#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vxx s ALA 5 N 0.00 3.78 -0.01 -1.46 0.00 -1.26 -5.01 121.76 117.80 2vxx s ALA 5 Ca 0.00 1.37 -0.16 0.00 0.00 0.00 0.00 51.96 53.17 2vxx s ALA 5 Cb 0.00 -3.65 -0.06 0.00 0.00 0.00 0.00 23.12 19.41 2vxx s ALA 5 CO 0.00 -0.88 0.44 -0.51 0.00 0.00 0.00 175.76 174.81 2vxx s LEU 6 N 1.53 4.44 0.73 0.00 1.43 -1.26 -5.08 118.68 120.48 2vxx s LEU 6 Ca 0.72 0.97 -0.12 0.00 -1.03 0.00 0.00 54.13 54.67 2vxx s LEU 6 Cb -0.44 -2.64 0.03 0.00 0.03 0.00 0.00 46.19 43.18 2vxx s LEU 6 CO 0.32 0.26 1.09 -2.16 0.23 0.00 0.00 176.35 176.09 2vxx s PRO 7 N -0.74 2.48 0.21 1.29 0.04 -1.26 -4.96 135.00 132.06 2vxx s PRO 7 Ca 0.25 1.22 -0.07 0.00 0.04 0.00 0.00 61.00 62.44 2vxx s PRO 7 Cb -0.17 -1.92 0.17 0.00 0.04 0.00 0.00 34.50 32.62 2vxx s PRO 7 CO 0.13 -1.48 1.74 0.00 0.04 0.00 0.00 177.00 177.44 2vxx h ARG 8 N -0.73 1.11 -3.51 4.56 3.08 -2.07 -3.41 114.38 113.41 2vxx h ARG 8 Ca -0.45 -0.25 -0.43 0.00 0.07 0.00 0.00 59.98 58.93 2vxx h ARG 8 Cb 1.23 -0.16 -0.39 0.00 0.08 0.00 0.00 29.97 30.74 2vxx h ARG 8 CO 0.53 0.97 -0.76 -1.14 -1.07 0.00 0.00 179.97 178.49 2vxx s GLN 9 N -5.34 0.37 0.45 0.04 0.74 -1.26 -5.14 119.66 109.51 2vxx s GLN 9 Ca -0.12 0.12 -0.23 0.00 0.05 0.00 0.00 55.36 55.18 2vxx s GLN 9 Cb 0.15 -1.03 -0.08 0.00 1.10 0.00 0.00 33.01 33.15 2vxx s GLN 9 CO 0.84 -0.38 1.12 0.00 -0.55 0.00 0.00 175.29 176.32 2vxx s ALA 10 N 2.03 2.98 0.29 1.58 0.00 -1.26 -4.97 121.76 122.41 2vxx s ALA 10 Ca 0.04 0.83 -0.30 0.00 0.00 0.00 0.00 51.96 52.53 2vxx s ALA 10 Cb -0.13 -3.34 -0.13 0.00 0.00 0.00 0.00 23.12 19.53 2vxx s ALA 10 CO -0.05 -0.50 1.41 0.34 0.00 0.00 0.00 175.76 176.96 2vxx n PHE 11 N -0.44 2.37 -0.99 0.00 -0.00 -1.26 -1.81 117.46 115.33 2vxx n PHE 11 Ca 0.07 0.43 0.00 0.00 -0.00 0.00 0.00 57.45 57.95 2vxx n PHE 11 Cb 0.49 -2.48 0.00 0.00 -0.00 0.00 0.00 39.48 37.49 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 1.66 0.50 3.64 7.13 0.00 -1.26 -5.03 105.19 111.82 2vxx n GLY 12 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.22 2.80 -0.14 1.61 2.12 -0.75 -5.11 118.70 119.01 2vxx s GLU 13 Ca 0.00 -0.55 -0.04 0.00 0.36 0.00 0.00 54.97 54.75 2vxx s GLU 13 Cb 0.00 -2.66 -0.03 0.00 0.26 0.00 0.00 34.13 31.70 2vxx s GLU 13 CO 0.00 0.66 -0.02 -1.64 -0.54 0.00 0.00 175.26 173.71 2vxx s MET 14 N -1.11 3.56 0.39 4.30 -1.94 -1.26 -4.44 119.30 118.79 2vxx s MET 14 Ca 0.15 -0.49 0.07 0.00 -1.71 0.00 0.00 55.69 53.72 2vxx s MET 14 Cb -0.11 -2.91 0.00 0.00 2.01 0.00 0.00 34.83 33.82 2vxx s MET 14 CO 0.05 0.34 0.54 0.00 -0.01 0.00 0.00 175.02 175.93 2vxx s ALA 15 N 0.11 4.38 0.44 3.03 0.00 -0.00 -5.05 121.76 124.67 2vxx s ALA 15 Ca 0.00 -1.56 -0.22 0.00 0.00 0.00 0.00 51.96 50.17 2vxx s ALA 15 Cb -0.13 -1.67 -0.08 0.00 0.00 0.00 0.00 23.12 21.23 2vxx s ALA 15 CO 0.02 -0.19 1.07 -0.51 0.00 0.00 0.00 175.76 176.15 2vxx s ASP 16 N -4.28 6.48 0.01 0.00 1.01 -1.26 -4.54 116.67 114.09 2vxx s ASP 16 Ca 0.51 2.06 -0.01 0.00 0.71 0.00 0.00 52.55 55.82 2vxx s ASP 16 Cb -0.10 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.21 2vxx s ASP 16 CO 0.32 -0.69 0.11 0.28 0.21 0.00 0.00 175.17 175.41 2vxx s THR 17 N -1.74 4.92 -1.15 -1.27 -1.32 -1.26 -4.68 115.64 109.15 2vxx s THR 17 Ca 0.62 -0.39 0.26 0.00 -1.21 0.00 0.00 61.69 60.98 2vxx s THR 17 Cb -0.21 -3.29 0.30 0.00 -1.51 0.00 0.00 72.50 67.79 2vxx s THR 17 CO 0.26 0.30 1.85 1.33 -2.21 0.00 0.00 174.62 176.16 2vxx n VAL 18 N 0.98 0.20 1.27 5.08 0.24 -1.26 -2.94 118.33 121.89 2vxx n VAL 18 Ca -0.11 0.05 0.06 0.00 -2.04 0.00 0.00 64.34 62.30 2vxx n VAL 18 Cb 0.52 -0.61 0.23 0.00 -1.47 0.00 0.00 33.84 32.52 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 -1.43 0.28 -3.20 1.34 -5.35 -1.26 -4.94 119.36 104.79 2vxx n ILE 19 Ca 0.08 -0.31 -0.15 0.00 -0.27 0.00 0.00 62.75 62.10 2vxx n ILE 19 Cb 0.27 0.18 0.07 0.00 -1.74 0.00 0.00 39.64 38.42 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 0.17 -5.10 -4.25 7.28 4.77 -1.15 -5.05 117.00 113.67 2vxx n LEU 20 Ca 0.11 -0.65 -0.30 0.00 -0.03 0.00 0.00 56.01 55.14 2vxx n LEU 20 Cb 0.23 -3.06 -0.16 0.00 -2.33 0.00 0.00 43.42 38.11 2vxx n LEU 20 CO 0.08 0.16 -0.55 -0.76 -1.33 0.00 0.00 177.39 174.99 2vxx s LEU 21 N -5.47 2.04 0.71 2.23 1.43 -1.26 -5.13 118.68 113.23 2vxx s LEU 21 Ca 0.33 -0.45 -0.16 0.00 -1.03 0.00 0.00 54.13 52.83 2vxx s LEU 21 Cb -0.04 -1.24 0.03 0.00 0.03 0.00 0.00 46.19 44.96 2vxx s LEU 21 CO 0.70 0.26 1.22 -1.61 0.23 0.00 0.00 176.35 177.15 2vxx s GLU 22 N -0.36 2.23 0.40 1.70 0.41 -1.26 -4.66 118.70 117.15 2vxx s GLU 22 Ca 0.04 1.81 0.08 0.00 -0.41 0.00 0.00 54.97 56.48 2vxx s GLU 22 Cb -0.11 -1.84 0.84 0.00 -1.78 0.00 0.00 34.13 31.25 2vxx s GLU 22 CO 0.01 -1.78 2.01 0.87 -0.49 0.00 0.00 175.26 175.89 2vxx h LYS 23 N -0.12 0.59 0.00 1.61 1.57 -1.98 -0.18 116.57 118.06 2vxx h LYS 23 Ca -0.48 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.26 2vxx h LYS 23 Cb 1.30 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.48 2vxx h LYS 23 CO 0.50 0.39 -0.00 0.00 -0.57 0.00 0.00 179.45 179.77 2vxx h ALA 24 N 1.68 1.30 0.00 3.86 0.00 -2.00 0.64 119.26 124.74 2vxx h ALA 24 Ca 0.23 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 2vxx h ALA 24 Cb 0.14 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2vxx h ALA 24 CO -0.06 0.00 -1.00 1.15 0.00 0.00 0.00 179.25 179.35 2vxx h THR 25 N 0.00 0.77 -0.14 0.00 2.02 -1.44 -3.41 112.91 110.71 2vxx h THR 25 Ca -0.00 -1.93 -0.12 0.00 0.77 0.00 0.00 66.41 65.13 2vxx h THR 25 Cb 0.01 1.