#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vxx s LEU 6 N 0.00 4.36 0.64 0.00 1.43 -1.26 -5.09 118.68 118.76 2vxx s LEU 6 Ca 0.00 0.44 -0.15 0.00 -1.03 0.00 0.00 54.13 53.39 2vxx s LEU 6 Cb 0.00 -2.69 -0.01 0.00 0.03 0.00 0.00 46.19 43.52 2vxx s LEU 6 CO 0.00 0.24 1.10 -2.16 0.23 0.00 0.00 176.35 175.76 2vxx s PRO 7 N -1.92 2.97 0.23 1.29 0.04 -1.26 -4.96 135.00 131.39 2vxx s PRO 7 Ca 0.28 1.35 -0.08 0.00 0.04 0.00 0.00 61.00 62.60 2vxx s PRO 7 Cb -0.13 -1.98 0.23 0.00 0.04 0.00 0.00 34.50 32.67 2vxx s PRO 7 CO 0.18 -1.11 1.90 0.00 0.04 0.00 0.00 177.00 178.01 2vxx h ARG 8 N 0.20 1.12 -3.95 4.56 3.08 -2.07 -3.40 114.38 113.91 2vxx h ARG 8 Ca -0.47 -0.07 -0.45 0.00 0.07 0.00 0.00 59.98 59.07 2vxx h ARG 8 Cb 1.24 -0.25 -0.36 0.00 0.08 0.00 0.00 29.97 30.67 2vxx h ARG 8 CO 0.55 0.74 -0.78 -1.14 -1.07 0.00 0.00 179.97 178.28 2vxx s GLN 9 N -6.12 0.91 0.41 0.04 0.74 -1.26 -5.14 119.66 109.24 2vxx s GLN 9 Ca -0.13 -0.06 -0.24 0.00 0.05 0.00 0.00 55.36 54.99 2vxx s GLN 9 Cb 0.17 -1.06 -0.09 0.00 1.10 0.00 0.00 33.01 33.13 2vxx s GLN 9 CO 0.80 -0.20 1.06 0.00 -0.55 0.00 0.00 175.29 176.40 2vxx s ALA 10 N 1.49 3.06 0.27 1.58 0.00 -1.26 -4.97 121.76 121.93 2vxx s ALA 10 Ca -0.02 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 52.35 2vxx s ALA 10 Cb -0.13 -3.28 -0.12 0.00 0.00 0.00 0.00 23.12 19.58 2vxx s ALA 10 CO -0.03 -0.26 1.51 0.34 0.00 0.00 0.00 175.76 177.31 2vxx n PHE 11 N -0.19 2.55 -0.77 0.00 -0.00 -1.26 -1.18 117.46 116.61 2vxx n PHE 11 Ca 0.06 0.34 0.00 0.00 -0.00 0.00 0.00 57.45 57.84 2vxx n PHE 11 Cb 0.50 -2.54 0.00 0.00 -0.00 0.00 0.00 39.48 37.44 2vxx n PHE 11 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2vxx n GLY 12 N 2.12 1.18 3.78 7.13 0.00 -1.26 -5.03 105.19 113.10 2vxx n GLY 12 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 2vxx n GLY 12 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vxx s GLU 13 N -0.11 4.08 -0.19 1.61 2.12 -0.33 -5.08 118.70 120.80 2vxx s GLU 13 Ca 0.00 0.31 -0.09 0.00 0.36 0.00 0.00 54.97 55.55 2vxx s GLU 13 Cb 0.00 -3.32 -0.05 0.00 0.26 0.00 0.00 34.13 31.02 2vxx s GLU 13 CO 0.00 0.45 0.11 -1.64 -0.54 0.00 0.00 175.26 173.64 2vxx s MET 14 N -0.27 4.08 0.33 4.30 -1.94 -1.26 -4.46 119.30 120.07 2vxx s MET 14 Ca 0.22 -0.26 0.07 0.00 -1.71 0.00 0.00 55.69 54.01 2vxx s MET 14 Cb -0.15 -3.34 -0.02 0.00 2.01 0.00 0.00 34.83 33.33 2vxx s MET 14 CO 0.10 0.32 0.33 0.00 -0.01 0.00 0.00 175.02 175.75 2vxx s ALA 15 N 0.28 3.91 0.46 3.03 0.00 0.02 -5.05 121.76 124.42 2vxx s ALA 15 Ca 0.07 -1.58 -0.22 0.00 0.00 0.00 0.00 51.96 50.23 2vxx s ALA 15 Cb -0.11 -1.31 -0.08 0.00 0.00 0.00 0.00 23.12 21.62 2vxx s ALA 15 CO -0.01 0.03 1.12 -0.51 0.00 0.00 0.00 175.76 176.39 2vxx s ASP 16 N -4.02 6.25 0.01 0.00 1.01 -1.26 -4.52 116.67 114.14 2vxx s ASP 16 Ca 0.41 2.19 -0.02 0.00 0.71 0.00 0.00 52.55 55.84 2vxx s ASP 16 Cb -0.07 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 2vxx s ASP 16 CO 0.27 -0.86 0.18 0.28 0.21 0.00 0.00 175.17 175.26 2vxx s THR 17 N -1.65 5.36 -1.63 -1.27 -1.32 -1.26 -4.71 115.64 109.15 2vxx s THR 17 Ca 0.64 -0.26 0.27 0.00 -1.21 0.00 0.00 61.69 61.13 2vxx s THR 17 Cb -0.25 -3.53 0.58 0.00 -1.51 0.00 0.00 72.50 67.78 2vxx s THR 17 CO 0.30 0.27 1.94 1.33 -2.21 0.00 0.00 174.62 176.25 2vxx n VAL 18 N 0.75 0.10 -0.24 5.08 0.24 -1.26 -3.76 118.33 119.23 2vxx n VAL 18 Ca -0.09 0.02 0.08 0.00 -2.04 0.00 0.00 64.34 62.31 2vxx n VAL 18 Cb 0.52 -0.59 0.30 0.00 -1.47 0.00 0.00 33.84 32.60 2vxx n VAL 18 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 2vxx n ILE 19 N -1.19 1.51 -3.25 1.34 -5.35 -1.26 -4.96 119.36 106.21 2vxx n ILE 19 Ca 0.15 -0.98 -0.15 0.00 -0.27 0.00 0.00 62.75 61.51 2vxx n ILE 19 Cb 0.17 0.07 0.08 0.00 -1.74 0.00 0.00 39.64 38.22 2vxx n ILE 19 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2vxx n LEU 20 N 0.93 -3.76 -4.23 7.28 4.77 -1.25 -5.04 117.00 115.71 2vxx n LEU 20 Ca 0.22 -0.54 -0.31 0.00 -0.03 0.00 0.00 56.01 55.35 2vxx n LEU 20 Cb 0.76 -2.78 -0.17 0.00 -2.33 0.00 0.00 43.42 38.90 2vxx n LEU 20 CO 0.20 0.34 -0.56 -0.76 -1.33 0.00 0.00 177.39 175.28 2vxx s LEU 21 N -5.80 2.05 0.66 2.23 1.43 -1.26 -5.13 118.68 112.86 2vxx s LEU 21 Ca 0.01 -0.51 -0.17 0.00 -1.03 0.00 0.00 54.13 52.43 2vxx s LEU 21 Cb -0.01 -1.34 -0.00 0.00 0.03 0.00 0.00 46.19 44.88 2vxx s LEU 21 CO 0.63 0.20 1.25 -1.61 0.23 0.00 0.00 176.35 177.05 2vxx s GLU 22 N 0.06 2.51 0.43 1.70 0.41 -1.26 -4.64 118.70 117.91 2vxx s GLU 22 Ca -0.10 1.91 0.12 0.00 -0.41 0.00 0.00 54.97 56.50 2vxx s GLU 22 Cb -0.15 -1.86 0.97 0.00 -1.78 0.00 0.00 34.13 31.31 2vxx s GLU 22 CO 0.05 -1.59 2.00 0.87 -0.49 0.00 0.00 175.26 176.11 2vxx h LYS 23 N 0.36 0.44 0.00 1.61 1.57 -1.98 -0.27 116.57 118.30 2vxx h LYS 23 Ca -0.50 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 2vxx h LYS 23 Cb 1.32 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2vxx h LYS 23 CO 0.52 0.29 0.00 0.00 -0.57 0.00 0.00 179.45 179.70 2vxx h ALA 24 N 1.71 1.00 0.00 3.86 0.00 -2.00 0.15 119.26 123.97 2vxx h ALA 24 Ca 0.24 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.82 2vxx h ALA 24 Cb 0.37 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 2vxx h ALA 24 CO -0.07 0.00 -1.81 2.41 0.00 0.00 0.00 179.25 179.78 2vxx n THR 25 N -2.64 1.53 0.13 0.00 -1.04 -0.19 -4.52 114.28 107.56 2vxx n THR 25 Ca -0.01 -0.18 -0.01 0.00 -2.04 0.00 0.00 64.05 61.81 2vxx n THR 25 Cb 0.11 -1.97 0.25 0.00 -1.82 0.00 0.00 70.33 66.90 2vxx n THR 25 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2vxx h THR 26 N -0.99 1.33 0.51 12.58 1.35 -1.09 -2.99 112.91 123.62 2vxx h THR 26 Ca -0.50 -1.60 -0.03 0.00 -0.55 0.00 0.00 66.41 63.73 2vxx h THR 26 Cb 1.44 1.81 0.01 0.00 -1.73 0.00 0.00 68.15 69.68 2vxx h THR 26 CO -0.30 0.47 -0.25 0.74 -0.25 0.00 0.00 175.52 175.93 2vxx h THR 27 N 0.08 0.43 -0.33 6.82 2.02 -0.96 0.27 112.91 121.24 2vxx h THR 27 Ca 0.00 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 2vxx h THR 27 Cb 0.84 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 2vxx h THR 27 CO 0.06 0.04 0.06 1.55 0.37 0.00 0.00 175.52 177.61 2vxx h PRO 28 N -0.89 0.49 -0.31 6.66 0.13 -1.79 -1.05 132.00 135.24 2vxx h PRO 28 Ca -0.07 -0.08 -0.05 0.00 -0.87 0.00 0.00 66.00 64.93 2vxx h PRO 28 Cb 0.60 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 2vxx h PRO 28 CO 0.12 0.47 0.02 0.82 -0.23 0.00 0.00 178.00 179.20 2vxx h ILE 29 N 0.48 1.25 -0.30 -3.56 2.04 -1.36 -2.15 117.51 113.91 2vxx h ILE 29 Ca 0.11 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 64.99 2vxx h ILE 29 Cb 0.22 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 2vxx h ILE 29 CO -0.00 0.29 -0.13 0.00 0.00 0.00 0.00 178.15 178.31 2vxx h GLU 31 N 0.48 0.10 -0.36 0.00 4.81 -0.97 -1.07 114.58 117.56 2vxx h GLU 31 Ca 0.09 -0.01 -0.16 0.00 -0.13 0.00 0.00 59.36 59.15 2vxx h GLU 31 Cb 0.52 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 2vxx h GLU 31 CO 0.03 0.07 -0.41 0.78 -0.73 0.00 0.00 179.01 178.74 2vxx h GLY 32 N 0.11 1.01 1.63 1.92 0.00 -1.27 -3.12 103.07 103.34 2vxx h GLY 32 Ca 0.08 -1.06 -0.03 0.00 0.00 0.00 0.00 47.33 46.33 2vxx h GLY 32 CO -0.11 0.96 0.10 1.98 0.00 0.00 0.00 176.54 179.46 2vxx h MET 33 N 0.74 0.47 -0.42 4.80 1.85 -0.95 -1.72 114.93 119.70 2vxx h MET 33 Ca 0.05 -0.07 -0.08 0.00 -0.61 0.00 0.00 59.70 58.99 2vxx h MET 33 Cb 1.01 -0.09 -0.02 0.00 0.43 0.00 0.00 31.60 32.94 2vxx h MET 33 CO 0.10 0.43 -0.08 -0.91 -0.40 0.00 0.00 176.91 176.04 2vxx h ASN 34 N 0.47 0.70 -0.45 1.39 2.35 -1.16 0.75 115.58 119.64 2vxx h ASN 34 Ca 0.11 -0.19 -0.05 0.00 -0.55 0.00 0.00 56.30 55.62 2vxx h ASN 34 Cb 0.16 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2vxx h ASN 34 CO -0.01 0.83 0.10 0.03 -1.65 0.00 0.00 177.43 176.73 2vxx h ARG 35 N 0.66 0.72 -0.43 0.81 3.08 -1.30 -0.07 114.38 117.86 2vxx h ARG 35 Ca 0.12 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 2vxx h ARG 35 Cb 0.53 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2vxx h ARG 35 CO 0.03 0.73 0.00 -0.07 -1.07 0.00 0.00 179.97 179.60 2vxx h LEU 36 N 0.59 0.73 -0.07 3.04 3.38 -1.19 0.11 115.31 121.92 2vxx h LEU 36 Ca 0.14 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.84 2vxx h LEU 36 Cb 0.34 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2vxx h LEU 36 CO 0.00 0.86 -0.15 0.25 0.09 0.00 0.00 178.44 179.49 2vxx h LEU 37 N 0.59 -0.46 -0.73 1.67 5.85 -0.76 0.13 115.31 121.59 2vxx h LEU 37 Ca 0.12 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 2vxx h LEU 37 Cb 0.48 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 2vxx h LEU 37 CO 0.02 -0.21 0.44 0.00 -0.34 0.00 0.00 178.44 178.35 2vxx h ALA 38 N 0.77 0.92 -0.35 1.25 0.00 -0.88 -0.06 119.26 120.92 2vxx h ALA 38 Ca 0.07 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2vxx h ALA 38 Cb 0.32 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2vxx h ALA 38 CO -0.20 0.39 0.08 0.77 0.00 0.00 0.00 179.25 180.30 2vxx h SER 39 N 0.99 0.54 -0.52 0.00 0.02 -0.61 -1.11 113.55 112.87 2vxx h SER 39 Ca 0.26 -0.24 -0.08 0.00 -0.84 0.00 0.00 61.79 60.89 2vxx h SER 39 Cb -0.04 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 2vxx h SER 39 CO -0.05 0.64 0.02 -0.26 -1.14 0.00 0.00 176.83 176.04 2vxx h PHE 40 N 0.42 1.02 -0.56 3.45 0.04 -0.59 -0.43 116.94 120.29 2vxx h PHE 40 Ca 0.11 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.73 2vxx h PHE 40 Cb 0.31 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 2vxx h PHE 40 CO 0.02 0.91 0.37 0.37 -0.60 0.00 0.00 178.31 179.37 2vxx h GLN 41 N 0.88 0.73 -0.49 1.51 5.75 -0.80 0.21 115.11 122.91 2vxx h GLN 41 Ca 0.17 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.55 2vxx h GLN 41 Cb 0.49 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 2vxx h GLN 41 CO 0.02 0.49 0.02 0.00 -2.65 0.00 0.00 178.83 176.71 2vxx h ALA 42 N 1.20 0.65 -0.36 3.38 0.00 -0.95 -2.21 119.26 120.98 2vxx h ALA 42 Ca 0.20 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2vxx h ALA 42 Cb -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2vxx h ALA 42 CO -0.04 0.44 -0.12 1.25 0.00 0.00 0.00 179.25 180.78 2vxx h LEU 43 N 0.71 0.62 -0.10 0.00 5.85 -0.80 -0.48 115.31 121.10 2vxx h LEU 43 Ca 0.14 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.71 2vxx h LEU 43 Cb 0.48 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2vxx h LEU 43 CO 0.02 0.77 -0.04 0.22 -0.34 0.00 0.00 178.44 179.07 2vxx h TYR 44 N 0.58 -0.08 -0.87 1.25 5.03 -0.46 -0.06 116.97 122.36 2vxx h TYR 44 Ca 0.10 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.40 2vxx h TYR 44 Cb 0.54 0.05 -0.04 0.00 1.55 0.00 0.00 36.73 38.83 2vxx h TYR 44 CO 0.02 -0.06 0.46 -0.07 -1.32 0.00 0.00 178.16 177.19 2vxx h LEU 45 N -0.02 1.09 -0.04 2.82 3.38 -0.86 -1.58 115.31 120.10 2vxx h LEU 45 Ca 0.05 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2vxx h LEU 45 Cb 0.10 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2vxx h LEU 45 CO -0.12 0.88 0.00 -0.61 0.09 0.00 0.00 178.44 178.69 2vxx h GLN 46 N 1.22 0.07 -0.87 1.13 4.15 -0.93 -0.71 115.11 119.17 2vxx h GLN 46 Ca 0.30 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.74 2vxx h GLN 46 Cb 0.05 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.68 2vxx h GLN 46 CO -0.05 0.36 0.57 1.88 -1.93 0.00 0.00 178.83 179.66 2vxx h TYR 47 N -0.22 1.04 -0.17 3.99 0.05 -0.92 -0.73 116.97 120.01 2vxx h TYR 47 Ca 0.01 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.78 2vxx h TYR 47 Cb 0.32 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 2vxx h TYR 47 CO 0.03 0.60 -0.03 0.37 -1.05 0.00 0.00 178.16 178.08 2vxx h GLN 48 N 1.07 0.32 -0.47 4.88 4.15 -1.18 -0.70 115.11 123.19 2vxx h GLN 48 Ca 0.35 -0.12 0.08 0.00 0.77 