#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ij3 s LYS 3 N 0.00 2.23 0.05 0.38 2.47 -0.06 -5.02 119.74 119.79 2ij3 s LYS 3 Ca 0.00 -1.06 -0.31 0.00 -1.56 0.00 0.00 55.97 53.04 2ij3 s LYS 3 Cb 0.00 -2.32 -0.06 0.00 -1.46 0.00 0.00 37.83 33.99 2ij3 s LYS 3 CO 0.00 0.49 1.21 -1.83 0.16 0.00 0.00 175.35 175.38 2ij3 s GLU 4 N -2.50 4.42 -0.03 4.03 1.03 -1.26 -4.64 118.70 119.74 2ij3 s GLU 4 Ca 0.24 1.78 -0.30 0.00 0.03 0.00 0.00 54.97 56.72 2ij3 s GLU 4 Cb -0.10 -3.37 -0.05 0.00 -0.80 0.00 0.00 34.13 29.82 2ij3 s GLU 4 CO 0.16 -0.29 1.35 1.41 -1.33 0.00 0.00 175.26 176.56 2ij3 s MET 5 N 1.19 4.29 0.52 -4.83 1.75 -1.26 -4.98 119.30 115.98 2ij3 s MET 5 Ca 0.59 1.88 -0.21 0.00 -1.25 0.00 0.00 55.69 56.69 2ij3 s MET 5 Cb -0.29 -3.61 -0.07 0.00 2.84 0.00 0.00 34.83 33.70 2ij3 s MET 5 CO 0.29 -0.57 1.11 -2.30 -0.65 0.00 0.00 175.02 172.90 2ij3 n PRO 6 N 5.53 1.33 -3.69 4.11 -0.02 -1.26 -4.71 135.00 136.28 2ij3 n PRO 6 Ca 0.13 0.49 -0.13 0.00 -2.02 0.00 0.00 63.50 61.97 2ij3 n PRO 6 Cb 0.44 -2.27 -0.09 0.00 -0.02 0.00 0.00 33.50 31.57 2ij3 n PRO 6 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2ij3 s GLN 7 N -2.55 0.60 1.08 -0.52 0.74 -1.26 -0.53 119.66 117.22 2ij3 s GLN 7 Ca 0.70 0.78 -0.15 0.00 0.05 0.00 0.00 55.36 56.74 2ij3 s GLN 7 Cb -0.46 0.25 0.23 0.00 1.10 0.00 0.00 33.01 34.13 2ij3 s GLN 7 CO 0.51 -0.09 1.09 -1.25 -0.55 0.00 0.00 175.29 175.01 2ij3 s PRO 8 N 0.51 -0.21 0.30 1.67 0.04 -1.26 -4.94 135.00 131.11 2ij3 s PRO 8 Ca -0.02 0.33 -0.30 0.00 0.04 0.00 0.00 61.00 61.05 2ij3 s PRO 8 Cb -0.04 -1.68 -0.12 0.00 0.04 0.00 0.00 34.50 32.69 2ij3 s PRO 8 CO -0.02 -3.12 1.45 1.17 0.04 0.00 0.00 177.00 176.52 2ij3 n LYS 9 N -4.41 2.35 -3.89 4.56 3.00 -1.26 -4.93 118.16 113.58 2ij3 n LYS 9 Ca 0.07 0.83 -0.33 0.00 -0.00 0.00 0.00 58.31 58.88 2ij3 n LYS 9 Cb 0.58 -2.52 -0.05 0.00 0.00 0.00 0.00 35.03 33.04 2ij3 n LYS 9 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2ij3 s THR 10 N -0.41 5.41 -0.54 3.15 -4.23 -1.26 -4.42 115.64 113.34 2ij3 s THR 10 Ca 0.62 -0.14 0.04 0.00 -1.18 0.00 0.00 61.69 61.03 2ij3 s THR 10 Cb -0.56 -3.55 0.14 0.00 1.34 0.00 0.00 72.50 69.87 2ij3 s THR 10 CO 0.54 0.31 0.31 -0.36 -0.54 0.00 0.00 174.62 174.88 2ij3 s PHE 11 N -1.34 2.90 0.00 3.99 0.08 0.59 -4.91 117.98 119.28 2ij3 s PHE 11 Ca 0.28 -3.00 0.00 0.00 0.12 0.00 0.00 56.93 54.33 2ij3 s PHE 11 Cb -0.13 -2.49 0.00 0.00 -0.57 0.00 0.00 43.02 39.84 2ij3 s PHE 11 CO 0.19 -0.71 0.00 0.41 -0.10 0.00 0.00 175.22 175.01 2ij3 n GLY 12 N 2.92 2.77 0.14 4.36 0.00 -1.26 -1.71 105.19 112.42 2ij3 n GLY 12 Ca 0.10 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 46.06 2ij3 n GLY 12 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ij3 h GLU 13 N 0.00 0.00 0.00 1.61 9.09 -2.05 -2.57 114.58 120.65 2ij3 h GLU 13 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2ij3 h GLU 13 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2ij3 h GLU 13 CO 0.00 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.34 2ij3 n LEU 14 N -2.34 0.79 0.00 3.06 4.77 -0.69 -4.42 117.00 118.17 2ij3 n LEU 14 Ca 0.02 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.61 2ij3 n LEU 14 Cb 0.26 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 2ij3 n LEU 14 CO 0.22 -0.31 0.00 0.29 -1.33 0.00 0.00 177.39 176.25 2ij3 n LYS 15 N -2.27 0.00 0.00 3.23 4.76 -0.97 -1.63 118.16 121.27 2ij3 n LYS 15 Ca 0.04 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.62 2ij3 n LYS 15 Cb 0.37 0.00 0.42 0.00 -1.84 0.00 0.00 35.03 33.98 2ij3 n LYS 15 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2ij3 n ASN 16 N 4.89 1.07 -0.33 4.39 5.03 0.05 -0.30 115.26 130.07 2ij3 n ASN 16 Ca 0.00 -0.98 0.10 0.00 0.87 0.00 0.00 54.58 54.57 2ij3 n ASN 16 Cb 0.00 0.09 0.28 0.00 -1.02 0.00 0.00 39.78 39.13 2ij3 n ASN 16 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 2ij3 h LEU 17 N 1.38 0.65 -2.47 3.41 5.85 -1.37 -1.14 115.31 121.63 2ij3 h LEU 17 Ca 0.00 0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2ij3 h LEU 17 Cb 0.49 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 2ij3 h LEU 17 CO 0.00 0.24 0.17 -0.65 -0.34 0.00 0.00 178.44 177.86 2ij3 h PRO 18 N 0.69 0.00 0.00 5.25 0.11 -1.79 -0.59 132.00 135.66 2ij3 h PRO 18 Ca 0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.64 2ij3 h PRO 18 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 2ij3 h PRO 18 CO -0.38 0.00 -0.22 1.28 -0.21 0.00 0.00 178.00 178.47 2ij3 n LEU 19 N -3.06 0.23 -2.88 2.35 4.77 -0.43 -3.96 117.00 114.02 2ij3 n LEU 19 Ca -0.02 0.29 -0.28 0.00 -0.03 0.00 0.00 56.01 55.97 2ij3 n LEU 19 Cb 0.24 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 40.91 2ij3 n LEU 19 CO 0.18 0.05 0.25 0.18 -1.33 0.00 0.00 177.39 176.72 2ij3 n LEU 20 N -1.51 4.74 -3.93 2.23 4.77 -0.23 -4.94 117.00 118.13 2ij3 n LEU 20 Ca 0.06 -5.56 -0.43 0.00 -0.03 0.00 0.00 56.01 50.06 2ij3 n LEU 20 Cb 0.34 -0.58 0.01 0.00 -2.33 0.00 0.00 43.42 40.86 2ij3 n LEU 20 CO 0.31 2.31 1.27 -0.46 -1.33 0.00 0.00 177.39 179.49 2ij3 n ASN 21 N -0.29 6.47 -3.65 -1.43 6.94 -1.25 -4.96 115.26 117.08 2ij3 n ASN 21 Ca 0.34 -3.42 -0.13 0.00 -0.02 0.00 0.00 54.58 51.34 2ij3 n ASN 21 Cb 0.44 -1.28 -0.06 0.00 -2.36 0.00 0.00 39.78 36.52 2ij3 n ASN 21 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2ij3 s THR 22 N -2.69 0.05 -2.36 5.53 -1.32 -1.26 -5.01 115.64 108.57 2ij3 s THR 22 Ca 0.33 -0.40 0.21 0.00 -1.21 0.00 0.00 61.69 60.63 2ij3 s THR 22 Cb 0.07 -0.93 0.43 0.00 -1.51 0.00 0.00 72.50 70.57 2ij3 s THR 22 CO 0.07 -0.22 1.48 0.47 -2.21 0.00 0.00 174.62 174.21 2ij3 n ASP 23 N 0.58 2.32 -3.19 8.08 8.00 -1.26 -4.46 116.55 126.62 2ij3 n ASP 23 Ca -0.19 -1.82 -0.26 0.00 0.71 0.00 0.00 54.79 53.23 2ij3 n ASP 23 Cb 0.59 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.48 2ij3 n ASP 23 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2ij3 n LYS 24 N 0.76 2.44 -0.12 -1.24 5.02 -1.26 -4.36 118.16 119.40 2ij3 n LYS 24 Ca 0.17 -4.45 -0.05 0.00 -2.02 0.00 0.00 58.31 51.96 2ij3 n LYS 24 Cb 0.43 -2.08 0.15 0.00 -0.02 0.00 0.00 35.03 33.51 2ij3 n LYS 24 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2ij3 h PRO 25 N 3.57 0.82 -0.33 1.97 0.13 -1.96 -2.11 132.00 134.09 2ij3 h PRO 25 Ca 0.15 -0.23 0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2ij3 h PRO 25 Cb 0.66 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.67 2ij3 h PRO 25 CO 0.75 0.83 0.17 0.28 -0.23 0.00 0.00 178.00 179.80 2ij3 h VAL 26 N 0.76 0.99 -0.27 1.56 2.07 -1.98 0.21 116.25 119.60 2ij3 h VAL 26 Ca 0.15 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.49 2ij3 h VAL 26 Cb 0.47 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 2ij3 h VAL 26 CO 0.02 0.06 -0.07 1.56 0.02 0.00 0.00 177.57 179.17 2ij3 h GLN 27 N 0.35 0.42 -0.16 1.57 4.20 -1.95 -0.57 115.11 118.97 2ij3 h GLN 27 Ca 0.14 -0.10 -0.17 0.00 0.06 0.00 0.00 58.65 58.58 2ij3 h GLN 27 Cb 0.04 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 2ij3 h GLN 27 CO -0.09 0.50 -0.62 0.00 -0.67 0.00 0.00 178.83 177.96 2ij3 h ALA 28 N 1.54 0.62 -0.23 3.87 0.00 -0.82 -2.95 119.26 121.28 2ij3 h ALA 28 Ca 0.08 -0.54 -0.11 0.00 0.00 0.00 0.00 54.91 54.34 2ij3 h ALA 28 Cb 0.37 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2ij3 h ALA 28 CO 0.02 0.71 -0.32 -0.07 0.00 0.00 0.00 179.25 179.58 2ij3 h LEU 29 N 0.41 0.50 -1.24 0.00 3.38 -0.16 -2.26 115.31 115.94 2ij3 h LEU 29 Ca -0.01 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.79 2ij3 h LEU 29 Cb 1.18 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 2ij3 h LEU 29 CO 0.12 0.79 0.52 0.24 0.09 0.00 0.00 178.44 180.20 2ij3 h MET 30 N 0.41 1.00 -0.40 1.13 2.86 -1.06 0.91 114.93 119.78 2ij3 h MET 30 Ca 0.05 -0.06 -0.15 0.00 -2.06 0.00 0.00 59.70 57.48 2ij3 h MET 30 Cb 0.77 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 2ij3 h MET 30 CO 0.06 0.66 -0.33 0.87 1.06 0.00 0.00 176.91 179.23 2ij3 h LYS 31 N 1.03 0.91 -0.67 1.72 1.57 -1.29 -0.67 116.57 119.16 2ij3 h LYS 31 Ca 0.30 -0.44 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 2ij3 h LYS 31 Cb -0.05 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 2ij3 h LYS 31 CO -0.08 1.10 0.23 0.82 -0.57 0.00 0.00 179.45 180.95 2ij3 h ILE 32 N 0.76 1.25 -0.77 1.86 2.04 -0.91 -2.51 117.51 119.22 2ij3 h ILE 32 Ca 0.08 -0.82 0.04 0.00 1.00 0.00 0.00 64.86 65.16 2ij3 h ILE 32 Cb 0.91 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.45 2ij3 h ILE 32 CO 0.08 0.32 0.48 0.00 0.00 0.00 0.00 178.15 179.03 2ij3 h ALA 33 N 1.10 1.02 -0.70 1.87 0.00 -0.59 0.38 119.26 122.35 2ij3 h ALA 33 Ca 0.22 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2ij3 h ALA 33 Cb 0.26 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2ij3 h ALA 33 CO -0.01 0.24 0.46 -0.44 0.00 0.00 0.00 179.25 179.50 2ij3 h ASP 34 N 0.90 0.74 0.04 0.00 3.32 -0.80 0.22 116.42 120.84 2ij3 h ASP 34 Ca 0.32 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.36 2ij3 h ASP 34 Cb 0.08 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.46 2ij3 h ASP 34 CO -0.14 0.51 -0.02 -0.08 -1.72 0.00 0.00 179.24 177.80 2ij3 h GLU 35 N 0.86 -0.05 0.00 3.56 4.81 -0.85 -3.40 114.58 119.51 2ij3 h GLU 35 Ca 0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 2ij3 h GLU 35 Cb 0.03 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.43 2ij3 h GLU 35 CO -0.07 0.61 -1.22 1.28 -0.73 0.00 0.00 179.01 178.87 2ij3 n LEU 36 N -4.77 0.55 0.00 1.64 4.77 0.12 -5.08 117.00 114.24 2ij3 n LEU 36 Ca -0.08 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 2ij3 n LEU 36 Cb 0.33 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2ij3 n LEU 36 CO 0.30 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2ij3 n GLY 37 N 1.34 -0.61 0.28 -0.72 0.00 0.75 -4.61 105.19 101.63 2ij3 n GLY 37 Ca 0.01 -1.89 0.19 0.00 0.00 0.00 0.00 46.02 44.32 2ij3 n GLY 37 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ij3 h GLU 38 N 0.00 0.00 -2.68 1.61 4.11 -1.93 -3.43 114.58 112.26 2ij3 h GLU 38 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.31 2ij3 h GLU 38 Cb 0.00 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.00 2ij3 h GLU 38 CO 0.00 0.00 -0.27 -1.50 0.07 0.00 0.00 179.01 177.31 2ij3 s ILE 39 N -3.83 -0.01 -0.01 -1.06 2.07 -1.26 -0.77 121.20 116.33 2ij3 s ILE 39 Ca -0.01 0.05 -0.11 0.00 -1.41 0.00 0.00 60.65 59.17 2ij3 s ILE 39 Cb 0.10 -0.60 0.01 0.00 0.13 0.00 0.00 42.46 42.11 2ij3 s ILE 39 CO 0.45 0.02 0.23 0.72 -1.91 0.00 0.00 174.94 174.46 2ij3 s PHE 40 N 0.88 -0.09 0.25 3.50 -0.12 -0.88 -4.33 117.98 117.19 2ij3 s PHE 40 Ca -0.05 0.12 -0.15 0.00 -0.05 0.00 0.00 56.93 56.80 2ij3 s PHE 40 Cb -0.06 0.03 -0.08 0.00 -0.63 0.00 0.00 43.02 42.28 2ij3 s PHE 40 CO -0.07 -0.33 0.67 0.21 -0.05 0.00 0.00 175.22 175.65 2ij3 s LYS 41 N -1.27 4.03 -0.04 1.99 2.20 0.31 -0.69 119.74 126.27 2ij3 s LYS 41 Ca -0.13 0.62 -0.00 0.00 -0.36 0.00 0.00 55.97 56.09 2ij3 s LYS 41 Cb -0.06 -2.67 0.03 0.00 -1.51 0.00 0.00 37.83 33.62 2ij3 s LYS 41 CO 0.03 0.30 0.01 0.12 -0.36 0.00 0.00 175.35 175.45 2ij3 s PHE 42 N -1.75 0.40 -0.03 4.03 5.36 0.24 -4.22 117.98 122.01 2ij3 s PHE 42 Ca 0.47 -0.02 0.07 0.00 -0.96 0.00 0.00 56.93 56.50 2ij3 s PHE 42 Cb -0.13 -0.53 -0.02 0.00 -0.34 0.00 0.00 43.02 42.00 2ij3 s PHE 42 CO 0.19 -0.19 -0.25 -1.21 -1.46 0.00 0.00 175.22 172.31 2ij3 s GLU 43 N 1.41 2.18 0.14 10.12 2.02 -1.26 -1.65 118.70 131.65 2ij3 s GLU 43 Ca -0.04 -0.90 0.05 0.00 0.02 0.00 0.00 54.97 54.09 2ij3 s GLU 43 Cb -0.13 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 31.97 2ij3 s GLU 43 CO -0.03 0.56 -0.11 0.00 0.02 0.00 0.00 175.26 175.71 2ij3 s ALA 44 N -0.60 1.42 -0.49 5.21 0.00 -0.67 -0.77 121.76 125.87 2ij3 s ALA 44 Ca 0.09 -1.44 -0.45 0.00 0.00 0.00 0.00 51.96 50.16 2ij3 s ALA 44 Cb -0.10 0.03 -0.19 0.00 0.00 0.00 0.00 23.12 22.86 2ij3 s ALA 44 CO -0.01 -0.07 1.94 -2.30 0.00 0.00 0.00 175.76 175.32 2ij3 n PRO 45 N -0.05 0.05 -1.25 0.00 -0.02 -1.26 -0.37 135.00 132.09 2ij3 n PRO 45 Ca -0.11 0.02 -0.08 0.00 -2.02 0.00 0.00 63.50 61.30 2ij3 n PRO 45 Cb 0.60 -1.54 -0.04 0.00 -0.02 0.00 0.00 33.50 32.51 2ij3 n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ij3 n GLY 46 N 6.13 1.01 3.32 -1.23 0.00 -1.26 -5.01 105.19 108.14 2ij3 n GLY 46 Ca 0.45 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.67 2ij3 n GLY 46 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ij3 s ARG 47 N -2.72 0.85 -0.15 1.61 3.03 0.50 -5.17 118.95 116.90 2ij3 s ARG 47 Ca 0.00 -0.24 -0.08 0.00 2.03 0.00 0.00 55.73 57.44 2ij3 s ARG 47 Cb 0.00 0.38 0.06 0.00 -1.03 0.00 0.00 34.95 34.36 2ij3 s ARG 47 CO 0.00 -0.27 0.37 0.54 -1.13 0.00 0.00 175.30 174.80 2ij3 s VAL 48 N -1.96 -0.03 0.21 4.99 0.11 -1.26 -1.66 120.40 120.79 2ij3 s VAL 48 Ca -0.09 0.11 0.00 0.00 -2.93 0.00 0.00 61.98 59.08 2ij3 s VAL 48 Cb -0.02 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.24 2ij3 s VAL 48 CO 0.01 0.04 0.09 0.28 -3.33 