#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xvj h MET 2 N 0.00 0.59 0.00 4.33 -1.53 -1.95 -2.57 114.93 113.79 1xvj h MET 2 Ca 0.00 -0.05 -0.00 0.00 -3.44 0.00 0.00 59.70 56.20 1xvj h MET 2 Cb 0.00 -0.12 -0.00 0.00 -0.55 0.00 0.00 31.60 30.93 1xvj h MET 2 CO 0.00 0.44 -0.01 1.79 0.14 0.00 0.00 176.91 179.27 1xvj h THR 3 N 0.59 0.02 0.00 -0.77 1.35 -1.90 -1.06 112.91 111.14 1xvj h THR 3 Ca 0.15 -0.69 -0.01 0.00 -0.55 0.00 0.00 66.41 65.31 1xvj h THR 3 Cb 0.02 1.68 -0.00 0.00 -1.73 0.00 0.00 68.15 68.12 1xvj h THR 3 CO -0.03 0.01 -0.06 0.44 -0.25 0.00 0.00 175.52 175.63 1xvj h ASP 4 N 0.00 0.00 0.05 5.36 3.32 -1.92 -3.35 116.42 119.88 1xvj h ASP 4 Ca -0.00 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.69 1xvj h ASP 4 Cb 0.67 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.16 1xvj h ASP 4 CO 0.00 0.06 -2.32 0.18 -1.72 0.00 0.00 179.24 175.44 1xvj n LEU 5 N -3.13 0.60 -4.16 1.55 4.77 -0.80 -5.02 117.00 110.80 1xvj n LEU 5 Ca 0.03 0.03 -0.13 0.00 -0.03 0.00 0.00 56.01 55.90 1xvj n LEU 5 Cb 0.48 0.22 -0.11 0.00 -2.33 0.00 0.00 43.42 41.68 1xvj n LEU 5 CO 0.33 0.56 -0.41 -0.76 -1.33 0.00 0.00 177.39 175.78 1xvj s LEU 6 N -5.74 2.42 0.12 2.23 1.43 -0.47 -5.03 118.68 113.63 1xvj s LEU 6 Ca -0.13 -0.83 -0.31 0.00 -1.03 0.00 0.00 54.13 51.82 1xvj s LEU 6 Cb 0.07 -0.23 -0.07 0.00 0.03 0.00 0.00 46.19 45.98 1xvj s LEU 6 CO 0.79 -0.31 1.29 -0.55 0.23 0.00 0.00 176.35 177.81 1xvj s SER 7 N -2.51 6.96 0.30 2.29 0.15 -1.26 -4.52 113.70 115.11 1xvj s SER 7 Ca 0.06 2.22 0.02 0.00 0.70 0.00 0.00 55.95 58.94 1xvj s SER 7 Cb -0.02 -2.59 0.57 0.00 -1.71 0.00 0.00 66.02 62.27 1xvj s SER 7 CO -0.01 -0.54 1.88 0.00 1.20 0.00 0.00 173.24 175.78 1xvj h ALA 8 N 6.40 1.55 -0.47 5.45 0.00 -1.95 -0.69 119.26 129.55 1xvj h ALA 8 Ca -0.43 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 1xvj h ALA 8 Cb 1.21 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1xvj h ALA 8 CO 0.82 0.27 -0.22 1.49 0.00 0.00 0.00 179.25 181.60 1xvj h GLU 9 N 0.99 0.98 -0.56 0.00 4.57 -1.99 -0.75 114.58 117.81 1xvj h GLU 9 Ca 0.43 -0.42 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 1xvj h GLU 9 Cb 0.35 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 1xvj h GLU 9 CO -0.19 1.09 0.19 -0.44 -1.18 0.00 0.00 179.01 178.49 1xvj h ASP 10 N 0.84 0.79 -0.60 1.04 3.32 -1.80 -1.68 116.42 118.33 1xvj h ASP 10 Ca 0.11 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 1xvj h ASP 10 Cb 0.80 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 1xvj h ASP 10 CO 0.07 0.77 0.33 0.40 -1.72 0.00 0.00 179.24 179.09 1xvj h ILE 11 N 0.77 1.20 -0.10 0.35 2.04 -1.02 -1.05 117.51 119.69 1xvj h ILE 11 Ca 0.18 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.55 1xvj h ILE 11 Cb 0.25 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1xvj h ILE 11 CO -0.01 0.21 0.05 0.50 0.00 0.00 0.00 178.15 178.91 1xvj h LYS 12 N 0.82 0.11 -0.43 2.37 3.64 -0.95 -0.18 116.57 121.94 1xvj h LYS 12 Ca 0.21 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1xvj h LYS 12 Cb 0.05 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1xvj h LYS 12 CO -0.03 0.07 0.17 0.87 -2.27 0.00 0.00 179.45 178.26 1xvj h LYS 13 N 0.11 0.64 -0.11 1.90 1.57 -1.21 -1.07 116.57 118.40 1xvj h LYS 13 Ca 0.04 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1xvj h LYS 13 Cb -0.00 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 1xvj h LYS 13 CO -0.02 0.60 0.02 0.00 -0.57 0.00 0.00 179.45 179.48 1xvj h ALA 14 N 1.01 0.14 -0.50 3.86 0.00 -1.03 -2.43 119.26 120.32 1xvj h ALA 14 Ca 0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1xvj h ALA 14 Cb 0.20 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1xvj h ALA 14 CO -0.01 -0.22 0.27 0.82 0.00 