0.00 0.00 58.65 59.74 2vxx h GLN 48 Cb 0.04 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.64 2vxx h GLN 48 CO -0.11 0.57 0.05 -0.22 -1.93 0.00 0.00 178.83 177.20 2vxx h LYS 49 N 0.04 0.17 -0.82 1.69 3.64 -0.84 -1.46 116.57 118.99 2vxx h LYS 49 Ca 0.04 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 2vxx h LYS 49 Cb 0.45 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.18 2vxx h LYS 49 CO 0.01 0.11 0.53 0.45 -2.27 0.00 0.00 179.45 178.28 2vxx h HIS 50 N 0.18 0.99 -0.99 1.91 3.86 -0.91 -0.69 115.15 119.48 2vxx h HIS 50 Ca 0.23 0.03 0.06 0.00 -1.16 0.00 0.00 60.37 59.53 2vxx h HIS 50 Cb 0.33 -0.33 -0.06 0.00 1.06 0.00 0.00 27.41 28.40 2vxx h HIS 50 CO -0.25 0.58 0.65 1.25 0.86 0.00 0.00 177.93 181.01 2vxx h HIS 51 N 1.03 1.19 -0.43 2.45 -0.00 -0.58 -1.99 115.15 116.81 2vxx h HIS 51 Ca 0.32 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.62 2vxx h HIS 51 Cb -0.01 -0.39 -0.01 0.00 -0.00 0.00 0.00 27.41 26.99 2vxx h HIS 51 CO -0.02 0.63 -0.13 0.74 -0.00 0.00 0.00 177.93 179.15 2vxx h PHE 52 N 1.18 0.97 0.00 5.26 0.04 -0.12 -3.38 116.94 120.88 2vxx h PHE 52 Ca 0.42 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 60.98 2vxx h PHE 52 Cb 0.14 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.06 2vxx h PHE 52 CO -0.00 0.97 -0.98 1.33 -0.60 0.00 0.00 178.31 179.03 2vxx n VAL 53 N -4.26 0.00 -1.77 -0.55 0.24 -0.57 -5.00 118.33 106.42 2vxx n VAL 53 Ca -0.01 -0.17 -0.40 0.00 -2.04 0.00 0.00 64.34 61.72 2vxx n VAL 53 Cb 0.39 0.81 0.02 0.00 -1.47 0.00 0.00 33.84 33.59 2vxx n VAL 53 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 2vxx n VAL 54 N -1.53 2.73 -3.96 3.34 3.14 -0.77 -4.99 118.33 116.29 2vxx n VAL 54 Ca 0.02 -0.50 -0.11 0.00 -2.96 0.00 0.00 64.34 60.79 2vxx n VAL 54 Cb 0.29 -1.87 -0.02 0.00 -1.06 0.00 0.00 33.84 31.18 2vxx n VAL 54 CO 0.00 0.00 0.00 -1.83 -6.46 0.00 0.00 176.83 168.54 2vxx s GLU 55 N -2.42 1.96 0.00 1.45 -1.05 -1.26 -4.95 118.70 112.42 2vxx s GLU 55 Ca 0.60 -1.52 0.00 0.00 -0.15 0.00 0.00 54.97 53.91 2vxx s GLU 55 Cb -0.45 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 33.76 2vxx s GLU 55 CO 0.58 -0.86 0.00 0.41 0.95 0.00 0.00 175.26 176.34 2vxx n GLY 56 N -0.52 -1.20 0.36 -3.83 0.00 -1.26 -4.44 105.19 94.32 2vxx n GLY 56 Ca -0.03 -2.11 0.13 0.00 0.00 0.00 0.00 46.02 44.00 2vxx n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vxx h ALA 57 N 0.00 2.00 -0.48 4.61 0.00 -2.07 -1.67 119.26 121.64 2vxx h ALA 57 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2vxx h ALA 57 Cb 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 2vxx h ALA 57 CO 0.00 -0.17 0.10 0.39 0.00 0.00 0.00 179.25 179.58 2vxx n GLU 58 N -4.48 2.97 -0.03 0.00 4.71 -1.26 -4.78 120.64 117.77 2vxx n GLU 58 Ca 0.12 -3.03 -0.15 0.00 -0.01 0.00 0.00 57.16 54.10 2vxx n GLU 58 Cb 0.42 -1.99 -0.09 0.00 -1.01 0.00 0.00 31.44 28.77 2vxx n GLU 58 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 2vxx h PHE 59 N 1.93 -1.58 0.17 -0.32 3.57 -1.51 -2.43 116.94 116.76 2vxx h PHE 59 Ca 0.17 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 2vxx h PHE 59 Cb 1.88 0.71 0.00 0.00 2.79 0.00 0.00 35.95 41.33 2vxx h PHE 59 CO 0.96 -0.53 -0.08 -0.92 -2.23 0.00 0.00 178.31 175.50 2vxx h TYR 60 N -0.55 -0.21 -0.31 0.41 3.20 -1.86 0.23 116.97 117.88 2vxx h TYR 60 Ca 0.04 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 2vxx h TYR 60 Cb 0.67 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 2vxx h TYR 60 CO -0.59 -0.04 -0.06 -1.35 -1.64 0.00 0.00 178.16 174.47 2vxx h PRO 61 N -0.33 0.50 -0.23 1.82 0.11 -1.94 -1.11 132.00 130.82 2vxx h PRO 61 Ca -0.02 -0.12 -0.08 0.00 0.11 0.00 0.00 66.00 65.89 2vxx h PRO 61 Cb 0.26 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 2vxx h PRO 61 CO 0.04 0.58 -0.15 -0.07 -0.21 0.00 0.00 178.00 178.18 2vxx h LEU 62 N 0.48 0.53 -0.73 2.35 3.38 -1.18 0.17 115.31 120.30 2vxx h LEU 62 Ca 0.10 -0.44 0.14 0.00 0.09 0.00 0.00 57.88 57.77 2vxx h LEU 62 Cb 0.41 -0.15 -0.14 0.00 0.09 0.00 0.00 40.66 40.87 2vxx h LEU 62 CO 0.02 0.85 -0.22 -0.74 0.09 0.00 0.00 178.44 178.44 2vxx h HIS 63 N 0.22 -0.51 -0.06 1.13 2.76 -0.34 0.15 115.15 118.49 2vxx h HIS 63 Ca 0.05 0.07 -0.01 0.00 -2.20 0.00 0.00 60.37 58.27 2vxx h HIS 63 Cb 0.67 0.34 -0.00 0.00 1.55 0.00 0.00 27.41 29.97 2vxx h HIS 63 CO 0.07 -0.34 -0.01 1.96 -1.30 0.00 0.00 177.93 178.31 2vxx h GLN 64 N -0.03 0.11 -0.68 5.26 4.20 -0.92 -3.04 115.11 120.02 2vxx h GLN 64 Ca 0.34 -0.04 0.09 0.00 0.06 0.00 0.00 58.65 59.10 2vxx h GLN 64 Cb 0.55 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.25 2vxx h GLN 64 CO -0.77 0.43 0.32 0.35 -0.67 0.00 0.00 178.83 178.49 2vxx h PHE 65 N -0.22 0.56 -0.80 2.96 3.04 -0.24 -1.19 116.94 121.06 2vxx h PHE 65 Ca 0.02 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 61.95 2vxx h PHE 65 Cb 0.39 -0.15 -0.04 0.00 2.56 0.00 0.00 35.95 38.71 2vxx h PHE 65 CO 0.05 0.19 0.33 0.74 -2.02 0.00 0.00 178.31 177.60 2vxx h PHE 66 N 0.54 1.20 -0.31 0.41 0.04 -1.01 -1.19 116.94 116.63 2vxx h PHE 66 Ca 0.34 -0.09 -0.06 0.00 2.80 0.00 0.00 57.97 60.96 2vxx h PHE 66 Cb 0.37 -0.36 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 2vxx h PHE 66 CO -0.12 0.90 -0.04 0.37 -0.60 0.00 0.00 178.31 178.82 2vxx h GLN 67 N 1.15 0.57 -0.95 1.51 4.15 -1.33 -0.79 115.11 119.42 2vxx h GLN 67 Ca 0.27 -0.20 0.11 0.00 0.77 0.00 0.00 58.65 59.60 2vxx h GLN 67 Cb 0.20 -0.04 -0.08 0.00 0.21 0.00 0.00 27.48 27.77 2vxx h GLN 67 CO -0.02 0.73 0.58 -0.44 -1.93 0.00 0.00 178.83 177.75 2vxx h ASP 68 N 0.35 0.84 0.21 -0.69 3.32 -1.01 -1.91 116.42 117.53 2vxx h ASP 68 Ca 0.08 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2vxx h ASP 68 Cb 0.50 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2vxx h ASP 68 CO 0.02 0.45 -0.10 0.00 -1.72 0.00 0.00 179.24 177.90 2vxx h TYR 70 N -0.58 0.49 -0.67 0.00 -0.00 -1.02 -0.60 116.97 114.60 2vxx h TYR 70 Ca -0.03 -0.09 -0.07 0.00 -0.00 0.00 0.00 58.73 58.54 2vxx h TYR 70 Cb 0.42 -0.13 -0.03 0.00 -0.00 0.00 0.00 36.73 37.00 2vxx h TYR 70 CO 0.02 0.63 0.14 0.93 -0.00 0.00 0.00 178.16 179.87 2vxx h GLU 71 N 0.40 1.07 -0.40 0.10 5.08 -1.38 0.30 114.58 119.76 2vxx h GLU 71 Ca 0.07 -0.26 -0.10 0.00 -1.00 0.00 0.00 59.36 58.07 2vxx h GLU 71 Cb 0.58 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2vxx h GLU 71 CO 0.04 0.96 -0.14 0.37 -1.00 0.00 0.00 179.01 179.24 2vxx h GLN 72 N 1.01 0.80 -0.61 2.33 4.15 -1.07 -2.77 115.11 118.96 2vxx h GLN 72 Ca 0.21 -0.33 -0.04 0.00 0.77 0.00 0.00 58.65 59.26 2vxx h GLN 72 Cb 0.39 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.02 2vxx h GLN 72 CO 0.01 0.95 0.23 0.28 -1.93 0.00 0.00 178.83 178.36 2vxx h VAL 73 N 0.61 1.23 -0.56 2.39 2.07 -0.81 -2.10 116.25 119.08 2vxx h VAL 73 Ca 0.10 -0.75 0.09 0.00 0.82 0.00 0.00 66.70 66.96 2vxx h VAL 73 Cb 0.68 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 2vxx h VAL 73 CO 0.05 0.29 0.38 -0.61 0.02 0.00 0.00 177.57 177.70 2vxx h GLN 74 N 0.85 0.38 -0.59 1.57 5.75 -0.37 -0.28 115.11 122.42 2vxx h GLN 74 Ca 0.20 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.59 2vxx h GLN 74 Cb 0.23 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.67 2vxx h GLN 74 CO -0.01 0.25 0.04 0.22 -2.65 0.00 0.00 178.83 176.68 2vxx h ASP 75 N 0.39 0.98 -0.67 -0.69 3.58 -1.09 -1.70 116.42 117.22 2vxx h ASP 75 Ca 0.26 -0.29 -0.00 0.00 0.42 0.00 0.00 57.03 57.42 2vxx h ASP 75 Cb 0.49 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 41.25 2vxx h ASP 75 CO -0.07 1.02 0.40 0.45 -2.88 0.00 0.00 179.24 178.16 2vxx h HIS 76 N 0.90 0.89 -0.18 0.28 3.86 -0.80 -2.38 115.15 117.72 2vxx h HIS 76 Ca 0.17 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.42 2vxx h HIS 76 Cb 0.49 -0.29 -0.05 0.00 1.06 0.00 0.00 27.41 28.62 2vxx h HIS 76 CO 0.04 0.60 -0.13 0.28 0.86 0.00 0.00 177.93 179.58 2vxx h VAL 77 N 0.91 0.63 0.03 2.45 2.07 -0.94 -1.78 116.25 119.63 2vxx h VAL 77 Ca 0.24 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.77 2vxx h VAL 77 Cb -0.02 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2vxx h VAL 77 CO -0.04 0.00 -0.10 -0.74 0.02 0.00 0.00 177.57 176.70 2vxx h HIS 78 N -0.12 -0.26 -0.84 1.57 6.17 -1.21 -0.90 115.15 119.55 2vxx h HIS 78 Ca 0.11 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.20 2vxx h HIS 78 Cb 0.29 0.11 -0.04 0.00 2.52 0.00 0.00 27.41 30.29 2vxx h HIS 78 CO -0.27 -0.16 0.54 0.00 0.71 0.00 0.00 177.93 178.75 2vxx h ALA 79 N 0.76 1.07 -0.02 5.26 0.00 -1.28 -2.06 119.26 123.00 2vxx h ALA 79 Ca 0.03 -0.07 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 2vxx h ALA 79 Cb 0.22 -0.34 0.02 0.00 0.00 0.00 0.00 17.79 17.69 2vxx h ALA 79 CO -0.08 0.50 -0.78 -0.07 0.00 0.00 0.00 179.25 178.81 2vxx h LEU 80 N 1.15 0.72 -0.55 0.00 3.38 -1.19 -1.64 115.31 117.18 2vxx h LEU 80 Ca 0.31 -0.73 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 2vxx h LEU 80 Cb -0.10 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 2vxx h LEU 80 CO -0.06 1.36 0.31 1.23 0.09 0.00 0.00 178.44 181.37 2vxx h GLY 81 N 0.15 0.82 1.01 0.83 0.00 -1.13 0.50 103.07 105.26 2vxx h GLY 81 Ca -0.09 -0.37 -0.13 0.00 0.00 0.00 0.00 47.33 46.74 2vxx h GLY 81 CO 0.16 0.35 -0.32 -2.09 0.00 0.00 0.00 176.54 174.64 2vxx h GLU 82 N 0.74 0.76 -0.34 4.80 4.81 -1.42 -2.76 114.58 121.17 2vxx h GLU 82 Ca 0.20 -0.41 -0.10 0.00 -0.13 0.00 0.00 59.36 58.92 2vxx h GLU 82 Cb 0.03 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2vxx h GLU 82 CO -0.03 1.03 -0.21 -0.09 -0.73 0.00 0.00 179.01 178.98 2vxx h ARG 83 N 0.52 0.66 -0.26 1.92 2.43 -1.13 -1.66 114.38 116.87 2vxx h ARG 83 Ca 0.05 -0.25 -0.00 0.00 -0.81 0.00 0.00 59.98 58.96 2vxx h ARG 83 Cb 0.90 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.40 2vxx h ARG 83 CO 0.08 0.83 0.15 1.25 -1.51 0.00 0.00 179.97 180.76 2vxx h LEU 84 N 0.58 0.32 -0.36 3.80 6.46 -0.85 0.19 115.31 125.45 2vxx h LEU 84 Ca 0.09 -0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.80 2vxx h LEU 84 Cb 0.68 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 40.51 2vxx h LEU 84 CO 0.05 0.29 0.21 -1.13 -0.62 0.00 0.00 178.44 177.24 2vxx h ASN 85 N 0.31 0.33 -0.94 1.25 -1.24 -1.44 -1.81 115.58 112.04 2vxx h ASN 85 Ca 0.09 0.01 0.14 0.00 0.71 0.00 0.00 56.30 57.24 2vxx h ASN 85 Cb 0.04 -0.06 -0.08 0.00 0.73 0.00 0.00 38.32 38.94 2vxx h ASN 85 CO -0.02 0.24 0.60 1.23 -1.29 0.00 0.00 177.43 178.19 2vxx h GLY 86 N 0.42 1.42 1.69 1.57 0.00 -0.62 0.39 103.07 107.93 2vxx h GLY 86 Ca 0.14 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2vxx h GLY 86 CO -0.07 0.11 0.00 1.04 0.00 0.00 0.00 176.54 177.62 2vxx n LEU 87 N -4.60 0.00 0.00 3.11 4.77 0.62 -4.61 117.00 116.30 2vxx n LEU 87 Ca 0.18 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 2vxx n LEU 87 Cb 0.43 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2vxx n LEU 87 CO 0.28 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 2vxx n GLY 88 N 0.73 1.04 1.21 -0.72 0.00 0.13 -4.41 105.19 103.17 2vxx n GLY 88 Ca 0.09 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.05 2vxx n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vxx n GLY 89 N -1.87 1.92 3.04 -0.02 0.00 -0.72 -0.80 105.19 106.74 2vxx n GLY 89 Ca 0.00 -2.16 -0.30 0.00 0.00 0.00 0.00 46.02 43.56 2vxx n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vxx s VAL 90 N -0.13 1.63 0.31 1.61 1.01 -1.26 -4.27 120.40 119.31 2vxx s VAL 90 Ca 0.19 -0.68 -0.28 0.00 0.00 0.00 0.00 61.98 61.22 2vxx s VAL 90 Cb -0.01 -1.52 -0.09 0.00 0.00 0.00 0.00 36.38 34.75 2vxx s VAL 90 CO 0.12 0.47 1.08 -2.16 0.00 0.00 0.00 175.10 174.61 2vxx s PRO 91 N 1.43 4.51 0.48 2.72 0.04 -1.26 -4.74 135.00 138.17 2vxx s PRO 91 Ca 0.04 1.70 -0.23 0.00 0.04 0.00 0.00 61.00 62.55 2vxx