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 2vxx h THR 25 CO 0.00 0.26 -0.42 0.71 0.37 0.00 0.00 175.52 176.44 2vxx h THR 26 N -1.00 1.31 0.59 3.16 1.35 -0.92 -3.11 112.91 114.30 2vxx h THR 26 Ca -0.25 -1.56 -0.03 0.00 -0.55 0.00 0.00 66.41 64.02 2vxx h THR 26 Cb 1.10 1.67 0.01 0.00 -1.73 0.00 0.00 68.15 69.19 2vxx h THR 26 CO -0.15 0.47 -0.28 0.74 -0.25 0.00 0.00 175.52 176.05 2vxx h THR 27 N 0.26 0.41 -0.11 6.82 2.02 -1.13 0.12 112.91 121.31 2vxx h THR 27 Ca 0.02 -0.06 -0.07 0.00 0.77 0.00 0.00 66.41 67.07 2vxx h THR 27 Cb 0.86 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 2vxx h THR 27 CO 0.07 0.01 -0.25 1.55 0.37 0.00 0.00 175.52 177.27 2vxx h PRO 28 N -0.83 0.20 -0.31 6.66 0.13 -1.80 -1.27 132.00 134.79 2vxx h PRO 28 Ca -0.08 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 64.94 2vxx h PRO 28 Cb 0.62 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 2vxx h PRO 28 CO 0.13 0.45 0.03 0.82 -0.23 0.00 0.00 178.00 179.19 2vxx h ILE 29 N 0.18 1.25 -0.45 -3.56 2.04 -1.45 -2.14 117.51 113.38 2vxx h ILE 29 Ca 0.03 -0.87 -0.07 0.00 1.00 0.00 0.00 64.86 64.95 2vxx h ILE 29 Cb 0.55 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2vxx h ILE 29 CO 0.04 0.29 0.01 0.00 0.00 0.00 0.00 178.15 178.48 2vxx h GLU 31 N 0.69 0.33 -0.13 0.00 4.22 -1.07 0.07 114.58 118.69 2vxx h GLU 31 Ca 0.14 -0.02 -0.16 0.00 0.08 0.00 0.00 59.36 59.40 2vxx h GLU 31 Cb 0.41 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2vxx h GLU 31 CO 0.02 0.22 -0.60 0.78 -2.18 0.00 0.00 179.01 177.24 2vxx h GLY 32 N 0.34 0.50 1.54 1.92 0.00 -1.18 -3.07 103.07 103.12 2vxx h GLY 32 Ca 0.14 -0.61 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 2vxx h GLY 32 CO -0.10 0.55 -0.32 1.98 0.00 0.00 0.00 176.54 178.64 2vxx h MET 33 N 0.34 0.52 -0.21 4.80 1.85 -0.58 -1.71 114.93 119.94 2vxx h MET 33 Ca -0.01 -0.23 -0.08 0.00 -0.61 0.00 0.00 59.70 58.78 2vxx h MET 33 Cb 1.15 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 33.15 2vxx h MET 33 CO 0.11 0.79 -0.20 -0.91 -0.40 0.00 0.00 176.91 176.29 2vxx h ASN 34 N 0.45 0.37 -0.56 1.39 2.35 -0.99 0.22 115.58 118.81 2vxx h ASN 34 Ca 0.05 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.60 2vxx h ASN 34 Cb 0.79 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.04 2vxx h ASN 34 CO 0.06 0.58 -0.03 0.03 -1.65 0.00 0.00 177.43 176.42 2vxx h ARG 35 N 0.34 1.00 -0.33 0.81 3.08 -1.35 -1.00 114.38 116.93 2vxx h ARG 35 Ca 0.06 -0.33 -0.10 0.00 0.07 0.00 0.00 59.98 59.67 2vxx h ARG 35 Cb 0.55 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2vxx h ARG 35 CO 0.04 1.01 -0.18 -0.07 -1.07 0.00 0.00 179.97 179.70 2vxx h LEU 36 N 0.88 0.73 0.18 3.04 3.38 -0.97 -0.72 115.31 121.84 2vxx h LEU 36 Ca 0.15 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.72 2vxx h LEU 36 Cb 0.58 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2vxx h LEU 36 CO 0.03 0.99 -0.33 0.25 0.09 0.00 0.00 178.44 179.48 2vxx h LEU 37 N 0.48 -0.92 -0.72 1.67 5.85 -0.49 0.15 115.31 121.32 2vxx h LEU 37 Ca 0.07 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.95 2vxx h LEU 37 Cb 0.72 0.34 -0.06 0.00 0.37 0.00 0.00 40.66 42.03 2vxx h LEU 37 CO 0.05 -0.43 0.42 0.00 -0.34 0.00 0.00 178.44 178.14 2vxx h ALA 38 N 0.01 0.98 -0.50 1.25 0.00 -1.15 0.98 119.26 120.82 2vxx h ALA 38 Ca 0.01 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2vxx h ALA 38 Cb 0.59 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2vxx h ALA 38 CO -0.15 0.12 0.06 0.77 0.00 0.00 0.00 179.25 180.05 2vxx h SER 39 N 0.77 0.82 -0.02 0.00 0.02 -0.85 -1.34 113.55 112.95 2vxx h SER 39 Ca 0.32 -0.27 -0.11 0.00 -0.84 0.00 0.00 61.79 60.89 2vxx h SER 39 Cb 0.18 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 2vxx h SER 39 CO -0.18 0.89 -0.30 -0.26 -1.14 0.00 0.00 176.83 175.84 2vxx h PHE 40 N 0.72 0.55 -0.41 3.45 0.04 -0.28 -1.36 116.94 119.65 2vxx h PHE 40 Ca 0.15 -0.13 -0.03 0.00 2.80 0.00 0.00 57.97 60.76 2vxx h PHE 40 Cb 0.43 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 2vxx h PHE 40 CO 0.03 0.73 0.14 0.37 -0.60 0.00 0.00 178.31 178.98 2vxx h GLN 41 N 0.41 0.64 -0.67 1.51 5.75 -0.59 0.20 115.11 122.36 2vxx h GLN 41 Ca 0.05 -0.13 -0.03 0.00 -0.15 0.00 0.00 58.65 58.39 2vxx h GLN 41 Cb 0.74 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.17 2vxx h GLN 41 CO 0.06 0.62 0.28 0.00 -2.65 0.00 0.00 178.83 177.14 2vxx h ALA 42 N 0.98 0.86 -0.64 3.38 0.00 -1.09 -2.30 119.26 120.47 2vxx h ALA 42 Ca 0.13 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2vxx h ALA 42 Cb 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2vxx h ALA 42 CO -0.01 0.47 0.06 1.25 0.00 0.00 0.00 179.25 181.02 2vxx h LEU 43 N 0.94 1.04 -0.17 0.00 5.85 -1.05 -0.86 115.31 121.06 2vxx h LEU 43 Ca 0.22 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.70 2vxx h LEU 43 Cb 0.18 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2vxx h LEU 43 CO -0.02 1.06 0.01 0.22 -0.34 0.00 0.00 178.44 179.37 2vxx h TYR 44 N 1.00 0.02 -0.81 1.25 5.03 -0.79 0.13 116.97 122.79 2vxx h TYR 44 Ca 0.19 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.48 2vxx h TYR 44 Cb 0.49 0.02 -0.04 0.00 1.55 0.00 0.00 36.73 38.76 2vxx h TYR 44 CO 0.04 -0.01 0.37 -0.07 -1.32 0.00 0.00 178.16 177.17 2vxx h LEU 45 N 0.07 1.06 -0.29 2.82 3.38 -1.25 -1.63 115.31 119.47 2vxx h LEU 45 Ca 0.08 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2vxx h LEU 45 Cb 0.09 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2vxx h LEU 45 CO -0.12 0.90 -0.03 -0.61 0.09 0.00 0.00 178.44 178.67 2vxx h GLN 46 N 1.15 0.53 -0.64 1.13 4.15 -0.77 -0.70 115.11 119.97 2vxx h GLN 46 Ca 0.28 -0.18 -0.05 0.00 0.77 0.00 0.00 58.65 59.46 2vxx h GLN 46 Cb 0.14 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 2vxx h GLN 46 CO -0.03 0.70 0.18 1.88 -1.93 0.00 0.00 178.83 179.63 2vxx h TYR 47 N 0.31 1.01 0.10 3.99 0.05 -0.63 -1.06 116.97 120.75 2vxx h TYR 47 Ca 0.08 -0.10 -0.00 0.00 0.05 0.00 0.00 58.73 58.76 2vxx h TYR 47 Cb 0.48 -0.30 0.00 0.00 1.01 0.00 0.00 36.73 37.93 2vxx h TYR 47 CO 0.04 0.82 -0.05 0.37 -1.05 0.00 0.00 178.16 178.29 2vxx h GLN 48 N 