0.00 0.00 179.25 180.11 1xvj h ILE 15 N -0.04 1.17 -0.12 0.00 1.08 -1.03 -2.83 117.51 115.75 1xvj h ILE 15 Ca 0.03 -0.44 0.03 0.00 -0.39 0.00 0.00 64.86 64.10 1xvj h ILE 15 Cb 0.26 0.56 -0.00 0.00 -3.07 0.00 0.00 36.82 34.57 1xvj h ILE 15 CO 0.00 0.18 0.10 1.23 -0.69 0.00 0.00 178.15 178.98 1xvj h GLY 16 N 0.66 0.00 1.53 5.37 0.00 -1.06 -2.33 103.07 107.24 1xvj h GLY 16 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1xvj h GLY 16 CO -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 176.54 176.51 1xvj n ALA 17 N -2.45 2.50 -2.35 3.60 0.00 -0.93 -3.81 120.51 117.08 1xvj n ALA 17 Ca -0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 53.44 53.28 1xvj n ALA 17 Cb 0.22 -1.49 0.07 0.00 0.00 0.00 0.00 19.45 18.24 1xvj n ALA 17 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1xvj n PHE 18 N -1.27 0.79 0.15 0.00 3.72 -0.88 -4.83 117.46 115.15 1xvj n PHE 18 Ca 0.15 -1.43 0.00 0.00 -0.05 0.00 0.00 57.45 56.12 1xvj n PHE 18 Cb 0.23 -0.22 0.23 0.00 -0.94 0.00 0.00 39.48 38.78 1xvj n PHE 18 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1xvj h THR 19 N 4.68 1.33 -3.91 4.37 1.35 -1.66 -3.45 112.91 115.62 1xvj h THR 19 Ca -0.07 -1.90 -0.53 0.00 -0.55 0.00 0.00 66.41 63.37 1xvj h THR 19 Cb 1.49 2.04 0.08 0.00 -1.73 0.00 0.00 68.15 70.03 1xvj h THR 19 CO 0.21 0.53 0.67 0.00 -0.25 0.00 0.00 175.52 176.68 1xvj s ALA 20 N -3.70 3.47 0.36 6.62 0.00 -1.26 -4.94 121.76 122.32 1xvj s ALA 20 Ca -0.01 1.34 -0.28 0.00 0.00 0.00 0.00 51.96 53.00 1xvj s ALA 20 Cb 0.13 -3.51 -0.11 0.00 0.00 0.00 0.00 23.12 19.62 1xvj s ALA 20 CO 0.74 -0.79 1.47 0.00 0.00 0.00 0.00 175.76 177.19 1xvj n ALA 21 N 0.57 2.23 -1.75 0.00 0.00 -1.26 -2.69 120.51 117.61 1xvj n ALA 21 Ca 0.01 0.35 -0.21 0.00 0.00 0.00 0.00 53.44 53.59 1xvj n ALA 21 Cb 0.41 -2.40 -0.07 0.00 0.00 0.00 0.00 19.45 17.39 1xvj n ALA 21 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1xvj n ASP 22 N 0.69 -5.50 -0.05 0.00 8.00 -1.26 -4.88 116.55 113.55 1xvj n ASP 22 Ca 0.03 0.41 0.12 0.00 0.71 0.00 0.00 54.79 56.06 1xvj n ASP 22 Cb 0.38 -4.81 0.24 0.00 -0.02 0.00 0.00 41.12 36.91 1xvj n ASP 22 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1xvj n SER 23 N -1.47 0.65 -4.75 -2.24 3.41 -1.10 -4.98 113.62 103.15 1xvj n SER 23 Ca -0.21 -0.44 -0.41 0.00 -0.26 0.00 0.00 58.87 57.54 1xvj n SER 23 Cb 0.68 0.29 -0.02 0.00 -0.26 0.00 0.00 64.21 64.90 1xvj n SER 23 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1xvj s PHE 24 N -2.90 2.88 -0.21 7.33 5.36 -1.26 -4.97 117.98 124.20 1xvj s PHE 24 Ca 0.13 0.96 -0.04 0.00 -0.96 0.00 0.00 56.93 57.03 1xvj s PHE 24 Cb 0.18 -3.93 0.07 0.00 -0.34 0.00 0.00 43.02 39.00 1xvj s PHE 24 CO 0.68 -3.02 0.08 0.34 -1.46 0.00 0.00 175.22 171.84 1xvj s ASP 25 N 0.32 2.82 0.33 6.13 -1.08 -1.26 -5.04 116.67 118.89 1xvj s ASP 25 Ca 0.60 -0.85 0.04 0.00 -0.52 0.00 0.00 52.55 51.81 1xvj s ASP 25 Cb -0.44 -0.40 0.58 0.00 -1.46 0.00 0.00 42.92 41.19 1xvj s ASP 25 CO 0.47 -0.36 1.87 1.12 0.52 0.00 0.00 175.17 178.80 1xvj h HIS 26 N 8.35 0.59 -0.02 -5.34 2.07 -1.98 -0.84 115.15 117.97 1xvj h HIS 26 Ca -0.16 -0.06 -0.00 0.00 -2.85 0.00 0.00 60.37 57.30 1xvj h HIS 26 Cb 1.11 -0.17 -0.00 0.00 2.57 0.00 0.00 27.41 30.92 1xvj h HIS 26 CO 0.23 0.56 -0.00 0.87 -3.07 0.00 0.00 177.93 176.51 1xvj h LYS 27 N 0.55 0.03 -0.66 5.12 1.57 -1.95 0.55 116.57 121.79 1xvj h LYS 27 Ca 0.12 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1xvj h LYS 27 Cb 0.31 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 1xvj h LYS 27 CO 0.01 0.35 0.35 -0.22 -0.57 0.00 0.00 179.45 179.37 1xvj h LYS 28 N -0.30 0.92 0.27 3.15 3.64 -1.94 -1.29 116.57 121.02 1xvj h LYS 28 Ca 0.00 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1xvj h LYS 28 