0.00 0.00 175.10 172.19 2ij3 s THR 49 N 1.37 0.33 -0.11 5.04 -1.32 -0.66 -4.75 115.64 115.54 2ij3 s THR 49 Ca -0.09 -1.98 0.02 0.00 -1.21 0.00 0.00 61.69 58.42 2ij3 s THR 49 Cb -0.09 -2.43 0.01 0.00 -1.51 0.00 0.00 72.50 68.48 2ij3 s THR 49 CO -0.12 -0.13 -0.15 -0.13 -2.21 0.00 0.00 174.62 171.88 2ij3 s ARG 50 N -4.06 2.20 -0.25 7.08 0.52 -1.21 -0.60 118.95 122.64 2ij3 s ARG 50 Ca 0.34 -0.55 -0.12 0.00 -0.52 0.00 0.00 55.73 54.88 2ij3 s ARG 50 Cb 0.07 -1.87 -0.05 0.00 0.52 0.00 0.00 34.95 33.62 2ij3 s ARG 50 CO 0.10 -0.06 0.21 0.71 0.02 0.00 0.00 175.30 176.28 2ij3 s TYR 51 N 0.98 3.29 -0.12 -0.53 2.02 0.14 -0.04 117.35 123.09 2ij3 s TYR 51 Ca -0.07 0.26 -0.05 0.00 -0.37 0.00 0.00 57.07 56.84 2ij3 s TYR 51 Cb -0.15 -2.35 -0.04 0.00 -0.40 0.00 0.00 41.96 39.02 2ij3 s TYR 51 CO -0.01 -0.02 0.07 -0.51 -1.57 0.00 0.00 175.55 173.51 2ij3 s LEU 52 N 1.33 3.98 0.00 -1.29 1.43 -0.01 -2.07 118.68 122.05 2ij3 s LEU 52 Ca 0.09 0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.46 2ij3 s LEU 52 Cb -0.14 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2ij3 s LEU 52 CO 0.07 0.35 0.29 -1.54 0.23 0.00 0.00 176.35 175.75 2ij3 n SER 53 N 2.39 0.06 -4.77 2.29 3.41 0.05 -1.67 113.62 115.37 2ij3 n SER 53 Ca -0.19 -1.02 -0.33 0.00 -0.26 0.00 0.00 58.87 57.07 2ij3 n SER 53 Cb 0.54 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.42 2ij3 n SER 53 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2ij3 s SER 54 N -0.02 5.65 0.36 4.04 1.04 -1.25 -2.88 113.70 120.64 2ij3 s SER 54 Ca 0.00 0.15 0.05 0.00 0.48 0.00 0.00 55.95 56.64 2ij3 s SER 54 Cb 0.00 -1.62 0.73 0.00 0.10 0.00 0.00 66.02 65.23 2ij3 s SER 54 CO 0.00 0.29 1.97 -0.61 0.98 0.00 0.00 173.24 175.87 2ij3 h GLN 55 N 4.24 0.74 -0.27 4.02 -0.00 -1.90 -0.92 115.11 121.01 2ij3 h GLN 55 Ca -0.50 -0.04 -0.10 0.00 -0.00 0.00 0.00 58.65 58.01 2ij3 h GLN 55 Cb 1.19 -0.17 -0.01 0.00 0.00 0.00 0.00 27.48 28.49 2ij3 h GLN 55 CO 0.61 0.49 -0.24 0.07 0.00 0.00 0.00 178.83 179.76 2ij3 h ARG 56 N 0.76 0.52 0.10 1.69 0.11 -1.95 -0.27 114.38 115.35 2ij3 h ARG 56 Ca 0.29 -0.19 -0.29 0.00 0.10 0.00 0.00 59.98 59.89 2ij3 h ARG 56 Cb 0.19 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.23 2ij3 h ARG 56 CO -0.09 0.72 -1.44 -0.07 0.10 0.00 0.00 179.97 179.19 2ij3 h LEU 57 N 0.46 0.34 -1.04 0.08 3.38 -1.87 -3.33 115.31 113.33 2ij3 h LEU 57 Ca 0.07 -0.45 -0.10 0.00 0.09 0.00 0.00 57.88 57.50 2ij3 h LEU 57 Cb 0.67 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2ij3 h LEU 57 CO 0.05 1.37 -0.36 0.40 0.09 0.00 0.00 178.44 179.99 2ij3 h ILE 58 N 0.06 1.29 -0.70 1.22 2.04 -1.03 -1.63 117.51 118.76 2ij3 h ILE 58 Ca -0.21 -1.38 0.14 0.00 1.00 0.00 0.00 64.86 64.41 2ij3 h ILE 58 Cb 1.99 1.60 -0.10 0.00 -0.74 0.00 0.00 36.82 39.57 2ij3 h ILE 58 CO 0.16 0.41 0.18 0.50 0.00 0.00 0.00 178.15 179.40 2ij3 h LYS 59 N 0.20 0.28 -0.21 2.37 3.64 -1.15 -0.41 116.57 121.29 2ij3 h LYS 59 Ca 0.02 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 2ij3 h LYS 59 Cb 0.73 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 2ij3 h LYS 59 CO 0.06 0.19 -0.39 0.93 -2.27 0.00 0.00 179.45 177.96 2ij3 h GLU 60 N 0.29 0.63 -0.10 1.90 5.08 -1.46 -3.05 114.58 117.87 2ij3 h GLU 60 Ca 0.39 -0.40 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 2ij3 h GLU 60 Cb 0.62 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 2ij3 h GLU 60 CO -0.47 1.02 0.08 0.00 -1.00 0.00 0.00 179.01 178.64 2ij3 h ALA 61 N 0.61 1.98 -0.06 3.43 0.00 -0.86 -1.69 119.26 122.67 2ij3 h ALA 61 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2ij3 h ALA 61 Cb 0.99 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2ij3 h ALA 61 CO 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.21 2ij3 s ASP 63 N -1.59 6.07 0.42 0.00 -1.08 -0.64 -4.89 116.67 114.96 2ij3 s ASP 63 Ca 0.30 0.27 0.29 0.00 -0.52 0.00 0.00 52.55 52.90 2ij3 s ASP 63 Cb 0.15 -2.55 1.34 0.00 -1.46 0.00 0.00 42.92 40.40 2ij3 s ASP 63 CO 0.24 -1.76 1.88 -0.33 0.52 0.00 0.00 175.17 175.72 2ij3 h GLU 64 N 11.29 0.00 0.00 4.34 5.08 -1.85 0.01 114.58 133.45 2ij3 h GLU 64 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2ij3 h GLU 64 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2ij3 h GLU 64 CO 1.18 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 179.85 2ij3 h SER 65 N 0.00 0.00 0.00 1.42 4.64 -1.97 -3.35 113.55 114.28 2ij3 h SER 65 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 2ij3 h SER 65 Cb 0.30 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.34 2ij3 h SER 65 CO 0.00 0.00 -2.05 0.54 -0.87 0.00 0.00 176.83 174.45 2ij3 n ARG 66 N -2.71 1.46 -3.92 4.77 1.74 -0.14 -4.86 116.66 113.00 2ij3 n ARG 66 Ca 0.04 -0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.00 2ij3 n ARG 66 Cb 0.45 -1.39 -0.14 0.00 -1.02 0.00 0.00 32.46 30.36 2ij3 n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2ij3 s PHE 67 N -2.37 0.08 0.31 -1.55 0.08 -0.43 -1.07 117.98 113.04 2ij3 s PHE 67 Ca -0.09 -0.06 0.07 0.00 0.12 0.00 0.00 56.93 56.98 2ij3 s PHE 67 Cb 0.05 -0.05 -0.06 0.00 -0.57 0.00 0.00 43.02 42.38 2ij3 s PHE 67 CO 0.61 -0.02 -0.06 0.34 -0.10 0.00 0.00 175.22 176.00 2ij3 s ASP 68 N -0.14 3.14 0.18 1.36 2.15 -0.87 -4.23 116.67 118.25 2ij3 s ASP 68 Ca -0.01 -1.22 -0.32 0.00 0.43 0.00 0.00 52.55 51.43 2ij3 s ASP 68 Cb -0.01 -0.24 -0.11 0.00 -0.30 0.00 0.00 42.92 42.26 2ij3 s ASP 68 CO -0.00 -0.33 1.70 -0.75 -0.17 0.00 0.00 175.17 175.62 2ij3 s LYS 69 N -3.70 4.15 0.02 4.34 2.20 -1.26 -1.28 119.74 124.20 2ij3 s LYS 69 Ca 0.31 2.54 -0.01 0.00 -0.36 0.00 0.00 55.97 58.45 2ij3 s LYS 69 Cb 0.04 -3.18 -0.04 0.00 -1.51 0.00 0.00 37.83 33.14 2ij3 s LYS 69 CO 0.14 -0.73 0.18 1.21 -0.36 0.00 0.00 175.35 175.79 2ij3 s ASN 70 N 1.41 6.27 -0.47 1.43 2.47 0.28 -4.75 114.94 121.57 2ij3 s ASN 70 Ca 0.74 0.29 -0.22 0.00 0.42 0.00 0.00 52.86 54.10 2ij3 s ASN 70 Cb -0.47 -1.93 0.03 0.00 -1.45 0.00 0.00 41.25 37.43 2ij3 s ASN 70 CO 0.32 0.23 0.73 -0.76 -3.72 0.00 0.00 177.10 173.91 2ij3 s LEU 71 N -2.11 4.44 1.14 3.21 1.43 -1.26 -4.38 118.68 121.15 2ij3 s LEU 71 Ca 0.29 -0.38 -0.14 0.00 -1.03 0.00 0.00 54.13 52.88 2ij3 s LEU 71 Cb -0.13 -2.76 0.24 0.00 0.03 0.00 0.00 46.19 43.57 2ij3 s LEU 71 CO 0.21 -0.92 0.83 -1.54 0.23 0.00 0.00 176.35 175.16 2ij3 n SER 72 N 6.59 -1.67 -0.12 2.29 3.41 -1.26 -4.69 113.62 118.18 2ij3 n SER 72 Ca -0.01 -0.08 0.01 0.00 -0.26 0.00 0.00 58.87 58.52 2ij3 n SER 72 Cb 0.47 -1.23 0.29 0.00 -0.26 0.00 0.00 64.21 63.49 2ij3 n SER 72 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2ij3 h GLN 73 N -2.48 0.79 -0.34 4.33 5.75 -1.99 -1.03 115.11 120.14 2ij3 h GLN 73 Ca -0.58 -0.08 0.03 0.00 -0.15 0.00 0.00 58.65 57.87 2ij3 h GLN 73 Cb 1.33 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 29.69 2ij3 h GLN 73 CO 0.46 0.58 0.15 0.00 -2.65 0.00 0.00 178.83 177.37 2ij3 h ALA 74 N 1.55 0.41 -0.26 3.38 0.00 -1.93 -1.63 119.26 120.79 2ij3 h ALA 74 Ca 0.20 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2ij3 h ALA 74 Cb 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2ij3 h ALA 74 CO -0.03 -0.23 -0.11 -0.07 0.00 0.00 0.00 179.25 178.80 2ij3 h LEU 75 N 0.32 0.41 -0.71 0.00 3.38 -1.72 -0.87 115.31 116.11 2ij3 h LEU 75 Ca 0.15 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 2ij3 h LEU 75 Cb 0.08 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2ij3 h LEU 75 CO -0.12 0.56 0.25 0.11 0.09 0.00 0.00 178.44 179.32 2ij3 h LYS 76 N 0.40 1.09 -0.39 1.13 1.57 -0.82 0.49 116.57 120.04 2ij3 h LYS 76 Ca 0.08 -0.22 -0.13 0.00 -1.87 0.00 0.00 60.65 58.50 2ij3 h LYS 76 Cb 0.44 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2ij3 h LYS 76 CO 0.02 0.92 -0.29 0.74 -0.57 0.00 0.00 179.45 180.28 2ij3 h PHE 77 N 1.04 0.97 -0.27 -1.35 0.04 -0.82 -3.03 116.94 113.53 2ij3 h PHE 77 Ca 0.23 -0.25 -0.04 0.00 2.80 0.00 0.00 57.97 60.71 2ij3 h PHE 77 Cb 0.27 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.18 2ij3 h PHE 77 CO 0.02 1.02 -0.03 0.28 -0.60 0.00 0.00 178.31 179.01 2ij3 h VAL 78 N 0.71 1.18 -0.25 -0.55 2.07 -0.91 -2.70 116.25 115.80 2ij3 h VAL 78 Ca 0.08 -0.72 0.07 0.00 0.82 0.00 0.00 66.70 66.95 2ij3 h VAL 78 Cb 0.84 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2ij3 h VAL 78 CO 0.07 0.24 0.26 -0.09 0.02 0.00 0.00 177.57 178.08 2ij3 h ARG 79 N 0.39 0.00 -0.12 1.57 2.43 -0.77 0.13 114.38 118.02 2ij3 h ARG 79 Ca 0.09 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 2ij3 h ARG 79 Cb 0.31 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2ij3 h ARG 79 CO 0.01 0.00 0.11 -0.44 -1.51 0.00 0.00 179.97 178.15 2ij3 h ASP 80 N 0.00 0.00 0.00 -3.80 3.32 -1.57 0.36 116.42 114.74 2ij3 h ASP 80 Ca 0.12 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 2ij3 h ASP 80 Cb 0.65 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 2ij3 h ASP 80 CO -0.00 0.00 -1.07 2.22 -1.72 0.00 0.00 179.24 178.67 2ij3 n PHE 81 N -3.98 0.00 0.80 4.55 1.16 -0.46 -4.69 117.46 114.85 2ij3 n PHE 81 Ca -0.00 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.70 2ij3 n PHE 81 Cb 0.23 -0.04 0.21 0.00 -1.61 0.00 0.00 39.48 38.27 2ij3 n PHE 81 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2ij3 n ALA 82 N -1.56 3.27 -0.86 1.98 0.00 0.32 -4.90 120.51 118.75 2ij3 n ALA 82 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2ij3 n ALA 82 Cb 0.05 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.36 2ij3 n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ij3 n GLY 83 N 1.43 2.91 2.29 0.00 0.00 0.13 -1.89 105.19 110.05 2ij3 n GLY 83 Ca 0.04 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 2ij3 n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ij3 n ASP 84 N 1.33 7.16 -4.49 1.61 5.75 -1.26 -4.54 116.55 122.11 2ij3 n ASP 84 Ca 0.00 -3.77 -0.29 0.00 -0.01 0.00 0.00 54.79 50.72 2ij3 n ASP 84 Cb 0.00 -0.92 0.22 0.00 -1.03 0.00 0.00 41.12 39.39 2ij3 n ASP 84 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2ij3 s GLY 85 N -1.92 1.55 0.35 6.12 0.00 -0.79 -4.69 107.32 107.92 2ij3 s GLY 85 Ca 0.63 -0.38 0.07 0.00 0.00 0.00 0.00 44.72 45.04 2ij3 s GLY 85 CO 0.00 0.32 1.89 1.41 0.00 0.00 0.00 173.10 176.72 2ij3 h LEU 86 N -2.31 0.70 -0.36 0.66 3.38 -1.89 -2.09 115.31 113.41 2ij3 h LEU 86 Ca -0.56 0.03 -0.18 0.00 0.09 0.00 0.00 57.88 57.25 2ij3 h LEU 86 Cb 1.33 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2ij3 h LEU 86 CO 0.53 0.39 -0.83 0.15 0.09 0.00 0.00 178.44 178.77 2ij3 h PHE 87 N 0.76 0.22 -0.13 1.13 3.57 -1.93 -3.28 116.94 117.28 2ij3 h PHE 87 Ca 0.41 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.80 2ij3 h PHE 87 Cb 0.54 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2ij3 h PHE 87 CO -0.00 0.91 0.00 0.25 -2.23 0.00 0.00 178.31 177.24 2ij3 n THR 88 N -3.67 1.95 -3.63 4.41 -2.24 -1.06 -5.00 114.28 105.03 2ij3 n THR 88 Ca -0.03 -1.96 -0.34 0.00 -2.27 0.00 0.00 64.05 59.46 2ij3 n THR 88 Cb 0.77 -0.16 -0.05 0.00 -2.10 0.00 0.00 70.33 68.79 2ij3 n THR 88 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2ij3 s SER 89 N -2.27 6.57 0.43 3.42 0.01 -0.81 -4.76 113.70 116.29 2ij3 s SER 89 Ca 0.34 0.69 -0.23 0.00 1.31 0.00 0.00 55.95 58.06 2ij3 s SER 89 Cb 0.28 -2.14 -0.09 0.00 0.21 0.00 0.00 66.02 64.28 2ij3 s SER 89 CO 0.06 0.15 1.05 0.26 0.41 0.00 0.00 173.24 175.16 2ij3 s TRP 90 N -1.46 3.18 0.36 2.43 0.52 -1.26 -4.96 118.94 117.74 2ij3 s TRP 90 Ca 0.35 1.62 0.08 0.00 0.02 0.00 0.00 56.10 58.17 2ij3 s TRP 90 Cb -0.13 -3.11 0.80 0.00 -1.15 0.00 0.00 33.47 29.87 2ij3 s TRP 90 CO 0.20 -0.70 1.90 1.15 0.02 0.00 0.00 176.95 179.51 2ij3 h THR 91 N 2.00 0.89 0.00 2.01 2.02 -1.97 -2.11 112.91 115.74 2ij3 h THR 91 Ca -0.49 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2ij3 h THR 91 Cb 1.22 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 2ij3 h THR 91 CO 0.61 0.13 0.00 1.12 0.37 0.00 0.00 175.52 177.75 2ij3 h HIS 92 N 0.71 0.00 -3.71 3.16 2.07 -1.98 -3.41 115.15 111.98 2ij3 h HIS 92 Ca 0.41 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 57.41 2ij3 h HIS 92 Cb 0.59 0.00 0.05 0.00 2.57 0.00 0.00 27.41 30.62 2ij3 h HIS 92 CO -0.00 0.00 0.64 -1.21 -3.07 0.00 0.00 177.93 174.29 2ij3 s GLU 93 N -3.60 4.37 0.24 5.12 2.02 -0.80 -4.92 118.70 121.13 2ij3 s GLU 93 Ca 0.02 2.16 -0.06 0.00 0.02 0.00 0.00 54.97 57.11 2ij3 s GLU 93 Cb 0.09 -3.11 0.35 0.00 0.10 0.00 0.00 34.13 31.56 2ij3 s GLU 93 CO 0.51 -0.20 1.81 -0.22 0.02 0.00 0.00 175.26 177.19 2ij3 h LYS 94 N 4.03 0.76 0.00 1.61 3.11 -1.89 -1.57 116.57 122.62 2ij3 h LYS 94 Ca -0.48 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.32 2ij3 h LYS 94 Cb 1.22 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 32.28 2ij3 h LYS 94 CO 0.69 0.51 0.00 -0.91 -2.81 0.00 0.00 179.45 176.93 2ij3 h ASN 95 N 0.79 0.00 0.62 4.20 2.35 -1.92 -2.92 115.58 118.70 2ij3 h ASN 95 Ca 0.37 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.09 2ij3 h ASN 95 Cb 0.29 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.67 