0.95 -0.13 -0.56 4.88 4.15 -1.19 -0.64 115.11 122.56 2vxx h GLN 48 Ca 0.21 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.75 2vxx h GLN 48 Cb 0.30 0.03 -0.10 0.00 0.21 0.00 0.00 27.48 27.91 2vxx h GLN 48 CO -0.01 -0.02 -0.11 -0.22 -1.93 0.00 0.00 178.83 176.55 2vxx h LYS 49 N -0.21 0.02 -0.44 1.69 3.64 -0.91 -0.44 116.57 119.91 2vxx h LYS 49 Ca -0.01 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 2vxx h LYS 49 Cb 0.17 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 2vxx h LYS 49 CO 0.02 0.01 -0.02 0.45 -2.27 0.00 0.00 179.45 177.65 2vxx h HIS 50 N 0.02 0.78 -0.39 1.91 3.86 -0.89 -0.72 115.15 119.73 2vxx h HIS 50 Ca 0.27 -0.11 0.03 0.00 -1.16 0.00 0.00 60.37 59.40 2vxx h HIS 50 Cb 0.42 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.65 2vxx h HIS 50 CO -0.44 0.74 0.19 1.25 0.86 0.00 0.00 177.93 180.54 2vxx h HIS 51 N 0.69 0.36 -0.79 2.45 -0.00 -0.43 -1.84 115.15 115.58 2vxx h HIS 51 Ca 0.13 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.48 2vxx h HIS 51 Cb 0.45 -0.10 -0.04 0.00 -0.00 0.00 0.00 27.41 27.73 2vxx h HIS 51 CO 0.02 0.19 0.34 0.74 -0.00 0.00 0.00 177.93 179.22 2vxx h PHE 52 N 0.39 1.17 0.00 5.26 0.04 -0.01 -3.36 116.94 120.44 2vxx h PHE 52 Ca 0.17 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.86 2vxx h PHE 52 Cb 0.07 -0.36 0.00 0.00 2.20 0.00 0.00 35.95 37.87 2vxx h PHE 52 CO -0.10 0.88 -1.41 1.33 -0.60 0.00 0.00 178.31 178.41 2vxx n VAL 53 N -4.32 0.00 -1.72 -0.55 0.24 -0.38 -5.01 118.33 106.59 2vxx n VAL 53 Ca 0.07 -0.29 -0.42 0.00 -2.04 0.00 0.00 64.34 61.66 2vxx n VAL 53 Cb 0.17 0.44 -0.01 0.00 -1.47 0.00 0.00 33.84 32.97 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 -1.83 1.83 -3.99 3.34 3.14 -0.70 -5.00 118.33 115.11 2vxx n VAL 54 Ca -0.01 -0.46 -0.12 0.00 -2.96 0.00 0.00 64.34 60.79 2vxx n VAL 54 Cb 0.37 -1.70 -0.03 0.00 -1.06 0.00 0.00 33.84 31.43 2vxx n VAL 54 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 2vxx n GLU 55 N 0.78 0.56 0.00 1.45 0.28 -1.26 -4.94 120.64 117.51 2vxx n GLU 55 Ca 0.05 -2.34 0.00 0.00 -0.16 0.00 0.00 57.16 54.71 2vxx n GLU 55 Cb 0.36 2.22 0.00 0.00 1.43 0.00 0.00 31.44 35.46 2vxx n GLU 55 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2vxx n GLY 56 N -0.48 -1.90 0.30 -1.84 0.00 -1.26 -4.42 105.19 95.60 2vxx n GLY 56 Ca 0.01 -2.05 0.09 0.00 0.00 0.00 0.00 46.02 44.07 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 1.97 -0.79 4.61 0.00 -2.07 -1.68 119.26 121.30 2vxx h ALA 57 Ca 0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 54.91 54.50 2vxx h ALA 57 Cb 0.00 -0.05 -0.23 0.00 0.00 0.00 0.00 17.79 17.50 2vxx h ALA 57 CO 0.00 -0.01 0.41 0.39 0.00 0.00 0.00 179.25 180.04 2vxx n GLU 58 N -4.50 2.27 0.19 0.00 4.71 -1.26 -4.78 120.64 117.28 2vxx n GLU 58 Ca 0.02 -3.07 -0.13 0.00 -0.01 0.00 0.00 57.16 53.97 2vxx n GLU 58 Cb 0.17 -2.08 -0.07 0.00 -1.01 0.00 0.00 31.44 28.45 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 1.15 -1.05 -0.03 -0.32 3.57 -1.51 -2.53 116.94 116.22 2vxx h PHE 59 Ca 0.48 0.01 0.04 0.00 3.53 0.00 0.00 57.97 62.03 2vxx h PHE 59 Cb 2.48 0.42 -0.05 0.00 2.79 0.00 0.00 35.95 41.58 2vxx h PHE 59 CO 1.41 -0.49 -0.30 -0.92 -2.23 0.00 0.00 178.31 175.78 2vxx h TYR 60 N -0.71 -0.83 -0.77 0.41 3.20 -1.86 0.18 116.97 116.59 2vxx h TYR 60 Ca -0.04 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 2vxx h TYR 60 Cb 0.63 0.37 -0.04 0.00 1.54 0.00 0.00 36.73 39.23 2vxx h TYR 60 CO -0.24 -0.39 0.41 -1.35 -1.64 0.00 0.00 178.16 174.94 2vxx h PRO 61 N -0.43 1.08 -0.33 1.82 0.11 -1.94 -2.18 132.00 130.13 2vxx h PRO 61 Ca 0.07 -0.13 -0.07 0.00 0.11 0.00 0.00 66.00 65.97 2vxx h PRO 61 Cb 0.54 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 2vxx h PRO 61 CO -0.28 0.81 -0.08 -0.07 -0.21 0.00 0.00 178.00 178.17 2vxx h LEU 62 N 1.06 0.65 -0.70 2.35 3.38 -1.07 -1.09 115.31 119.89 2vxx h LEU 62 Ca 0.27 -0.36 0.12 0.00 0.09 0.00 0.00 57.88 58.00 2vxx h LEU 62 Cb 0.06 -0.18 -0.13 0.00 0.09 0.00 0.00 40.66 40.50 2vxx h LEU 62 CO -0.04 0.86 -0.33 -0.74 0.09 0.00 0.00 178.44 178.28 2vxx h HIS 63 N 0.43 -0.90 -0.05 1.13 2.76 -0.49 0.11 115.15 118.13 2vxx h HIS 63 Ca 0.08 0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 2vxx h HIS 63 Cb 0.58 0.50 -0.00 0.00 1.55 0.00 0.00 27.41 30.03 2vxx h HIS 63 CO 0.05 -0.38 0.00 1.96 -1.30 0.00 0.00 177.93 178.26 2vxx h GLN 64 N -0.11 0.10 -0.64 5.26 4.20 -1.26 -3.00 115.11 119.67 2vxx h GLN 64 Ca 0.28 -0.03 0.08 0.00 0.06 0.00 0.00 58.65 59.03 2vxx h GLN 64 Cb 0.56 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.27 2vxx h GLN 64 CO -0.76 0.37 0.30 0.35 -0.67 0.00 0.00 178.83 178.42 2vxx h PHE 65 N -0.19 0.54 -0.30 2.96 3.04 -0.68 -1.10 116.94 121.22 2vxx h PHE 65 Ca 0.02 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.97 2vxx h PHE 65 Cb 0.33 -0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.68 2vxx h PHE 65 CO 0.03 0.20 0.08 0.74 -2.02 0.00 0.00 178.31 177.35 2vxx h PHE 66 N 0.54 0.42 -0.12 0.41 0.04 -0.81 -1.28 116.94 116.14 2vxx h PHE 66 Ca 0.31 -0.02 -0.05 0.00 2.80 0.00 0.00 57.97 61.01 2vxx h PHE 66 Cb 0.30 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.31 2vxx h PHE 66 CO -0.12 0.37 -0.13 0.37 -0.60 0.00 0.00 178.31 178.20 2vxx h GLN 67 N 0.42 0.30 -0.95 1.51 4.15 -1.11 -1.97 115.11 117.46 2vxx h GLN 67 Ca 0.10 -0.16 0.13 0.00 0.77 0.00 0.00 58.65 59.49 2vxx h GLN 67 Cb 0.15 0.01 -0.08 0.00 0.21 0.00 0.00 27.48 27.77 2vxx h GLN 67 CO -0.01 0.71 0.61 -0.44 -1.93 0.00 0.00 178.83 177.77 2vxx h ASP 68 N -0.11 0.81 0.22 -0.69 3.32 -0.93 -0.98 116.42 118.06 2vxx h ASP 68 Ca 0.02 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2vxx h ASP 68 Cb 0.66 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2vxx h ASP 68 CO 0.03 0.42 -0.11 0.00 -1.72 0.00 0.00 179.24 177.86 2vxx h TYR 70 N -0.68 0.00 -0.39 0.00 -0.00 -1.13 0.62 116.97 115.39 2vxx h TYR 70 Ca -0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.59 2vxx h TYR 70 Cb 0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.20 2vxx h TYR 70 CO 0.04 0.33 -0.17 0.93 -0.00 0.00 0.00 178.16 179.29 2vxx h GLU 71 N 0.00 0.80 -0.27 0.10 5.08 -1.20 0.56 114.58 119.65 2vxx h GLU 71 Ca -0.00 -0.34 -0.10 0.00 -1.00 0.00 0.00 59.36 57.91 2vxx h GLU 71 Cb 0.60 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 2vxx h GLU 71 CO 0.04 0.97 -0.24 0.37 -1.00 0.00 0.00 179.01 179.15 2vxx h GLN 72 N 0.60 0.64 -0.80 2.33 4.15 -0.94 -2.72 115.11 118.37 2vxx h GLN 72 Ca 0.09 -0.33 -0.02 0.00 0.77 0.00 0.00 58.65 59.16 2vxx h GLN 72 Cb 0.71 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.37 2vxx h GLN 72 CO 0.05 0.93 0.43 0.28 -1.93 0.00 0.00 178.83 178.59 2vxx h VAL 73 N 0.37 1.24 -0.99 2.39 2.07 -0.89 -1.55 116.25 118.89 2vxx h VAL 73 Ca 0.05 -0.60 0.13 0.00 0.82 0.00 0.00 66.70 67.09 2vxx h VAL 73 Cb 0.79 0.16 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 2vxx h VAL 73 CO 0.06 0.27 0.62 -0.61 0.02 0.00 0.00 177.57 177.93 2vxx h GLN 74 N 1.12 0.92 -0.82 1.57 5.75 -0.78 -1.10 115.11 121.77 2vxx h GLN 74 Ca 0.28 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.71 2vxx h GLN 74 Cb 0.04 -0.21 -0.04 0.00 1.07 0.00 0.00 27.48 28.34 2vxx h GLN 74 CO -0.04 0.61 0.45 0.22 -2.65 0.00 0.00 178.83 177.41 2vxx h ASP 75 N 0.95 1.02 -0.59 -0.69 3.58 -0.97 -1.47 116.42 118.24 2vxx h ASP 75 Ca 0.49 -0.10 -0.09 0.00 0.42 0.00 0.00 57.03 57.75 2vxx h ASP 75 Cb 0.53 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 2vxx h ASP 75 CO -0.26 0.83 0.00 0.45 -2.88 0.00 0.00 179.24 177.38 2vxx h HIS 76 N 1.14 1.14 0.01 0.28 3.86 -0.97 -1.66 115.15 118.95 2vxx h HIS 76 Ca 0.29 -0.20 0.02 0.00 -1.16 0.00 0.00 60.37 59.32 2vxx h HIS 76 Cb 0.03 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.17 2vxx h HIS 76 CO 0.00 1.01 -0.17 0.28 0.86 0.00 0.00 177.93 179.91 2vxx h VAL 77 N 0.94 0.59 -0.17 2.45 2.07 -0.85 -0.84 116.25 120.44 2vxx h VAL 77 Ca 0.17 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.74 2vxx h VAL 77 Cb 0.55 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 2vxx h VAL 77 CO 0.03 0.00 -0.18 -0.74 0.02 0.00 0.00 177.57 176.70 2vxx h HIS 78 N -0.29 -0.48 -0.61 1.57 6.17 -1.16 -0.43 115.15 119.93 2vxx h HIS 78 Ca 0.05 0.03 0.02 0.00 0.71 0.00 0.00 60.37 61.17 2vxx h HIS 78 Cb 0.35 0.24 -0.03 0.00 2.52 0.00 0.00 27.41 30.48 2vxx h HIS 78 CO -0.22 -0.26 0.39 0.00 0.71 0.00 0.00 177.93 178.55 2vxx h ALA 79 N 0.85 0.78 -0.04 5.26 0.00 -1.07 -2.53 119.26 122.50 2vxx h ALA 79 Ca 0.11 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2vxx h ALA 79 Cb 0.38 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.96 2vxx h ALA 79 CO -0.30 0.16 -0.36 -0.07 0.00 0.00 0.00 179.25 178.68 2vxx h LEU 80 N 0.78 0.39 -0.85 0.00 3.38 -0.90 -2.29 115.31 115.82 2vxx h LEU 80 Ca 0.23 -0.69 0.04 0.00 0.09 0.00 0.00 57.88 57.55 2vxx h LEU 80 Cb -0.04 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 2vxx h LEU 80 CO -0.07 1.02 0.54 1.23 0.09 0.00 0.00 178.44 181.24 2vxx h GLY 81 N -0.22 1.24 0.88 0.83 0.00 -1.09 0.34 103.07 105.05 2vxx h GLY 81 Ca -0.03 -0.40 -0.14 0.00 0.00 0.00 0.00 47.33 46.76 2vxx h GLY 81 CO 0.07 0.32 -0.46 -2.09 0.00 0.00 0.00 176.54 174.39 2vxx h GLU 82 N 1.03 0.53 -0.76 4.80 4.81 -1.49 -2.86 114.58 120.64 2vxx h GLU 82 Ca 0.35 -0.40 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 2vxx h GLU 82 Cb 0.06 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 2vxx h GLU 82 CO -0.13 1.03 0.28 -0.09 -0.73 0.00 0.00 179.01 179.36 2vxx h ARG 83 N 0.15 1.16 -0.19 1.92 2.43 -1.26 -1.32 114.38 117.27 2vxx h ARG 83 Ca -0.02 -0.22 0.02 0.00 -0.81 0.00 0.00 59.98 58.95 2vxx h ARG 83 Cb 1.09 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.43 2vxx h ARG 83 CO 0.10 0.96 0.04 1.25 -1.51 0.00 0.00 179.97 180.80 2vxx h LEU 84 N 1.12 0.01 -0.60 3.80 6.46 -0.92 0.72 115.31 125.90 2vxx h LEU 84 Ca 0.25 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.03 2vxx h LEU 84 Cb 0.25 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.19 2vxx h LEU 84 CO -0.02 0.03 0.35 -1.13 -0.62 0.00 0.00 178.44 177.06 2vxx h ASN 85 N 0.11 0.72 -0.70 1.25 -1.24 -1.40 -2.05 115.58 112.27 2vxx h ASN 85 Ca 0.08 -0.07 0.12 0.00 0.71 0.00 0.00 56.30 57.15 2vxx h ASN 85 Cb 0.08 -0.18 -0.05 0.00 0.73 0.00 0.00 38.32 38.90 2vxx h ASN 85 CO -0.11 0.58 0.47 1.23 -1.29 0.00 0.00 177.43 178.31 2vxx h GLY 86 N 0.80 0.71 1.56 1.57 0.00 -0.46 -1.13 103.07 106.12 2vxx h GLY 86 Ca 0.21 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2vxx h GLY 86 CO -0.04 0.09 -0.00 1.04 0.00 0.00 0.00 176.54 177.63 2vxx n LEU 87 N -4.48 0.01 0.00 3.11 4.77 0.18 -4.54 117.00 116.05 2vxx n LEU 87 Ca 0.12 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 2vxx n LEU 87 Cb 0.44 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2vxx n LEU 87 CO 0.33 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2vxx n GLY 88 N 1.29 1.04 3.82 -0.72 0.00 -0.43 -4.30 105.19 105.90 2vxx n GLY 88 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.86 1.77 3.13 -0.02 0.00 -0.82 -0.82 105.19 106.56 2vxx n GLY 89 Ca 0.00 -2.20 -0.33 0.00 0.00 0.00 0.00 46.02 43.49 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 -2.59 2.23 0.35 1.61 1.01 -1.26 -4.22 120.40 117.53 2vxx s VAL 90 Ca 0.60 -1.09 -0.27 0.00 0.00 0.00 0.00 61.98 61.22 2vxx s VAL 90 Cb -0.05 -2.05 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 2vxx s VAL 90 CO 0.39 0.37 1.23 -2.16 0.00 0.00 0.00 175.10 174.92 2vxx s PRO 91 N 1.26 4.26 0.36 2.72 0.04 -1.26 -4.77 135.00 137.61 2vxx s PRO 91 Ca 0.01 2.02 -0.27 0.00 0.04 0.00 0.00 61.00 62.80 2vxx s PRO 91 Cb -0.15 -2.93 -0.10 0.00 0.04 0.00 