Cb 0.34 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1xvj h LYS 28 CO 0.00 0.70 -0.21 0.35 -2.27 0.00 0.00 179.45 178.02 1xvj h PHE 29 N 0.90 -0.56 -0.72 1.91 3.57 -0.98 -0.52 116.94 120.54 1xvj h PHE 29 Ca 0.23 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 1xvj h PHE 29 Cb 0.06 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 1xvj h PHE 29 CO -0.00 -0.32 0.37 0.74 -2.23 0.00 0.00 178.31 176.86 1xvj h PHE 30 N -0.49 1.00 -0.14 0.41 0.04 -0.76 0.83 116.94 117.83 1xvj h PHE 30 Ca -0.02 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1xvj h PHE 30 Cb 0.44 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 1xvj h PHE 30 CO -0.13 0.72 0.09 0.37 -0.60 0.00 0.00 178.31 178.75 1xvj h GLN 31 N 1.01 0.18 -0.39 1.51 -0.00 -1.11 -1.65 115.11 114.66 1xvj h GLN 31 Ca 0.25 -0.01 -0.15 0.00 -0.00 0.00 0.00 58.65 58.74 1xvj h GLN 31 Cb 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.50 1xvj h GLN 31 CO -0.04 0.15 -0.34 0.52 0.00 0.00 0.00 178.83 179.12 1xvj h MET 32 N 0.16 0.90 0.00 1.69 2.86 -0.23 -2.58 114.93 117.74 1xvj h MET 32 Ca 0.05 -0.45 0.00 0.00 -2.06 0.00 0.00 59.70 57.24 1xvj h MET 32 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1xvj h MET 32 CO -0.01 1.10 0.00 -0.24 1.06 0.00 0.00 176.91 178.82 1xvj h VAL 33 N 0.75 0.00 0.00 -2.22 3.04 -0.92 -3.45 116.25 113.46 1xvj h VAL 33 Ca 0.07 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.48 1xvj h VAL 33 Cb 0.92 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.27 1xvj h VAL 33 CO 0.09 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.26 1xvj n GLY 34 N 0.13 0.95 0.22 3.17 0.00 -0.97 -4.57 105.19 104.11 1xvj n GLY 34 Ca 0.02 -0.02 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1xvj n GLY 34 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xvj h LEU 35 N 0.00 0.00 -2.29 0.99 3.38 -1.52 -1.84 115.31 114.03 1xvj h LEU 35 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xvj h LEU 35 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1xvj h LEU 35 CO 0.00 0.25 0.00 0.11 0.09 0.00 0.00 178.44 178.89 1xvj h LYS 36 N 0.00 0.00 0.00 1.13 1.79 -1.85 -2.50 116.57 115.14 1xvj h LYS 36 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1xvj h LYS 36 Cb 0.49 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 1xvj h LYS 36 CO 0.03 0.00 -0.20 1.63 -1.08 0.00 0.00 179.45 179.83 1xvj n LYS 37 N -3.08 0.03 -2.99 3.15 5.02 -0.69 -4.92 118.16 114.68 1xvj n LYS 37 Ca -0.01 0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 1xvj n LYS 37 Cb 0.18 -1.52 -0.06 0.00 -0.02 0.00 0.00 35.03 33.60 1xvj n LYS 37 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1xvj s LYS 38 N -3.01 4.16 0.92 1.97 -0.14 -0.94 -5.05 119.74 117.65 1xvj s LYS 38 Ca 0.12 0.91 -0.11 0.00 -1.36 0.00 0.00 55.97 55.54 1xvj s LYS 38 Cb 0.18 -2.43 0.15 0.00 -1.68 0.00 0.00 37.83 34.05 1xvj s LYS 38 CO 0.60 0.13 1.12 -1.54 -0.76 0.00 0.00 175.35 174.90 1xvj s SER 39 N -2.11 2.93 0.35 2.83 1.04 -1.26 -4.77 113.70 112.70 1xvj s SER 39 Ca 0.55 2.02 0.06 0.00 0.48 0.00 0.00 55.95 59.06 1xvj s SER 39 Cb -0.11 -2.51 0.72 0.00 0.10 0.00 0.00 66.02 64.22 1xvj s SER 39 CO 0.17 -3.07 1.92 0.00 0.98 0.00 0.00 173.24 173.24 1xvj h ALA 40 N -1.85 1.71 -0.61 5.32 0.00 -1.98 -0.82 119.26 121.03 1xvj h ALA 40 Ca -0.46 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 1xvj h ALA 40 Cb 1.27 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1xvj h ALA 40 CO 0.45 0.13 0.10 -0.44 0.00 0.00 0.00 179.25 179.49 1xvj h ASP 41 N 0.80 0.97 0.29 0.00 3.32 -2.00 -2.20 116.42 117.60 1xvj h ASP 41 Ca 0.38 -0.26 -0.17 0.00 0.02 0.00 0.00 57.03 57.00 1xvj h ASP 41 Cb 0.41 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1xvj h ASP 41 CO -0.15 