4.40 3.03 1.56 0.00 -1.26 -4.17 105.19 110.12 1vhc n GLY 95 Ca -0.03 -2.03 -0.31 0.00 0.00 0.00 0.00 46.02 43.64 1vhc n GLY 95 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vhc s LEU 96 N 0.00 3.87 -0.30 0.99 0.20 -1.09 -2.37 118.68 119.98 1vhc s LEU 96 Ca 0.00 -1.68 -0.07 0.00 0.69 0.00 0.00 54.13 53.06 1vhc s LEU 96 Cb 0.00 -1.54 0.01 0.00 -0.43 0.00 0.00 46.19 44.23 1vhc s LEU 96 CO 0.00 -0.27 0.09 0.21 -0.29 0.00 0.00 176.35 176.09 1vhc s ASN 97 N 1.06 5.20 0.50 3.68 3.84 -1.26 -5.01 114.94 122.94 1vhc s ASN 97 Ca -0.01 -0.72 0.15 0.00 0.21 0.00 0.00 52.86 52.50 1vhc s ASN 97 Cb -0.19 -1.90 1.18 0.00 -0.55 0.00 0.00 41.25 39.79 1vhc s ASN 97 CO -0.07 -0.20 2.11 -0.65 -2.79 0.00 0.00 177.10 175.49 1vhc h PRO 98 N 8.25 0.03 -0.31 0.43 0.11 -1.99 -1.53 132.00 136.99 1vhc h PRO 98 Ca -0.31 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.69 1vhc h PRO 98 Cb 1.13 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1vhc h PRO 98 CO 0.61 0.07 -0.27 1.57 -0.21 0.00 0.00 178.00 179.76 1vhc h LYS 99 N 0.03 0.62 -0.36 1.05 2.10 -1.99 -0.56 116.57 117.46 1vhc h LYS 99 Ca 0.01 -0.25 -0.15 0.00 -2.00 0.00 0.00 60.65 58.25 1vhc h LYS 99 Cb 0.07 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.37 1vhc h LYS 99 CO 0.00 0.83 -0.37 0.82 -2.00 0.00 0.00 179.45 178.73 1vhc h ILE 100 N 0.54 1.28 -0.35 0.07 1.08 -1.70 -1.98 117.51 116.45 1vhc h ILE 100 Ca 0.07 -1.55 -0.04 0.00 -0.39 0.00 0.00 64.86 62.95 1vhc h ILE 100 Cb 0.74 1.45 -0.01 0.00 -3.07 0.00 0.00 36.82 35.92 1vhc h ILE 100 CO 0.06 0.51 0.06 0.58 -0.69 0.00 0.00 178.15 178.68 1vhc h VAL 101 N 0.68 1.23 -0.89 1.67 2.07 -1.18 -2.21 116.25 117.62 1vhc h VAL 101 Ca 0.05 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1vhc h VAL 101 Cb 0.97 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.79 1vhc h VAL 101 CO 0.09 0.27 0.57 0.50 0.02 0.00 0.00 177.57 179.02 1vhc h LYS 102 N 0.41 1.19 -0.25 1.57 1.63 -1.11 -1.92 116.57 118.08 1vhc h LYS 102 Ca 0.11 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 1vhc h LYS 102 Cb 0.34 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 1vhc h LYS 102 CO 0.01 0.81 0.17 1.25 -3.45 0.00 0.00 179.45 178.23 1vhc h LEU 103 N 1.22 0.29 -0.81 5.20 5.85 -1.28 0.14 115.31 125.92 1vhc h LEU 103 Ca 0.32 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 1vhc h LEU 103 Cb -0.10 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.81 1vhc h LEU 103 CO -0.07 0.22 0.49 0.00 -0.34 0.00 0.00 178.44 178.75 1vhc h GLN 105 N 1.11 0.90 0.00 0.00 4.20 -1.01 0.15 115.11 120.45 1vhc h GLN 105 Ca 0.29 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.92 1vhc h GLN 105 Cb -0.05 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.54 1vhc h GLN 105 CO -0.06 0.64 0.00 -0.44 -0.67 0.00 0.00 178.83 178.31 1vhc h ASP 106 N 0.90 0.00 -0.49 1.46 3.32 -0.35 -1.51 116.42 119.75 1vhc h ASP 106 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 1vhc h ASP 106 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1vhc h ASP 106 CO -0.04 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.66 1vhc n LEU 107 N -2.57 3.85 -3.94 1.55 4.77 -0.56 -4.97 117.00 115.14 1vhc n LEU 107 Ca 0.01 -2.33 -0.25 0.00 -0.03 0.00 0.00 56.01 53.41 1vhc n LEU 107 Cb 0.25 -0.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.89 1vhc n LEU 107 CO 0.22 0.78 -0.21 -3.20 -1.33 0.00 0.00 177.39 173.66 1vhc n ASN 108 N 0.69 -0.49 -3.99 -1.43 5.15 -0.57 -4.96 115.26 109.67 1vhc n ASN 108 Ca 0.20 -0.99 -0.31 0.00 -0.60 0.00 0.00 54.58 52.88 1vhc n ASN 108 Cb 0.69 -3.15 -0.15 0.00 -0.53 0.00 0.00 39.78 36.64 1vhc n ASN 108 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1vhc s PHE 109 N -3.91 2.83 0.36 1.20 5.36 0.43 -5.03 117.98 119.23 1vhc s PHE 109 Ca 0.03 -2.09 -0.27 0.00 -0.96 0.00 0.00 56.93 53.63 1vhc s PHE 109 Cb -0.01 -1.84 -0.12 0.00 -0.34 0.00 0.00 43.02 40.71 1vhc s PHE 109 CO 0.88 -0.83 1.29 -2.30 -1.46 0.00 0.00 175.22 172.80 1vhc n PRO 110 N 4.55 2.10 -3.80 10.12 -0.02 -1.26 -4.25 135.00 142.44 1vhc n PRO 110 Ca -0.11 0.74 -0.13 0.00 -2.02 0.00 0.00 63.50 61.98 1vhc n PRO 110 Cb 0.43 -2.35 -0.14 0.00 -0.02 0.00 0.00 33.50 31.42 1vhc n PRO 110 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1vhc s ILE 111 N -1.12 -0.02 -0.41 4.25 2.07 -1.26 -1.31 121.20 123.39 1vhc s ILE 111 Ca 0.56 0.09 -0.03 0.00 -1.41 0.00 0.00 60.65 59.86 1vhc s ILE 111 Cb -0.55 -0.15 0.11 0.00 0.13 0.00 0.00 42.46 42.00 1vhc s ILE 111 CO 0.61 0.04 0.21 0.42 -1.91 0.00 0.00 174.94 174.31 1vhc s THR 112 N 0.55 3.36 0.42 4.00 -4.23 0.26 -4.94 115.64 115.06 1vhc s THR 112 Ca -0.04 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 58.34 1vhc s THR 112 Cb -0.06 -3.29 -0.07 0.00 1.34 0.00 0.00 72.50 70.43 1vhc s THR 112 CO -0.02 -0.68 0.81 -2.16 -0.54 0.00 0.00 174.62 172.03 1vhc s PRO 113 N 1.16 3.84 0.04 3.99 0.04 -1.26 -3.27 135.00 139.55 1vhc s PRO 113 Ca 0.08 0.60 -0.22 0.00 0.04 0.00 0.00 61.00 61.49 1vhc s PRO 113 Cb -0.23 -2.34 -0.06 0.00 0.04 0.00 0.00 34.50 31.91 1vhc s PRO 113 CO -0.04 -0.07 0.67 0.20 0.04 0.00 0.00 177.00 177.80 1vhc s GLY 114 N -3.05 2.72 0.11 0.56 0.00 -0.31 -0.72 107.32 106.63 1vhc s GLY 114 Ca 0.53 0.15 0.04 0.00 0.00 0.00 0.00 44.72 45.44 1vhc s GLY 114 CO 0.30 0.83 -0.10 -1.34 0.00 0.00 0.00 173.10 172.79 1vhc s VAL 115 N -0.40 0.99 0.00 1.40 -7.23 -0.18 -2.68 120.40 112.30 1vhc s VAL 115 Ca 0.34 -1.78 0.00 0.00 -1.81 0.00 0.00 61.98 58.73 1vhc s VAL 115 Cb -0.20 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.22 1vhc s VAL 115 CO 0.20 -0.63 0.33 -0.46 -0.31 0.00 0.00 175.10 174.24 1vhc n ASN 116 N 0.31 0.00 -3.61 4.85 6.94 -1.26 -3.11 115.26 119.37 1vhc n ASN 116 Ca -0.14 -1.00 -0.10 0.00 -0.02 0.00 0.00 54.58 53.32 1vhc n ASN 116 Cb 0.59 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.98 1vhc n ASN 116 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1vhc s ASN 117 N 0.00 0.13 0.00 0.53 2.20 -1.26 -5.05 114.94 111.49 1vhc s ASN 117 Ca 0.00 -1.05 0.00 0.00 -0.94 0.00 0.00 52.86 50.87 1vhc s ASN 117 Cb 0.00 0.67 0.00 0.00 -2.00 0.00 0.00 41.25 39.92 1vhc s ASN 117 CO 0.00 -1.31 0.17 -2.65 -2.94 0.00 0.00 177.10 170.37 1vhc n PRO 118 N -0.46 0.14 0.00 3.55 -0.02 -1.26 -2.09 135.00 134.86 1vhc n PRO 118 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 1vhc n PRO 118 Cb 0.61 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 1vhc n PRO 118 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vhc n ALA 120 N 1.14 0.00 -0.28 3.55 0.00 -1.26 -1.55 120.51 122.11 1vhc n ALA 120 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1vhc n ALA 120 Cb 0.07 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.63 1vhc n ALA 120 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1vhc h ILE 121 N 0.00 1.05 0.00 0.00 2.04 -1.82 -2.36 117.51 116.42 1vhc h ILE 121 Ca 0.00 -0.30 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 1vhc h ILE 121 Cb 0.00 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.15 1vhc h ILE 121 CO 0.00 0.16 -0.27 -0.33 0.00 0.00 0.00 178.15 177.71 1vhc h GLU 122 N 0.89 0.00 -0.21 2.37 5.08 -1.57 -1.29 114.58 119.84 1vhc h GLU 122 Ca 0.33 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.57 1vhc h GLU 122 Cb 0.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1vhc h GLU 122 CO -0.16 0.27 -0.35 0.82 -1.00 0.00 0.00 179.01 178.60 1vhc h ILE 123 N 0.00 1.32 -0.58 3.13 2.04 -1.74 -1.81 117.51 119.87 1vhc h ILE 123 Ca -0.00 -1.56 0.04 0.00 1.00 0.00 0.00 64.86 64.33 1vhc h ILE 123 Cb 0.63 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 38.47 1vhc h ILE 123 CO 0.04 0.49 0.34 0.00 0.00 0.00 0.00 178.15 179.01 1vhc h ALA 124 N 0.62 0.75 -0.25 1.87 0.00 -0.91 -2.58 119.26 118.76 1vhc h ALA 124 Ca 0.02 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1vhc h ALA 124 Cb 0.94 