2ij3 h ASN 95 CO -0.22 0.00 -0.30 -0.25 -1.65 0.00 0.00 177.43 175.01 2ij3 h TRP 96 N 0.00 -0.77 -0.88 1.19 7.01 -1.55 -2.08 115.95 118.87 2ij3 h TRP 96 Ca 0.00 -0.02 0.01 0.00 2.11 0.00 0.00 58.89 60.99 2ij3 h TRP 96 Cb 0.32 0.25 -0.04 0.00 -2.10 0.00 0.00 29.16 27.59 2ij3 h TRP 96 CO 0.00 -0.48 0.59 -0.22 -2.79 0.00 0.00 178.44 175.54 2ij3 h LYS 97 N -1.13 1.16 0.25 2.65 1.63 -1.64 0.16 116.57 119.65 2ij3 h LYS 97 Ca -0.08 -0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 59.64 2ij3 h LYS 97 Cb 0.63 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 31.99 2ij3 h LYS 97 CO 0.14 0.77 -0.20 -0.22 -3.45 0.00 0.00 179.45 176.49 2ij3 h LYS 98 N 1.20 -0.45 -0.57 1.90 3.64 -1.62 0.56 116.57 121.22 2ij3 h LYS 98 Ca 0.33 0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.64 2ij3 h LYS 98 Cb -0.13 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2ij3 h LYS 98 CO -0.07 -0.30 -0.03 0.00 -2.27 0.00 0.00 179.45 176.79 2ij3 h ALA 99 N 0.24 0.87 -0.05 5.00 0.00 -1.07 -1.59 119.26 122.66 2ij3 h ALA 99 Ca -0.01 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.61 2ij3 h ALA 99 Cb 0.41 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2ij3 h ALA 99 CO -0.02 0.66 -0.12 1.25 0.00 0.00 0.00 179.25 181.02 2ij3 h HIS 100 N 0.93 -0.32 -0.66 0.00 -0.00 -0.47 0.85 115.15 115.48 2ij3 h HIS 100 Ca 0.16 0.01 -0.06 0.00 -0.00 0.00 0.00 60.37 60.49 2ij3 h HIS 100 Cb 0.57 0.15 -0.03 0.00 -0.00 0.00 0.00 27.41 28.10 2ij3 h HIS 100 CO 0.04 -0.19 0.19 -0.91 -0.00 0.00 0.00 177.93 177.06 2ij3 h ASN 101 N -0.19 0.98 -0.40 3.26 2.35 -0.72 -2.21 115.58 118.65 2ij3 h ASN 101 Ca 0.06 -0.22 -0.14 0.00 -0.55 0.00 0.00 56.30 55.46 2ij3 h ASN 101 Cb 0.27 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2ij3 h ASN 101 CO -0.16 0.94 -0.29 0.40 -1.65 0.00 0.00 177.43 176.67 2ij3 h ILE 102 N 0.97 1.28 0.00 2.81 2.04 -1.09 -3.33 117.51 120.19 2ij3 h ILE 102 Ca 0.21 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.62 2ij3 h ILE 102 Cb 0.32 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2ij3 h ILE 102 CO -0.00 0.49 -0.64 -0.07 0.00 0.00 0.00 178.15 177.92 2ij3 h LEU 103 N 0.72 0.00 -0.36 1.44 3.38 -0.77 -3.39 115.31 116.33 2ij3 h LEU 103 Ca 0.08 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.10 2ij3 h LEU 103 Cb 0.87 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.57 2ij3 h LEU 103 CO 0.08 0.00 0.05 0.25 0.09 0.00 0.00 178.44 178.91 2ij3 h LEU 104 N 0.00 -0.03 -1.86 1.67 5.85 -1.50 -0.98 115.31 118.46 2ij3 h LEU 104 Ca 0.00 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2ij3 h LEU 104 Cb 0.99 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 2ij3 h LEU 104 CO 0.00 0.02 -0.14 -0.65 -0.34 0.00 0.00 178.44 177.33 2ij3 h PRO 105 N 0.17 0.00 0.00 5.25 0.11 -1.79 -1.99 132.00 133.74 2ij3 h PRO 105 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2ij3 h PRO 105 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 2ij3 h PRO 105 CO -0.24 0.14 0.00 0.43 -0.21 0.00 0.00 178.00 178.11 2ij3 n SER 106 N -3.88 0.66 -0.25 -2.05 7.64 -0.40 -3.43 113.62 111.92 2ij3 n SER 106 Ca -0.02 0.64 0.03 0.00 1.01 0.00 0.00 58.87 60.53 2ij3 n SER 106 Cb 0.23 -0.79 0.04 0.00 -1.01 0.00 0.00 64.21 62.68 2ij3 n SER 106 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2ij3 n PHE 107 N -2.21 0.06 -1.13 1.43 3.72 -0.77 -4.82 117.46 113.75 2ij3 n PHE 107 Ca 0.03 -0.13 -0.30 0.00 -0.05 0.00 0.00 57.45 56.99 2ij3 n PHE 107 Cb 0.27 -0.01 0.13 0.00 -0.94 0.00 0.00 39.48 38.92 2ij3 n PHE 107 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2ij3 s SER 108 N -0.61 3.77 0.28 4.37 1.04 -1.11 -4.52 113.70 116.92 2ij3 s SER 108 Ca 0.08 1.75 0.02 0.00 0.48 0.00 0.00 55.95 58.27 2ij3 s SER 108 Cb 0.05 -2.40 0.61 0.00 0.10 0.00 0.00 66.02 64.38 2ij3 s SER 108 CO 0.07 -2.49 1.76 -0.61 0.98 0.00 0.00 173.24 172.95 2ij3 h GLN 109 N -1.45 0.64 -0.62 4.02 5.75 -1.94 -1.08 115.11 120.44 2ij3 h GLN 109 Ca -0.46 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 57.96 2ij3 h GLN 109 Cb 1.26 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 29.64 2ij3 h GLN 109 CO 0.51 0.42 0.22 1.96 -2.65 0.00 0.00 178.83 179.29 2ij3 h GLN 110 N 0.66 0.91 0.00 1.69 1.08 -1.93 -2.28 115.11 115.24 2ij3 h GLN 110 Ca 0.51 -0.16 -0.01 0.00 -1.45 0.00 0.00 58.65 57.54 2ij3 h GLN 110 Cb 0.76 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 28.03 2ij3 h GLN 110 CO -0.38 0.76 -0.06 0.00 -0.95 0.00 0.00 178.83 178.20 2ij3 h ALA 111 N 1.35 1.38 -0.00 3.87 0.00 -1.44 -2.68 119.26 121.74 2ij3 h ALA 111 Ca 0.21 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2ij3 h ALA 111 Cb 0.21 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2ij3 h ALA 111 CO -0.01 0.08 -0.09 0.52 0.00 0.00 0.00 179.25 179.74 2ij3 h MET 112 N 0.00 0.01 -1.00 0.00 2.86 -1.21 -1.47 114.93 114.11 2ij3 h MET 112 Ca -0.00 -0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.76 2ij3 h MET 112 Cb 0.17 -0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.75 2ij3 h MET 112 CO 0.01 0.10 0.63 0.87 1.06 0.00 0.00 176.91 179.57 2ij3 h LYS 113 N 0.01 0.96 0.00 1.72 1.57 -1.61 -0.76 116.57 118.45 2ij3 h LYS 113 Ca 0.00 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 2ij3 h LYS 113 Cb 0.17 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2ij3 h LYS 113 CO 0.01 0.64 -0.34 0.78 -0.57 0.00 0.00 179.45 179.97 2ij3 h GLY 114 N 0.99 0.00 0.65 3.86 0.00 -1.45 -3.21 103.07 103.91 2ij3 h GLY 114 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.83 2ij3 h GLY 114 CO -0.27 0.00 -1.18 -1.72 0.00 0.00 0.00 176.54 173.38 2ij3 n TYR 115 N -3.65 0.47 -0.16 5.60 4.01 -0.64 -4.57 117.16 118.23 2ij3 n TYR 115 Ca -0.01 0.14 -0.03 0.00 -0.16 0.00 0.00 57.90 57.84 2ij3 n TYR 115 Cb 0.45 -0.64 0.04 0.00 -0.31 0.00 0.00 39.34 38.89 2ij3 n TYR 115 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2ij3 h HIS 116 N 0.00 -0.17 -0.76 -0.72 2.76 -1.18 -1.79 115.15 113.30 2ij3 h HIS 116 Ca 0.00 0.04 0.05 0.00 -2.20 0.00 0.00 60.37 58.26 2ij3 h HIS 116 Cb 0.87 0.15 -0.05 0.00 1.55 0.00 0.00 27.41 29.93 2ij3 h HIS 116 CO 0.00 -0.17 0.47 0.00 -1.30 0.00 0.00 177.93 176.92 2ij3 h ALA 117 N 1.47 1.02 -0.02 5.26 0.00 -1.81 0.10 119.26 125.29 2ij3 h ALA 117 Ca 0.24 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 2ij3 h ALA 117 Cb 0.37 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2ij3 h ALA 117 CO -0.47 0.22 -0.68 0.52 0.00 0.00 0.00 179.25 178.84 2ij3 h MET 118 N 0.88 0.11 -0.53 0.00 2.07 -1.73 -0.88 114.93 114.85 2ij3 h MET 118 Ca 0.32 -0.09 -0.07 0.00 -2.07 0.00 0.00 59.70 57.80 2ij3 h MET 118 Cb 0.10 0.02 -0.02 0.00 -1.87 0.00 0.00 31.60 29.83 2ij3 h MET 118 CO -0.14 0.75 0.07 0.52 1.07 0.00 0.00 176.91 179.17 2ij3 h MET 119 N 0.07 0.89 -0.67 1.72 2.86 -0.59 -2.84 114.93 116.38 2ij3 h MET 119 Ca -0.01 -0.25 0.00 0.00 -2.06 0.00 0.00 59.70 57.38 2ij3 h MET 119 Cb 1.21 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.74 2ij3 h MET 119 CO 0.10 0.88 0.42 0.28 1.06 0.00 0.00 176.91 179.65 2ij3 h VAL 120 N 0.77 1.18 -0.40 -2.22 2.07 -0.63 -1.17 116.25 115.85 2ij3 h VAL 120 Ca 0.16 -0.38 0.08 0.00 0.82 0.00 0.00 66.70 67.38 2ij3 h VAL 120 Cb 0.43 0.23 -0.09 0.00 -1.52 0.00 0.00 31.29 30.35 2ij3 h VAL 120 CO 0.01 0.18 -0.30 -0.78 0.02 0.00 0.00 177.57 176.71 2ij3 h ASP 121 N 0.91 -1.00 -0.24 0.57 1.82 -0.97 0.11 116.42 117.61 2ij3 h ASP 121 Ca 0.24 0.18 -0.15 0.00 -0.39 0.00 0.00 57.03 56.92 2ij3 h ASP 121 Cb -0.06 0.48 0.00 0.00 0.68 0.00 0.00 39.33 40.43 2ij3 h ASP 121 CO -0.05 -0.31 -0.44 0.40 -1.61 0.00 0.00 179.24 177.24 2ij3 h ILE 122 N -0.23 1.31 -0.56 2.25 1.08 -1.34 -2.69 117.51 117.32 2ij3 h ILE 122 Ca 0.18 -1.65 0.08 0.00 -0.39 0.00 0.00 64.86 63.08 2ij3 h ILE 122 Cb 0.52 1.76 -0.07 0.00 -3.07 0.00 0.00 36.82 35.96 2ij3 h ILE 122 CO -0.53 0.52 0.20 0.00 -0.69 0.00 0.00 178.15 177.65 2ij3 h ALA 123 N 0.64 0.70 -0.73 1.87 0.00 -0.77 -1.57 119.26 119.39 2ij3 h ALA 123 Ca 0.01 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2ij3 h ALA 123 Cb 1.04 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2ij3 h ALA 123 CO 0.10 -0.21 0.47 0.28 0.00 0.00 0.00 179.25 179.89 2ij3 h VAL 124 N 0.38 1.15 -0.96 0.00 2.07 -0.74 -1.33 116.25 116.81 2ij3 h VAL 124 Ca 0.28 -0.32 0.05 0.00 0.82 0.00 0.00 66.70 67.52 2ij3 h VAL 124 Cb 0.33 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 30.16 2ij3 h VAL 124 CO -0.28 0.17 0.62 1.56 0.02 0.00 0.00 177.57 179.66 2ij3 h GLN 125 N 0.94 1.13 -0.12 1.57 4.20 -1.02 -0.23 115.11 121.59 2ij3 h GLN 125 Ca 0.28 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.91 2ij3 h GLN 125 Cb -0.05 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 27.47 2ij3 h GLN 125 CO -0.08 0.75 0.03 1.25 -0.67 0.00 0.00 178.83 180.11 2ij3 h LEU 126 N 1.17 0.18 -0.43 1.46 5.85 -0.55 -0.73 115.31 122.26 2ij3 h LEU 126 Ca 0.40 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.93 2ij3 h LEU 126 Cb 0.08 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2ij3 h LEU 126 CO -0.15 0.34 0.23 0.58 -0.34 0.00 0.00 178.44 179.11 2ij3 h VAL 127 N -0.00 1.00 -0.80 1.05 2.07 -1.03 -2.15 116.25 116.39 2ij3 h VAL 127 Ca 0.04 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2ij3 h VAL 127 Cb 0.23 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 2ij3 h VAL 127 CO -0.00 0.08 0.45 1.56 0.02 0.00 0.00 177.57 179.69 2ij3 h GLN 128 N 0.46 1.10 -0.32 1.57 4.20 -0.96 0.85 115.11 122.01 2ij3 h GLN 128 Ca 0.18 -0.12 0.07 0.00 0.06 0.00 0.00 58.65 58.84 2ij3 h GLN 128 Cb 0.06 -0.22 -0.07 0.00 0.30 0.00 0.00 27.48 27.55 2ij3 h GLN 128 CO -0.11 0.80 -0.11 -0.22 -0.67 0.00 0.00 178.83 178.53 2ij3 h LYS 129 N 1.10 -0.04 -0.27 1.46 3.64 -0.74 -2.03 116.57 119.68 2ij3 h LYS 129 Ca 0.28 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.54 2ij3 h LYS 129 Cb 0.01 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2ij3 h LYS 129 CO -0.05 -0.03 -0.36 -1.49 -2.27 0.00 0.00 179.45 175.25 2ij3 h TRP 130 N -0.04 0.73 -0.27 1.91 6.55 -0.79 -2.60 115.95 121.44 2ij3 h TRP 130 Ca 0.16 -0.20 0.01 0.00 0.95 0.00 0.00 58.89 59.81 2ij3 h TRP 130 Cb 0.28 -0.16 -0.01 0.00 -0.86 0.00 0.00 29.16 28.41 2ij3 h TRP 130 CO -0.33 0.90 0.18 0.93 -1.05 0.00 0.00 178.44 179.07 2ij3 h GLU 131 N 0.52 0.32 -0.01 0.49 4.39 -0.57 -2.93 114.58 116.78 2ij3 h GLU 131 Ca 0.05 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2ij3 h GLU 131 Cb 0.87 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 2ij3 h GLU 131 CO 0.07 0.21 -0.19 0.54 -1.16 0.00 0.00 179.01 178.49 2ij3 n ARG 132 N -4.50 1.35 -2.12 2.33 1.74 -0.79 -4.90 116.66 109.77 2ij3 n ARG 132 Ca 0.01 -0.92 -0.41 0.00 -0.77 0.00 0.00 57.85 55.77 2ij3 n ARG 132 Cb 0.10 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.04 2ij3 n ARG 132 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2ij3 s LEU 133 N -2.29 4.43 0.72 0.55 1.43 -1.11 -5.01 118.68 117.40 2ij3 s LEU 133 Ca 0.28 2.68 -0.11 0.00 -1.03 0.00 0.00 54.13 55.95 2ij3 s LEU 133 Cb 0.20 -3.65 0.02 0.00 0.03 0.00 0.00 46.19 42.79 2ij3 s LEU 133 CO 0.45 -0.53 1.07 0.20 0.23 0.00 0.00 176.35 177.77 2ij3 s ASN 134 N -0.48 5.19 0.35 2.29 0.01 -1.26 -4.95 114.94 116.09 2ij3 s ASN 134 Ca 0.49 1.47 0.11 0.00 -0.71 0.00 0.00 52.86 54.22 2ij3 s ASN 134 Cb -0.40 -2.31 0.89 0.00 0.41 0.00 0.00 41.25 39.85 2ij3 s ASN 134 CO 0.53 -1.54 1.79 0.00 -1.51 0.00 0.00 177.10 176.37 2ij3 h ALA 135 N -0.79 1.91 0.00 0.60 0.00 -1.99 -2.03 119.26 116.95 2ij3 h ALA 135 Ca -0.45 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2ij3 h ALA 135 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2ij3 h ALA 135 CO 0.59 -0.27 0.00 -0.44 0.00 0.00 0.00 179.25 179.12 2ij3 h ASP 136 N 0.61 0.00 -4.30 0.00 3.32 -2.03 -3.47 116.42 110.55 2ij3 h ASP 136 Ca 0.56 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 57.11 2ij3 h ASP 136 Cb 1.09 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.70 2ij3 h ASP 136 CO -0.32 0.00 0.40 -1.61 -1.72 0.00 0.00 179.24 175.98 2ij3 s GLU 137 N -3.15 3.56 0.42 3.56 2.02 -0.77 -5.09 118.70 119.25 2ij3 s GLU 137 Ca 0.09 0.87 0.03 0.00 0.02 0.00 0.00 54.97 55.98 2ij3 s GLU 137 Cb 0.11 -2.08 -0.03 0.00 0.10 0.00 0.00 34.13 32.24 2ij3 s GLU 137 CO 0.57 -0.60 0.09 -3.38 0.02 0.00 0.00 175.26 171.96 2ij3 s HIS 138 N -2.96 1.84 -0.13 1.61 -3.43 -1.26 -4.81 115.29 106.14 2ij3 s HIS 138 Ca 0.57 -1.16 -0.00 0.00 -0.80 0.00 0.00 55.06 53.67 2ij3 s HIS 138 Cb -0.12 -1.29 -0.01 0.00 -1.43 0.00 0.00 32.58 29.73 2ij3 s HIS 138 CO 0.47 -0.13 -0.13 0.42 -2.00 0.00 0.00 174.74 173.37 2ij3 s ILE 139 N -3.14 3.05 -0.61 -5.38 1.01 0.71 -4.99 121.20 111.86 2ij3 s ILE 139 Ca 0.22 -0.66 -0.23 0.00 0.00 0.00 0.00 60.65 59.98 2ij3 s ILE 139 Cb 0.03 -2.28 0.06 0.00 0.01 0.00 0.00 42.46 40.28 2ij3 s ILE 139 CO 0.12 0.52 0.93 -1.61 0.00 0.00 0.00 174.94 174.90 2ij3 s GLU 140 N 0.39 3.18 0.03 2.79 2.02 -1.26 -2.10 