s PRO 91 Cb -0.13 -3.00 -0.07 0.00 0.04 0.00 0.00 34.50 31.34 2vxx s PRO 91 CO -0.10 0.12 1.27 0.54 0.04 0.00 0.00 177.00 178.87 2vxx s VAL 92 N -1.31 2.60 0.00 -0.36 0.11 -1.26 -4.93 120.40 115.25 2vxx s VAL 92 Ca 0.48 0.47 0.00 0.00 -2.93 0.00 0.00 61.98 60.00 2vxx s VAL 92 Cb -0.29 -3.25 0.00 0.00 -1.53 0.00 0.00 36.38 31.31 2vxx s VAL 92 CO 0.37 0.01 0.00 0.00 -3.33 0.00 0.00 175.10 172.15 2vxx n ALA 93 N -0.54 0.48 -2.27 1.54 0.00 -1.26 -4.95 120.51 113.51 2vxx n ALA 93 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 2vxx n ALA 93 Cb 0.46 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.85 2vxx n ALA 93 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2vxx s GLY 94 N -0.54 2.36 0.26 0.00 0.00 -1.26 -4.92 107.32 103.21 2vxx s GLY 94 Ca 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 44.72 44.62 2vxx s GLY 94 CO 0.00 0.12 1.74 0.74 0.00 0.00 0.00 173.10 175.71 2vxx h PHE 95 N 2.66 0.66 -0.21 1.90 0.04 -2.00 0.11 116.94 120.10 2vxx h PHE 95 Ca -0.48 0.04 -0.05 0.00 2.80 0.00 0.00 57.97 60.28 2vxx h PHE 95 Cb 1.18 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 39.15 2vxx h PHE 95 CO 0.62 0.12 -0.05 0.37 -0.60 0.00 0.00 178.31 178.77 2vxx h GLN 96 N 0.53 0.40 -0.45 1.51 4.15 -1.99 -1.27 115.11 118.00 2vxx h GLN 96 Ca 0.45 -0.15 -0.13 0.00 0.77 0.00 0.00 58.65 59.59 2vxx h GLN 96 Cb 0.68 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 2vxx h GLN 96 CO -0.39 0.65 -0.24 0.37 -1.93 0.00 0.00 178.83 177.29 2vxx h GLN 97 N 0.13 0.94 -0.15 1.69 5.75 -1.84 -1.56 115.11 120.06 2vxx h GLN 97 Ca 0.05 -0.41 0.03 0.00 -0.15 0.00 0.00 58.65 58.18 2vxx h GLN 97 Cb 0.50 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.99 2vxx h GLN 97 CO 0.02 1.07 -0.06 -0.07 -2.65 0.00 0.00 178.83 177.14 2vxx h LEU 98 N 0.80 -0.20 -1.55 -2.39 3.38 -0.77 -1.36 115.31 113.22 2vxx h LEU 98 Ca 0.10 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.13 2vxx h LEU 98 Cb 0.81 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 2vxx h LEU 98 CO 0.07 -0.08 0.31 0.00 0.09 0.00 0.00 178.44 178.83 2vxx h ALA 99 N 1.10 1.70 -0.12 1.53 0.00 -1.04 -2.07 119.26 120.36 2vxx h ALA 99 Ca 0.08 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 2vxx h ALA 99 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2vxx h ALA 99 CO -0.17 0.27 -0.62 0.00 0.00 0.00 0.00 179.25 178.73 2vxx h ALA 100 N 1.71 0.70 0.00 0.00 0.00 -0.62 -3.32 119.26 117.74 2vxx h ALA 100 Ca 0.18 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2vxx h ALA 100 Cb -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2vxx h ALA 100 CO -0.04 0.72 -1.17 1.28 0.00 0.00 0.00 179.25 180.04 2vxx n LEU 101 N -3.90 0.70 -4.70 0.00 4.77 -0.58 -4.94 117.00 108.35 2vxx n LEU 101 Ca -0.03 0.27 -0.44 0.00 -0.03 0.00 0.00 56.01 55.77 2vxx n LEU 101 Cb 0.64 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.65 2vxx n LEU 101 CO 0.47 -0.15 1.15 0.00 -1.33 0.00 0.00 177.39 177.52 2vxx s PHE 104 N -2.86 2.31 -0.32 0.00 -0.12 -1.26 -4.92 117.98 110.82 2vxx s PHE 104 Ca 0.14 -0.51 -0.24 0.00 -0.05 0.00 0.00 56.93 56.27 2vxx s PHE 104 Cb 0.18 -1.28 0.00 0.00 -0.63 0.00 0.00 43.02 41.29 2vxx s PHE 104 CO 0.68 0.55 0.82 0.99 -0.05 0.00 0.00 175.22 178.21 2vxx s THR 105 N -2.66 4.75 0.62 -4.49 2.01 -1.26 -5.03 115.64 109.58 2vxx s THR 105 Ca 0.32 1.19 -0.16 0.00 0.31 0.00 0.00 61.69 63.34 2vxx s THR 105 Cb 0.02 -4.18 -0.02 0.00 0.01 0.00 0.00 72.50 68.32 2vxx s THR 105 CO 0.15 -0.31 1.10 -2.84 -0.69 0.00 0.00 174.62 172.04 2vxx s PRO 106 N 3.05 3.04 0.28 4.92 0.02 -1.26 -4.96 135.00 140.10 2vxx s PRO 106 Ca 0.33 1.39 -0.30 0.00 0.02 0.00 0.00 61.00 62.45 2vxx s PRO 106 Cb -0.14 -1.98 -0.10 0.00 0.02 0.00 0.00 34.50 32.30 2vxx s PRO 106 CO 0.14 -1.06 1.46 -2.00 -0.33 0.00 0.00 177.00 175.21 2vxx s GLU 107 N -3.91 4.23 1.04 5.54 2.12 -1.26 -5.00 118.70 121.45 2vxx s GLU 107 Ca 0.67 2.39 -0.12 0.00 0.36 0.00 0.00 54.97 58.27 2vxx s GLU 107 Cb -0.20 -3.07 0.21 0.00 0.26 0.00 0.00 34.13 31.33 2vxx s GLU 107 CO 0.37 -0.45 1.08 -2.14 -0.54 0.00 0.00 175.26 173.58 2vxx s PRO 108 N -0.77 0.11 0.61 4.30 0.02 -1.26 -4.99 135.00 133.02 2vxx s PRO 108 Ca 0.58 0.58 -0.19 0.00 0.02 0.00 0.00 61.00 62.00 2vxx s PRO 108 Cb -0.43 -1.69 -0.03 0.00 0.02 0.00 0.00 34.50 32.36 2vxx s PRO 108 CO 0.48 -2.96 1.24 -1.21 -0.33 0.00 0.00 177.00 174.22 2vxx s GLU 109 N -4.86 2.83 0.00 5.54 0.41 -1.26 -4.89 118.70 116.47 2vxx s GLU 109 Ca 0.66 1.92 0.00 0.00 -0.41 0.00 0.00 54.97 57.14 2vxx s GLU 109 Cb -0.20 -1.90 0.00 0.00 -1.78 0.00 0.00 34.13 30.25 2vxx s GLU 109 CO 0.59 -1.35 0.00 0.41 -0.49 0.00 0.00 175.26 174.43 2vxx n GLY 110 N 0.65 3.19 3.43 -1.39 0.00 -1.26 -5.02 105.19 104.79 2vxx n GLY 110 Ca 0.14 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 2vxx n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vxx s ALA 111 N -2.99 3.38 0.48 4.61 0.00 -1.26 -5.08 121.76 120.91 2vxx s ALA 111 Ca 0.00 -1.65 0.01 0.00 0.00 0.00 0.00 51.96 50.32 2vxx s ALA 111 Cb 0.00 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.43 2vxx s ALA 111 CO 0.00 -1.32 0.70 -0.06 0.00 0.00 0.00 175.76 175.08 2vxx s PHE 112 N 1.63 3.07 0.75 0.00 0.08 -1.26 -5.09 117.98 117.17 2vxx s PHE 112 Ca 0.04 0.11 -0.11 0.00 0.12 0.00 0.00 56.93 57.09 2vxx s PHE 112 Cb -0.19 -2.46 0.05 0.00 -0.57 0.00 0.00 43.02 39.85 2vxx s PHE 112 CO 0.08 -0.53 1.09 0.54 -0.10 0.00 0.00 175.22 176.30 2vxx s ASN 113 N -4.29 4.67 0.43 1.36 6.03 -1.26 -4.79 114.94 117.08 2vxx s ASN 113 Ca 0.52 1.81 0.18 0.00 -1.03 0.00 0.00 52.86 54.34 2vxx s ASN 113 Cb -0.10 -2.52 0.96 0.00 -3.03 0.00 0.00 41.25 36.56 2vxx s ASN 113 CO 0.38 -1.93 1.90 0.00 -2.03 0.00 0.00 177.10 175.42 2vxx h ARG 115 N 0.00 0.64 -0.39 0.00 2.43 -1.99 -1.81 114.38 113.26 2vxx h ARG 115 Ca -0.00 -0.28 -0.02 0.00 -0.81 0.00 0.00 59.98 58.87 2vxx h ARG 115 