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1vhc h ALA 124 CO 0.08 0.04 -0.33 -0.07 0.00 0.00 0.00 179.25 178.97 1vhc h LEU 125 N 0.65 0.56 -3.20 0.00 3.38 -1.25 0.18 115.31 115.64 1vhc h LEU 125 Ca 0.24 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1vhc h LEU 125 Cb 0.07 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1vhc h LEU 125 CO -0.13 0.85 0.00 1.21 0.09 0.00 0.00 178.44 180.46 1vhc n GLU 126 N -4.07 0.33 -0.19 1.13 4.07 -0.68 -4.20 120.64 117.03 1vhc n GLU 126 Ca -0.01 0.00 0.07 0.00 -0.06 0.00 0.00 57.16 57.16 1vhc n GLU 126 Cb 0.47 -1.34 0.09 0.00 -0.06 0.00 0.00 31.44 30.60 1vhc n GLU 126 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1vhc n GLY 128 N 1.55 3.40 3.41 8.31 0.00 -1.05 -5.09 105.19 115.71 1vhc n GLY 128 Ca 0.00 -0.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.94 1vhc n GLY 128 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vhc s ILE 129 N -1.92 3.55 -0.22 -0.61 1.01 0.61 -4.94 121.20 118.67 1vhc s ILE 129 Ca 0.21 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.42 1vhc s ILE 129 Cb 0.18 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 1vhc s ILE 129 CO 0.02 0.47 0.26 -1.54 0.00 0.00 0.00 174.94 174.15 1vhc n SER 130 N 3.95 0.45 -4.27 3.58 3.41 -1.26 -3.53 113.62 115.94 1vhc n SER 130 Ca -0.18 -0.73 -0.36 0.00 -0.26 0.00 0.00 58.87 57.35 1vhc n SER 130 Cb 0.52 0.73 -0.13 0.00 -0.26 0.00 0.00 64.21 65.07 1vhc n SER 130 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vhc s ALA 131 N -1.02 2.90 0.11 7.33 0.00 -1.26 -0.78 121.76 129.04 1vhc s ALA 131 Ca 0.02 -1.49 0.03 0.00 0.00 0.00 0.00 51.96 50.51 1vhc s ALA 131 Cb 0.02 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 21.14 1vhc s ALA 131 CO 0.10 -0.93 -0.08 0.14 0.00 0.00 0.00 175.76 174.99 1vhc s VAL 132 N 1.41 0.86 0.18 0.00 -7.23 -0.34 -4.36 120.40 110.91 1vhc s VAL 132 Ca 0.01 -1.90 -0.27 0.00 -1.81 0.00 0.00 61.98 58.01 1vhc s VAL 132 Cb -0.17 -1.65 -0.08 0.00 0.56 0.00 0.00 36.38 35.04 1vhc s VAL 132 CO -0.00 -0.78 0.83 -0.54 -0.31 0.00 0.00 175.10 174.30 1vhc s LYS 133 N -3.59 4.65 -0.35 4.82 -0.14 0.10 -4.33 119.74 120.90 1vhc s LYS 133 Ca 0.12 1.26 -0.08 0.00 -1.36 0.00 0.00 55.97 55.90 1vhc s LYS 133 Cb 0.03 -3.28 0.03 0.00 -1.68 0.00 0.00 37.83 32.93 1vhc s LYS 133 CO -0.02 0.52 0.15 0.12 -0.76 0.00 0.00 175.35 175.35 1vhc s PHE 134 N -1.03 3.25 -0.14 3.18 5.36 -1.26 -1.01 117.98 126.33 1vhc s PHE 134 Ca 0.38 -1.22 -0.11 0.00 -0.96 0.00 0.00 56.93 55.02 1vhc s PHE 134 Cb -0.24 -2.34 0.04 0.00 -0.34 0.00 0.00 43.02 40.14 1vhc s PHE 134 CO 0.28 -0.69 0.36 0.12 -1.46 0.00 0.00 175.22 173.83 1vhc s PHE 135 N 1.47 -0.44 -0.22 10.12 5.36 -1.18 -1.24 117.98 131.85 1vhc s PHE 135 Ca -0.00 1.03 -0.23 0.00 -0.96 0.00 0.00 56.93 56.76 1vhc s PHE 135 Cb -0.19 0.16 -0.01 0.00 -0.34 0.00 0.00 43.02 42.63 1vhc s PHE 135 CO 0.04 -0.23 0.76 -1.25 -1.46 0.00 0.00 175.22 173.08 1vhc s PRO 136 N 0.56 4.21 0.05 10.12 0.04 -1.26 -4.43 135.00 144.29 1vhc s PRO 136 Ca -0.03 0.83 -0.18 0.00 0.04 0.00 0.00 61.00 61.66 1vhc s PRO 136 Cb -0.05 -3.61 -0.08 0.00 0.04 0.00 0.00 34.50 30.80 1vhc s PRO 136 CO -0.03 -0.39 1.29 0.00 0.04 0.00 0.00 177.00 177.90 1vhc h ALA 137 N 7.58 -0.79 0.14 8.56 0.00 -0.94 -1.28 119.26 132.54 1vhc h ALA 137 Ca -0.27 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1vhc h ALA 137 Cb 1.12 0.68 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1vhc h ALA 137 CO 0.83 -0.86 -0.07 0.93 0.00 0.00 0.00 179.25 180.08 1vhc h GLU 138 N -0.40 -0.19 0.00 0.00 4.39 -1.52 -0.67 114.58 116.19 1vhc h GLU 138 Ca -0.00 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 1vhc h GLU 138 Cb 0.40 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1vhc h GLU 138 CO -0.15 -0.04 -0.09 0.00 -1.16 0.00 0.00 179.01 177.57 1vhc h ALA 139 N 0.55 1.38 -0.02 3.43 0.00 -1.82 -2.16 119.26 120.62 1vhc h ALA 139 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1vhc