0.00 34.50 31.36 2vxx s PRO 91 CO -0.10 -0.20 1.29 0.54 0.04 0.00 0.00 177.00 178.58 2vxx s VAL 92 N -1.24 2.72 0.00 -0.36 0.11 -1.26 -4.94 120.40 115.43 2vxx s VAL 92 Ca 0.52 0.69 0.00 0.00 -2.93 0.00 0.00 61.98 60.25 2vxx s VAL 92 Cb -0.35 -3.42 0.00 0.00 -1.53 0.00 0.00 36.38 31.07 2vxx s VAL 92 CO 0.46 0.13 0.00 0.00 -3.33 0.00 0.00 175.10 172.36 2vxx n ALA 93 N 0.49 0.00 -2.89 1.54 0.00 -1.26 -4.94 120.51 113.46 2vxx n ALA 93 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 2vxx n ALA 93 Cb 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.84 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 0.00 2.08 0.33 0.00 0.00 -1.26 -4.98 107.32 103.49 2vxx s GLY 94 Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 44.72 43.89 2vxx s GLY 94 CO 0.00 -0.82 1.97 0.74 0.00 0.00 0.00 173.10 174.99 2vxx h PHE 95 N 2.80 0.83 0.39 1.90 0.04 -1.99 0.83 116.94 121.75 2vxx h PHE 95 Ca -0.46 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.29 2vxx h PHE 95 Cb 1.17 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 39.05 2vxx h PHE 95 CO 0.59 0.56 -0.19 0.37 -0.60 0.00 0.00 178.31 179.05 2vxx h GLN 96 N 0.88 -0.51 -0.16 1.51 5.75 -1.99 -1.67 115.11 118.92 2vxx h GLN 96 Ca 0.23 0.03 -0.11 0.00 -0.15 0.00 0.00 58.65 58.65 2vxx h GLN 96 Cb -0.02 0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 2vxx h GLN 96 CO -0.04 -0.20 -0.39 0.37 -2.65 0.00 0.00 178.83 175.92 2vxx h GLN 97 N -0.86 0.35 -0.52 1.69 5.75 -1.96 -2.08 115.11 117.47 2vxx h GLN 97 Ca -0.05 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.29 2vxx h GLN 97 Cb 0.55 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.06 2vxx h GLN 97 CO 0.09 0.69 0.34 -0.07 -2.65 0.00 0.00 178.83 177.23 2vxx h LEU 98 N 0.29 0.59 -1.07 -2.39 3.38 -0.86 -1.87 115.31 113.38 2vxx h LEU 98 Ca 0.03 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 2vxx h LEU 98 Cb 0.82 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2vxx h LEU 98 CO 0.07 0.42 -0.14 0.00 0.09 0.00 0.00 178.44 178.88 2vxx h ALA 99 N 1.20 1.22 -0.01 1.53 0.00 -1.01 -2.77 119.26 119.41 2vxx h ALA 99 Ca 0.19 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 2vxx h ALA 99 Cb -0.07 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2vxx h ALA 99 CO -0.05 0.51 -0.73 0.00 0.00 0.00 0.00 179.25 178.98 2vxx h ALA 100 N 1.40 0.77 0.00 0.00 0.00 -1.09 -3.28 119.26 117.06 2vxx h ALA 100 Ca 0.08 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2vxx h ALA 100 Cb 0.52 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2vxx h ALA 100 CO 0.03 0.87 -0.94 1.28 0.00 0.00 0.00 179.25 180.49 2vxx n LEU 101 N -3.71 0.64 -4.73 0.00 4.77 -0.73 -4.93 117.00 108.30 2vxx n LEU 101 Ca -0.02 0.07 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 2vxx n LEU 101 Cb 0.70 -0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.66 2vxx n LEU 101 CO 0.44 -0.00 1.29 0.00 -1.33 0.00 0.00 177.39 177.80 2vxx s PHE 104 N -1.98 1.66 -0.25 0.00 -0.12 -1.26 -4.90 117.98 111.13 2vxx s PHE 104 Ca 0.34 -0.96 -0.21 0.00 -0.05 0.00 0.00 56.93 56.05 2vxx s PHE 104 Cb 0.21 -1.00 -0.02 0.00 -0.63 0.00 0.00 43.02 41.58 2vxx s PHE 104 CO 0.32 -0.06 0.65 0.99 -0.05 0.00 0.00 175.22 177.06 2vxx s THR 105 N -3.43 4.97 0.67 -4.49 2.01 -1.26 -5.05 115.64 109.06 2vxx s THR 105 Ca 0.32 1.17 -0.13 0.00 0.31 0.00 0.00 61.69 63.35 2vxx s THR 105 Cb 0.07 -3.95 0.00 0.00 0.01 0.00 0.00 72.50 68.63 2vxx s THR 105 CO 0.11 0.02 1.08 -2.84 -0.69 0.00 0.00 174.62 172.30 2vxx s PRO 106 N 2.52 2.90 0.31 4.92 0.02 -1.26 -4.94 135.00 139.47 2vxx s PRO 106 Ca 0.27 1.19 -0.29 0.00 0.02 0.00 0.00 61.00 62.18 2vxx s PRO 106 Cb -0.15 -1.98 -0.12 0.00 0.02 0.00 0.00 34.50 32.27 2vxx s PRO 106 CO 0.08 -1.15 1.48 -1.91 -0.33 0.00 0.00 177.00 175.17 2vxx n GLU 107 N -2.66 2.45 -0.91 5.54 2.13 -1.26 -4.97 120.64 120.95 2vxx n GLU 107 Ca 0.09 0.87 -0.30 0.00 0.66 0.00 0.00 57.16 58.47 2vxx n GLU 107 Cb 0.53 -2.57 0.16 0.00 0.27 0.00 0.00 31.44 29.82 2vxx n GLU 107 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2vxx s PRO 108 N -1.07 1.02 0.87 5.31 0.02 -1.26 -4.98 135.00 134.90 2vxx s PRO 108 Ca 0.61 1.19 -0.11 0.00 0.02 0.00 0.00 61.00 62.71 2vxx s PRO 108 Cb -0.54 -1.75 0.12 0.00 0.02 0.00 0.00 34.50 32.35 2vxx s PRO 108 CO 0.55 -2.51 1.15 -1.21 -0.33 0.00 0.00 177.00 174.64 2vxx s GLU 109 N -4.74 1.31 0.00 5.54 0.41 -1.26 -4.88 118.70 115.09 2vxx s GLU 109 Ca 0.65 1.53 0.00 0.00 -0.41 0.00 0.00 54.97 56.74 2vxx s GLU 109 Cb -0.21 -1.76 0.00 0.00 -1.78 0.00 0.00 34.13 30.38 2vxx s GLU 109 CO 0.58 -2.41 0.00 0.41 -0.49 0.00 0.00 175.26 173.35 2vxx n GLY 110 N 0.04 2.29 3.70 -1.39 0.00 -1.26 -5.00 105.19 103.57 2vxx n GLY 110 Ca 0.12 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 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 3.48 0.34 4.61 0.00 -1.26 -5.08 121.76 120.86 2vxx s ALA 111 Ca 0.00 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 51.83 2vxx s ALA 111 Cb 0.00 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 2vxx s ALA 111 CO 0.00 -0.21 0.30 -0.06 0.00 0.00 0.00 175.76 175.79 2vxx s PHE 112 N 1.10 2.89 0.91 0.00 0.08 -1.26 -5.13 117.98 116.57 2vxx s PHE 112 Ca 0.28 -0.32 -0.12 0.00 0.12 0.00 0.00 56.93 56.89 2vxx s PHE 112 Cb -0.16 -1.83 0.14 0.00 -0.57 0.00 0.00 43.02 40.60 2vxx s PHE 112 CO 0.11 0.16 1.11 0.54 -0.10 0.00 0.00 175.22 177.04 2vxx s ASN 113 N -4.01 3.42 0.30 1.36 6.03 -1.26 -4.78 114.94 116.00 2vxx s ASN 113 Ca 0.42 1.16 0.05 0.00 -1.03 0.00 0.00 52.86 53.46 2vxx s ASN 113 Cb -0.06 -1.81 0.49 0.00 -3.03 0.00 0.00 41.25 36.84 2vxx s ASN 113 CO 0.27 -2.63 1.75 0.00 -2.03 0.00 0.00 177.10 174.46 2vxx h ARG 115 N 0.34 0.90 -0.29 0.00 2.43 -1.99 -2.04 114.38 113.73 2vxx h ARG 115 Ca 0.05 -0.35 -0.03 0.00 -0.81 0.00 0.00 59.98 58.85 2vxx h ARG 115 Cb 0.65 