0.99 -0.67 0.44 -1.72 0.00 0.00 179.24 178.13 1xvj h ASP 42 N 0.92 0.40 -0.67 6.45 3.32 -1.74 -2.09 116.42 123.01 1xvj h ASP 42 Ca 0.19 -0.25 0.04 0.00 0.02 0.00 0.00 57.03 57.02 1xvj h ASP 42 Cb 0.43 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.82 1xvj h ASP 42 CO 0.01 0.95 0.41 0.58 -1.72 0.00 0.00 179.24 179.48 1xvj h VAL 43 N 0.25 1.06 -0.81 -1.35 2.07 -0.99 -0.78 116.25 115.70 1xvj h VAL 43 Ca -0.02 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1xvj h VAL 43 Cb 1.21 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1xvj h VAL 43 CO 0.11 0.14 0.35 0.11 0.02 0.00 0.00 177.57 178.31 1xvj h LYS 44 N 0.79 1.20 -0.90 1.57 1.57 -1.15 -1.58 116.57 118.07 1xvj h LYS 44 Ca 0.28 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1xvj h LYS 44 Cb 0.05 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 1xvj h LYS 44 CO -0.12 0.95 0.53 0.87 -0.57 0.00 0.00 179.45 181.11 1xvj h LYS 45 N 1.17 1.23 -0.30 3.15 1.57 -0.72 -1.30 116.57 121.37 1xvj h LYS 45 Ca 0.27 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1xvj h LYS 45 Cb 0.18 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1xvj h LYS 45 CO -0.03 0.87 0.20 0.28 -0.57 0.00 0.00 179.45 180.19 1xvj h VAL 46 N 1.24 1.09 -0.59 0.50 2.07 -0.65 -2.56 116.25 117.35 1xvj h VAL 46 Ca 0.32 -0.17 0.07 0.00 0.82 0.00 0.00 66.70 67.74 1xvj h VAL 46 Cb -0.04 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 1xvj h VAL 46 CO -0.06 0.08 0.26 0.15 0.02 0.00 0.00 177.57 178.03 1xvj h PHE 47 N 0.40 0.47 -0.15 1.57 3.57 -0.32 -1.41 116.94 121.07 1xvj h PHE 47 Ca 0.11 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.55 1xvj h PHE 47 Cb -0.03 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1xvj h PHE 47 CO -0.05 0.18 -0.31 0.45 -2.23 0.00 0.00 178.31 176.35 1xvj h HIS 48 N 0.48 0.34 -0.22 0.41 3.86 -1.05 0.78 115.15 119.74 1xvj h HIS 48 Ca 0.28 -0.07 -0.04 0.00 -1.16 0.00 0.00 60.37 59.38 1xvj h HIS 48 Cb 0.28 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 1xvj h HIS 48 CO -0.13 0.58 -0.02 0.82 0.86 0.00 0.00 177.93 180.04 1xvj h ILE 49 N 0.26 1.27 0.00 2.45 2.04 -1.04 -2.92 117.51 119.58 1xvj h ILE 49 Ca 0.04 -0.95 -0.04 0.00 1.00 0.00 0.00 64.86 64.90 1xvj h ILE 49 Cb 0.68 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 1xvj h ILE 49 CO 0.05 0.29 -0.20 -0.07 0.00 0.00 0.00 178.15 178.23 1xvj h LEU 50 N 0.16 0.00 -7.67 1.44 3.38 -0.74 -3.31 115.31 108.57 1xvj h LEU 50 Ca 0.06 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.53 1xvj h LEU 50 Cb 0.44 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1xvj h LEU 50 CO 0.02 0.20 1.69 -0.67 0.09 0.00 0.00 178.44 179.76 1xvj n ASP 51 N -3.98 3.67 -0.03 -0.43 2.03 0.22 -4.82 116.55 113.21 1xvj n ASP 51 Ca -0.02 -2.78 0.00 0.00 0.52 0.00 0.00 54.79 52.51 1xvj n ASP 51 Cb 0.28 -1.67 0.29 0.00 -0.72 0.00 0.00 41.12 39.30 1xvj n ASP 51 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1xvj h LYS 52 N 8.60 0.59 -0.23 -0.67 1.57 -1.78 -1.68 116.57 122.97 1xvj h LYS 52 Ca 0.34 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1xvj h LYS 52 Cb 0.87 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1xvj h LYS 52 CO 1.42 0.56 0.00 -0.40 -0.57 0.00 0.00 179.45 180.46 1xvj n ASP 53 N -4.31 2.37 -3.92 0.86 5.68 -1.26 -4.96 116.55 111.02 1xvj n ASP 53 Ca 0.02 -1.82 -0.31 0.00 -0.50 0.00 0.00 54.79 52.18 1xvj n ASP 53 Cb 0.21 -0.15 0.01 0.00 -1.14 0.00 0.00 41.12 40.05 1xvj n ASP 53 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1xvj n LYS 54 N 0.79 -4.46 0.20 0.11 4.76 -0.63 -4.86 118.16 114.07 1xvj n LYS 54 Ca 0.17 0.51 0.14 0.00 -2.87 0.00 0.00 58.31 56.27 1xvj n LYS 54 Cb 0.44 -5.33 0.45 0.00 -1.84 0.00 0.00 35.03 28.75 1xvj n LYS 54 