h ALA 139 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1vhc h ALA 139 CO 0.03 0.11 0.00 0.43 0.00 0.00 0.00 179.25 179.82 1vhc n SER 140 N -3.74 0.37 0.00 0.00 7.64 -0.48 -4.87 113.62 112.54 1vhc n SER 140 Ca -0.02 -1.34 0.00 0.00 1.01 0.00 0.00 58.87 58.52 1vhc n SER 140 Cb 0.19 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1vhc n SER 140 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vhc n GLY 141 N 0.94 1.05 7.00 0.23 0.00 -0.82 -4.99 105.19 108.60 1vhc n GLY 141 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1vhc n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vhc n GLY 142 N 0.00 2.09 0.31 -0.02 0.00 -0.28 -3.03 105.19 104.27 1vhc n GLY 142 Ca 0.00 -0.43 0.03 0.00 0.00 0.00 0.00 46.02 45.61 1vhc n GLY 142 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1vhc h VAL 143 N 0.00 1.14 0.00 1.61 2.07 -1.95 -2.60 116.25 116.52 1vhc h VAL 143 Ca 0.00 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1vhc h VAL 143 Cb 0.00 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1vhc h VAL 143 CO 0.00 0.15 0.00 1.17 0.02 0.00 0.00 177.57 178.91 1vhc n LYS 144 N -4.43 0.06 0.00 1.57 4.81 -1.17 -1.49 118.16 117.50 1vhc n LYS 144 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 1vhc n LYS 144 Cb 0.08 -1.14 0.00 0.00 0.02 0.00 0.00 35.03 33.99 1vhc n LYS 144 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1vhc n ILE 146 N 0.60 0.00 -0.32 3.15 5.41 -0.98 -2.08 119.36 125.14 1vhc n ILE 146 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 62.75 63.71 1vhc n ILE 146 Cb 0.02 0.00 0.08 0.00 -0.71 0.00 0.00 39.64 39.03 1vhc n ILE 146 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1vhc h LYS 147 N 0.00 1.14 -0.61 0.38 1.57 -1.55 -1.61 116.57 115.90 1vhc h LYS 147 Ca 0.00 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1vhc h LYS 147 Cb 0.00 -0.26 -0.03 0.00 0.08 0.00 0.00 32.23 32.03 1vhc h LYS 147 CO 0.00 0.77 0.24 0.00 -0.57 0.00 0.00 179.45 179.88 1vhc h ALA 148 N 1.31 0.79 0.00 3.86 0.00 -1.67 -2.58 119.26 120.97 1vhc h ALA 148 Ca 0.32 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1vhc h ALA 148 Cb -0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1vhc h ALA 148 CO -0.07 0.41 -0.24 -0.07 0.00 0.00 0.00 179.25 179.29 1vhc h LEU 149 N 0.85 0.00 0.00 0.00 3.38 -1.78 -3.15 115.31 114.61 1vhc h LEU 149 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1vhc h LEU 149 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1vhc h LEU 149 CO -0.02 0.24 0.00 0.18 0.09 0.00 0.00 178.44 178.93 1vhc n LEU 150 N -3.68 0.00 0.25 1.67 4.77 -0.63 -1.60 117.00 117.77 1vhc n LEU 150 Ca -0.01 0.48 -0.10 0.00 -0.03 0.00 0.00 56.01 56.35 1vhc n LEU 150 Cb 0.35 -0.48 -0.05 0.00 -2.33 0.00 0.00 43.42 40.92 1vhc n LEU 150 CO 0.34 -0.15 0.40 1.23 -1.33 0.00 0.00 177.39 177.88 1vhc h GLY 151 N 3.45 -0.67 2.00 -0.72 0.00 -1.53 -3.14 103.07 102.46 1vhc h GLY 151 Ca 0.00 0.25 -0.20 0.00 0.00 0.00 0.00 47.33 47.37 1vhc h GLY 151 CO 0.00 -0.24 -0.97 -0.56 0.00 0.00 0.00 176.54 174.76 1vhc h PRO 152 N -0.79 0.00 -2.43 4.80 0.13 -1.78 -3.35 132.00 128.59 1vhc h PRO 152 Ca -0.07 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 64.32 1vhc h PRO 152 Cb 0.49 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.30 1vhc h PRO 152 CO 0.11 0.97 0.44 0.66 -0.23 0.00 0.00 178.00 179.95 1vhc n TYR 153 N -3.38 2.99 0.26 1.56 4.01 -0.63 -4.85 117.16 117.12 1vhc n TYR 153 Ca -0.00 -3.05 0.13 0.00 -0.16 0.00 0.00 57.90 54.83 1vhc n TYR 153 Cb 0.92 -0.99 0.72 0.00 -0.31 0.00 0.00 39.34 39.67 1vhc n TYR 153 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1vhc h ALA 154 N 4.29 1.21 -0.36 -0.72 0.00 -1.69 -2.56 119.26 119.43 1vhc h ALA 154 Ca 0.33 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1vhc h ALA 154 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1vhc h ALA 154 CO 1.11 0.15 0.00 1.04 0.00 0.00 0.00 