118.70 123.75 2ij3 s GLU 140 Ca -0.10 -0.67 -0.25 0.00 0.02 0.00 0.00 54.97 53.97 2ij3 s GLU 140 Cb -0.16 -4.16 -0.14 0.00 0.10 0.00 0.00 34.13 29.77 2ij3 s GLU 140 CO 0.05 -1.67 1.30 0.28 0.02 0.00 0.00 175.26 175.25 2ij3 h VAL 141 N 5.98 0.00 -0.68 2.63 2.07 -1.65 -1.48 116.25 123.11 2ij3 h VAL 141 Ca -0.28 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.24 2ij3 h VAL 141 Cb 1.07 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2ij3 h VAL 141 CO 1.14 0.00 0.45 -0.65 0.02 0.00 0.00 177.57 178.52 2ij3 h PRO 142 N -0.94 0.71 -0.10 1.57 0.11 -1.86 -0.25 132.00 131.24 2ij3 h PRO 142 Ca -0.09 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.97 2ij3 h PRO 142 Cb 0.69 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 2ij3 h PRO 142 CO 0.15 0.47 0.06 0.93 -0.21 0.00 0.00 178.00 179.40 2ij3 h GLU 143 N 0.73 0.13 -0.21 1.05 3.07 -1.89 -0.78 114.58 116.69 2ij3 h GLU 143 Ca 0.28 -0.01 -0.14 0.00 -0.50 0.00 0.00 59.36 58.99 2ij3 h GLU 143 Cb 0.19 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 2ij3 h GLU 143 CO -0.09 0.14 -0.47 -0.44 -1.40 0.00 0.00 179.01 176.76 2ij3 h ASP 144 N 0.09 0.58 -0.33 1.42 3.32 -0.83 -2.32 116.42 118.35 2ij3 h ASP 144 Ca 0.03 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 2ij3 h ASP 144 Cb 0.05 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2ij3 h ASP 144 CO -0.01 0.97 0.03 0.24 -1.72 0.00 0.00 179.24 178.75 2ij3 h MET 145 N 0.43 0.66 -0.50 3.56 2.86 -0.91 -1.13 114.93 119.90 2ij3 h MET 145 Ca 0.03 -0.15 -0.12 0.00 -2.06 0.00 0.00 59.70 57.40 2ij3 h MET 145 Cb 0.98 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.54 2ij3 h MET 145 CO 0.09 0.66 -0.14 1.15 1.06 0.00 0.00 176.91 179.74 2ij3 h THR 146 N 0.63 1.27 -0.51 2.22 2.02 -1.08 -0.35 112.91 117.12 2ij3 h THR 146 Ca 0.13 -1.29 0.00 0.00 0.77 0.00 0.00 66.41 66.03 2ij3 h THR 146 Cb 0.36 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 2ij3 h THR 146 CO 0.01 0.45 0.32 0.03 0.37 0.00 0.00 175.52 176.70 2ij3 h ARG 147 N 0.84 0.68 0.07 6.66 3.08 -1.07 -1.39 114.38 123.25 2ij3 h ARG 147 Ca 0.12 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 2ij3 h ARG 147 Cb 0.70 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.61 2ij3 h ARG 147 CO 0.05 0.48 -0.03 1.25 -1.07 0.00 0.00 179.97 180.65 2ij3 h LEU 148 N 0.69 -0.08 -0.36 3.04 5.85 -1.01 -1.99 115.31 121.45 2ij3 h LEU 148 Ca 0.19 -0.06 -0.18 0.00 0.84 0.00 0.00 57.88 58.66 2ij3 h LEU 148 Cb -0.04 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 2ij3 h LEU 148 CO -0.04 0.01 -0.59 0.71 -0.34 0.00 0.00 178.44 178.19 2ij3 h THR 149 N -0.17 1.30 -0.24 1.05 1.35 -0.95 0.06 112.91 115.31 2ij3 h THR 149 Ca -0.01 -1.81 -0.00 0.00 -0.55 0.00 0.00 66.41 64.03 2ij3 h THR 149 Cb 0.14 1.75 -0.01 0.00 -1.73 0.00 0.00 68.15 68.30 2ij3 h THR 149 CO 0.02 0.58 0.14 -0.07 -0.25 0.00 0.00 175.52 175.93 2ij3 h LEU 150 N 0.55 0.29 -0.87 3.87 3.38 -1.31 -0.88 115.31 120.33 2ij3 h LEU 150 Ca 0.00 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 2ij3 h LEU 150 Cb 1.18 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 2ij3 h LEU 150 CO 0.12 0.27 0.06 0.44 0.09 0.00 0.00 178.44 179.43 2ij3 h ASP 151 N 0.28 0.86 -0.31 -0.43 5.19 -1.22 -0.29 116.42 120.49 2ij3 h ASP 151 Ca 0.08 -0.20 -0.04 0.00 -0.62 0.00 0.00 57.03 56.26 2ij3 h ASP 151 Cb 0.04 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 2ij3 h ASP 151 CO -0.01 0.88 0.04 0.74 -3.12 0.00 0.00 179.24 177.77 2ij3 h THR 152 N 0.85 1.24 -0.33 0.35 2.02 -0.86 -1.15 112.91 115.03 2ij3 h THR 152 Ca 0.17 -0.85 -0.12 0.00 0.77 0.00 0.00 66.41 66.38 2ij3 h THR 152 Cb 0.42 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 2ij3 h THR 152 CO 0.01 0.28 -0.30 0.40 0.37 0.00 0.00 175.52 176.28 2ij3 h ILE 153 N 0.34 1.28 -0.43 3.11 2.04 -1.05 0.58 117.51 123.37 2ij3 h ILE 153 Ca 0.09 -1.42 0.02 0.00 1.00 0.00 0.00 64.86 64.55 2ij3 h ILE 153 Cb 0.37 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 2ij3 h ILE 153 CO 0.01 0.46 0.25 1.23 0.00 0.00 0.00 178.15 180.10 2ij3 h GLY 154 N 0.98 0.60 0.45 5.37 0.00 -0.96 0.51 103.07 110.03 2ij3 h GLY 154 Ca 0.07 -0.19 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 2ij3 h GLY 154 CO 0.07 0.16 -0.30 -2.00 0.00 0.00 0.00 176.54 174.47 2ij3 h LEU 155 N 0.50 0.24 -0.78 3.11 5.85 -1.01 -1.73 115.31 121.50 2ij3 h LEU 155 Ca 0.18 -0.81 -0.13 0.00 0.84 0.00 0.00 57.88 57.96 2ij3 h LEU 155 Cb 0.03 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2ij3 h LEU 155 CO -0.09 1.02 -0.59 0.00 -0.34 0.00 0.00 178.44 178.45 2ij3 h GLY 157 N 1.67 0.32 -1.97 0.00 0.00 -0.01 -2.19 103.07 100.89 2ij3 h GLY 157 Ca -0.01 -0.73 -0.10 0.00 0.00 0.00 0.00 47.33 46.50 2ij3 h GLY 157 CO 0.08 0.64 -0.55 1.97 0.00 0.00 0.00 176.54 178.68 2ij3 n PHE 158 N -4.23 0.00 -3.79 5.60 1.16 -0.71 -1.37 117.46 114.12 2ij3 n PHE 158 Ca -0.12 -0.31 -0.29 0.00 -1.87 0.00 0.00 57.45 54.86 2ij3 n PHE 158 Cb 0.73 0.12 0.03 0.00 -1.61 0.00 0.00 39.48 38.74 2ij3 n PHE 158 CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18 2ij3 n ASN 159 N 0.17 -4.91 -4.38 5.98 5.15 -0.70 -4.96 115.26 111.62 2ij3 n ASN 159 Ca -0.06 -0.70 -0.32 0.00 -0.60 0.00 0.00 54.58 52.90 2ij3 n ASN 159 Cb 0.82 -3.93 -0.15 0.00 -0.53 0.00 0.00 39.78 36.00 2ij3 n ASN 159 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2ij3 s TYR 160 N -3.25 2.67 -0.39 1.20 5.04 -0.83 -4.94 117.35 116.85 2ij3 s TYR 160 Ca 0.62 -0.51 -0.13 0.00 -2.44 0.00 0.00 57.07 54.61 2ij3 s TYR 160 Cb -0.31 -1.70 0.02 0.00 0.35 0.00 0.00 41.96 40.33 2ij3 s TYR 160 CO 0.76 -0.08 0.25 1.03 -1.34 0.00 0.00 175.55 176.17 2ij3 s ARG 161 N -0.16 2.90 0.47 4.97 0.52 -1.26 -2.86 118.95 123.52 2ij3 s ARG 161 Ca -0.01 -1.05 0.26 0.00 -0.52 0.00 0.00 55.73 54.41 2ij3 s ARG 161 Cb -0.14 -3.84 1.02 0.00 0.52 0.00 0.00 34.95 32.51 2ij3 s ARG 161 CO 0.03 -0.72 1.86 0.74 0.02 0.00 0.00 175.30 177.24 2ij3 h PHE 162 N 8.52 0.00 -6.17 -0.53 0.04 -1.92 -3.47 116.94 113.40 2ij3 h PHE 162 Ca -0.26 0.00 -0.44 0.00 2.80 0.00 0.00 57.97 60.07 2ij3 h PHE 162 Cb 1.11 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.28 2ij3 h PHE 162 CO 0.56 0.18 -0.80 0.09 -0.60 0.00 0.00 178.31 177.74 2ij3 n ASN 163 N -3.34 -2.66 0.25 2.17 5.03 -1.26 -4.61 115.26 110.84 2ij3 n ASN 163 Ca 0.00 -0.80 0.09 0.00 0.87 0.00 0.00 54.58 54.74 2ij3 n ASN 163 Cb 0.40 -4.00 0.64 0.00 -1.02 0.00 0.00 39.78 35.80 2ij3 n ASN 163 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 2ij3 h SER 164 N -1.98 0.00 -0.04 6.41 0.02 -1.92 -1.75 113.55 114.30 2ij3 h SER 164 Ca -0.60 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 2ij3 h SER 164 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 2ij3 h SER 164 CO 0.61 0.10 0.00 0.49 -1.14 0.00 0.00 176.83 176.89 2ij3 n PHE 165 N -4.18 0.05 0.35 3.45 3.72 -1.26 -2.97 117.46 116.62 2ij3 n PHE 165 Ca -0.03 -0.02 0.07 0.00 -0.05 0.00 0.00 57.45 57.42 2ij3 n PHE 165 Cb 0.18 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 38.82 2ij3 n PHE 165 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2ij3 n TYR 166 N -0.51 0.16 -4.11 1.38 4.01 -0.66 -5.03 117.16 112.41 2ij3 n TYR 166 Ca 0.10 -0.14 -0.15 0.00 -0.16 0.00 0.00 57.90 57.55 2ij3 n TYR 166 Cb 0.09 -0.01 -0.12 0.00 -0.31 0.00 0.00 39.34 39.00 2ij3 n TYR 166 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2ij3 s ARG 167 N -1.11 0.66 -0.18 -0.72 0.52 -1.16 -5.02 118.95 111.94 2ij3 s ARG 167 Ca 0.20 -0.86 -0.24 0.00 -0.52 0.00 0.00 55.73 54.30 2ij3 s ARG 167 Cb 0.12 -0.49 -0.22 0.00 0.52 0.00 0.00 34.95 34.88 2ij3 s ARG 167 CO 0.18 0.10 0.45 -0.44 0.02 0.00 0.00 175.30 175.61 2ij3 h ASP 168 N 4.33 0.01 -3.46 0.23 3.32 -1.96 -3.46 116.42 115.44 2ij3 h ASP 168 Ca -0.38 -0.72 -0.60 0.00 0.02 0.00 0.00 57.03 55.35 2ij3 h ASP 168 Cb 1.20 -0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.64 2ij3 h ASP 168 CO 0.42 1.30 -0.06 -1.10 -1.72 0.00 0.00 179.24 178.08 2ij3 s GLN 169 N -2.31 4.19 0.86 3.56 1.11 -1.26 -5.06 119.66 120.75 2ij3 s GLN 169 Ca -0.24 0.39 -0.11 0.00 0.01 0.00 0.00 55.36 55.40 2ij3 s GLN 169 Cb 0.02 -3.56 0.11 0.00 -1.01 0.00 0.00 33.01 28.58 2ij3 s GLN 169 CO 0.64 -0.14 1.17 -2.14 0.01 0.00 0.00 175.29 174.83 2ij3 s PRO 170 N 1.59 1.34 0.23 2.91 0.02 -1.26 -4.92 135.00 134.92 2ij3 s PRO 170 Ca 0.24 1.62 -0.27 0.00 0.02 0.00 0.00 61.00 62.60 2ij3 s PRO 170 Cb -0.15 -1.76 -0.17 0.00 0.02 0.00 0.00 34.50 32.44 2ij3 s PRO 170 CO 0.09 -2.41 0.50 1.58 -0.33 0.00 0.00 177.00 176.43 2ij3 n HIS 171 N -3.80 -0.58 -0.33 6.54 -0.00 -1.26 -4.64 115.22 111.14 2ij3 n HIS 171 Ca 0.12 0.91 0.13 0.00 -0.00 0.00 0.00 57.72 58.89 2ij3 n HIS 171 Cb 0.51 -1.95 0.35 0.00 -0.00 0.00 0.00 29.99 28.90 2ij3 n HIS 171 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2ij3 h PRO 172 N 0.97 0.71 -0.36 1.57 0.11 -1.97 -0.84 132.00 132.18 2ij3 h PRO 172 Ca -0.30 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.83 2ij3 h PRO 172 Cb 1.43 -0.16 -0.06 0.00 0.11 0.00 0.00 31.00 32.33 2ij3 h PRO 172 CO 0.56 0.47 0.01 0.35 -0.21 0.00 0.00 178.00 179.18 2ij3 h PHE 173 N 0.73 -0.00 -0.31 0.65 3.57 -1.91 -1.53 116.94 118.13 2ij3 h PHE 173 Ca 0.53 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 62.04 2ij3 h PHE 173 Cb 0.87 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2ij3 h PHE 173 CO -0.00 -0.06 0.12 0.82 -2.23 0.00 0.00 178.31 176.95 2ij3 h ILE 174 N 0.11 1.19 -0.74 1.41 2.04 -1.51 0.43 117.51 120.43 2ij3 h ILE 174 Ca 0.18 -0.59 0.10 0.00 1.00 0.00 0.00 64.86 65.55 2ij3 h ILE 174 Cb 0.24 0.99 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 2ij3 h ILE 174 CO -0.29 0.20 0.38 0.74 0.00 0.00 0.00 178.15 179.18 2ij3 h THR 175 N 0.35 0.84 -0.29 -0.27 2.02 -1.18 -0.22 112.91 114.17 2ij3 h THR 175 Ca 0.10 -0.22 -0.11 0.00 0.77 0.00 0.00 66.41 66.95 2ij3 h THR 175 Cb 0.20 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.76 2ij3 h THR 175 CO -0.01 0.12 -0.26 0.28 0.37 0.00 0.00 175.52 176.02 2ij3 h SER 176 N 0.63 0.72 -0.47 4.18 0.02 -0.98 -1.97 113.55 115.68 2ij3 h SER 176 Ca 0.37 -0.46 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2ij3 h SER 176 Cb 0.40 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2ij3 h SER 176 CO -0.28 1.03 0.31 -0.03 -1.14 0.00 0.00 176.83 176.72 2ij3 h MET 177 N 0.42 0.62 -0.53 3.45 -1.53 -0.59 0.10 114.93 116.88 2ij3 h MET 177 Ca 0.05 -0.04 -0.02 0.00 -3.44 0.00 0.00 59.70 56.25 2ij3 h MET 177 Cb 0.82 -0.14 -0.02 0.00 -0.55 0.00 0.00 31.60 31.70 2ij3 h MET 177 CO 0.07 0.42 0.26 0.28 0.14 0.00 0.00 176.91 178.08 2ij3 h VAL 178 N 0.63 1.19 -0.38 -5.77 2.07 -1.03 -1.29 116.25 111.68 2ij3 h VAL 178 Ca 0.17 -0.53 -0.11 0.00 0.82 0.00 0.00 66.70 67.05 2ij3 h VAL 178 Cb -0.06 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 2ij3 h VAL 178 CO -0.04 0.21 -0.20 -0.09 0.02 0.00 0.00 177.57 177.48 2ij3 h ARG 179 N 0.71 0.73 -0.23 1.57 2.43 -1.04 -1.55 114.38 116.99 2ij3 h ARG 179 Ca 0.18 -0.28 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 2ij3 h ARG 179 Cb 0.10 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2ij3 h ARG 179 CO -0.02 0.87 0.02 0.00 -1.51 0.00 0.00 179.97 179.33 2ij3 h ALA 180 N 1.13 0.31 -0.31 2.80 0.00 -0.62 -0.51 119.26 122.07 2ij3 h ALA 180 Ca 0.09 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2ij3 h ALA 180 Cb 0.69 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 2ij3 h ALA 180 CO 0.05 0.02 0.06 1.25 0.00 0.00 0.00 179.25 180.63 2ij3 h LEU 181 N 0.19 0.00 -0.72 0.00 5.85 -1.18 -0.79 115.31 118.67 2ij3 h LEU 181 Ca 0.07 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 2ij3 h LEU 181 Cb 0.37 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 2ij3 h LEU 181 CO 0.01 0.04 0.39 -0.78 -0.34 0.00 0.00 178.44 177.75 2ij3 h ASP 182 N 0.17 0.91 -0.48 1.25 3.58 -1.18 -2.36 116.42 118.31 2ij3 h ASP 182 Ca 0.15 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.47 2ij3 h ASP 182 Cb 0.16 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.96 2ij3 h ASP 182 CO -0.20 0.75 0.21 -0.08 -2.88 0.00 0.00 179.24 177.05 2ij3 h GLU 183 N 1.00 0.70 -0.94 0.28 4.57 -0.80 -0.60 114.58 118.79 2ij3 h GLU 183 Ca 0.25 -0.12 0.07 0.00 -1.18 0.00 0.00 59.36 58.39 2ij3 h GLU 183 Cb 0.05 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 28.46 2ij3 h GLU 183 CO -0.04 0.61 0.61 0.00 -1.18 0.00 0.00 179.01 179.01 2ij3 h ALA 184 N 1.06 1.50 -0.02 2.92 0.00 -0.86 -0.44 119.26 123.42 2ij3 h ALA 184 Ca 0.16 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.81 2ij3 h ALA 184 Cb 0.16 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2ij3 h ALA 184 CO -0.02 0.34 -0.97 0.52 0.00 0.00 0.00 179.25 179.13 2ij3 h MET 185 N 1.05 0.58 0.00 0.00 2.86 -1.25 -3.17 114.93 115.01 2ij3 h MET 185 Ca 0.41 -0.61 -0.03 0.00 -2.06 0.00 0.00 59.70 57.42 2ij3 h MET 185 Cb 0.24 0.17 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 2ij3 h MET 185 CO -0.17 1.22 -0.15 -0.91 1.06 