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1xvj h SER 55 N -1.72 0.00 0.00 4.39 4.64 -1.93 -3.46 113.55 115.46 1xvj h SER 55 Ca -0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 1xvj h SER 55 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1xvj h SER 55 CO 0.69 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.26 1xvj n GLY 56 N 0.56 0.43 2.98 -0.77 0.00 -1.26 -5.06 105.19 102.07 1xvj n GLY 56 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1xvj n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xvj s PHE 57 N -2.04 0.28 -0.51 1.61 0.08 -1.26 -4.42 117.98 111.71 1xvj s PHE 57 Ca 0.00 -0.50 -0.20 0.00 0.12 0.00 0.00 56.93 56.35 1xvj s PHE 57 Cb 0.00 -0.20 0.06 0.00 -0.57 0.00 0.00 43.02 42.31 1xvj s PHE 57 CO 0.00 -0.17 0.67 0.42 -0.10 0.00 0.00 175.22 176.04 1xvj s ILE 58 N -1.39 4.80 0.88 0.64 1.01 -0.27 -4.83 121.20 122.05 1xvj s ILE 58 Ca -0.15 -0.39 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 1xvj s ILE 58 Cb -0.10 -4.34 0.14 0.00 0.01 0.00 0.00 42.46 38.18 1xvj s ILE 58 CO -0.01 -0.86 1.25 -1.61 0.00 0.00 0.00 174.94 173.71 1xvj s GLU 59 N 2.82 1.30 0.24 2.79 8.01 -1.26 -1.21 118.70 131.39 1xvj s GLU 59 Ca 0.17 -0.17 -0.05 0.00 0.01 0.00 0.00 54.97 54.94 1xvj s GLU 59 Cb -0.18 -1.90 0.44 0.00 -4.31 0.00 0.00 34.13 28.17 1xvj s GLU 59 CO 0.13 -2.00 1.73 1.49 0.01 0.00 0.00 175.26 176.61 1xvj h GLU 60 N -1.34 0.41 -0.32 1.61 4.81 -1.97 -0.94 114.58 116.83 1xvj h GLU 60 Ca -0.45 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 58.67 1xvj h GLU 60 Cb 1.28 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1xvj h GLU 60 CO 0.52 0.27 -0.14 0.38 -0.73 0.00 0.00 179.01 179.31 1xvj h ASP 61 N 0.42 0.55 0.87 1.04 2.03 -1.99 -1.06 116.42 118.28 1xvj h ASP 61 Ca 0.40 -0.15 -0.13 0.00 -0.73 0.00 0.00 57.03 56.42 1xvj h ASP 61 Cb 0.61 -0.15 -0.02 0.00 -0.83 0.00 0.00 39.33 38.95 1xvj h ASP 61 CO -0.41 0.72 -0.63 -0.33 -1.03 0.00 0.00 179.24 177.56 1xvj h GLU 62 N 0.51 0.00 -0.37 4.15 5.08 -1.76 -2.25 114.58 119.95 1xvj h GLU 62 Ca 0.09 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.32 1xvj h GLU 62 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1xvj h GLU 62 CO 0.03 0.63 -0.28 1.25 -1.00 0.00 0.00 179.01 179.64 1xvj h LEU 63 N 0.00 0.88 -1.54 1.33 5.85 -0.49 -2.41 115.31 118.92 1xvj h LEU 63 Ca -0.01 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.24 1xvj h LEU 63 Cb 1.23 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 42.01 1xvj h LEU 63 CO 0.08 1.14 -0.17 1.23 -0.34 0.00 0.00 178.44 180.39 1xvj h GLY 64 N 0.63 0.00 -1.71 3.75 0.00 -1.09 -2.54 103.07 102.12 1xvj h GLY 64 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1xvj h GLY 64 CO 0.07 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.05 1xvj n SER 65 N -3.49 2.49 -0.25 0.19 7.64 -0.86 -0.75 113.62 118.60 1xvj n SER 65 Ca -0.01 -2.00 -0.01 0.00 1.01 0.00 0.00 58.87 57.87 1xvj n SER 65 Cb 0.33 -0.31 0.11 0.00 -1.01 0.00 0.00 64.21 63.33 1xvj n SER 65 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1xvj h ILE 66 N 2.72 0.96 -0.08 0.44 2.10 -0.99 -1.89 117.51 120.77 1xvj h ILE 66 Ca 0.00 -0.24 -0.07 0.00 1.08 0.00 0.00 64.86 65.63 1xvj h ILE 66 Cb 0.62 0.18 -0.01 0.00 -1.09 0.00 0.00 36.82 36.52 1xvj h ILE 66 CO 0.00 0.13 -0.25 -0.07 -1.08 0.00 0.00 178.15 176.88 1xvj h LEU 67 N 0.71 0.14 -1.63 2.19 3.38 -1.82 -1.92 115.31 116.37 1xvj h LEU 67 Ca 0.32 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 1xvj h LEU 67 Cb 0.22 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1xvj h LEU 67 CO -0.20 0.40 -0.20 0.11 0.09 0.00 0.00 178.44 178.65 1xvj h LYS 68 N 0.13 0.00 -0.50 1.13 1.57 -1.49 -0.89 116.57 116.53 1xvj h LYS 68 Ca 0.02 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 