179.25 181.55 1vhc n GLN 155 N -3.53 3.30 -2.23 0.00 1.13 -1.26 -5.01 117.38 109.78 1vhc n GLN 155 Ca -0.01 -2.78 -0.40 0.00 -1.94 0.00 0.00 57.00 51.86 1vhc n GLN 155 Cb 0.26 -1.83 -0.02 0.00 0.11 0.00 0.00 30.24 28.75 1vhc n GLN 155 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1vhc s LEU 156 N -2.47 4.35 -0.26 1.08 1.43 -0.97 -4.97 118.68 116.88 1vhc s LEU 156 Ca 0.42 2.50 -0.09 0.00 -1.03 0.00 0.00 54.13 55.93 1vhc s LEU 156 Cb 0.32 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.71 1vhc s LEU 156 CO 0.12 -0.54 0.11 -1.10 0.23 0.00 0.00 176.35 175.18 1vhc s GLN 157 N -1.93 3.76 0.00 1.70 -0.21 0.04 -4.82 119.66 118.20 1vhc s GLN 157 Ca 0.51 -0.42 0.00 0.00 0.02 0.00 0.00 55.36 55.47 1vhc s GLN 157 Cb -0.35 -3.44 0.00 0.00 1.00 0.00 0.00 33.01 30.21 1vhc s GLN 157 CO 0.46 -0.19 0.00 -0.89 -2.12 0.00 0.00 175.29 172.55 1vhc n ILE 158 N 4.97 0.00 -3.63 1.08 5.41 -0.70 -1.19 119.36 125.30 1vhc n ILE 158 Ca -0.15 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.47 1vhc n ILE 158 Cb 0.52 -0.31 -0.07 0.00 -0.71 0.00 0.00 39.64 39.06 1vhc n ILE 158 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1vhc s PRO 160 N -0.53 0.74 -0.01 0.38 0.02 -1.23 -1.07 135.00 133.30 1vhc s PRO 160 Ca 0.00 0.90 -0.01 0.00 0.02 0.00 0.00 61.00 61.90 1vhc s PRO 160 Cb 0.00 0.35 -0.00 0.00 0.02 0.00 0.00 34.50 34.87 1vhc s PRO 160 CO 0.00 -0.09 0.03 0.99 -0.33 0.00 0.00 177.00 177.60 1vhc s THR 161 N 0.41 0.02 0.00 0.99 2.01 -0.37 -1.20 115.64 117.50 1vhc s THR 161 Ca 0.00 -0.18 0.00 0.00 0.31 0.00 0.00 61.69 61.82 1vhc s THR 161 Cb -0.05 -0.11 0.00 0.00 0.01 0.00 0.00 72.50 72.35 1vhc s THR 161 CO -0.02 -0.10 0.00 0.61 -0.69 0.00 0.00 174.62 174.42 1vhc n GLY 162 N 2.75 2.10 2.19 4.40 0.00 -1.26 -0.66 105.19 114.71 1vhc n GLY 162 Ca -0.15 -1.00 -0.07 0.00 0.00 0.00 0.00 46.02 44.80 1vhc n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vhc n GLY 163 N 1.11 0.66 3.72 -0.02 0.00 -1.26 -1.41 105.19 107.98 1vhc n GLY 163 Ca 0.00 -0.67 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 1vhc n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vhc s ILE 164 N -2.30 5.30 0.00 -0.61 1.01 -1.26 -4.80 121.20 118.53 1vhc s ILE 164 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 60.65 61.19 1vhc s ILE 164 Cb 0.00 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.84 1vhc s ILE 164 CO 0.00 0.37 0.00 0.61 0.00 0.00 0.00 174.94 175.92 1vhc n GLY 165 N 3.52 4.05 0.36 6.18 0.00 -1.26 -4.85 105.19 113.19 1vhc n GLY 165 Ca -0.12 -1.60 -0.02 0.00 0.00 0.00 0.00 46.02 44.28 1vhc n GLY 165 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1vhc h LEU 166 N 0.00 1.03 -2.49 0.99 3.38 -2.01 -0.47 115.31 115.75 1vhc h LEU 166 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1vhc h LEU 166 Cb 0.00 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1vhc h LEU 166 CO 0.00 0.79 0.00 1.12 0.09 0.00 0.00 178.44 180.44 1vhc h HIS 167 N 1.18 0.00 0.00 1.13 2.07 -1.99 -3.31 115.15 114.23 1vhc h HIS 167 Ca 0.31 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.83 1vhc h HIS 167 Cb -0.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.93 1vhc h HIS 167 CO 0.01 0.00 0.00 0.27 -3.07 0.00 0.00 177.93 175.14 1vhc n ASN 168 N -3.04 0.23 -0.04 3.10 0.23 -0.91 -4.87 115.26 109.96 1vhc n ASN 168 Ca -0.02 -1.04 0.01 0.00 -0.53 0.00 0.00 54.58 52.99 1vhc n ASN 168 Cb 0.13 0.00 0.31 0.00 -2.08 0.00 0.00 39.78 38.14 1vhc n ASN 168 CO 0.00 0.00 0.00 -0.29 -0.93 0.00 0.00 177.26 176.04 1vhc h ILE 169 N 1.18 1.18 -0.22 1.53 2.10 -1.19 -2.29 117.51 119.80 1vhc h ILE 169 Ca 0.00 -0.60 -0.08 0.00 1.08 0.00 0.00 64.86 65.26 1vhc h ILE 169 Cb 0.52 0.71 -0.01 0.00 -1.09 0.00 0.00 36.82 36.95 1vhc h ILE 169 CO 0.00 0.23 -0.22 0.03 -1.08 0.00 0.00 178.15 177.11 1vhc h ARG 170 N 0.61 0.40 -0.51 2.19 3.08 -1.86 -1.28 114.38 117.00 1vhc h ARG 170 Ca 0.14 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1vhc