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 2vxx h ARG 115 CO 0.05 0.99 0.08 1.96 -1.51 0.00 0.00 179.97 181.54 2vxx h GLN 116 N 0.74 0.46 -0.39 0.20 4.20 -1.85 -1.13 115.11 117.34 2vxx h GLN 116 Ca 0.12 -0.10 0.06 0.00 0.06 0.00 0.00 58.65 58.78 2vxx h GLN 116 Cb 0.66 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.33 2vxx h GLN 116 CO 0.05 0.53 0.06 0.52 -0.67 0.00 0.00 178.83 179.31 2vxx h MET 117 N 0.31 0.17 -0.58 1.46 2.86 -1.13 -0.50 114.93 117.51 2vxx h MET 117 Ca 0.09 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 2vxx h MET 117 Cb 0.27 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 2vxx h MET 117 CO -0.00 0.11 0.21 -0.07 1.06 0.00 0.00 176.91 178.22 2vxx h LEU 118 N 0.18 0.82 -0.45 1.22 3.38 -1.27 -1.14 115.31 118.04 2vxx h LEU 118 Ca 0.19 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2vxx h LEU 118 Cb 0.23 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2vxx h LEU 118 CO -0.26 0.79 0.30 0.28 0.09 0.00 0.00 178.44 179.63 2vxx h SER 119 N 0.81 0.52 -0.50 -0.43 0.02 -0.84 0.24 113.55 113.37 2vxx h SER 119 Ca 0.19 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2vxx h SER 119 Cb 0.24 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 2vxx h SER 119 CO -0.01 0.38 0.32 0.78 -1.14 0.00 0.00 176.83 177.16 2vxx h ASN 120 N 0.62 0.54 -0.69 3.07 2.35 -0.95 -0.70 115.58 119.82 2vxx h ASN 120 Ca 0.17 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.86 2vxx h ASN 120 Cb -0.07 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 2vxx h ASN 120 CO -0.04 0.38 0.24 0.44 -1.65 0.00 0.00 177.43 176.81 2vxx h ASP 121 N 0.64 0.98 0.01 5.81 3.32 -0.69 -1.65 116.42 124.85 2vxx h ASP 121 Ca 0.19 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2vxx h ASP 121 Cb -0.03 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.26 2vxx h ASP 121 CO -0.06 0.91 -0.01 0.25 -1.72 0.00 0.00 179.24 178.61 2vxx h LEU 122 N 0.99 -0.02 -0.91 1.55 5.85 -0.24 -0.83 115.31 121.71 2vxx h LEU 122 Ca 0.22 -0.14 0.11 0.00 0.84 0.00 0.00 57.88 58.91 2vxx h LEU 122 Cb 0.26 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.22 2vxx h LEU 122 CO -0.01 0.13 0.54 1.56 -0.34 0.00 0.00 178.44 180.32 2vxx h GLN 123 N -0.16 0.84 0.18 1.25 4.20 -1.05 0.41 115.11 120.78 2vxx h GLN 123 Ca -0.00 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2vxx h GLN 123 Cb 0.16 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2vxx h GLN 123 CO 0.00 0.56 -0.09 0.00 -0.67 0.00 0.00 178.83 178.63 2vxx h ALA 124 N 1.50 -0.24 -0.93 3.87 0.00 -1.08 -1.14 119.26 121.25 2vxx h ALA 124 Ca 0.45 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.35 2vxx h ALA 124 Cb 0.45 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 2vxx h ALA 124 CO -0.27 -0.61 0.58 0.93 0.00 0.00 0.00 179.25 179.89 2vxx h GLU 125 N -0.31 1.02 -0.51 0.00 4.39 -0.57 -1.11 114.58 117.50 2vxx h GLU 125 Ca -0.03 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 2vxx h GLU 125 Cb 0.24 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 2vxx h GLU 125 CO 0.04 0.68 0.08 1.96 -1.16 0.00 0.00 179.01 180.60 2vxx h GLN 126 N 1.05 0.84 -0.75 2.33 4.20 -0.77 0.17 115.11 122.18 2vxx h GLN 126 Ca 0.41 -0.23 0.03 0.00 0.06 0.00 0.00 58.65 58.91 2vxx h GLN 126 Cb 0.19 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 27.83 2vxx h GLN 126 CO -0.18 0.84 0.48 0.00 -0.67 0.00 0.00 178.83 179.29 2vxx h ALA 127 N 0.97 0.97 -0.41 3.87 0.00 -0.76 -2.17 119.26 121.73 2vxx h ALA 127 Ca 0.15 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 2vxx h ALA 127 Cb 0.41 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2vxx h ALA 127 CO 0.01 0.29 -0.20 0.82 0.00 0.00 0.00 179.25 180.17 2vxx h ILE 128 N 0.94 1.28 -0.52 0.00 2.04 -0.73 -2.78 117.51 117.73 2vxx h ILE 128 Ca 0.29 -1.34 0.10 0.00 1.00 0.00 0.00 64.86 64.92 2vxx h ILE 128 Cb -0.01 1.27 -0.08 0.00 -0.74 0.00 0.00 36.82 37.25 2vxx h ILE 128 CO -0.10 0.45 0.03 0.40 0.00 0.00 0.00 178.15 178.93 2vxx h ILE 129 N 0.67 0.61 -0.59 -0.67 2.04 -0.47 0.24 117.51 119.33 2vxx h ILE 129 Ca 0.09 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 65.96 2vxx h ILE 129 Cb 0.76 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 2vxx h ILE 129 CO 0.06 0.03 0.31 1.23 0.00 0.00 0.00 178.15 179.77 2vxx h GLY 130 N 0.15 0.85 1.00 5.37 0.00 -1.28 -1.61 103.07 107.54 2vxx h GLY 130 Ca 0.27 -0.21 -0.14 0.00 0.00 0.00 0.00 47.33 47.25 2vxx h GLY 130 CO -0.42 0.12 -0.36 -2.08 0.00 0.00 0.00 176.54 173.80 2vxx h VAL 131 N 0.58 1.30 -0.48 4.60 2.07 -1.10 -2.72 116.25 120.49 2vxx h VAL 131 Ca 0.27 -1.54 0.08 0.00 0.82 0.00 0.00 66.70 66.32 2vxx h VAL 131 Cb 0.18 1.64 -0.07 0.00 -1.52 0.00 0.00 31.29 31.52 2vxx h VAL 131 CO -0.18 0.49 0.10 -0.07 0.02 0.00 0.00 177.57 177.93 2vxx h LEU 132 N 0.47 0.01 -0.03 2.57 3.38 -0.31 0.15 115.31 121.55 2vxx h LEU 132 Ca 0.03 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2vxx h LEU 132 Cb 0.94 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2vxx h LEU 132 CO 0.08 0.03 0.01 0.03 0.09 0.00 0.00 178.44 178.69 2vxx h ARG 133 N 0.23 0.04 -0.69 1.13 3.08 -1.31 0.17 114.38 117.03 2vxx h ARG 133 Ca 0.24 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.30 2vxx h ARG 133 Cb 0.31 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 2vxx h ARG 133 CO -0.31 0.19 0.45 1.96 -1.07 0.00 0.00 179.97 181.19 2vxx h GLN 134 N -0.13 0.87 -0.12 0.04 4.20 -1.28 -0.46 115.11 118.23 2vxx h GLN 134 Ca 0.01 -0.05 -0.17 0.00 0.06 0.00 0.00 58.65 58.50 2vxx h GLN 134 Cb 0.17 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2vxx h GLN 134 CO -0.00 0.58 -0.64 1.96 -0.67 0.00 0.00 178.83 180.06 2vxx h GLN 135 N 0.90 0.46 -0.54 1.46 1.08 -0.59 -2.22 115.11 115.66 2vxx h GLN 135 Ca 0.27 -0.33 -0.06 0.00 -1.45 0.00 0.00 58.65 57.08 2vxx h GLN 135 Cb -0.05 