1xvj h LYS 68 Cb 0.52 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 1xvj h LYS 68 CO 0.04 0.20 0.33 0.78 -0.57 0.00 0.00 179.45 180.23 1xvj h GLY 69 N 1.05 0.59 0.64 3.86 0.00 -1.23 -3.07 103.07 104.92 1xvj h GLY 69 Ca -0.00 -0.20 -0.36 0.00 0.00 0.00 0.00 47.33 46.77 1xvj h GLY 69 CO 0.03 0.16 -1.98 0.69 0.00 0.00 0.00 176.54 175.44 1xvj n PHE 70 N -4.47 1.19 -3.61 5.60 3.72 -0.61 -4.75 117.46 114.52 1xvj n PHE 70 Ca 0.06 0.27 -0.08 0.00 -0.05 0.00 0.00 57.45 57.65 1xvj n PHE 70 Cb 0.20 -1.16 -0.09 0.00 -0.94 0.00 0.00 39.48 37.49 1xvj n PHE 70 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1xvj s SER 71 N -6.89 -0.22 0.65 4.37 0.15 -0.44 -4.89 113.70 106.43 1xvj s SER 71 Ca -0.20 0.90 0.38 0.00 0.70 0.00 0.00 55.95 57.73 1xvj s SER 71 Cb 0.07 1.35 2.09 0.00 -1.71 0.00 0.00 66.02 67.82 1xvj s SER 71 CO 0.77 -0.24 2.24 0.77 1.20 0.00 0.00 173.24 177.98 1xvj h SER 72 N 8.17 0.00 -0.01 5.45 4.64 -1.79 -1.07 113.55 128.94 1xvj h SER 72 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1xvj h SER 72 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1xvj h SER 72 CO 0.14 0.00 -0.01 -0.90 -0.87 0.00 0.00 176.83 175.19 1xvj n ASP 73 N -3.26 1.75 -4.75 4.97 5.68 -1.26 -4.88 116.55 114.81 1xvj n ASP 73 Ca -0.02 -1.56 -0.31 0.00 -0.50 0.00 0.00 54.79 52.39 1xvj n ASP 73 Cb 0.17 0.01 0.10 0.00 -1.14 0.00 0.00 41.12 40.26 1xvj n ASP 73 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xvj s ALA 74 N -2.02 2.11 0.68 2.12 0.00 -0.40 -5.01 121.76 119.23 1xvj s ALA 74 Ca 0.35 0.41 -0.13 0.00 0.00 0.00 0.00 51.96 52.59 1xvj s ALA 74 Cb 0.21 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 20.01 1xvj s ALA 74 CO 0.34 -1.92 1.08 -0.98 0.00 0.00 0.00 175.76 174.27 1xvj s ARG 75 N -4.69 2.83 0.56 0.00 1.70 -1.26 -4.66 118.95 113.43 1xvj s ARG 75 Ca 0.64 1.19 -0.18 0.00 -0.47 0.00 0.00 55.73 56.90 1xvj s ARG 75 Cb -0.19 -1.97 -0.05 0.00 -0.57 0.00 0.00 34.95 32.17 1xvj s ARG 75 CO 0.54 -1.20 1.09 -0.51 -1.08 0.00 0.00 175.30 174.14 1xvj s ASP 76 N -3.12 5.79 0.39 -2.89 1.01 -1.26 -4.49 116.67 112.11 1xvj s ASP 76 Ca 0.63 2.00 -0.25 0.00 0.71 0.00 0.00 52.55 55.63 1xvj s ASP 76 Cb -0.17 -2.56 -0.09 0.00 1.01 0.00 0.00 42.92 41.12 1xvj s ASP 76 CO 0.47 -1.17 1.13 -0.76 0.21 0.00 0.00 175.17 175.05 1xvj s LEU 77 N -4.07 4.19 0.89 1.23 1.43 0.07 -5.04 118.68 117.38 1xvj s LEU 77 Ca 0.68 2.25 -0.11 0.00 -1.03 0.00 0.00 54.13 55.92 1xvj s LEU 77 Cb -0.19 -4.05 0.12 0.00 0.03 0.00 0.00 46.19 42.10 1xvj s LEU 77 CO 0.30 -0.60 1.09 -0.94 0.23 0.00 0.00 176.35 176.44 1xvj s SER 78 N -1.26 3.50 0.29 2.29 1.04 -1.26 -4.79 113.70 113.51 1xvj s SER 78 Ca 0.57 1.62 0.04 0.00 0.48 0.00 0.00 55.95 58.66 1xvj s SER 78 Cb -0.28 -2.29 0.70 0.00 0.10 0.00 0.00 66.02 64.25 1xvj s SER 78 CO 0.35 -2.64 1.74 0.00 0.98 0.00 0.00 173.24 173.68 1xvj h ALA 79 N -1.55 1.52 -0.21 5.32 0.00 -1.99 -0.85 119.26 121.50 1xvj h ALA 79 Ca -0.48 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.42 1xvj h ALA 79 Cb 1.27 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1xvj h ALA 79 CO 0.52 -0.17 -0.32 -0.22 0.00 0.00 0.00 179.25 179.06 1xvj h LYS 80 N 0.60 0.58 -0.41 0.00 1.63 -1.99 -1.20 116.57 115.78 1xvj h LYS 80 Ca 0.55 -0.35 -0.01 0.00 -0.85 0.00 0.00 60.65 59.99 1xvj h LYS 80 Cb 0.93 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.57 1xvj h LYS 80 CO -0.43 0.95 0.21 0.93 -3.45 0.00 0.00 179.45 177.66 1xvj h GLU 81 N 0.26 0.56 -0.22 1.90 5.08 -1.78 -0.94 114.58 119.44 1xvj h GLU 81 Ca 0.02 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1xvj h GLU 81 Cb 0.90 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1xvj h GLU 81 CO 0.07 0.43 -0.24 1.15 -1.00 0.00 0.00 179.01 179.42 1xvj