h ARG 170 Cb 0.19 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1vhc h ARG 170 CO -0.01 0.60 0.16 -0.44 -1.07 0.00 0.00 179.97 179.21 1vhc h ASP 171 N 0.36 0.69 0.02 7.04 3.32 -1.77 -1.23 116.42 124.86 1vhc h ASP 171 Ca 0.06 -0.10 -0.17 0.00 0.02 0.00 0.00 57.03 56.84 1vhc h ASP 171 Cb 0.58 -0.18 0.02 0.00 0.22 0.00 0.00 39.33 39.97 1vhc h ASP 171 CO 0.04 0.66 -0.70 1.88 -1.72 0.00 0.00 179.24 179.40 1vhc h TYR 172 N 0.73 0.66 0.00 4.55 0.05 -1.36 -3.27 116.97 118.33 1vhc h TYR 172 Ca 0.17 -0.37 0.00 0.00 0.05 0.00 0.00 58.73 58.58 1vhc h TYR 172 Cb 0.21 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 37.89 1vhc h TYR 172 CO 0.01 1.21 0.00 1.28 -1.05 0.00 0.00 178.16 179.61 1vhc n LEU 173 N -4.16 0.19 0.26 3.88 4.77 -0.51 -2.24 117.00 119.19 1vhc n LEU 173 Ca -0.11 0.55 0.15 0.00 -0.03 0.00 0.00 56.01 56.57 1vhc n LEU 173 Cb 0.73 -0.53 0.60 0.00 -2.33 0.00 0.00 43.42 41.89 1vhc n LEU 173 CO 0.48 -0.36 0.94 0.00 -1.33 0.00 0.00 177.39 177.12 1vhc h ALA 174 N 2.41 1.01 -2.23 -1.18 0.00 -1.28 -3.42 119.26 114.57 1vhc h ALA 174 Ca 0.00 -0.05 -0.59 0.00 0.00 0.00 0.00 54.91 54.27 1vhc h ALA 174 Cb 0.27 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 1vhc h ALA 174 CO 0.00 0.07 0.58 0.42 0.00 0.00 0.00 179.25 180.32 1vhc s ILE 175 N -3.65 4.79 0.39 0.00 1.01 -0.95 -4.95 121.20 117.84 1vhc s ILE 175 Ca 0.01 1.74 0.08 0.00 0.00 0.00 0.00 60.65 62.48 1vhc s ILE 175 Cb 0.09 -4.19 0.30 0.00 0.01 0.00 0.00 42.46 38.67 1vhc s ILE 175 CO 0.57 -0.10 1.98 -0.65 0.00 0.00 0.00 174.94 176.75 1vhc h PRO 176 N 7.55 0.62 0.00 2.79 0.11 -1.88 -0.58 132.00 140.61 1vhc h PRO 176 Ca -0.22 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1vhc h PRO 176 Cb 1.09 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1vhc h PRO 176 CO 0.90 0.41 0.00 -0.91 -0.21 0.00 0.00 178.00 178.20 1vhc h ASN 177 N 0.64 0.00 -2.89 -2.05 4.21 -1.92 -3.42 115.58 110.15 1vhc h ASN 177 Ca 0.28 0.00 -0.56 0.00 1.21 0.00 0.00 56.30 57.22 1vhc h ASN 177 Cb 0.28 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.44 1vhc h ASN 177 CO -0.09 0.00 1.03 -0.63 -1.29 0.00 0.00 177.43 176.45 1vhc s ILE 178 N -3.42 3.94 -0.05 2.81 1.01 -0.23 -1.72 121.20 123.54 1vhc s ILE 178 Ca 0.04 1.08 -0.23 0.00 0.00 0.00 0.00 60.65 61.54 1vhc s ILE 178 Cb 0.07 -3.87 -0.26 0.00 0.01 0.00 0.00 42.46 38.41 1vhc s ILE 178 CO 0.60 -0.29 0.97 0.58 0.00 0.00 0.00 174.94 176.80 1vhc h VAL 179 N 5.88 1.55 -1.37 2.92 2.07 -1.37 -3.47 116.25 122.47 1vhc h VAL 179 Ca -0.31 -2.19 0.14 0.00 0.82 0.00 0.00 66.70 65.17 1vhc h VAL 179 Cb 1.13 2.93 -0.25 0.00 -1.52 0.00 0.00 31.29 33.59 1vhc h VAL 179 CO 1.00 0.61 0.71 0.00 0.02 0.00 0.00 177.57 179.90 1vhc s ALA 180 N -2.83 -2.01 0.18 1.67 0.00 -1.26 -4.28 121.76 113.23 1vhc s ALA 180 Ca -0.15 1.71 0.07 0.00 0.00 0.00 0.00 51.96 53.58 1vhc s ALA 180 Cb 0.01 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 1vhc s ALA 180 CO 0.77 -0.28 0.03 0.00 0.00 0.00 0.00 175.76 176.28 1vhc s GLY 182 N -3.03 1.76 0.17 0.00 0.00 -0.34 -0.31 107.32 105.56 1vhc s GLY 182 Ca 0.28 -1.25 -0.24 0.00 0.00 0.00 0.00 44.72 43.51 1vhc s GLY 182 CO 0.20 -1.22 0.83 -0.32 0.00 0.00 0.00 173.10 172.58 1vhc s GLY 183 N -2.12 -0.28 0.00 0.20 0.00 -0.79 -4.42 107.32 99.92 1vhc s GLY 183 Ca 0.20 0.17 0.00 0.00 0.00 0.00 0.00 44.72 45.10 1vhc s GLY 183 CO 0.12 0.05 0.66 -1.14 0.00 0.00 0.00 173.10 172.79 1vhc n SER 184 N -0.42 0.77 0.09 1.64 3.41 -1.26 -1.40 113.62 116.44 1vhc n SER 184 Ca -0.07 -1.37 -0.01 0.00 -0.26 0.00 0.00 58.87 57.16 1vhc n SER 184 Cb 0.61 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.84 1vhc n SER 184 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 1vhc h TRP 185 N 0.00 0.32 -0.00 7.33 0.09 -1.92 0.11 115.95 121.88 1vhc h TRP 185 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 58.89 58.92 1vhc h TRP 185 Cb 0.77 -0.08 0.00 0.00 0.08 0.00 