Cb 0.57 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2vxx h ARG 115 CO 0.04 0.87 0.18 1.96 -1.51 0.00 0.00 179.97 181.50 2vxx h GLN 116 N 0.39 0.56 -0.18 0.20 4.20 -1.76 -1.29 115.11 117.22 2vxx h GLN 116 Ca 0.07 -0.09 0.04 0.00 0.06 0.00 0.00 58.65 58.73 2vxx h GLN 116 Cb 0.68 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 2vxx h GLN 116 CO 0.05 0.50 -0.04 0.52 -0.67 0.00 0.00 178.83 179.19 2vxx h MET 117 N 0.48 0.01 -0.75 1.46 2.86 -1.17 0.01 114.93 117.84 2vxx h MET 117 Ca 0.13 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 2vxx h MET 117 Cb 0.13 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.75 2vxx h MET 117 CO -0.02 0.01 0.48 -0.07 1.06 0.00 0.00 176.91 178.37 2vxx h LEU 118 N 0.01 0.87 -0.63 1.22 3.38 -1.22 -1.63 115.31 117.32 2vxx h LEU 118 Ca 0.09 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 2vxx h LEU 118 Cb 0.13 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2vxx h LEU 118 CO -0.18 0.65 0.20 0.28 0.09 0.00 0.00 178.44 179.48 2vxx h SER 119 N 1.02 0.92 -0.68 -0.43 0.02 -0.72 -0.32 113.55 113.36 2vxx h SER 119 Ca 0.27 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2vxx h SER 119 Cb -0.09 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.17 2vxx h SER 119 CO -0.06 0.88 0.42 0.78 -1.14 0.00 0.00 176.83 177.71 2vxx h ASN 120 N 0.91 0.80 -0.57 3.07 2.35 -0.74 -1.84 115.58 119.56 2vxx h ASN 120 Ca 0.21 -0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.88 2vxx h ASN 120 Cb 0.29 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 2vxx h ASN 120 CO -0.01 0.62 0.25 0.44 -1.65 0.00 0.00 177.43 177.08 2vxx h ASP 121 N 0.92 0.76 0.20 5.81 3.32 -0.93 -1.19 116.42 125.31 2vxx h ASP 121 Ca 0.24 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 2vxx h ASP 121 Cb -0.05 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2vxx h ASP 121 CO -0.05 0.70 -0.16 0.25 -1.72 0.00 0.00 179.24 178.27 2vxx h LEU 122 N 0.77 -0.41 -0.69 1.55 5.85 -0.85 -1.05 115.31 120.49 2vxx h LEU 122 Ca 0.19 0.03 0.11 0.00 0.84 0.00 0.00 57.88 59.05 2vxx h LEU 122 Cb 0.16 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.25 2vxx h LEU 122 CO -0.02 -0.25 0.30 1.56 -0.34 0.00 0.00 178.44 179.69 2vxx h GLN 123 N -0.37 0.48 -0.56 1.25 4.20 -1.23 0.16 115.11 119.03 2vxx h GLN 123 Ca -0.01 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.70 2vxx h GLN 123 Cb 0.33 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 2vxx h GLN 123 CO -0.02 0.32 0.34 0.00 -0.67 0.00 0.00 178.83 178.80 2vxx h ALA 124 N 1.46 0.72 -0.49 3.87 0.00 -1.00 -1.20 119.26 122.62 2vxx h ALA 124 Ca 0.36 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.16 2vxx h ALA 124 Cb 0.45 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2vxx h ALA 124 CO -0.32 0.06 -0.09 0.93 0.00 0.00 0.00 179.25 179.84 2vxx h GLU 125 N 0.67 0.88 -0.24 0.00 4.39 0.15 -1.99 114.58 118.44 2vxx h GLU 125 Ca 0.23 -0.29 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 2vxx h GLU 125 Cb 0.02 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 2vxx h GLU 125 CO -0.10 0.93 0.08 1.96 -1.16 0.00 0.00 179.01 180.73 2vxx h GLN 126 N 0.80 0.37 -0.70 2.33 4.20 -0.46 0.16 115.11 121.80 2vxx h GLN 126 Ca 0.13 -0.08 0.04 0.00 0.06 0.00 0.00 58.65 58.81 2vxx h GLN 126 Cb 0.60 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.27 2vxx h GLN 126 CO 0.04 0.44 0.43 0.00 -0.67 0.00 0.00 178.83 179.06 2vxx h ALA 127 N 0.92 0.93 -0.46 3.87 0.00 -1.16 -2.07 119.26 121.28 2vxx h ALA 127 Ca 0.08 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2vxx h ALA 127 Cb 0.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2vxx h ALA 127 CO -0.00 0.17 -0.19 0.82 0.00 0.00 0.00 179.25 180.05 2vxx h ILE 128 N 0.82 1.27 -0.81 0.00 2.04 -1.08 -2.76 117.51 116.99 2vxx h ILE 128 Ca 0.29 -1.35 0.11 0.00 1.00 0.00 0.00 64.86 64.92 2vxx h ILE 128 Cb 0.08 1.16 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2vxx h ILE 128 CO -0.13 0.46 0.44 0.40 0.00 0.00 0.00 178.15 179.31 2vxx h ILE 129 N 0.79 0.83 -0.42 -0.67 2.04 -0.37 -0.05 117.51 119.66 2vxx h ILE 129 Ca 0.11 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 2vxx h ILE 129 Cb 0.76 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2vxx h ILE 129 CO 0.06 0.13 0.20 1.23 0.00 0.00 0.00 178.15 179.77 2vxx h GLY 130 N 0.69 0.65 0.93 5.37 0.00 -1.14 -2.48 103.07 107.09 2vxx h GLY 130 Ca 0.41 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 2vxx h GLY 130 CO -0.29 0.31 -0.00 -2.08 0.00 0.00 0.00 176.54 174.47 2vxx h VAL 131 N 0.54 1.26 -0.57 4.60 2.07 -1.13 -2.33 116.25 120.69 2vxx h VAL 131 Ca 0.14 -1.00 0.07 0.00 0.82 0.00 0.00 66.70 66.74 2vxx h VAL 131 Cb 0.12 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 2vxx h VAL 131 CO -0.02 0.33 0.25 -0.07 0.02 0.00 0.00 177.57 178.08 2vxx h LEU 132 N 0.47 0.30 -0.07 2.57 3.38 -0.93 0.33 115.31 121.36 2vxx h LEU 132 Ca 0.10 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2vxx h LEU 132 Cb 0.47 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 2vxx h LEU 132 CO 0.02 0.19 0.04 0.03 0.09 0.00 0.00 178.44 178.81 2vxx h ARG 133 N 0.46 0.10 -0.04 1.13 3.08 -1.38 0.29 114.38 118.03 2vxx h ARG 133 Ca 0.27 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.34 2vxx h ARG 133 Cb 0.27 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 2vxx h ARG 133 CO -0.24 0.17 -0.16 0.37 -1.07 0.00 0.00 179.97 179.03 2vxx h GLN 134 N 0.01 -0.24 -0.20 0.04 4.15 -0.90 -1.07 115.11 116.89 2vxx h GLN 134 Ca 0.03 0.02 -0.13 0.00 0.77 0.00 0.00 58.65 59.33 2vxx h GLN 134 Cb 0.10 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 2vxx h GLN 134 CO -0.00 -0.16 -0.41 1.96 -1.93 0.00 0.00 178.83 178.28 2vxx h GLN 135 N -0.25 0.48 -0.17 1.69 1.08 -0.19 -1.64 115.11 116.10 2vxx h GLN 135 Ca 0.06 -0.24 -0.01 0.00 -1.45 0.00 0.00 58.65 57.01 2vxx h