0.00 0.00 176.91 177.96 2ij3 h ASN 186 N 0.34 0.00 0.23 1.22 2.35 -0.43 -2.47 115.58 116.82 2ij3 h ASN 186 Ca -0.10 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.61 2ij3 h ASN 186 Cb 1.61 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.98 2ij3 h ASN 186 CO 0.18 0.15 -0.18 0.11 -1.65 0.00 0.00 177.43 176.04 2ij3 h LYS 187 N 0.00 0.00 0.00 0.81 1.57 -1.07 -2.77 116.57 115.11 2ij3 h LYS 187 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2ij3 h LYS 187 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 2ij3 h LYS 187 CO 0.02 0.18 -0.08 -0.07 -0.57 0.00 0.00 179.45 178.93 2ij3 h LEU 188 N 0.00 0.00 -3.82 2.94 3.38 -1.53 -2.91 115.31 113.37 2ij3 h LEU 188 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2ij3 h LEU 188 Cb 0.35 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 40.74 2ij3 h LEU 188 CO 0.02 0.08 -0.11 0.00 0.09 0.00 0.00 178.44 178.52 2ij3 n GLN 189 N -3.71 3.12 -3.98 1.13 1.13 -1.04 -4.95 117.38 109.08 2ij3 n GLN 189 Ca -0.02 -3.76 -0.33 0.00 -1.94 0.00 0.00 57.00 50.95 2ij3 n GLN 189 Cb 0.19 -2.25 -0.14 0.00 0.11 0.00 0.00 30.24 28.15 2ij3 n GLN 189 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2ij3 s ARG 190 N -3.66 2.03 0.13 -1.09 0.52 -1.10 -4.98 118.95 110.79 2ij3 s ARG 190 Ca 0.56 -1.55 -0.16 0.00 -0.52 0.00 0.00 55.73 54.07 2ij3 s ARG 190 Cb 0.45 -3.14 -0.02 0.00 0.52 0.00 0.00 34.95 32.76 2ij3 s ARG 190 CO 0.02 -0.75 1.63 0.00 0.02 0.00 0.00 175.30 176.21 2ij3 h ALA 191 N 7.81 0.52 -3.22 2.13 0.00 -1.92 -3.36 119.26 121.21 2ij3 h ALA 191 Ca -0.14 -0.19 -0.65 0.00 0.00 0.00 0.00 54.91 53.92 2ij3 h ALA 191 Cb 1.04 -0.15 -0.40 0.00 0.00 0.00 0.00 17.79 18.28 2ij3 h ALA 191 CO 0.53 0.19 -0.51 0.54 0.00 0.00 0.00 179.25 179.99 2ij3 s ASN 192 N -5.99 4.77 0.53 0.00 6.03 -1.26 -4.97 114.94 114.05 2ij3 s ASN 192 Ca -0.13 -3.26 0.29 0.00 -1.03 0.00 0.00 52.86 48.73 2ij3 s ASN 192 Cb 0.10 -1.71 1.48 0.00 -3.03 0.00 0.00 41.25 38.09 2ij3 s ASN 192 CO 0.77 -0.22 2.07 -0.65 -2.03 0.00 0.00 177.10 177.04 2ij3 h PRO 193 N 6.29 0.00 -0.05 3.55 0.11 -1.98 -2.97 132.00 136.94 2ij3 h PRO 193 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2ij3 h PRO 193 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2ij3 h PRO 193 CO 0.72 0.11 0.00 -0.25 -0.21 0.00 0.00 178.00 178.36 2ij3 n ASP 194 N -3.50 2.78 -4.66 -2.05 8.00 -1.26 -4.86 116.55 111.00 2ij3 n ASP 194 Ca -0.01 -1.92 -0.49 0.00 0.71 0.00 0.00 54.79 53.08 2ij3 n ASP 194 Cb 0.25 -0.02 -0.05 0.00 -0.02 0.00 0.00 41.12 41.28 2ij3 n ASP 194 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2ij3 n ASP 195 N 1.17 2.80 -0.18 -2.24 -0.08 -1.12 -4.83 116.55 112.06 2ij3 n ASP 195 Ca 0.15 1.07 0.28 0.00 -1.51 0.00 0.00 54.79 54.78 2ij3 n ASP 195 Cb 0.56 -1.34 0.50 0.00 2.34 0.00 0.00 41.12 43.18 2ij3 n ASP 195 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2ij3 h PRO 196 N 6.40 0.00 0.00 -0.67 0.11 -1.92 0.33 132.00 136.25 2ij3 h PRO 196 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2ij3 h PRO 196 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2ij3 h PRO 196 CO 0.88 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.67 2ij3 h ALA 197 N 0.71 1.00 -0.64 -0.75 0.00 -1.96 -2.74 119.26 114.87 2ij3 h ALA 197 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2ij3 h ALA 197 Cb 2.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.45 2ij3 h ALA 197 CO -0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.91 2ij3 n TYR 198 N -2.30 1.23 -0.12 0.00 4.02 0.10 -4.41 117.16 115.69 2ij3 n TYR 198 Ca 0.02 -0.58 -0.07 0.00 -0.01 0.00 0.00 57.90 57.26 2ij3 n TYR 198 Cb 0.22 -0.15 0.09 0.00 -0.02 0.00 0.00 39.34 39.48 2ij3 n TYR 198 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 2ij3 h ASP 199 N 3.91 0.84 -0.32 7.72 5.19 -1.66 -1.74 116.42 130.36 2ij3 h ASP 199 Ca 0.00 -0.26 -0.08 0.00 -0.62 0.00 0.00 57.03 56.06 2ij3 h ASP 199 Cb 1.26 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.53 2ij3 h ASP 199 CO 0.14 0.98 -0.13 -0.08 -3.12 0.00 0.00 179.24 177.03 2ij3 h GLU 200 N 0.76 0.65 -0.45 3.56 4.57 -1.83 -1.38 114.58 120.47 2ij3 h GLU 200 Ca 0.12 -0.27 0.08 0.00 -1.18 0.00 0.00 59.36 58.11 2ij3 h GLU 200 Cb 0.62 -0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.12 2ij3 h GLU 200 CO 0.04 0.85 0.02 -0.91 -1.18 0.00 0.00 179.01 177.84 2ij3 h ASN 201 N 0.42 -0.14 -0.56 1.04 4.21 -1.80 0.43 115.58 119.18 2ij3 h ASN 201 Ca 0.08 0.10 -0.09 0.00 1.21 0.00 0.00 56.30 57.60 2ij3 h ASN 201 Cb 0.64 0.17 -0.02 0.00 -1.12 0.00 0.00 38.32 37.99 2ij3 h ASN 201 CO 0.04 -0.04 0.00 0.11 -1.29 0.00 0.00 177.43 176.26 2ij3 h LYS 202 N 0.14 0.98 -0.21 0.81 1.57 -1.24 0.88 116.57 119.50 2ij3 h LYS 202 Ca 0.23 -0.31 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 2ij3 h LYS 202 Cb 0.32 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2ij3 h LYS 202 CO -0.35 0.98 0.07 -0.09 -0.57 0.00 0.00 179.45 179.48 2ij3 h ARG 203 N 0.87 0.33 -0.54 3.15 2.43 -1.00 -2.33 114.38 117.29 2ij3 h ARG 203 Ca 0.16 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.20 2ij3 h ARG 203 Cb 0.54 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 2ij3 h ARG 203 CO 0.03 0.42 0.08 0.37 -1.51 0.00 0.00 179.97 179.36 2ij3 h GLN 204 N 0.17 0.85 -0.65 0.20 5.75 -0.77 -2.01 115.11 118.66 2ij3 h GLN 204 Ca 0.07 -0.20 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 2ij3 h GLN 204 Cb 0.23 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.63 2ij3 h GLN 204 CO -0.00 0.80 0.30 0.35 -2.65 0.00 0.00 178.83 177.63 2ij3 h PHE 205 N 0.81 0.94 -0.35 3.99 3.57 -0.73 -1.09 116.94 124.08 2ij3 h PHE 205 Ca 0.17 -0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.48 2ij3 h PHE 205 Cb 0.37 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2ij3 h PHE 205 CO 0.02 0.71 -0.35 1.96 -2.23 0.00 0.00 178.31 178.43 2ij3 h GLN 206 N 0.90 0.79 -0.32 1.11 1.08 -1.13 -1.82 115.11 115.70 2ij3 h GLN 206 Ca 0.22 -0.38 0.00 0.00 -1.45 0.00 0.00 58.65 57.04 2ij3 h GLN 206 Cb 0.13 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.54 2ij3 h GLN 206 CO -0.03 1.01 0.20 1.49 -0.95 0.00 0.00 178.83 180.56 2ij3 h GLU 207 N 0.66 0.44 -0.58 1.46 4.81 -1.21 -2.17 114.58 117.98 2ij3 h GLU 207 Ca 0.06 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2ij3 h GLU 207 Cb 0.89 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.15 2ij3 h GLU 207 CO 0.08 0.31 0.27 -0.44 -0.73 0.00 0.00 179.01 178.50 2ij3 h ASP 208 N 0.43 0.76 -0.91 1.04 3.32 -0.94 -0.14 116.42 119.98 2ij3 h ASP 208 Ca 0.12 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 57.04 2ij3 h ASP 208 Cb -0.02 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.29 2ij3 h ASP 208 CO -0.02 0.69 0.60 0.40 -1.72 0.00 0.00 179.24 179.19 2ij3 h ILE 209 N 0.79 1.23 -0.31 0.35 2.04 -1.31 -1.97 117.51 118.32 2ij3 h ILE 209 Ca 0.20 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 2ij3 h ILE 209 Cb 0.13 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.09 2ij3 h ILE 209 CO -0.02 0.22 0.07 0.50 0.00 0.00 0.00 178.15 178.92 2ij3 h LYS 210 N 1.23 0.49 -0.46 2.37 3.64 -0.70 0.14 116.57 123.28 2ij3 h LYS 210 Ca 0.34 -0.12 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 2ij3 h LYS 210 Cb -0.13 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.56 2ij3 h LYS 210 CO -0.08 0.56 0.07 0.28 -2.27 0.00 0.00 179.45 178.02 2ij3 h VAL 211 N 0.33 0.72 0.24 2.00 2.07 -0.85 0.34 116.25 121.10 2ij3 h VAL 211 Ca 0.10 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 2ij3 h VAL 211 Cb 0.29 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2ij3 h VAL 211 CO 0.00 0.04 -0.12 0.24 0.02 0.00 0.00 177.57 177.75 2ij3 h MET 212 N 0.19 -0.31 -0.47 1.57 2.86 -1.05 -2.44 114.93 115.29 2ij3 h MET 212 Ca 0.23 0.02 0.07 0.00 -2.06 0.00 0.00 59.70 57.96 2ij3 h MET 212 Cb 0.31 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.98 2ij3 h MET 212 CO -0.32 -0.05 0.14 -0.91 1.06 0.00 0.00 176.91 176.82 2ij3 h ASN 213 N -0.54 0.10 0.10 1.22 2.35 -0.51 -2.63 115.58 115.67 2ij3 h ASN 213 Ca -0.03 0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2ij3 h ASN 213 Cb 0.40 0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.82 2ij3 h ASN 213 CO 0.05 0.09 -0.13 0.44 -1.65 0.00 0.00 177.43 176.23 2ij3 h ASP 214 N 0.29 -0.34 0.10 5.81 3.32 -0.24 0.20 116.42 125.56 2ij3 h ASP 214 Ca 0.23 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.33 2ij3 h ASP 214 Cb 0.26 0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 2ij3 h ASP 214 CO -0.26 -0.19 -0.18 0.25 -1.72 0.00 0.00 179.24 177.14 2ij3 h LEU 215 N -0.27 -0.50 -0.48 1.55 5.85 -1.40 -0.50 115.31 119.57 2ij3 h LEU 215 Ca 0.01 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 2ij3 h LEU 215 Cb 0.27 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 2ij3 h LEU 215 CO -0.05 -0.26 0.04 0.58 -0.34 0.00 0.00 178.44 178.41 2ij3 h VAL 216 N -0.35 1.26 -0.54 1.05 2.07 -1.30 -1.33 116.25 117.10 2ij3 h VAL 216 Ca 0.02 -0.99 0.01 0.00 0.82 0.00 0.00 66.70 66.57 2ij3 h VAL 216 Cb 0.36 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 2ij3 h VAL 216 CO -0.10 0.35 0.35 0.44 0.02 0.00 0.00 177.57 178.63 2ij3 h ASP 217 N 0.68 0.59 -0.47 0.57 3.32 -0.56 -1.06 116.42 119.50 2ij3 h ASP 217 Ca 0.14 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.20 2ij3 h ASP 217 Cb 0.45 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 2ij3 h ASP 217 CO 0.02 0.42 0.28 0.50 -1.72 0.00 0.00 179.24 178.74 2ij3 h LYS 218 N 0.71 0.55 -0.49 3.56 3.64 -0.82 -1.33 116.57 122.39 2ij3 h LYS 218 Ca 0.20 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2ij3 h LYS 218 Cb -0.05 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 2ij3 h LYS 218 CO -0.06 0.37 0.16 0.82 -2.27 0.00 0.00 179.45 178.46 2ij3 h ILE 219 N 0.57 1.23 -0.40 2.00 2.04 -0.96 0.17 117.51 122.16 2ij3 h ILE 219 Ca 0.18 -0.76 0.03 0.00 1.00 0.00 0.00 64.86 65.32 2ij3 h ILE 219 Cb -0.00 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2ij3 h ILE 219 CO -0.08 0.28 0.20 0.40 0.00 0.00 0.00 178.15 178.95 2ij3 h ILE 220 N 0.66 0.98 -0.56 -0.67 2.04 -1.03 -1.69 117.51 117.23 2ij3 h ILE 220 Ca 0.16 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 2ij3 h ILE 220 Cb 0.27 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2ij3 h ILE 220 CO -0.01 0.07 0.22 0.00 0.00 0.00 0.00 178.15 178.44 2ij3 h ALA 221 N 1.21 0.72 -0.99 1.87 0.00 -0.90 -2.34 119.26 118.84 2ij3 h ALA 221 Ca 0.17 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2ij3 h ALA 221 Cb 0.08 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 2ij3 h ALA 221 CO -0.12 0.34 0.65 -0.44 0.00 0.00 0.00 179.25 179.68 2ij3 h ASP 222 N 0.76 1.12 -0.28 0.00 3.32 -0.45 -2.51 116.42 118.39 2ij3 h ASP 222 Ca 0.19 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.17 2ij3 h ASP 222 Cb 0.20 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2ij3 h ASP 222 CO -0.02 0.80 0.02 -0.09 -1.72 0.00 0.00 179.24 178.24 2ij3 h ARG 223 N 1.32 0.48 -0.13 3.56 9.65 -1.10 -1.97 114.38 126.18 2ij3 h ARG 223 Ca 0.37 -0.14 -0.05 0.00 -1.10 0.00 0.00 59.98 59.06 2ij3 h ARG 223 Cb -0.12 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.40 2ij3 h ARG 223 CO -0.09 0.62 -0.15 0.87 2.80 0.00 0.00 179.97 184.02 2ij3 h LYS 224 N 0.28 0.21 -0.02 0.20 1.57 -1.30 -1.53 116.57 115.97 2ij3 h LYS 224 Ca 0.08 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 2ij3 h LYS 224 Cb 0.39 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2ij3 h LYS 224 CO 0.01 0.37 -0.09 0.00 -0.57 0.00 0.00 179.45 179.16 2ij3 h ALA 225 N 1.65 0.04 0.00 3.86 0.00 -1.35 -3.31 119.26 120.15 2ij3 h ALA 225 Ca 0.04 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2ij3 h ALA 225 Cb 0.39 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2ij3 h ALA 225 CO 0.02 -0.07 -0.01 0.66 0.00 0.00 0.00 179.25 179.86 2ij3 h SER 226 N -0.49 0.00 0.00 0.00 4.64 -1.26 -3.46 113.55 112.98 2ij3 h SER 226 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ij3 h SER 226 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 2ij3 h SER 226 CO 0.02 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 2ij3 n GLY 227 N 0.52 0.35 3.72 -0.77 0.00 -0.59 -4.96 105.19 103.46 2ij3 n GLY 227 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2ij3 n GLY 227 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ij3 n GLU 228 N -1.45 2.49 -4.56 1.61 0.00 -1.24 -5.01 120.64 112.48 2ij3 n GLU 228 Ca 0.00 0.89 -0.34 0.00 0.00 0.00 0.00 57.16 57.71 2ij3 n GLU 228 Cb 0.13 -2.63 -0.11 0.00 0.00 0.00 0.00 31.44 28.82 2ij3 n GLU 228 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 2ij3 s GLN 229 N -0.37 2.92 0.32 5.31 -1.52 -1.26 -4.95 119.66 120.11 2ij3 s GLN 229 Ca 0.66 -0.52 0.05 0.00 -1.95 0.00 0.00 55.36 53.60 2ij3 s GLN 229 Cb -0.55 -2.67 -0.03 0.00 -0.22 0.00 0.00 33.01 29.55 2ij3 s GLN 229 CO 0.48 0.61 0.21 -1.12 -0.25 0.00 0.00 175.29 175.22 2ij3 s SER 