0.00 29.16 29.93 1vhc h TRP 185 CO 0.00 0.54 -0.12 1.97 0.09 0.00 0.00 178.44 180.92 1vhc n PHE 186 N -4.14 0.00 -2.33 0.12 -1.74 -1.26 -3.41 117.46 104.70 1vhc n PHE 186 Ca -0.01 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.76 1vhc n PHE 186 Cb 0.38 -0.40 0.04 0.00 1.52 0.00 0.00 39.48 41.03 1vhc n PHE 186 CO 0.00 0.00 0.00 1.33 -0.56 0.00 0.00 176.76 177.53 1vhc n VAL 187 N -1.44 1.94 -1.65 1.97 0.24 -0.06 -4.70 118.33 114.64 1vhc n VAL 187 Ca 0.08 -3.55 -0.43 0.00 -2.04 0.00 0.00 64.34 58.40 1vhc n VAL 187 Cb 0.33 -0.07 -0.01 0.00 -1.47 0.00 0.00 33.84 32.61 1vhc n VAL 187 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1vhc n GLU 188 N -0.64 1.72 -0.29 7.34 0.00 -0.69 -4.80 120.64 123.28 1vhc n GLU 188 Ca 0.27 0.60 0.07 0.00 0.00 0.00 0.00 57.16 58.10 1vhc n GLU 188 Cb 0.90 -2.11 0.22 0.00 0.00 0.00 0.00 31.44 30.45 1vhc n GLU 188 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1vhc h LYS 189 N 2.17 0.58 -0.35 5.31 3.64 -1.86 -0.94 116.57 125.12 1vhc h LYS 189 Ca -0.43 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 58.85 1vhc h LYS 189 Cb 1.31 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 1vhc h LYS 189 CO 0.61 0.39 -0.05 0.87 -2.27 0.00 0.00 179.45 179.00 1vhc h LYS 190 N 0.60 0.57 -0.23 1.90 1.57 -1.96 -0.78 116.57 118.24 1vhc h LYS 190 Ca 0.45 -0.14 -0.14 0.00 -1.87 0.00 0.00 60.65 58.95 1vhc h LYS 190 Cb 0.64 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 1vhc h LYS 190 CO -0.36 0.63 -0.43 -0.07 -0.57 0.00 0.00 179.45 178.64 1vhc h LEU 191 N 0.54 0.60 -0.30 2.94 3.38 -1.56 -2.07 115.31 118.83 1vhc h LEU 191 Ca 0.11 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 1vhc h LEU 191 Cb 0.41 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1vhc h LEU 191 CO 0.02 0.95 -0.07 0.40 0.09 0.00 0.00 178.44 179.84 1vhc h ILE 192 N 0.45 1.28 -0.57 1.22 2.04 -0.96 -1.35 117.51 119.62 1vhc h ILE 192 Ca 0.03 -1.10 -0.01 0.00 1.00 0.00 0.00 64.86 64.78 1vhc h ILE 192 Cb 0.94 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 1vhc h ILE 192 CO 0.08 0.35 0.30 1.56 0.00 0.00 0.00 178.15 180.44 1vhc h GLN 193 N 0.34 0.79 -0.01 2.37 4.20 -1.13 -1.38 115.11 120.30 1vhc h GLN 193 Ca 0.08 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1vhc h GLN 193 Cb 0.55 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1vhc h GLN 193 CO 0.03 0.60 -0.06 -1.13 -0.67 0.00 0.00 178.83 177.59 1vhc n SER 194 N -4.38 0.58 -3.72 1.46 3.41 -0.78 -4.93 113.62 105.25 1vhc n SER 194 Ca 0.05 -0.88 -0.26 0.00 -0.26 0.00 0.00 58.87 57.52 1vhc n SER 194 Cb 0.11 -0.04 0.06 0.00 -0.26 0.00 0.00 64.21 64.08 1vhc n SER 194 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1vhc n ASN 195 N -0.72 -5.51 -4.22 4.04 5.03 -0.52 -4.90 115.26 108.46 1vhc n ASN 195 Ca 0.18 -0.65 -0.43 0.00 0.87 0.00 0.00 54.58 54.55 1vhc n ASN 195 Cb 0.25 -4.56 0.00 0.00 -1.02 0.00 0.00 39.78 34.46 1vhc n ASN 195 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1vhc n ASN 196 N -2.95 5.20 0.22 6.41 2.85 -0.58 -4.79 115.26 121.62 1vhc n ASN 196 Ca 0.01 -3.04 0.07 0.00 -0.11 0.00 0.00 54.58 51.51 1vhc n ASN 196 Cb 0.55 -1.53 0.51 0.00 1.24 0.00 0.00 39.78 40.55 1vhc n ASN 196 CO 0.00 0.00 0.00 -0.50 -2.11 0.00 0.00 177.26 174.65 1vhc h TRP 197 N 6.55 0.00 -0.05 1.20 -0.00 -1.91 -2.61 115.95 119.13 1vhc h TRP 197 Ca 0.35 0.00 -0.06 0.00 -0.00 0.00 0.00 58.89 59.18 1vhc h TRP 197 Cb 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.93 1vhc h TRP 197 CO 1.15 0.25 -0.20 -0.44 -0.00 0.00 0.00 178.44 179.21 1vhc h ASP 198 N 0.00 0.27 -0.59 -3.49 3.32 -1.99 -0.95 116.42 113.00 1vhc h ASP 198 Ca -0.00 -0.63 0.03 0.00 0.02 0.00 0.00 57.03 56.45 1vhc h ASP 198 Cb 0.53 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.96 1vhc h ASP 198 CO 0.03 0.85 0.35 -0.08 -1.72 0.00 0.00 179.24 178.68 1vhc h GLU 199 N -0.30 0.67 0.26 3.56 4.57 -1.95 -0.79 114.58 120.60 1vhc h GLU 199 