h THR 82 N 0.57 1.32 -0.87 1.13 2.02 -0.95 -1.48 112.91 114.64 1xvj h THR 82 Ca 0.15 -1.41 0.10 0.00 0.77 0.00 0.00 66.41 66.02 1xvj h THR 82 Cb 0.04 1.73 -0.08 0.00 -1.74 0.00 0.00 68.15 68.10 1xvj h THR 82 CO -0.02 0.44 0.52 0.11 0.37 0.00 0.00 175.52 176.93 1xvj h LYS 83 N 0.25 0.83 -0.34 6.66 1.79 -0.78 0.62 116.57 125.59 1xvj h LYS 83 Ca 0.03 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.44 1xvj h LYS 83 Cb 0.80 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 31.24 1xvj h LYS 83 CO 0.06 0.55 0.16 1.15 -1.08 0.00 0.00 179.45 180.28 1xvj h THR 84 N 0.85 1.17 -0.35 -0.16 2.02 -0.97 -1.41 112.91 114.06 1xvj h THR 84 Ca 0.42 -0.48 -0.16 0.00 0.77 0.00 0.00 66.41 66.97 1xvj h THR 84 Cb 0.39 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1xvj h THR 84 CO -0.25 0.17 -0.42 0.25 0.37 0.00 0.00 175.52 175.64 1xvj h LEU 85 N 0.41 0.95 -0.74 2.58 5.85 -0.93 -1.25 115.31 122.18 1xvj h LEU 85 Ca 0.12 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.37 1xvj h LEU 85 Cb 0.13 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 1xvj h LEU 85 CO -0.01 1.23 0.40 -0.03 -0.34 0.00 0.00 178.44 179.69 1xvj h MET 86 N 0.71 1.04 -0.72 1.25 4.05 -0.78 -1.33 114.93 119.14 1xvj h MET 86 Ca 0.05 -0.13 -0.06 0.00 -0.28 0.00 0.00 59.70 59.28 1xvj h MET 86 Cb 1.00 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.57 1xvj h MET 86 CO 0.10 0.78 0.20 0.00 0.23 0.00 0.00 176.91 178.22 1xvj h ALA 87 N 1.20 0.95 -0.70 0.39 0.00 -1.06 0.38 119.26 120.43 1xvj h ALA 87 Ca 0.26 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1xvj h ALA 87 Cb 0.05 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1xvj h ALA 87 CO -0.04 0.66 0.32 0.00 0.00 0.00 0.00 179.25 180.18 1xvj h ALA 88 N 1.10 1.24 0.04 0.00 0.00 -0.88 -3.34 119.26 117.41 1xvj h ALA 88 Ca 0.23 -0.15 -0.36 0.00 0.00 0.00 0.00 54.91 54.62 1xvj h ALA 88 Cb 0.34 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1xvj h ALA 88 CO -0.00 0.58 -2.21 0.41 0.00 0.00 0.00 179.25 178.03 1xvj n GLY 89 N -1.05 -0.65 3.51 0.00 0.00 -0.53 -4.79 105.19 101.69 1xvj n GLY 89 Ca 0.07 -0.22 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1xvj n GLY 89 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xvj s ASP 90 N -6.39 6.93 0.00 1.61 2.15 0.13 -4.76 116.67 116.34 1xvj s ASP 90 Ca -0.22 -2.66 0.24 0.00 0.43 0.00 0.00 52.55 50.34 1xvj s ASP 90 Cb 0.08 -2.48 0.65 0.00 -0.30 0.00 0.00 42.92 40.87 1xvj s ASP 90 CO 0.73 -0.96 1.51 0.29 -0.17 0.00 0.00 175.17 176.57 1xvj n LYS 91 N 6.91 1.99 -0.00 4.34 4.76 -1.26 -4.02 118.16 130.88 1xvj n LYS 91 Ca 0.40 -1.47 0.00 0.00 -2.87 0.00 0.00 58.31 54.37 1xvj n LYS 91 Cb 0.45 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.19 1xvj n LYS 91 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1xvj n ASP 92 N 0.72 1.92 -1.23 4.39 5.75 -1.26 -5.01 116.55 121.83 1xvj n ASP 92 Ca 0.17 -1.97 -0.13 0.00 -0.01 0.00 0.00 54.79 52.85 1xvj n ASP 92 Cb 0.44 -0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.49 1xvj n ASP 92 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xvj n GLY 93 N -0.49 0.69 0.12 6.12 0.00 -1.26 -4.90 105.19 105.47 1xvj n GLY 93 Ca 0.00 -0.37 0.12 0.00 0.00 0.00 0.00 46.02 45.77 1xvj n GLY 93 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xvj h SER 94 N 0.00 0.00 0.00 1.61 4.64 -1.95 -3.47 113.55 114.38 1xvj h SER 94 Ca -0.29 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1xvj h SER 94 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1xvj h SER 94 CO 0.38 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 1xvj n GLY 95 N 1.26 0.79 3.69 -0.77 0.00 -1.26 -5.01 105.19 103.90 1xvj n GLY 95 Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 1xvj