230 N -0.65 1.69 -0.15 5.90 0.01 -1.26 -5.03 113.70 114.20 2ij3 s SER 230 Ca 0.10 -1.66 -0.00 0.00 1.31 0.00 0.00 55.95 55.70 2ij3 s SER 230 Cb -0.12 0.49 0.13 0.00 0.21 0.00 0.00 66.02 66.73 2ij3 s SER 230 CO 0.02 -0.97 1.81 0.47 0.41 0.00 0.00 173.24 174.98 2ij3 n ASP 231 N -1.23 5.25 -4.64 2.44 8.00 -1.26 -4.77 116.55 120.34 2ij3 n ASP 231 Ca 0.03 -2.67 -0.25 0.00 0.71 0.00 0.00 54.79 52.62 2ij3 n ASP 231 Cb 0.64 -0.96 -0.08 0.00 -0.02 0.00 0.00 41.12 40.69 2ij3 n ASP 231 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2ij3 s ASP 232 N 0.89 4.20 0.41 -2.24 -4.77 -1.26 -4.69 116.67 109.21 2ij3 s ASP 232 Ca 0.16 -1.01 0.08 0.00 -3.30 0.00 0.00 52.55 48.48 2ij3 s ASP 232 Cb 0.13 -0.53 0.85 0.00 -1.09 0.00 0.00 42.92 42.28 2ij3 s ASP 232 CO 0.01 -0.28 2.02 -0.07 0.70 0.00 0.00 175.17 177.55 2ij3 h LEU 233 N 1.77 0.39 -0.41 2.11 3.38 -1.31 -2.94 115.31 118.30 2ij3 h LEU 233 Ca -0.43 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 2ij3 h LEU 233 Cb 1.25 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 2ij3 h LEU 233 CO 0.68 0.35 0.22 0.25 0.09 0.00 0.00 178.44 180.02 2ij3 h LEU 234 N 0.44 0.51 -0.19 1.67 5.85 -1.50 -0.74 115.31 121.36 2ij3 h LEU 234 Ca 0.11 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.76 2ij3 h LEU 234 Cb 0.08 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2ij3 h LEU 234 CO -0.01 0.46 0.03 0.74 -0.34 0.00 0.00 178.44 179.32 2ij3 h THR 235 N 0.52 0.91 -0.56 1.05 2.02 -1.82 -0.55 112.91 114.48 2ij3 h THR 235 Ca 0.14 -0.04 0.11 0.00 0.77 0.00 0.00 66.41 67.39 2ij3 h THR 235 Cb 0.07 0.80 -0.09 0.00 -1.74 0.00 0.00 68.15 67.19 2ij3 h THR 235 CO -0.02 0.02 0.07 0.45 0.37 0.00 0.00 175.52 176.41 2ij3 h HIS 236 N 0.10 0.10 -0.31 3.16 3.86 -1.37 -1.37 115.15 119.33 2ij3 h HIS 236 Ca 0.08 0.04 -0.15 0.00 -1.16 0.00 0.00 60.37 59.18 2ij3 h HIS 236 Cb 0.08 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 2ij3 h HIS 236 CO -0.14 -0.07 -0.41 0.52 0.86 0.00 0.00 177.93 178.69 2ij3 h MET 237 N 0.20 0.74 -0.12 2.45 2.07 -0.73 0.19 114.93 119.72 2ij3 h MET 237 Ca 0.29 -0.39 -0.11 0.00 -2.07 0.00 0.00 59.70 57.42 2ij3 h MET 237 Cb 0.43 0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 30.17 2ij3 h MET 237 CO -0.41 1.01 -0.40 -0.07 1.07 0.00 0.00 176.91 178.12 2ij3 h LEU 238 N 0.61 0.28 0.00 1.22 3.38 -0.85 -3.29 115.31 116.67 2ij3 h LEU 238 Ca 0.05 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2ij3 h LEU 238 Cb 0.96 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2ij3 h LEU 238 CO 0.09 0.66 -1.54 0.59 0.09 0.00 0.00 178.44 178.32 2ij3 n ASN 239 N -4.04 0.46 -4.77 -0.43 3.02 -0.54 -4.99 115.26 103.98 2ij3 n ASN 239 Ca -0.01 0.19 -0.39 0.00 -0.03 0.00 0.00 54.58 54.33 2ij3 n ASN 239 Cb 0.47 1.05 -0.03 0.00 -0.61 0.00 0.00 39.78 40.65 2ij3 n ASN 239 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2ij3 s GLY 240 N -4.56 2.96 -0.03 7.41 0.00 0.65 -5.06 107.32 108.68 2ij3 s GLY 240 Ca -0.04 0.92 0.07 0.00 0.00 0.00 0.00 44.72 45.66 2ij3 s GLY 240 CO 0.84 1.47 -0.25 0.54 0.00 0.00 0.00 173.10 175.71 2ij3 s LYS 241 N -1.86 2.27 -0.14 2.90 -0.14 -1.26 -4.22 119.74 117.29 2ij3 s LYS 241 Ca 0.50 -0.90 -0.29 0.00 -1.36 0.00 0.00 55.97 53.92 2ij3 s LYS 241 Cb -0.31 -2.11 -0.04 0.00 -1.68 0.00 0.00 37.83 33.69 2ij3 s LYS 241 CO 0.39 0.52 1.69 0.34 -0.76 0.00 0.00 175.35 177.53 2ij3 s ASP 242 N -0.50 6.43 0.60 2.83 2.15 0.10 -4.80 116.67 123.49 2ij3 s ASP 242 Ca 0.07 1.93 0.30 0.00 0.43 0.00 0.00 52.55 55.28 2ij3 s ASP 242 Cb -0.11 -2.53 1.68 0.00 -0.30 0.00 0.00 42.92 41.66 2ij3 s ASP 242 CO 0.00 -1.17 2.07 1.55 -0.17 0.00 0.00 175.17 177.46 2ij3 h PRO 243 N 10.55 0.00 0.17 4.34 0.13 -1.90 1.08 132.00 146.37 2ij3 h PRO 243 Ca -0.37 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.75 2ij3 h PRO 243 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2ij3 h PRO 243 CO 0.98 0.00 -0.08 0.93 -0.23 0.00 0.00 178.00 179.60 2ij3 h GLU 244 N 0.00 -0.21 0.00 0.86 5.08 -1.96 -3.38 114.58 114.96 2ij3 h GLU 244 Ca 0.09 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2ij3 h GLU 244 Cb 0.58 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2ij3 h GLU 244 CO -0.00 0.09 -1.13 0.25 -1.00 0.00 0.00 179.01 177.21 2ij3 n THR 245 N -4.91 0.48 -0.95 1.13 -2.24 -1.12 -4.96 114.28 101.72 2ij3 n THR 245 Ca -0.06 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2ij3 n THR 245 Cb 0.20 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 2ij3 n THR 245 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ij3 n GLY 246 N 1.21 0.81 3.86 3.38 0.00 0.37 -4.99 105.19 109.84 2ij3 n GLY 246 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2ij3 n GLY 246 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ij3 s GLU 247 N -0.14 3.87 0.61 1.61 2.02 -1.25 -4.57 118.70 120.85 2ij3 s GLU 247 Ca 0.00 0.36 -0.05 0.00 0.02 0.00 0.00 54.97 55.30 2ij3 s GLU 247 Cb 0.00 -2.79 0.02 0.00 0.10 0.00 0.00 34.13 31.46 2ij3 s GLU 247 CO 0.00 0.40 0.91 -1.25 0.02 0.00 0.00 175.26 175.34 2ij3 s PRO 248 N -2.39 2.74 0.34 0.39 0.04 -1.26 0.03 135.00 134.89 2ij3 s PRO 248 Ca 0.42 -0.13 -0.27 0.00 0.04 0.00 0.00 61.00 61.06 2ij3 s PRO 248 Cb -0.13 -2.28 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 2ij3 s PRO 248 CO 0.20 -0.80 1.14 -0.51 0.04 0.00 0.00 177.00 177.07 2ij3 s LEU 249 N -5.01 4.36 0.79 -3.56 1.43 -1.26 -4.95 118.68 110.47 2ij3 s LEU 249 Ca 0.55 2.32 -0.12 0.00 -1.03 0.00 0.00 54.13 55.85 2ij3 s LEU 249 Cb -0.11 -3.84 0.07 0.00 0.03 0.00 0.00 46.19 42.34 2ij3 s LEU 249 CO 0.44 -0.42 1.15 1.51 0.23 0.00 0.00 176.35 179.26 2ij3 s ASP 250 N -1.01 4.68 0.33 2.29 1.47 -1.26 -4.86 116.67 118.31 2ij3 s ASP 250 Ca 0.51 0.92 0.03 0.00 1.18 0.00 0.00 52.55 55.19 2ij3 s ASP 250 Cb -0.31 -1.52 0.58 0.00 -0.34 0.00 0.00 42.92 41.34 2ij3 s ASP 250 CO 0.40 -1.81 1.89 0.44 0.68 0.00 0.00 175.17 176.77 2ij3 h ASP 251 N -0.98 0.57 -0.40 2.11 3.32 -1.99 -1.18 116.42 117.86 2ij3 h ASP 251 Ca -0.46 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.38 2ij3 h ASP 251 Cb 1.31 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 2ij3 h ASP 251 CO 0.65 0.58 -0.22 -0.08 -1.72 0.00 0.00 179.24 178.45 2ij3 h GLU 252 N 0.60 0.85 -0.48 3.56 4.81 -2.00 -2.11 114.58 119.82 2ij3 h GLU 252 Ca 0.13 -0.38 -0.12 0.00 -0.13 0.00 0.00 59.36 58.86 2ij3 h GLU 252 Cb 0.26 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 2ij3 h GLU 252 CO -0.00 1.02 -0.17 -0.97 -0.73 0.00 0.00 179.01 178.16 2ij3 h ASN 253 N 0.66 0.98 -0.76 1.04 -0.73 -1.84 -1.94 115.58 112.99 2ij3 h ASN 253 Ca 0.09 -0.38 0.10 0.00 1.87 0.00 0.00 56.30 57.97 2ij3 h ASN 253 Cb 0.78 -0.27 -0.07 0.00 0.27 0.00 0.00 38.32 39.03 2ij3 h ASN 253 CO 0.06 1.14 0.40 0.40 -0.37 0.00 0.00 177.43 179.06 2ij3 h ILE 254 N 0.81 0.86 -0.49 2.57 2.04 -1.16 0.52 117.51 122.66 2ij3 h ILE 254 Ca 0.11 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2ij3 h ILE 254 Cb 0.74 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2ij3 h ILE 254 CO 0.06 0.12 0.28 -0.09 0.00 0.00 0.00 178.15 178.53 2ij3 h ARG 255 N 0.67 0.68 -0.85 2.37 2.43 -1.14 -1.45 114.38 117.10 2ij3 h ARG 255 Ca 0.37 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.48 2ij3 h ARG 255 Cb 0.38 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.75 2ij3 h ARG 255 CO -0.26 0.52 0.55 1.88 -1.51 0.00 0.00 179.97 181.15 2ij3 h TYR 256 N 0.66 1.07 -0.46 2.20 0.05 -0.40 -1.33 116.97 118.77 2ij3 h TYR 256 Ca 0.18 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.92 2ij3 h TYR 256 Cb 0.02 -0.36 -0.02 0.00 1.01 0.00 0.00 36.73 37.38 2ij3 h TYR 256 CO -0.02 0.68 0.05 1.96 -1.05 0.00 0.00 178.16 179.78 2ij3 h GLN 257 N 1.15 0.78 -0.01 4.88 1.08 -0.52 -0.84 115.11 121.63 2ij3 h GLN 257 Ca 0.31 -0.22 -0.00 0.00 -1.45 0.00 0.00 58.65 57.29 2ij3 h GLN 257 Cb -0.12 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.22 2ij3 h GLN 257 CO -0.07 0.81 0.01 0.82 -0.95 0.00 0.00 178.83 179.45 2ij3 h ILE 258 N 0.63 1.04 -0.94 2.54 2.04 -0.87 -0.56 117.51 121.40 2ij3 h ILE 258 Ca 0.14 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.92 2ij3 h ILE 258 Cb 0.43 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.55 2ij3 h ILE 258 CO 0.01 0.03 0.60 0.40 0.00 0.00 0.00 178.15 179.20 2ij3 h ILE 259 N -0.03 1.13 0.04 -0.67 2.04 -1.20 -2.10 117.51 116.71 2ij3 h ILE 259 Ca 0.00 -0.39 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 2ij3 h ILE 259 Cb 0.05 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.01 2ij3 h ILE 259 CO -0.00 0.21 -0.02 0.74 0.00 0.00 0.00 178.15 179.08 2ij3 h THR 260 N 1.15 1.01 -0.85 -0.27 2.02 -0.87 0.17 112.91 115.27 2ij3 h THR 260 Ca 0.38 -0.15 0.09 0.00 0.77 0.00 0.00 66.41 67.51 2ij3 h THR 260 Cb 0.06 1.11 -0.07 0.00 -1.74 0.00 0.00 68.15 67.51 2ij3 h THR 260 CO -0.14 0.04 0.49 -0.26 0.37 0.00 0.00 175.52 176.02 2ij3 h PHE 261 N -0.12 0.90 0.30 3.16 0.04 -0.75 -1.37 116.94 119.09 2ij3 h PHE 261 Ca -0.01 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 2ij3 h PHE 261 Cb 0.10 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 37.98 2ij3 h PHE 261 CO -0.05 0.38 -0.14 -0.07 -0.60 0.00 0.00 178.31 177.82 2ij3 h LEU 262 N 0.83 -0.34 -0.63 1.54 3.38 -1.03 -0.79 115.31 118.27 2ij3 h LEU 262 Ca 0.41 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 2ij3 h LEU 262 Cb 0.36 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2ij3 h LEU 262 CO -0.24 0.06 -0.00 0.16 0.09 0.00 0.00 178.44 178.51 2ij3 h ILE 263 N -0.80 1.27 0.01 1.22 -0.00 -0.43 -2.41 117.51 116.36 2ij3 h ILE 263 Ca -0.04 -1.16 -0.25 0.00 -0.00 0.00 0.00 64.86 63.41 2ij3 h ILE 263 Cb 0.51 0.79 -0.04 0.00 -0.00 0.00 0.00 36.82 38.09 2ij3 h ILE 263 CO 0.07 0.42 -1.37 1.57 -0.00 0.00 0.00 178.15 178.84 2ij3 n HIS 264 N -4.18 0.97 -0.30 0.16 -0.00 -0.54 -4.17 115.22 107.16 2ij3 n HIS 264 Ca 0.03 0.41 -0.02 0.00 0.46 0.00 0.00 57.72 58.60 2ij3 n HIS 264 Cb 0.35 -1.10 0.10 0.00 -0.12 0.00 0.00 29.99 29.22 2ij3 n HIS 264 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 2ij3 h GLY 265 N -0.91 1.19 1.20 1.57 0.00 -1.24 -2.76 103.07 102.12 2ij3 h GLY 265 Ca -0.37 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.42 2ij3 h GLY 265 CO -0.21 0.34 -0.26 1.12 0.00 0.00 0.00 176.54 177.52 2ij3 h HIS 266 N 1.02 1.05 -0.06 5.60 2.07 -1.47 -2.59 115.15 120.78 2ij3 h HIS 266 Ca 0.33 -0.27 -0.07 0.00 -2.85 0.00 0.00 60.37 57.52 2ij3 h HIS 266 Cb 0.01 -0.24 0.00 0.00 2.57 0.00 0.00 27.41 29.75 2ij3 h HIS 266 CO -0.03 1.06 -0.22 0.93 -3.07 0.00 0.00 177.93 176.60 2ij3 h GLU 267 N 0.77 0.25 -0.40 5.12 5.08 -1.70 -1.73 114.58 121.98 2ij3 h GLU 267 Ca 0.09 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 2ij3 h GLU 267 Cb 0.83 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 2ij3 h GLU 267 CO 0.07 0.83 0.15 1.79 -1.00 0.00 0.00 179.01 180.85 2ij3 h THR 268 N -0.27 1.20 -0.17 1.13 1.35 -1.57 -1.69 112.91 112.89 2ij3 h THR 268 Ca -0.01 -0.64 -0.18 0.00 -0.55 0.00 0.00 66.41 65.03 2ij3 h THR 268 Cb 0.86 0.88 -0.00 0.00 -1.73 0.00 0.00 68.15 68.16 2ij3 h THR 268 CO 0.05 0.23 -0.62 0.74 -0.25 0.00 0.00 175.52 175.66 2ij3 h THR 269 N 0.49 1.32 -0.57 6.82 2.02 -1.49 -1.51 112.91 120.00 2ij3 h THR 269 Ca 0.13 -1.89 -0.04 0.00 0.77 0.00 0.00 66.41 65.38 2ij3 h THR 269 Cb 0.21 1.86 -0.02 0.00 -1.74 0.00 0.00 68.15 68.46 2ij3 h THR 269 CO -0.01 0.59 0.20 -1.28 0.37 0.00 0.00 175.52 175.39 2ij3 h SER 270 N 0.44 0.81 -0.45 4.18 0.87 -1.30 -2.02 113.55 116.07 2ij3 h SER 270 Ca -0.01 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.36 2ij3 h SER 270 Cb 1.19 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.92 2ij3 h SER 270 CO 0.12 0.78 0.25 1.23 -0.53 0.00 0.00 176.83 178.68 2ij3 h GLY 271 N 0.79 0.68 0.85 5.77 0.00 -1.14 -1.44 103.07 108.58 2ij3 h GLY 271 Ca 0.19 -0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.22 2ij3 h GLY 271 CO -0.01 0.29 -0.09 -2.00 0.00 0.00 0.00 176.54 174.73 2ij3 h LEU 272 N 0.60 -0.25 -0.93 3.11 5.85 -1.10 0.91 115.31 123.50 2ij3 h LEU 272 Ca 0.16 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.94 2ij3 h LEU 272 Cb 0.05 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 2ij3 h LEU 272 CO -0.03 -0.14 0.61 -0.07 -0.34 0.00 0.00 178.44 178.47 2ij3 h LEU 273 N -0.19 1.01 -0.33 2.25 3.38 -1.25 0.45 115.31 120.62 2ij3 h LEU 273 Ca 0.01 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2ij3 h LEU 273 Cb 0.20 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2ij3 h LEU 273 CO -0.04 0.69 -0.01 0.28 0.09 0.00 0.00 178.44 179.45 2ij3 h SER 274 N 1.18 0.58 -0.42 -0.43 0.02 -0.89 -1.39 113.55 112.20 2ij3 h SER 274 Ca 0.37 -0.32 -0.11 0.00 -0.84 0.00 0.00 61.79 60.90 2ij3 h SER 274 Cb -0.00 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 2ij3 h SER 274 CO -0.12 0.75 -0.15 -0.26 -1.14 0.00 0.00 176.83 175.92 2ij3 h PHE 275 N 0.39 1.00 -0.30 3.45 0.04 -0.57 -0.54 116.94 120.40 2ij3 h PHE 275 Ca 0.09 -0.21 0.02 0.00 2.80 0.00 0.00 57.97 60.67 2ij3 h PHE 275 Cb 0.46 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 2ij3 h PHE 275 CO 0.04 0.97 0.16 0.00 -0.60 0.00 0.00 178.31 178.87 2ij3 h ALA 276 N 1.04 0.37 -0.51 2.45 0.00 -0.81 0.45 119.26 122.24 2ij3 h ALA 276 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2ij3 h ALA 276 Cb 0.68 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2ij3 h ALA 276 CO 0.05 -0.22 0.01 1.25 0.00 0.00 0.00 179.25 180.33 2ij3 h LEU 277 N 0.32 0.88 -0.11 0.00 5.85 -1.10 -1.51 115.31 119.64 2ij3 h LEU 277 Ca 0.12 -0.30 0.04 0.00 0.84 0.00 0.00 57.88 58.58 2ij3 h LEU 277 Cb 0.03 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.76 2ij3 h LEU 277 CO -0.08 0.97 -0.45 0.22 -0.34 0.00 0.00 178.44 178.76 2ij3 h TYR 278 N 0.77 -1.29 -0.52 1.25 3.20 -0.85 -1.59 116.97 117.94 2ij3 h TYR 278 Ca 0.15 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 2ij3 h TYR 278 Cb 0.51 0.58 -0.03 0.00 1.54 0.00 0.00 36.73 39.34 2ij3 h TYR 278 CO 0.04 -0.50 0.26 0.74 -1.64 0.00 0.00 178.16 177.06 2ij3 h PHE 279 N -0.53 0.70 -0.24 -3.82 0.04 -0.69 -1.84 116.94 110.57 2ij3 h PHE 279 Ca 0.06 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 2ij3 h PHE 279 Cb 0.65 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.56 2ij3 h PHE 279 CO -0.50 0.51 0.07 -0.07 -0.60 0.00 0.00 178.31 177.72 2ij3 h LEU 280 N 0.72 0.35 -1.18 1.54 3.38 -1.07 -1.41 115.31 117.65 2ij3 h LEU 280 Ca 0.18 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 2ij3 h LEU 280 Cb 0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2ij3 h LEU 280 CO -0.03 0.47 -0.37 -0.37 0.09 0.00 0.00 178.44 178.23 2ij3 h VAL 281 N 0.21 1.08 0.00 1.22 -1.51 -1.01 -2.16 116.25 114.08 2ij3 h VAL 281 Ca 0.08 -1.