Ca -0.01 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1vhc h GLU 199 Cb 0.84 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 1vhc h GLU 199 CO 0.04 0.44 -0.19 0.82 -1.18 0.00 0.00 179.01 178.95 1vhc h ILE 200 N 0.69 0.60 -0.24 2.32 2.04 -1.42 -0.94 117.51 120.57 1vhc h ILE 200 Ca 0.24 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.16 1vhc h ILE 200 Cb 0.04 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1vhc h ILE 200 CO -0.11 0.00 0.17 1.23 0.00 0.00 0.00 178.15 179.44 1vhc h GLY 201 N -0.45 0.04 0.66 5.37 0.00 -1.05 -1.39 103.07 106.25 1vhc h GLY 201 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 1vhc h GLY 201 CO 0.01 0.01 -0.12 -0.09 0.00 0.00 0.00 176.54 176.35 1vhc h ARG 202 N 0.04 -0.32 -0.32 4.80 2.43 0.17 -1.92 114.38 119.26 1vhc h ARG 202 Ca 0.11 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.35 1vhc h ARG 202 Cb 0.40 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1vhc h ARG 202 CO -0.01 0.01 0.22 -0.07 -1.51 0.00 0.00 179.97 178.61 1vhc h LEU 203 N -0.68 0.22 0.32 3.80 3.38 -0.97 -0.53 115.31 120.84 1vhc h LEU 203 Ca -0.03 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1vhc h LEU 203 Cb 0.47 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1vhc h LEU 203 CO 0.06 0.15 -0.15 0.58 0.09 0.00 0.00 178.44 179.16 1vhc h VAL 204 N 0.25 0.68 -0.99 1.22 2.07 -1.08 -2.17 116.25 116.23 1vhc h VAL 204 Ca 0.14 -0.57 0.09 0.00 0.82 0.00 0.00 66.70 67.18 1vhc h VAL 204 Cb 0.24 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 1vhc h VAL 204 CO -0.03 0.11 0.63 0.03 0.02 0.00 0.00 177.57 178.33 1vhc h ARG 205 N -0.75 1.05 -0.41 1.57 3.08 -0.74 -1.34 114.38 116.83 1vhc h ARG 205 Ca -0.04 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 1vhc h ARG 205 Cb 0.50 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1vhc h ARG 205 CO 0.07 0.69 0.14 1.49 -1.07 0.00 0.00 179.97 181.29 1vhc h GLU 206 N 1.08 0.59 0.09 0.04 4.81 -0.96 -0.80 114.58 119.43 1vhc h GLU 206 Ca 0.45 -0.09 -0.27 0.00 -0.13 0.00 0.00 59.36 59.32 1vhc h GLU 206 Cb 0.30 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1vhc h GLU 206 CO -0.20 0.51 -1.27 -0.24 -0.73 0.00 0.00 179.01 177.09 1vhc h VAL 207 N 0.59 1.45 -0.71 0.32 3.04 -0.68 -2.19 116.25 118.06 1vhc h VAL 207 Ca 0.14 -3.08 -0.06 0.00 -1.01 0.00 0.00 66.70 62.70 1vhc h VAL 207 Cb 0.16 2.87 -0.03 0.00 -2.01 0.00 0.00 31.29 32.28 1vhc h VAL 207 CO -0.01 0.88 0.21 0.40 -1.01 0.00 0.00 177.57 178.05 1vhc h ILE 208 N 0.05 1.26 -0.21 3.17 2.04 -1.05 -1.94 117.51 120.83 1vhc h ILE 208 Ca -0.13 -0.90 -0.03 0.00 1.00 0.00 0.00 64.86 64.79 1vhc h ILE 208 Cb 1.94 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1vhc h ILE 208 CO 0.18 0.35 0.01 0.44 0.00 0.00 0.00 178.15 179.13 1vhc h ASP 209 N 1.06 0.36 -0.30 1.72 3.32 -1.02 -2.24 116.42 119.32 1vhc h ASP 209 Ca 0.23 -0.30 -0.04 0.00 0.02 0.00 0.00 57.03 56.94 1vhc h ASP 209 Cb 0.31 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1vhc h ASP 209 CO -0.01 0.57 0.06 0.40 -1.72 0.00 0.00 179.24 178.54 1vhc h ILE 210 N 0.13 1.19 -0.31 0.35 5.03 -1.22 -2.60 117.51 120.09 1vhc h ILE 210 Ca 0.06 -0.70 -0.10 0.00 -0.12 0.00 0.00 64.86 64.00 1vhc h ILE 210 Cb 0.38 0.83 -0.01 0.00 -3.03 0.00 0.00 36.82 35.00 1vhc h ILE 210 CO 0.01 0.25 -0.20 0.40 -0.68 0.00 0.00 178.15 177.93 1vhc h ILE 211 N 0.56 1.30 -0.05 -0.67 2.04 -1.20 -2.76 117.51 116.73 1vhc h ILE 211 Ca 0.13 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.65 1vhc h ILE 211 Cb 0.27 1.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.83 1vhc h ILE 211 CO 0.00 0.43 0.00 0.29 0.00 0.00 0.00 178.15 178.87 1vhc n LYS 212 N -4.33 1.31 0.00 2.37 5.02 -0.86 -5.07 118.16 116.61 1vhc n LYS 212 Ca -0.03 -0.26 0.11 0.00 -2.02 0.00 0.00 58.31 56.11 1vhc n LYS 212 Cb 0.42 -1.50 0.65 0.00 -0.02 0.00 0.00 35.03 34.58 1vhc n LYS 212 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03