GLN 135 Cb 0.34 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 2vxx h GLN 135 CO -0.18 0.81 0.06 0.00 -0.95 0.00 0.00 178.83 178.56 2vxx h ALA 136 N 1.16 0.22 -0.73 3.87 0.00 -0.33 -1.07 119.26 122.38 2vxx h ALA 136 Ca 0.03 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.86 2vxx h ALA 136 Cb 0.89 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 2vxx h ALA 136 CO 0.08 -0.16 0.45 1.15 0.00 0.00 0.00 179.25 180.76 2vxx h THR 137 N 0.10 1.06 -0.34 0.00 2.02 -1.04 -1.76 112.91 112.94 2vxx h THR 137 Ca 0.06 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 2vxx h THR 137 Cb 0.22 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2vxx h THR 137 CO -0.00 0.16 0.17 -0.61 0.37 0.00 0.00 175.52 175.60 2vxx h GLN 138 N 0.86 0.49 -0.23 6.66 4.15 -1.20 -1.44 115.11 124.40 2vxx h GLN 138 Ca 0.31 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.65 2vxx h GLN 138 Cb 0.08 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 2vxx h GLN 138 CO -0.14 0.44 0.14 0.00 -1.93 0.00 0.00 178.83 177.35 2vxx h ALA 139 N 1.02 0.30 0.05 3.38 0.00 -0.78 -0.38 119.26 122.85 2vxx h ALA 139 Ca 0.12 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2vxx h ALA 139 Cb 0.11 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2vxx h ALA 139 CO -0.02 -0.20 -0.33 0.93 0.00 0.00 0.00 179.25 179.64 2vxx h GLU 140 N 0.28 -0.50 -0.78 0.00 5.08 -1.29 0.13 114.58 117.51 2vxx h GLU 140 Ca 0.08 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.60 2vxx h GLU 140 Cb 0.02 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 2vxx h GLU 140 CO -0.02 -0.33 0.52 1.03 -1.00 0.00 0.00 179.01 179.21 2vxx h SER 141 N -0.51 0.54 0.54 1.42 0.87 -0.97 -0.15 113.55 115.28 2vxx h SER 141 Ca 0.05 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2vxx h SER 141 Cb 0.58 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 2vxx h SER 141 CO -0.24 0.30 -0.31 0.18 -0.53 0.00 0.00 176.83 176.22 2vxx n LEU 142 N -4.51 0.48 0.00 2.23 4.77 -0.18 -4.94 117.00 114.85 2vxx n LEU 142 Ca 0.14 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2vxx n LEU 142 Cb 0.43 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2vxx n LEU 142 CO 0.32 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2vxx n GLY 143 N 1.44 0.64 3.35 -0.72 0.00 -0.07 -4.99 105.19 104.84 2vxx n GLY 143 Ca 0.08 -0.50 -0.44 0.00 0.00 0.00 0.00 46.02 45.16 2vxx n GLY 143 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2vxx n ASP 144 N 0.91 5.27 -0.29 1.61 -0.08 0.31 -4.85 116.55 119.43 2vxx n ASP 144 Ca 0.00 -3.02 0.00 0.00 -1.51 0.00 0.00 54.79 50.26 2vxx n ASP 144 Cb 0.00 -1.53 0.13 0.00 2.34 0.00 0.00 41.12 42.06 2vxx n ASP 144 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 2vxx h ARG 145 N 6.81 0.86 -0.45 -0.67 3.08 -1.89 -2.45 114.38 119.67 2vxx h ARG 145 Ca 0.31 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 60.17 2vxx h ARG 145 Cb 0.83 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 2vxx h ARG 145 CO 1.28 0.57 -0.28 0.00 -1.07 0.00 0.00 179.97 180.47 2vxx h ALA 146 N 1.39 0.65 -0.41 0.04 0.00 -1.95 -0.52 119.26 118.45 2vxx h ALA 146 Ca 0.35 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2vxx h ALA 146 Cb 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2vxx h ALA 146 CO -0.18 0.68 0.21 1.15 0.00 0.00 0.00 179.25 181.11 2vxx h THR 147 N 0.83 1.17 -0.52 0.00 2.02 -1.93 0.31 112.91 114.79 2vxx h THR 147 Ca 0.09 -0.46 0.03 0.00 0.77 0.00 0.00 66.41 66.84 2vxx h THR 147 Cb 0.87 0.72 -0.04 0.00 -1.74 0.00 0.00 68.15 67.96 2vxx h THR 147 CO 0.08 0.18 0.31 0.00 0.37 0.00 0.00 175.52 176.46 2vxx h ALA 148 N 1.06 0.67 -0.11 6.16 0.00 -1.26 0.15 119.26 125.93 2vxx h ALA 148 Ca 0.14 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2vxx h ALA 148 Cb 0.10 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2vxx h ALA 148 CO -0.02 0.02 -0.03 -0.92 0.00 0.00 0.00 179.25 178.30 2vxx h TYR 149 N 0.62 -0.06 -0.35 0.00 5.03 -0.88 -0.83 116.97 120.50 2vxx h TYR 149 Ca 0.21 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.56 2vxx h TYR 149 Cb 0.03 0.04 -0.03 0.00 1.55 0.00 0.00 36.73 38.32 2vxx h TYR 149 CO -0.07 -0.05 0.16 1.25 -1.32 0.00 0.00 178.16 178.14 2vxx h LEU 150 N -0.00 0.22 -0.73 2.82 5.85 -0.56 -1.65 115.31 121.26 2vxx h LEU 150 Ca 0.05 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2vxx h LEU 150 Cb 0.08 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 2vxx h LEU 150 CO -0.11 0.17 0.46 1.88 -0.34 0.00 0.00 178.44 180.50 2vxx h TYR 151 N 0.34 0.87 -0.49 1.25 0.05 -0.56 -1.37 116.97 117.04 2vxx h TYR 151 Ca 0.15 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.94 2vxx h TYR 151 Cb 0.08 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.51 2vxx h TYR 151 CO -0.11 0.50 0.27 -0.44 -1.05 0.00 0.00 178.16 177.33 2vxx h ASP 152 N 0.90 0.61 -0.56 3.88 3.32 -0.81 0.37 116.42 124.13 2vxx h ASP 152 Ca 0.29 -0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.30 2vxx h ASP 152 Cb 0.01 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 2vxx h ASP 152 CO -0.11 0.52 0.31 -0.61 -1.72 0.00 0.00 179.24 177.64 2vxx h GLN 153 N 0.66 0.59 -0.39 3.56 4.15 -1.07 -0.51 115.11 122.10 2vxx h GLN 153 Ca 0.17 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.44 2vxx h GLN 153 Cb 0.04 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 2vxx h GLN 153 CO -0.03 0.39 -0.21 0.82 -1.93 0.00 0.00 178.83 177.87 2vxx h ILE 154 N 0.61 1.28 -0.83 2.39 2.04 -0.92 -3.11 117.51 118.97 2vxx h ILE 154 Ca 0.24 -1.35 0.05 0.00 1.00 0.00 0.00 64.86 64.80 2vxx h ILE 154 Cb 0.10 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 37.45 2vxx h ILE 154 CO -0.14 0.45 0.52 0.25 0.00 0.00 0.00 178.15 179.22 2vxx h LEU 155 N 0.63 0.82 -0.51 1.44 5.85 0.12 -0.12 115.31 123.54 2vxx h LEU 155 Ca 0.08 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.83 