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 2vxx h GLN 135 CO -0.08 0.95 0.10 0.00 -0.95 0.00 0.00 178.83 178.85 2vxx h ALA 136 N 0.97 0.72 -0.69 3.87 0.00 -0.38 -1.29 119.26 122.47 2vxx h ALA 136 Ca -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2vxx h ALA 136 Cb 1.19 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 2vxx h ALA 136 CO 0.11 0.45 0.35 1.15 0.00 0.00 0.00 179.25 181.31 2vxx h THR 137 N 0.78 1.22 0.31 0.00 2.02 -1.05 -2.26 112.91 113.92 2vxx h THR 137 Ca 0.17 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 2vxx h THR 137 Cb 0.39 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2vxx h THR 137 CO 0.01 0.26 -0.16 -0.61 0.37 0.00 0.00 175.52 175.38 2vxx h GLN 138 N 0.95 -0.43 -0.29 6.66 4.15 -1.24 -0.47 115.11 124.44 2vxx h GLN 138 Ca 0.24 0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.75 2vxx h GLN 138 Cb 0.09 0.10 -0.06 0.00 0.21 0.00 0.00 27.48 27.81 2vxx h GLN 138 CO -0.03 -0.28 -0.13 0.00 -1.93 0.00 0.00 178.83 176.45 2vxx h ALA 139 N 0.24 0.11 -0.27 3.38 0.00 -1.15 0.20 119.26 121.78 2vxx h ALA 139 Ca -0.04 0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2vxx h ALA 139 Cb 0.35 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 2vxx h ALA 139 CO 0.06 -0.53 -0.15 0.93 0.00 0.00 0.00 179.25 179.56 2vxx h GLU 140 N -0.09 -0.12 -0.82 0.00 5.08 -1.39 0.10 114.58 117.35 2vxx h GLU 140 Ca 0.15 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.58 2vxx h GLU 140 Cb 0.31 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.54 2vxx h GLU 140 CO -0.35 -0.08 0.54 1.03 -1.00 0.00 0.00 179.01 179.15 2vxx h SER 141 N -0.12 0.79 0.09 1.42 0.87 0.08 -2.42 113.55 114.27 2vxx h SER 141 Ca 0.14 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2vxx h SER 141 Cb 0.34 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 2vxx h SER 141 CO -0.34 0.50 -0.10 0.18 -0.53 0.00 0.00 176.83 176.54 2vxx n LEU 142 N -4.49 1.27 0.00 2.23 4.77 0.60 -4.93 117.00 116.45 2vxx n LEU 142 Ca 0.12 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 2vxx n LEU 142 Cb 0.22 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2vxx n LEU 142 CO 0.33 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 2vxx n GLY 143 N 1.24 0.75 3.47 -0.72 0.00 -0.62 -4.98 105.19 104.32 2vxx n GLY 143 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 2vxx n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2vxx s ASP 144 N -2.32 6.81 0.14 1.61 -1.08 0.26 -4.87 116.67 117.22 2vxx s ASP 144 Ca 0.00 -2.42 -0.13 0.00 -0.52 0.00 0.00 52.55 49.48 2vxx s ASP 144 Cb 0.00 -2.41 0.00 0.00 -1.46 0.00 0.00 42.92 39.05 2vxx s ASP 144 CO 0.00 -0.96 1.59 0.03 0.52 0.00 0.00 175.17 176.35 2vxx h ARG 145 N 8.15 0.79 -0.48 4.34 3.08 -1.91 -2.90 114.38 125.45 2vxx h ARG 145 Ca 0.23 -0.25 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2vxx h ARG 145 Cb 0.96 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.92 2vxx h ARG 145 CO 1.19 0.84 0.00 0.00 -1.07 0.00 0.00 179.97 180.93 2vxx h ALA 146 N 0.92 0.64 -0.16 0.04 0.00 -1.96 -1.40 119.26 117.33 2vxx h ALA 146 Ca 0.13 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.79 2vxx h ALA 146 Cb 0.48 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2vxx h ALA 146 CO 0.02 0.44 0.00 1.15 0.00 0.00 0.00 179.25 180.86 2vxx h THR 147 N 0.69 0.89 -0.94 0.00 2.02 -1.96 0.24 112.91 113.85 2vxx h THR 147 Ca 0.14 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 67.33 2vxx h THR 147 Cb 0.50 0.83 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 2vxx h THR 147 CO 0.02 0.01 0.62 0.00 0.37 0.00 0.00 175.52 176.54 2vxx h ALA 148 N 1.13 1.40 -0.19 6.16 0.00 -1.36 0.15 119.26 126.56 2vxx h ALA 148 Ca 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2vxx h ALA 148 Cb 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2vxx h ALA 148 CO -0.12 0.50 -0.01 -0.92 0.00 0.00 0.00 179.25 178.70 2vxx h TYR 149 N 1.18 0.37 -0.40 0.00 5.03 -0.69 -1.50 116.97 120.96 2vxx h TYR 149 Ca 0.38 -0.07 -0.00 0.00 2.58 0.00 0.00 58.73 61.62 2vxx h TYR 149 Cb 0.02 -0.09 -0.02 0.00 1.55 0.00 0.00 36.73 38.19 2vxx h TYR 149 CO -0.00 0.54 0.24 1.25 -1.32 0.00 0.00 178.16 178.87 2vxx h LEU 150 N 0.08 0.48 -0.95 2.82 5.85 0.09 -1.49 115.31 122.20 2vxx h LEU 150 Ca 0.05 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2vxx h LEU 150 Cb 0.40 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 2vxx h LEU 150 CO 0.01 0.39 0.63 1.88 -0.34 0.00 0.00 178.44 181.01 2vxx h TYR 151 N 0.52 1.19 -0.63 1.25 0.05 -0.67 -0.79 116.97 117.90 2vxx h TYR 151 Ca 0.14 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.92 2vxx h TYR 151 Cb 0.00 -0.40 -0.03 0.00 1.01 0.00 0.00 36.73 37.31 2vxx h TYR 151 CO -0.04 0.75 0.29 -0.44 -1.05 0.00 0.00 178.16 177.67 2vxx h ASP 152 N 1.29 0.84 -0.38 3.88 3.32 -0.97 0.55 116.42 124.94 2vxx h ASP 152 Ca 0.35 -0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.27 2vxx h ASP 152 Cb -0.15 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.16 2vxx h ASP 152 CO -0.08 0.75 0.21 -0.61 -1.72 0.00 0.00 179.24 177.80 2vxx h GLN 153 N 0.88 0.42 -0.48 3.56 4.15 -0.90 -0.58 115.11 122.15 2vxx h GLN 153 Ca 0.22 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.49 2vxx h GLN 153 Cb 0.15 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 2vxx h GLN 153 CO -0.02 0.28 -0.17 0.82 -1.93 0.00 0.00 178.83 177.80 2vxx h ILE 154 N 0.43 1.27 -0.63 2.39 2.04 -0.81 -3.15 117.51 119.05 2vxx h ILE 154 Ca 0.16 -1.32 0.02 0.00 1.00 0.00 0.00 64.86 64.71 2vxx h ILE 154 Cb 0.03 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 2vxx h ILE 154 CO -0.09 0.46 0.40 0.25 0.00 0.00 0.00 178.15 179.17 2vxx h LEU 155 N 0.81 0.67 -0.47 1.44 5.85 0.43 0.22 115.31 124.26 2vxx h LEU 155 Ca 0.11 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.88 2vxx h LEU 155 Cb 0.74 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 2vxx h LEU 155 CO 0.06 0.47 0.20 0.25 -0.34 0.00 0.00 178.44 179.08 2vxx h LEU 156 N 0.80 0.26 -0.39 2.25 5.85 -1.07 0.13 115.31 123.13 2vxx h LEU 156 Ca 0.25 0.04 -0.18 0.00 0.84 0.00 0.00 57.88 58.82 2vxx h LEU 156 Cb -0.