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.17 2ij3 h VAL 281 Cb 0.25 1.78 0.00 0.00 -2.13 0.00 0.00 31.29 31.19 2ij3 h VAL 281 CO -0.00 0.37 -0.07 0.29 -1.23 0.00 0.00 177.57 176.92 2ij3 n LYS 282 N -3.82 0.06 -3.45 5.19 4.76 -0.71 -4.35 118.16 115.84 2ij3 n LYS 282 Ca -0.01 0.05 -0.26 0.00 -2.87 0.00 0.00 58.31 55.21 2ij3 n LYS 282 Cb 0.44 -1.57 -0.09 0.00 -1.84 0.00 0.00 35.03 31.97 2ij3 n LYS 282 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2ij3 n ASN 283 N -1.68 1.40 -0.27 4.39 3.02 -0.54 -5.00 115.26 116.58 2ij3 n ASN 283 Ca 0.06 -2.88 0.22 0.00 -0.03 0.00 0.00 54.58 51.95 2ij3 n ASN 283 Cb 0.36 -0.65 0.53 0.00 -0.61 0.00 0.00 39.78 39.42 2ij3 n ASN 283 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2ij3 h PRO 284 N 4.77 0.35 -0.18 3.52 0.11 -1.75 0.62 132.00 139.45 2ij3 h PRO 284 Ca 0.17 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.13 2ij3 h PRO 284 Cb 0.81 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.83 2ij3 h PRO 284 CO 0.58 0.23 -0.45 0.45 -0.21 0.00 0.00 178.00 178.60 2ij3 h HIS 285 N 0.36 0.52 -0.25 0.65 3.86 -1.95 -0.74 115.15 117.60 2ij3 h HIS 285 Ca 0.51 -0.16 -0.11 0.00 -1.16 0.00 0.00 60.37 59.46 2ij3 h HIS 285 Cb 1.37 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 29.73 2ij3 h HIS 285 CO -0.00 0.81 -0.27 0.28 0.86 0.00 0.00 177.93 179.60 2ij3 h VAL 286 N 0.35 1.31 -0.56 2.45 2.07 -1.23 -2.80 116.25 117.85 2ij3 h VAL 286 Ca 0.02 -1.45 0.03 0.00 0.82 0.00 0.00 66.70 66.13 2ij3 h VAL 286 Cb 0.93 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 32.33 2ij3 h VAL 286 CO 0.08 0.45 0.33 0.25 0.02 0.00 0.00 177.57 178.70 2ij3 h LEU 287 N 0.34 0.53 -0.41 2.57 5.85 -1.14 -1.14 115.31 121.92 2ij3 h LEU 287 Ca 0.04 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.79 2ij3 h LEU 287 Cb 0.84 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 2ij3 h LEU 287 CO 0.07 0.37 0.22 -0.61 -0.34 0.00 0.00 178.44 178.15 2ij3 h GLN 288 N 0.65 0.44 -0.76 1.25 4.15 -1.14 0.66 115.11 120.36 2ij3 h GLN 288 Ca 0.23 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.57 2ij3 h GLN 288 Cb 0.04 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.60 2ij3 h GLN 288 CO -0.11 0.29 0.27 -0.22 -1.93 0.00 0.00 178.83 177.14 2ij3 h LYS 289 N 0.45 1.15 -0.38 1.69 3.64 -1.19 -0.29 116.57 121.65 2ij3 h LYS 289 Ca 0.17 -0.22 -0.11 0.00 -1.27 0.00 0.00 60.65 59.22 2ij3 h LYS 289 Cb 0.04 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2ij3 h LYS 289 CO -0.10 0.95 -0.18 0.00 -2.27 0.00 0.00 179.45 177.86 2ij3 h ALA 290 N 1.18 0.53 -0.28 5.00 0.00 -0.93 -2.55 119.26 122.20 2ij3 h ALA 290 Ca 0.25 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2ij3 h ALA 290 Cb 0.26 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2ij3 h ALA 290 CO -0.01 0.47 -0.19 0.00 0.00 0.00 0.00 179.25 179.52 2ij3 h ALA 291 N 0.80 1.15 -0.64 0.00 0.00 -0.67 -1.67 119.26 118.23 2ij3 h ALA 291 Ca 0.09 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2ij3 h ALA 291 Cb 0.73 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2ij3 h ALA 291 CO 0.05 0.54 0.27 0.93 0.00 0.00 0.00 179.25 181.05 2ij3 h GLU 292 N 0.46 0.94 -0.11 0.00 5.08 -0.99 -1.84 114.58 118.13 2ij3 h GLU 292 Ca 0.08 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2ij3 h GLU 292 Cb 0.59 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 2ij3 h GLU 292 CO 0.04 0.78 0.04 1.49 -1.00 0.00 0.00 179.01 180.36 2ij3 h GLU 293 N 0.89 0.17 -0.38 2.33 4.81 -1.06 -1.75 114.58 119.58 2ij3 h GLU 293 Ca 0.21 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.46 2ij3 h GLU 293 Cb 0.18 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 2ij3 h GLU 293 CO -0.02 0.29 0.10 0.00 -0.73 0.00 0.00 179.01 178.65 2ij3 h ALA 294 N 0.87 0.43 -0.89 2.92 0.00 -1.23 0.11 119.26 121.47 2ij3 h ALA 294 Ca 0.04 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2ij3 h ALA 294 Cb 0.19 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2ij3 h ALA 294 CO -0.00 -0.30 0.58 0.00 0.00 0.00 0.00 179.25 179.53 2ij3 h ALA 295 N 1.27 1.13 -0.26 0.00 0.00 -1.28 0.12 119.26 120.24 2ij3 h ALA 295 Ca 0.18 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 2ij3 h ALA 295 Cb 0.19 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2ij3 h ALA 295 CO -0.21 0.55 -0.55 -0.09 0.00 0.00 0.00 179.25 178.94 2ij3 h ARG 296 N 1.22 0.80 0.10 0.00 2.43 -0.63 -3.36 114.38 114.93 2ij3 h ARG 296 Ca 0.33 -0.50 -0.27 0.00 -0.81 0.00 0.00 59.98 58.72 2ij3 h ARG 296 Cb -0.13 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2ij3 h ARG 296 CO -0.07 1.13 -1.39 0.28 -1.51 0.00 0.00 179.97 178.42 2ij3 h VAL 297 N 0.61 1.01 -0.99 0.20 2.07 -0.62 -3.41 116.25 115.12 2ij3 h VAL 297 Ca 0.01 -2.36 -0.73 0.00 0.82 0.00 0.00 66.70 64.44 2ij3 h VAL 297 Cb 1.14 2.66 -0.11 0.00 -1.52 0.00 0.00 31.29 33.46 2ij3 h VAL 297 CO 0.12 0.67 2.31 0.18 0.02 0.00 0.00 177.57 180.87 2ij3 n LEU 298 N -3.98 6.40 0.04 2.57 4.77 0.40 -4.70 117.00 122.51 2ij3 n LEU 298 Ca -0.26 -4.40 0.13 0.00 -0.03 0.00 0.00 56.01 51.45 2ij3 n LEU 298 Cb 0.87 -1.58 0.35 0.00 -2.33 0.00 0.00 43.42 40.74 2ij3 n LEU 298 CO 0.38 1.11 0.64 1.33 -1.33 0.00 0.00 177.39 179.52 2ij3 n VAL 299 N 4.30 0.21 -2.98 4.08 0.24 -1.26 -4.87 118.33 118.05 2ij3 n VAL 299 Ca 0.44 -0.13 -0.22 0.00 -2.04 0.00 0.00 64.34 62.39 2ij3 n VAL 299 Cb 0.39 -0.21 0.01 0.00 -1.47 0.00 0.00 33.84 32.56 2ij3 n VAL 299 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2ij3 s ASP 300 N -3.64 5.76 0.46 -1.34 1.01 -1.26 -5.01 116.67 112.65 2ij3 s ASP 300 Ca 0.10 0.18 0.19 0.00 0.71 0.00 0.00 52.55 53.74 2ij3 s ASP 300 Cb 0.16 -1.39 1.10 0.00 1.01 0.00 0.00 42.92 43.79 2ij3 s ASP 300 CO 0.64 -0.74 1.97 -0.65 0.21 0.00 0.00 175.17 176.61 2ij3 h PRO 301 N 0.40 0.00 -4.54 8.23 0.11 -1.87 -3.42 132.00 130.91 2ij3 h PRO 301 Ca -0.45 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.36 2ij3 h PRO 301 Cb 1.26 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.14 2ij3 h PRO 301 CO 0.56 0.21 -0.74 0.14 -0.21 0.00 0.00 178.00 177.96 2ij3 s VAL 302 N -4.31 0.54 0.27 3.15 -7.23 -1.26 -4.45 120.40 107.10 2ij3 s VAL 302 Ca -0.03 -0.88 -0.29 0.00 -1.81 0.00 0.00 61.98 58.96 2ij3 s VAL 302 Cb 0.14 -0.57 -0.10 0.00 0.56 0.00 0.00 36.38 36.42 2ij3 s VAL 302 CO 0.66 -0.25 1.33 -2.84 -0.31 0.00 0.00 175.10 173.69 2ij3 s PRO 303 N -1.24 4.36 0.56 4.82 0.02 -1.26 -5.01 135.00 137.25 2ij3 s PRO 303 Ca -0.07 2.17 -0.07 0.00 0.02 0.00 0.00 61.00 63.05 2ij3 s PRO 303 Cb -0.08 -3.12 -0.02 0.00 0.02 0.00 0.00 34.50 31.30 2ij3 s PRO 303 CO 0.00 -0.25 0.89 -1.54 -0.33 0.00 0.00 177.00 175.78 2ij3 s SER 304 N -0.05 6.02 0.23 2.53 1.04 -1.26 -4.98 113.70 117.22 2ij3 s SER 304 Ca 0.54 0.99 -0.07 0.00 0.48 0.00 0.00 55.95 57.89 2ij3 s SER 304 Cb -0.39 -2.12 0.35 0.00 0.10 0.00 0.00 66.02 63.95 2ij3 s SER 304 CO 0.46 -0.83 1.78 0.22 0.98 0.00 0.00 173.24 175.85 2ij3 h TYR 305 N -0.06 0.64 -0.83 5.02 3.20 -1.96 -2.58 116.97 120.39 2ij3 h TYR 305 Ca -0.46 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.43 2ij3 h TYR 305 Cb 1.22 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.27 2ij3 h TYR 305 CO 0.56 0.22 0.47 0.87 -1.64 0.00 0.00 178.16 178.65 2ij3 h LYS 306 N 0.60 1.15 -0.64 1.82 6.56 -2.00 -2.83 116.57 121.23 2ij3 h LYS 306 Ca 0.36 -0.12 -0.08 0.00 -1.06 0.00 0.00 60.65 59.75 2ij3 h LYS 306 Cb 0.38 -0.23 -0.03 0.00 -0.57 0.00 0.00 32.23 31.79 2ij3 h LYS 306 CO -0.28 0.83 0.10 1.96 -2.06 0.00 0.00 179.45 180.01 2ij3 h GLN 307 N 1.16 1.05 -0.92 3.15 4.20 -1.84 -2.34 115.11 119.57 2ij3 h GLN 307 Ca 0.30 -0.27 0.03 0.00 0.06 0.00 0.00 58.65 58.76 2ij3 h GLN 307 Cb 0.00 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 27.61 2ij3 h GLN 307 CO -0.05 0.97 0.61 0.28 -0.67 0.00 0.00 178.83 179.96 2ij3 h VAL 308 N 0.99 1.18 0.00 -0.54 2.07 -1.25 -1.60 116.25 117.09 2ij3 h VAL 308 Ca 0.20 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 2ij3 h VAL 308 Cb 0.43 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2ij3 h VAL 308 CO 0.01 0.22 -0.18 0.11 0.02 0.00 0.00 177.57 177.75 2ij3 h LYS 309 N 1.18 0.00 -0.01 1.57 1.79 -1.28 -2.21 116.57 117.61 2ij3 h LYS 309 Ca 0.36 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.83 2ij3 h LYS 309 Cb -0.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.62 2ij3 h LYS 309 CO -0.10 0.18 -0.04 1.04 -1.08 0.00 0.00 179.45 179.45 2ij3 n GLN 310 N -3.75 1.35 -2.14 3.15 1.13 -0.62 -4.53 117.38 111.97 2ij3 n GLN 310 Ca -0.02 -0.66 -0.42 0.00 -1.94 0.00 0.00 57.00 53.96 2ij3 n GLN 310 Cb 0.29 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.16 2ij3 n GLN 310 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2ij3 n LEU 311 N -0.25 6.44 -0.06 1.08 4.77 -0.83 -4.76 117.00 123.39 2ij3 n LEU 311 Ca 0.19 -4.32 -0.15 0.00 -0.03 0.00 0.00 56.01 51.70 2ij3 n LEU 311 Cb 0.30 -1.60 -0.07 0.00 -2.33 0.00 0.00 43.42 39.72 2ij3 n LEU 311 CO 0.19 1.07 0.48 0.11 -1.33 0.00 0.00 177.39 177.90 2ij3 h LYS 312 N 6.18 0.57 -0.31 3.23 1.79 -1.86 -1.88 116.57 124.29 2ij3 h LYS 312 Ca 0.47 -0.37 -0.13 0.00 -2.18 0.00 0.00 60.65 58.44 2ij3 h LYS 312 Cb 0.68 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.37 2ij3 h LYS 312 CO 1.70 0.99 -0.34 -0.92 -1.08 0.00 0.00 179.45 179.80 2ij3 h TYR 313 N 0.23 0.82 -0.74 -1.35 3.20 -1.97 -1.64 116.97 115.51 2ij3 h TYR 313 Ca 0.00 -0.22 -0.00 0.00 3.14 0.00 0.00 58.73 61.65 2ij3 h TYR 313 Cb 0.97 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.03 2ij3 h TYR 313 CO 0.09 0.94 0.45 0.28 -1.64 0.00 0.00 178.16 178.29 2ij3 h VAL 314 N 0.59 1.21 -0.91 1.81 2.07 -1.88 0.16 116.25 119.29 2ij3 h VAL 314 Ca 0.06 -0.45 0.06 0.00 0.82 0.00 0.00 66.70 67.19 2ij3 h VAL 314 Cb 0.86 0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 2ij3 h VAL 314 CO 0.07 0.22 0.58 1.23 0.02 0.00 0.00 177.57 179.69 2ij3 h GLY 315 N 1.01 1.39 1.23 2.17 0.00 -1.10 -1.53 103.07 106.24 2ij3 h GLY 315 Ca 0.27 -0.42 -0.14 0.00 0.00 0.00 0.00 47.33 47.04 2ij3 h GLY 315 CO -0.05 0.29 -0.32 -0.33 0.00 0.00 0.00 176.54 176.12 2ij3 h MET 316 N 1.04 0.86 -0.55 4.80 2.07 -0.52 -1.45 114.93 121.19 2ij3 h MET 316 Ca 0.40 -0.41 0.04 0.00 -2.07 0.00 0.00 59.70 57.66 2ij3 h MET 316 Cb 0.18 -0.01 -0.04 0.00 -1.87 0.00 0.00 31.60 29.86 2ij3 h MET 316 CO -0.18 1.06 0.30 0.28 1.07 0.00 0.00 176.91 179.44 2ij3 h VAL 317 N 0.72 0.99 -0.60 -2.22 2.07 -0.31 -1.17 116.25 115.73 2ij3 h VAL 317 Ca 0.07 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.30 2ij3 h VAL 317 Cb 0.89 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2ij3 h VAL 317 CO 0.08 0.11 -0.01 -0.07 0.02 0.00 0.00 177.57 177.70 2ij3 h LEU 318 N 0.58 1.04 -0.89 2.57 3.38 -1.10 -1.41 115.31 119.48 2ij3 h LEU 318 Ca 0.24 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 2ij3 h LEU 318 Cb 0.11 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2ij3 h LEU 318 CO -0.14 1.09 -0.02 0.78 0.09 0.00 0.00 178.44 180.24 2ij3 h ASN 319 N 0.96 0.77 0.82 -0.43 2.35 -0.98 -1.43 115.58 117.64 2ij3 h ASN 319 Ca 0.17 -0.19 -0.14 0.00 -0.55 0.00 0.00 56.30 55.59 2ij3 h ASN 319 Cb 0.57 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 