2vxx h LEU 155 Cb 0.77 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2vxx h LEU 155 CO 0.06 0.54 0.32 0.25 -0.34 0.00 0.00 178.44 179.28 2vxx h LEU 156 N 0.96 0.54 -0.56 2.25 5.85 -1.07 0.41 115.31 123.71 2vxx h LEU 156 Ca 0.35 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.94 2vxx h LEU 156 Cb 0.11 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 2vxx h LEU 156 CO -0.15 0.39 -0.20 0.11 -0.34 0.00 0.00 178.44 178.25 2vxx h LYS 157 N 0.65 0.95 -0.17 1.25 1.79 -1.41 -2.55 116.57 117.08 2vxx h LYS 157 Ca 0.20 -0.39 -0.04 0.00 -2.18 0.00 0.00 60.65 58.24 2vxx h LYS 157 Cb -0.03 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.57 2vxx h LYS 157 CO -0.07 1.06 -0.04 1.15 -1.08 0.00 0.00 179.45 180.47 2vxx h THR 158 N 0.83 1.28 -0.86 -0.16 2.02 -0.68 -1.47 112.91 113.86 2vxx h THR 158 Ca 0.11 -0.98 0.06 0.00 0.77 0.00 0.00 66.41 66.37 2vxx h THR 158 Cb 0.76 1.59 -0.05 0.00 -1.74 0.00 0.00 68.15 68.71 2vxx h THR 158 CO 0.06 0.29 0.56 -0.33 0.37 0.00 0.00 175.52 176.48 2vxx h GLU 159 N 0.03 0.96 -0.48 6.66 5.08 -0.97 -1.09 114.58 124.78 2vxx h GLU 159 Ca 0.04 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 2vxx h GLU 159 Cb 0.46 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2vxx h GLU 159 CO 0.02 0.63 0.05 1.49 -1.00 0.00 0.00 179.01 180.20 2vxx h GLU 160 N 0.99 0.81 -0.57 2.33 4.81 -1.12 -1.04 114.58 120.79 2vxx h GLU 160 Ca 0.37 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2vxx h GLU 160 Cb 0.18 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 2vxx h GLU 160 CO -0.13 0.83 0.30 0.00 -0.73 0.00 0.00 179.01 179.28 2vxx h ARG 161 N 0.67 0.80 -0.06 1.92 3.08 -0.84 -2.08 114.38 117.87 2vxx h ARG 161 Ca 0.14 -0.10 0.02 0.00 0.07 0.00 0.00 59.98 60.12 2vxx h ARG 161 Cb 0.43 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 2vxx h ARG 161 CO 0.01 0.62 -0.09 0.00 -1.07 0.00 0.00 179.97 179.44 2vxx h ALA 162 N 1.13 -0.05 0.00 0.04 0.00 -0.83 -1.08 119.26 118.46 2vxx h ALA 162 Ca 0.20 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2vxx h ALA 162 Cb 0.07 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2vxx h ALA 162 CO -0.03 -0.57 -0.13 0.10 0.00 0.00 0.00 179.25 178.62 2vxx h TYR 163 N -0.14 0.00 -0.49 0.00 -0.00 -1.14 -1.56 116.97 113.63 2vxx h TYR 163 Ca 0.06 0.00 -0.10 0.00 -0.00 0.00 0.00 58.73 58.69 2vxx h TYR 163 Cb 0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 36.93 2vxx h TYR 163 CO -0.19 0.13 -0.07 0.45 -0.00 0.00 0.00 178.16 178.48 2vxx h HIS 164 N 0.00 1.02 -0.37 0.10 3.86 -0.98 -1.87 115.15 116.90 2vxx h HIS 164 Ca -0.00 -0.20 -0.01 0.00 -1.16 0.00 0.00 60.37 59.00 2vxx h HIS 164 Cb 0.76 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 2vxx h HIS 164 CO 0.00 0.97 0.20 0.82 0.86 0.00 0.00 177.93 180.78 2vxx h ILE 165 N 0.77 1.15 -0.71 2.45 2.04 -0.83 -2.57 117.51 119.81 2vxx h ILE 165 Ca 0.13 -0.39 0.13 0.00 1.00 0.00 0.00 64.86 65.73 2vxx h ILE 165 Cb 0.61 0.73 -0.09 0.00 -0.74 0.00 0.00 36.82 37.33 2vxx h ILE 165 CO 0.04 0.15 0.25 1.23 0.00 0.00 0.00 178.15 179.83 2vxx h GLY 166 N 0.47 1.04 0.95 5.37 0.00 -1.15 -1.81 103.07 107.94 2vxx h GLY 166 Ca 0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 2vxx h GLY 166 CO -0.02 -0.10 0.16 0.45 0.00 0.00 0.00 176.54 177.03 2vxx h HIS 167 N 0.40 0.66 -0.97 5.60 3.86 -1.12 -2.14 115.15 121.44 2vxx h HIS 167 Ca 0.38 -0.06 0.16 0.00 -1.16 0.00 0.00 60.37 59.70 2vxx h HIS 167 Cb 0.58 -0.20 -0.09 0.00 1.06 0.00 0.00 27.41 28.76 2vxx h HIS 167 CO -0.19 0.59 0.61 0.74 0.86 0.00 0.00 177.93 180.54 2vxx h PHE 168 N 0.54 0.96 0.00 2.45 0.04 -0.98 -2.29 116.94 117.67 2vxx h PHE 168 Ca 0.14 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.94 2vxx h PHE 168 Cb 0.22 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.07 2vxx h PHE 168 CO 0.00 0.30 -0.09 1.28 -0.60 0.00 0.00 178.31 179.20 2vxx n LEU 169 N -4.64 0.28 -4.75 1.54 4.77 -0.75 -4.93 117.00 108.53 2vxx n LEU 169 Ca 0.20 0.44 -0.34 0.00 -0.03 0.00 0.00 56.01 56.28 2vxx n LEU 169 Cb 0.50 -0.41 0.06 0.00 -2.33 0.00 0.00 43.42 41.24 2vxx n LEU 169 CO 0.26 -0.03 0.79 0.00 -1.33 0.00 0.00 177.39 177.08 2vxx s ALA 170 N -3.03 2.34 -1.36 -1.18 0.00 -0.86 -4.91 121.76 112.75 2vxx s ALA 170 Ca 0.12 0.80 -0.13 0.00 0.00 0.00 0.00 51.96 52.76 2vxx s ALA 170 Cb 0.17 -3.41 0.10 0.00 0.00 0.00 0.00 23.12 19.98 2vxx s ALA 170 CO 0.58 -1.49 1.99 -1.71 0.00 0.00 0.00 175.76 175.13 2vxx n ASN 171 N -2.32 4.53 -3.85 0.00 5.15 -1.26 -4.85 115.26 112.66 2vxx n ASN 171 Ca 0.12 -2.96 -0.10 0.00 -0.60 0.00 0.00 54.58 51.04 2vxx n ASN 171 Cb 0.51 -1.59 -0.08 0.00 -0.53 0.00 0.00 39.78 38.08 2vxx n ASN 171 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2vxx s ASP 172 N 2.39 0.05 -0.15 1.20 2.15 -1.26 -5.18 116.67 115.87 2vxx s ASP 172 Ca 0.45 -0.40 -0.30 0.00 0.43 0.00 0.00 52.55 52.72 2vxx s ASP 172 Cb 0.10 0.29 0.13 0.00 -0.30 0.00 0.00 42.92 43.14 2vxx s ASP 172 CO -0.03 -0.57 1.04 -0.55 -0.17 0.00 0.00 175.17 174.89 2vxx s SER 173 N -2.14 -0.31 0.46 -0.34 0.15 -1.26 -5.02 113.70 105.22 2vxx s SER 173 Ca -0.04 0.27 0.26 0.00 0.70 0.00 0.00 55.95 57.13 2vxx s SER 173 Cb -0.01 0.27 0.90 0.00 -1.71 0.00 0.00 66.02 65.48 2vxx s SER 173 CO -0.04 -0.34 1.81 -0.07 1.20 0.00 0.00 173.24 175.80 2vxx h LEU 174 N 2.37 0.00 -8.67 3.45 3.38 -2.03 -3.42 115.31 110.38 2vxx h LEU 174 Ca -0.17 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.26 2vxx h LEU 174 Cb 1.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2vxx h LEU 174 CO 0.29 0.17 1.29 -0.75 0.09 0.00 0.00 178.44 179.53 2vxx s LYS 175 N -3.56 3.02 0.00 1.13 2.47 -1.26 -5.39 119.74 116.16 2vxx s LYS 175 Ca 0.02 0.95 0.26 0.00 -1.56 0.00 0.00 55.97 55.64 2vxx s LYS 175 Cb 0.09 -4.27 0.58 0.00 -1.46 0.00 0.00 37.83 32.78 2vxx s LYS 175 CO 0.63 -2.25 1.48 1.55 0.16 0.00 0.00 175.35 176.92