n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xvj s LYS 96 N -0.26 1.66 -0.33 1.61 -2.85 -1.26 -4.68 119.74 113.63 1xvj s LYS 96 Ca 0.00 -1.17 -0.15 0.00 -1.00 0.00 0.00 55.97 53.66 1xvj s LYS 96 Cb 0.00 0.53 -0.02 0.00 -2.06 0.00 0.00 37.83 36.28 1xvj s LYS 96 CO 0.00 -0.72 0.34 0.42 0.10 0.00 0.00 175.35 175.48 1xvj s ILE 97 N -3.93 5.19 0.72 3.79 1.01 -0.35 -4.78 121.20 122.86 1xvj s ILE 97 Ca 0.18 0.11 -0.10 0.00 0.00 0.00 0.00 60.65 60.84 1xvj s ILE 97 Cb -0.03 -3.77 0.04 0.00 0.01 0.00 0.00 42.46 38.72 1xvj s ILE 97 CO 0.09 -0.02 1.08 -1.61 0.00 0.00 0.00 174.94 174.48 1xvj s GLU 98 N 1.97 2.52 0.18 2.79 8.01 -1.26 -1.11 118.70 131.80 1xvj s GLU 98 Ca 0.11 0.21 -0.13 0.00 0.01 0.00 0.00 54.97 55.17 1xvj s GLU 98 Cb -0.16 -2.05 0.17 0.00 -4.31 0.00 0.00 34.13 27.77 1xvj s GLU 98 CO 0.11 -1.18 1.75 0.28 0.01 0.00 0.00 175.26 176.23 1xvj h VAL 99 N -0.70 0.84 -0.81 2.63 2.07 -1.99 -1.67 116.25 116.62 1xvj h VAL 99 Ca -0.45 -0.13 0.13 0.00 0.82 0.00 0.00 66.70 67.07 1xvj h VAL 99 Cb 1.28 0.44 -0.09 0.00 -1.52 0.00 0.00 31.29 31.40 1xvj h VAL 99 CO 0.64 0.07 0.40 -0.08 0.02 0.00 0.00 177.57 178.61 1xvj h GLU 100 N 0.37 0.58 -0.16 1.57 4.81 -1.98 -0.74 114.58 119.03 1xvj h GLU 100 Ca 0.24 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.30 1xvj h GLU 100 Cb 0.25 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1xvj h GLU 100 CO -0.24 0.38 -0.48 0.93 -0.73 0.00 0.00 179.01 178.88 1xvj h GLU 101 N 0.59 0.41 -0.35 1.92 5.08 -1.66 -0.96 114.58 119.62 1xvj h GLU 101 Ca 0.43 -0.23 -0.11 0.00 -1.00 0.00 0.00 59.36 58.45 1xvj h GLU 101 Cb 0.58 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1xvj h GLU 101 CO -0.35 0.80 -0.22 0.35 -1.00 0.00 0.00 179.01 178.59 1xvj h PHE 102 N 0.33 0.89 -0.89 4.33 3.57 -0.73 -0.16 116.94 124.28 1xvj h PHE 102 Ca 0.02 -0.24 0.06 0.00 3.53 0.00 0.00 57.97 61.34 1xvj h PHE 102 Cb 0.96 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.44 1xvj h PHE 102 CO 0.03 0.98 0.56 0.77 -2.23 0.00 0.00 178.31 178.42 1xvj h SER 103 N 0.54 0.88 -0.11 0.41 0.02 -0.87 -1.45 113.55 112.98 1xvj h SER 103 Ca 0.07 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1xvj h SER 103 Cb 0.78 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 1xvj h SER 103 CO 0.06 0.56 0.00 0.74 -1.14 0.00 0.00 176.83 177.06 1xvj h THR 104 N 1.02 1.24 -0.60 -2.27 2.02 -1.03 -1.00 112.91 112.28 1xvj h THR 104 Ca 0.39 -0.77 0.12 0.00 0.77 0.00 0.00 66.41 66.92 1xvj h THR 104 Cb 0.18 1.54 -0.10 0.00 -1.74 0.00 0.00 68.15 68.03 1xvj h THR 104 CO -0.18 0.22 -0.02 -0.07 0.37 0.00 0.00 175.52 175.85 1xvj h LEU 105 N -0.07 -0.30 -0.16 2.58 4.07 -0.65 -1.06 115.31 119.72 1xvj h LEU 105 Ca 0.03 0.15 -0.05 0.00 0.08 0.00 0.00 57.88 58.09 1xvj h LEU 105 Cb 0.34 0.28 -0.00 0.00 1.08 0.00 0.00 40.66 42.35 1xvj h LEU 105 CO 0.00 -0.12 -0.11 0.58 -1.08 0.00 0.00 178.44 177.71 1xvj h VAL 106 N 0.10 1.33 0.00 1.22 2.07 -1.18 -3.11 116.25 116.68 1xvj h VAL 106 Ca 0.31 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 1xvj h VAL 106 Cb 0.50 1.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1xvj h VAL 106 CO -0.53 0.36 -0.12 0.00 0.02 0.00 0.00 177.57 177.30 1xvj h ALA 107 N 0.64 1.34 -0.46 1.67 0.00 -0.89 -1.90 119.26 119.67 1xvj h ALA 107 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xvj h ALA 107 Cb 0.62 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1xvj h ALA 107 CO 0.03 0.15 0.00 0.39 0.00 0.00 0.00 179.25 179.82 1xvj n GLU 108 N -3.72 2.29 0.00 0.00 1.02 -0.43 -5.08 120.64 114.72 1xvj n GLU 108 Ca -0.02 -1.99 0.16 0.00 -0.02 0.00 0.00 57.16 55.29 1xvj n GLU 108 Cb 0.23 -1.46 0.87 0.00 -0.02 0.00 0.00 31.44 31.05 1xvj n GLU 108 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74