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2vxx h LEU 156 CO -0.09 0.18 -0.78 0.11 -0.34 0.00 0.00 178.44 177.52 2vxx h LYS 157 N 0.40 0.27 -0.25 1.25 1.57 -1.47 -2.40 116.57 115.94 2vxx h LYS 157 Ca 0.21 -0.25 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2vxx h LYS 157 Cb 0.17 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2vxx h LYS 157 CO -0.19 0.93 -0.03 1.15 -0.57 0.00 0.00 179.45 180.74 2vxx h THR 158 N 0.17 1.27 -0.56 -0.16 2.02 -0.54 -1.31 112.91 113.81 2vxx h THR 158 Ca -0.04 -1.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.14 2vxx h THR 158 Cb 1.37 1.42 -0.03 0.00 -1.74 0.00 0.00 68.15 69.18 2vxx h THR 158 CO 0.12 0.31 0.32 -0.33 0.37 0.00 0.00 175.52 176.32 2vxx h GLU 159 N 0.22 0.77 -0.84 6.66 5.08 -0.78 -1.38 114.58 124.31 2vxx h GLU 159 Ca 0.07 -0.08 0.07 0.00 -1.00 0.00 0.00 59.36 58.41 2vxx h GLU 159 Cb 0.48 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 2vxx h GLU 159 CO 0.02 0.58 0.51 1.49 -1.00 0.00 0.00 179.01 180.61 2vxx h GLU 160 N 0.75 0.90 -0.50 2.33 4.81 -1.31 -1.21 114.58 120.35 2vxx h GLU 160 Ca 0.20 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 2vxx h GLU 160 Cb 0.02 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 2vxx h GLU 160 CO -0.03 0.60 0.23 -0.09 -0.73 0.00 0.00 179.01 178.99 2vxx h ARG 161 N 0.93 0.72 0.03 1.92 2.43 -0.83 -2.09 114.38 117.49 2vxx h ARG 161 Ca 0.37 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.44 2vxx h ARG 161 Cb 0.20 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 2vxx h ARG 161 CO -0.18 0.61 -0.10 0.00 -1.51 0.00 0.00 179.97 178.79 2vxx h ALA 162 N 1.08 -0.13 0.00 2.80 0.00 -0.26 -1.80 119.26 120.94 2vxx h ALA 162 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2vxx h ALA 162 Cb 0.13 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2vxx h ALA 162 CO -0.02 -0.60 0.00 0.10 0.00 0.00 0.00 179.25 178.73 2vxx h TYR 163 N -0.18 0.00 -0.49 0.00 -0.00 -1.25 -0.28 116.97 114.77 2vxx h TYR 163 Ca 0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 58.73 58.67 2vxx h TYR 163 Cb 0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 36.92 2vxx h TYR 163 CO -0.14 0.00 -0.02 0.45 -0.00 0.00 0.00 178.16 178.44 2vxx h HIS 164 N 0.00 0.96 -0.54 0.10 3.86 -1.13 -1.27 115.15 117.14 2vxx h HIS 164 Ca 0.00 -0.18 -0.04 0.00 -1.16 0.00 0.00 60.37 59.00 2vxx h HIS 164 Cb 0.70 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.90 2vxx h HIS 164 CO 0.00 0.91 0.18 0.82 0.86 0.00 0.00 177.93 180.71 2vxx h ILE 165 N 0.73 1.23 -0.78 2.45 2.04 -0.81 -2.51 117.51 119.86 2vxx h ILE 165 Ca 0.14 -0.75 0.15 0.00 1.00 0.00 0.00 64.86 65.39 2vxx h ILE 165 Cb 0.55 0.71 -0.10 0.00 -0.74 0.00 0.00 36.82 37.24 2vxx h ILE 165 CO 0.03 0.28 0.33 1.23 0.00 0.00 0.00 178.15 180.02 2vxx h GLY 166 N 0.74 1.22 1.11 5.37 0.00 -0.90 -1.80 103.07 108.81 2vxx h GLY 166 Ca 0.18 -0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 2vxx h GLY 166 CO -0.01 -0.11 -0.02 0.45 0.00 0.00 0.00 176.54 176.85 2vxx h HIS 167 N 0.46 1.15 -0.73 5.60 3.86 -0.99 -2.33 115.15 122.18 2vxx h HIS 167 Ca 0.44 -0.21 0.07 0.00 -1.16 0.00 0.00 60.37 59.52 2vxx h HIS 167 Cb 0.68 -0.30 -0.05 0.00 1.06 0.00 0.00 27.41 28.80 2vxx h HIS 167 CO -0.16 1.03 0.48 0.74 0.86 0.00 0.00 177.93 180.88 2vxx h PHE 168 N 0.96 0.74 0.00 2.45 0.04 -0.91 -2.60 116.94 117.62 2vxx h PHE 168 Ca 0.17 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.96 2vxx h PHE 168 Cb 0.58 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.49 2vxx h PHE 168 CO 0.04 0.38 -0.46 1.28 -0.60 0.00 0.00 178.31 178.94 2vxx n LEU 169 N -4.49 0.48 -4.70 1.54 4.77 -0.90 -4.95 117.00 108.75 2vxx n LEU 169 Ca 0.11 0.11 -0.34 0.00 -0.03 0.00 0.00 56.01 55.86 2vxx n LEU 169 Cb 0.26 -0.27 0.12 0.00 -2.33 0.00 0.00 43.42 41.21 2vxx n LEU 169 CO 0.33 0.07 0.79 0.00 -1.33 0.00 0.00 177.39 177.25 2vxx s ALA 170 N -3.03 1.90 -1.28 -1.18 0.00 -0.90 -4.90 121.76 112.36 2vxx s ALA 170 Ca 0.10 0.89 -0.08 0.00 0.00 0.00 0.00 51.96 52.87 2vxx s ALA 170 Cb 0.17 -3.50 0.16 0.00 0.00 0.00 0.00 23.12 19.95 2vxx s ALA 170 CO 0.68 -2.22 1.96 -1.71 0.00 0.00 0.00 175.76 174.47 2vxx n ASN 171 N -3.14 5.67 -4.06 0.00 5.15 -1.26 -4.88 115.26 112.73 2vxx n ASN 171 Ca 0.14 -3.13 -0.09 0.00 -0.60 0.00 0.00 54.58 50.90 2vxx n ASN 171 Cb 0.50 -1.45 -0.11 0.00 -0.53 0.00 0.00 39.78 38.20 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 0.67 0.57 -0.03 1.20 2.15 -1.26 -5.17 116.67 114.80 2vxx s ASP 172 Ca 0.42 -0.78 -0.29 0.00 0.43 0.00 0.00 52.55 52.33 2vxx s ASP 172 Cb 0.11 0.13 0.10 0.00 -0.30 0.00 0.00 42.92 42.96 2vxx s ASP 172 CO -0.01 -0.43 0.86 -0.55 -0.17 0.00 0.00 175.17 174.88 2vxx s SER 173 N -2.29 -0.41 0.11 -0.34 0.15 -1.26 -5.00 113.70 104.66 2vxx s SER 173 Ca -0.02 0.15 0.27 0.00 0.70 0.00 0.00 55.95 57.05 2vxx s SER 173 Cb -0.01 0.40 0.84 0.00 -1.71 0.00 0.00 66.02 65.55 2vxx s SER 173 CO -0.05 -0.60 1.72 0.18 1.20 0.00 0.00 173.24 175.69 2vxx n LEU 174 N 0.05 0.51 -4.54 3.45 4.77 -1.26 -4.84 117.00 115.14 2vxx n LEU 174 Ca -0.11 0.44 -0.47 0.00 -0.03 0.00 0.00 56.01 55.85 2vxx n LEU 174 Cb 0.61 -0.35 -0.05 0.00 -2.33 0.00 0.00 43.42 41.30 2vxx n LEU 174 CO 0.13 -0.07 1.80 0.29 -1.33 0.00 0.00 177.39 178.21 2vxx n LYS 175 N -1.92 1.59 0.00 3.23 4.76 -1.26 -5.39 118.16 119.16 2vxx n LYS 175 Ca 0.06 0.45 0.05 0.00 -2.87 0.00 0.00 58.31 56.00 2vxx n LYS 175 Cb 0.39 -2.85 0.05 0.00 -1.84 0.00 0.00 35.03 30.78 2vxx n LYS 175 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58