2ij3 h ASN 319 CO 0.03 0.85 -0.65 -0.08 -1.65 0.00 0.00 177.43 175.93 2ij3 h GLU 320 N 0.74 0.00 -0.41 0.81 4.57 -1.01 0.18 114.58 119.47 2ij3 h GLU 320 Ca 0.14 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.24 2ij3 h GLU 320 Cb 0.47 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 2ij3 h GLU 320 CO 0.02 0.65 -0.05 0.00 -1.18 0.00 0.00 179.01 178.46 2ij3 h ALA 321 N 1.35 0.56 0.00 2.92 0.00 -1.07 -2.61 119.26 120.41 2ij3 h ALA 321 Ca -0.01 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 2ij3 h ALA 321 Cb 1.24 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2ij3 h ALA 321 CO 0.08 0.39 -0.28 -0.07 0.00 0.00 0.00 179.25 179.37 2ij3 h LEU 322 N 0.58 0.00 0.49 0.00 3.38 -1.00 -0.25 115.31 118.52 2ij3 h LEU 322 Ca 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2ij3 h LEU 322 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2ij3 h LEU 322 CO 0.03 0.28 -0.24 -0.09 0.09 0.00 0.00 178.44 178.52 2ij3 h ARG 323 N 0.00 -0.64 -0.02 1.13 2.43 -0.50 -2.63 114.38 114.16 2ij3 h ARG 323 Ca -0.00 0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2ij3 h ARG 323 Cb 0.52 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.21 2ij3 h ARG 323 CO 0.04 -0.34 -0.00 -0.07 -1.51 0.00 0.00 179.97 178.08 2ij3 h LEU 324 N -0.87 0.04 -6.49 3.80 3.38 -1.37 -3.39 115.31 110.41 2ij3 h LEU 324 Ca -0.07 -0.37 -0.60 0.00 0.09 0.00 0.00 57.88 56.94 2ij3 h LEU 324 Cb 0.59 -0.01 -0.40 0.00 0.09 0.00 0.00 40.66 40.93 2ij3 h LEU 324 CO 0.11 0.40 -0.82 0.79 0.09 0.00 0.00 178.44 179.01 2ij3 n TRP 325 N -4.89 1.16 -1.68 1.13 7.02 -0.11 -4.83 117.44 115.24 2ij3 n TRP 325 Ca -0.08 -3.79 -0.42 0.00 -1.02 0.00 0.00 57.50 52.19 2ij3 n TRP 325 Cb 0.20 -0.25 -0.03 0.00 -2.42 0.00 0.00 31.31 28.82 2ij3 n TRP 325 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 2ij3 s PRO 326 N -1.04 4.14 0.47 -0.99 0.04 -0.99 -4.60 135.00 132.04 2ij3 s PRO 326 Ca 0.32 2.61 0.30 0.00 0.04 0.00 0.00 61.00 64.26 2ij3 s PRO 326 Cb 0.06 -4.04 1.05 0.00 0.04 0.00 0.00 34.50 31.61 2ij3 s PRO 326 CO -0.14 -0.93 1.85 1.79 0.04 0.00 0.00 177.00 179.61 2ij3 h THR 327 N 5.43 0.00 -3.64 1.26 1.35 -1.87 -3.07 112.91 112.37 2ij3 h THR 327 Ca -0.49 -0.59 -0.74 0.00 -0.55 0.00 0.00 66.41 64.04 2ij3 h THR 327 Cb 1.23 1.56 -0.31 0.00 -1.73 0.00 0.00 68.15 68.90 2ij3 h THR 327 CO 0.94 0.00 -0.08 0.00 -0.25 0.00 0.00 175.52 176.13 2ij3 s ALA 328 N -3.49 3.96 -1.64 6.62 0.00 -1.26 -1.15 121.76 124.79 2ij3 s ALA 328 Ca 0.03 -3.41 0.31 0.00 0.00 0.00 0.00 51.96 48.89 2ij3 s ALA 328 Cb 0.08 -3.09 1.60 0.00 0.00 0.00 0.00 23.12 21.71 2ij3 s ALA 328 CO 0.56 -2.19 2.08 -0.35 0.00 0.00 0.00 175.76 175.86 2ij3 n PRO 329 N 3.46 0.65 -3.78 0.00 -0.04 -1.16 -4.78 135.00 129.34 2ij3 n PRO 329 Ca 0.13 -0.04 -0.13 0.00 -0.04 0.00 0.00 63.50 63.42 2ij3 n PRO 329 Cb 0.41 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.28 2ij3 n PRO 329 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ij3 s ALA 330 N -2.38 -0.68 0.06 0.55 0.00 -1.26 -1.55 121.76 116.50 2ij3 s ALA 330 Ca 0.35 0.38 0.02 0.00 0.00 0.00 0.00 51.96 52.70 2ij3 s ALA 330 Cb 0.21 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.22 2ij3 s ALA 330 CO 0.43 -0.22 -0.06 -0.59 0.00 0.00 0.00 175.76 175.32 2ij3 s PHE 331 N -0.91 0.71 0.01 0.00 -0.12 -1.17 -5.00 117.98 111.51 2ij3 s PHE 331 Ca -0.10 -0.73 0.06 0.00 -0.05 0.00 0.00 56.93 56.12 2ij3 s PHE 331 Cb -0.05 -0.43 -0.03 0.00 -0.63 0.00 0.00 43.02 41.88 2ij3 s PHE 331 CO 0.03 -0.15 -0.17 0.45 -0.05 0.00 0.00 175.22 175.33 2ij3 s SER 332 N -2.29 3.85 0.17 1.98 0.15 -1.26 -1.03 113.70 115.26 2ij3 s SER 332 Ca 0.00 -0.36 0.06 0.00 0.70 0.00 0.00 55.95 56.35 2ij3 s SER 332 Cb -0.02 -0.67 -0.04 0.00 -1.71 0.00 0.00 66.02 63.57 2ij3 s SER 332 CO -0.03 0.28 -0.13 -0.76 1.20 0.00 0.00 173.24 173.81 2ij3 s LEU 333 N -1.22 2.53 0.03 3.45 1.43 0.27 -0.56 118.68 124.60 2ij3 s LEU 333 Ca 0.14 -0.99 0.04 0.00 -1.03 0.00 0.00 54.13 52.29 2ij3 s LEU 333 Cb -0.11 -0.54 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 2ij3 s LEU 333 CO 0.04 -0.23 -0.12 -0.72 0.23 0.00 0.00 176.35 175.55 2ij3 s TYR 334 N -2.98 1.05 -0.07 0.29 -0.85 -0.41 -0.79 117.35 113.59 2ij3 s TYR 334 Ca 0.18 -0.33 -0.30 0.00 -0.52 0.00 0.00 57.07 56.11 2ij3 s TYR 334 Cb -0.00 -0.63 -0.04 0.00 0.38 0.00 0.00 41.96 41.66 2ij3 s TYR 334 CO 0.04 0.01 1.50 0.00 -1.52 0.00 0.00 175.55 175.58 2ij3 s ALA 335 N -0.80 3.63 0.29 9.51 0.00 -0.55 -2.06 121.76 131.79 2ij3 s ALA 335 Ca 0.00 0.80 0.05 0.00 0.00 0.00 0.00 51.96 52.81 2ij3 s ALA 335 Cb -0.07 -3.69 0.46 0.00 0.00 0.00 0.00 23.12 19.82 2ij3 s ALA 335 CO 0.01 -1.25 1.72 0.87 0.00 0.00 0.00 175.76 177.11 2ij3 h LYS 336 N 8.85 0.33 -4.26 0.00 1.57 -1.43 0.22 116.57 121.86 2ij3 h LYS 336 Ca -0.35 -0.14 -0.15 0.00 -1.87 0.00 0.00 60.65 58.13 2ij3 h LYS 336 Cb 1.16 -0.01 -0.14 0.00 0.08 0.00 0.00 32.23 33.31 2ij3 h LYS 336 CO 0.95 0.63 -0.57 -1.21 -0.57 0.00 0.00 179.45 178.68 2ij3 s GLU 337 N -4.32 0.93 0.17 3.15 0.41 -1.26 -4.76 118.70 113.03 2ij3 s GLU 337 Ca -0.05 -1.33 -0.33 0.00 -0.41 0.00 0.00 54.97 52.84 2ij3 s GLU 337 Cb 0.14 0.27 -0.15 0.00 -1.78 0.00 0.00 34.13 32.60 2ij3 s GLU 337 CO 0.78 -0.28 1.22 -0.25 -0.49 0.00 0.00 175.26 176.24 2ij3 n ASP 338 N -0.09 1.58 -3.88 -0.19 8.00 -1.26 -4.08 116.55 116.64 2ij3 n ASP 338 Ca -0.07 1.14 -0.08 0.00 0.71 0.00 0.00 54.79 56.48 2ij3 n ASP 338 Cb 0.63 -1.24 -0.03 0.00 -0.02 0.00 0.00 41.12 40.45 2ij3 n ASP 338 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2ij3 s THR 339 N -0.10 0.00 -0.14 -3.53 -1.32 -0.69 -4.91 115.64 104.97 2ij3 s THR 339 Ca 0.74 -1.07 0.02 0.00 -1.21 0.00 0.00 61.69 60.16 2ij3 s THR 339 Cb -0.83 -1.98 0.01 0.00 -1.51 0.00 0.00 72.50 68.19 2ij3 s THR 339 CO 0.51 -0.01 -0.19 -0.69 -2.21 0.00 0.00 174.62 172.03 2ij3 s VAL 340 N -3.94 1.83 -0.13 5.08 1.01 -1.26 -0.12 120.40 122.86 2ij3 s VAL 340 Ca 0.14 -0.82 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 2ij3 s VAL 340 Cb -0.04 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2ij3 s VAL 340 CO 0.06 0.50 0.53 -0.22 0.00 0.00 0.00 175.10 175.97 2ij3 s LEU 341 N 1.05 4.25 -1.28 3.92 2.96 0.73 -4.14 118.68 126.15 2ij3 s LEU 341 Ca -0.03 0.85 0.00 0.00 -0.22 0.00 0.00 54.13 54.73 2ij3 s LEU 341 Cb -0.15 -2.77 0.00 0.00 0.50 0.00 0.00 46.19 43.77 2ij3 s LEU 341 CO -0.05 -0.07 0.00 0.61 -1.32 0.00 0.00 176.35 175.52 2ij3 n GLY 342 N 3.39 1.19 2.46 7.98 0.00 -1.26 -1.30 105.19 117.65 2ij3 n GLY 342 Ca -0.05 -0.06 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 2ij3 n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ij3 n GLY 343 N -0.12 0.60 0.00 -0.02 0.00 -1.26 -4.81 105.19 99.58 2ij3 n GLY 343 Ca -0.12 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2ij3 n GLY 343 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ij3 n GLU 344 N -1.49 0.89 -3.90 1.61 1.02 -0.54 -3.82 120.64 114.41 2ij3 n GLU 344 Ca -0.04 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.76 2ij3 n GLU 344 Cb 0.31 -0.67 -0.13 0.00 -0.02 0.00 0.00 31.44 30.93 2ij3 n GLU 344 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2ij3 s TYR 345 N -1.33 3.57 0.21 -0.32 2.02 -0.42 -0.88 117.35 120.20 2ij3 s TYR 345 Ca 0.00 -2.50 -0.30 0.00 -0.37 0.00 0.00 57.07 53.89 2ij3 s TYR 345 Cb 0.00 -2.85 -0.10 0.00 -0.40 0.00 0.00 41.96 38.62 2ij3 s TYR 345 CO 0.00 -0.93 1.43 -2.14 -1.57 0.00 0.00 175.55 172.34 2ij3 s PRO 346 N 1.08 4.29 0.01 -1.71 0.02 -1.26 -0.20 135.00 137.23 2ij3 s PRO 346 Ca 0.06 2.24 0.07 0.00 0.02 0.00 0.00 61.00 63.38 2ij3 s PRO 346 Cb -0.21 -3.15 -0.02 0.00 0.02 0.00 0.00 34.50 31.14 2ij3 s PRO 346 CO -0.05 -0.42 -0.21 -0.51 -0.33 0.00 0.00 177.00 175.49 2ij3 s LEU 347 N 0.08 2.09 0.23 -5.54 1.43 0.83 -4.93 118.68 112.87 2ij3 s LEU 347 Ca 0.61 -0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 53.17 2ij3 s LEU 347 Cb -0.40 -1.03 -0.07 0.00 0.03 0.00 0.00 46.19 44.71 2ij3 s LEU 347 CO 0.39 0.22 0.57 -1.61 0.23 0.00 0.00 176.35 176.14 2ij3 s GLU 348 N -0.76 3.85 -0.15 1.70 2.02 -1.26 -1.70 118.70 122.40 2ij3 s GLU 348 Ca 0.08 0.34 -0.42 0.00 0.02 0.00 0.00 54.97 55.00 2ij3 s GLU 348 Cb -0.08 -2.67 -0.19 0.00 0.10 0.00 0.00 34.13 31.29 2ij3 s GLU 348 CO 0.00 0.32 1.29 1.17 0.02 0.00 0.00 175.26 178.07 2ij3 n LYS 349 N -0.02 0.19 -0.00 1.61 4.81 -1.26 -1.13 118.16 122.36 2ij3 n LYS 349 Ca -0.00 0.07 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2ij3 n LYS 349 Cb 0.52 -1.59 0.00 0.00 0.02 0.00 0.00 35.03 33.98 2ij3 n LYS 349 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ij3 n GLY 350 N 2.48 1.59 3.76 3.14 0.00 0.79 -4.94 105.19 112.01 2ij3 n GLY 350 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 2ij3 n GLY 350 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ij3 n ASP 351 N 0.00 3.59 -4.85 1.61 8.00 -0.28 -4.63 116.55 120.00 2ij3 n ASP 351 Ca 0.00 1.22 -0.34 0.00 0.71 0.00 0.00 54.79 56.37 2ij3 n ASP 351 Cb 0.00 -1.60 -0.06 0.00 -0.02 0.00 0.00 41.12 39.44 2ij3 n ASP 351 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2ij3 s GLU 352 N -2.09 3.30 0.01 -1.24 2.02 -1.26 -1.48 118.70 117.96 2ij3 s GLU 352 Ca 0.54 -0.32 0.05 0.00 0.02 0.00 0.00 54.97 55.27 2ij3 s GLU 352 Cb -0.49 -3.03 -0.02 0.00 0.10 0.00 0.00 34.13 30.69 2ij3 s GLU 352 CO 0.63 0.70 -0.16 -0.51 0.02 0.00 0.00 175.26 175.94 2ij3 s LEU 353 N -1.54 2.09 -0.12 1.80 1.43 0.03 -3.28 118.68 119.09 2ij3 s LEU 353 Ca 0.21 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 2ij3 s LEU 353 Cb -0.12 -0.79 -0.01 0.00 0.03 0.00 0.00 46.19 45.30 2ij3 s LEU 353 CO 0.12 0.15 -0.18 -0.04 0.23 0.00 0.00 176.35 176.63 2ij3 s MET 354 N -0.69 3.22 -0.36 1.70 -1.94 0.94 -0.57 119.30 121.61 2ij3 s MET 354 Ca 0.05 -0.78 -0.22 0.00 -1.71 0.00 0.00 55.69 53.04 2ij3 s MET 354 Cb -0.07 -2.47 0.01 0.00 2.01 0.00 0.00 34.83 34.30 2ij3 s MET 354 CO 0.00 0.19 0.70 0.08 -0.01 0.00 0.00 175.02 175.98 2ij3 s VAL 355 N 0.36 4.83 -1.01 -6.03 1.01 -0.20 -0.83 120.40 118.54 2ij3 s VAL 355 Ca -0.15 0.71 -0.19 0.00 0.00 0.00 0.00 61.98 62.36 2ij3 s VAL 355 Cb -0.17 -4.13 0.11 0.00 0.00 0.00 0.00 36.38 32.20 2ij3 s VAL 355 CO 0.07 -0.36 1.28 -0.22 0.00 0.00 0.00 175.10 175.87 2ij3 s LEU 356 N 2.86 4.61 0.19 3.92 2.96 -0.67 -3.04 118.68 129.51 2ij3 s LEU 356 Ca 0.27 -2.04 -0.11 0.00 -0.22 0.00 0.00 54.13 52.03 2ij3 s LEU 356 Cb -0.14 -2.45 0.12 0.00 0.50 0.00 0.00 46.19 44.22 2ij3 s LEU 356 CO 0.15 -1.14 1.81 0.40 -1.32 0.00 0.00 176.35 176.25 2ij3 h ILE 357 N 5.91 1.22 0.00 6.68 2.04 -1.58 -0.83 117.51 130.94 2ij3 h ILE 357 Ca 0.20 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 2ij3 h ILE 357 Cb 0.99 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2ij3 h ILE 357 CO 1.22 0.24 -0.14 -0.65 0.00 0.00 0.00 178.15 178.82 2ij3 h PRO 358 N 0.96 0.00 0.07 2.37 0.11 -1.87 -0.71 132.00 132.93 2ij3 h PRO 358 Ca 0.24 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.18 2ij3 h PRO 358 Cb 0.05 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.18 2ij3 h PRO 358 CO -0.04 0.14 -0.71 0.37 -0.21 0.00 0.00 178.00 177.55 2ij3 h GLN 359 N 0.00 0.36 -0.74 1.05 5.75 -1.68 -3.13 115.11 116.74 2ij3 h GLN 359 Ca -0.00 -0.48 0.16 0.00 -0.15 0.00 0.00 58.65 58.18 2ij3 h GLN 359 Cb 0.30 0.16 -0.12 0.00 1.07 0.00 0.00 27.48 28.89 2ij3 h GLN 359 CO 0.02 1.17 0.12 1.25 -2.65 0.00 0.00 178.83 178.74 2ij3 h LEU 360 N -0.21 -0.10 0.00 -2.39 5.85 -0.74 -0.35 115.31 117.36 2ij3 h LEU 360 Ca -0.11 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2ij3 h LEU 360 Cb 1.47 0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.74 2ij3 h LEU 360 CO 0.14 -0.09 0.00 1.41 -0.34 0.00 0.00 178.44 179.56 2ij3 n HIS 361 N -5.22 0.00 -0.80 1.25 8.25 -0.31 -1.79 115.22 116.60 2ij3 n HIS 361 Ca 0.14 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.68 2ij3 n HIS 361 Cb 0.47 -0.06 0.16 0.00 1.12 0.00 0.00 29.99 31.68 2ij3 n HIS 361 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ij3 n ARG 362 N -1.06 2.25 -1.88 -0.41 1.74 -0.15 -4.86 116.66 112.29 2ij3 n ARG 362 Ca 0.12 -2.46 -0.41 0.00 -0.77 0.00 0.00 57.85 54.33 2ij3 n ARG 362 Cb 0.08 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 29.96 2ij3 n ARG 362 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2ij3 s ASP 363 N -2.10 5.40 0.53 0.55 -1.08 -0.74 -4.86 116.67 114.37 2ij3 s ASP 363 Ca 0.30 1.09 0.27 0.00 -0.52 0.00 0.00 52.55 53.69 2ij3 s ASP 363 Cb 0.24 -2.52 1.51 0.00 -1.46 0.00 0.00 42.92 40.69 2ij3 s ASP 363 CO 0.06 -2.14 2.11 0.11 0.52 0.00 0.00 175.17 175.84 2ij3 h LYS 364 N 14.96 0.00 0.00 4.34 1.57 -1.91 -0.88 116.57 134.64 2ij3 h LYS 364 Ca -0.31 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.46 2ij3 h LYS 364 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.50 2ij3 h LYS 364 CO 1.09 0.09 -0.07 1.79 -0.57 0.00 0.00 179.45 181.79 2ij3 h THR 365 N 0.00 0.25 0.00 -0.16 1.35 -1.89 -1.15 112.91 111.31 2ij3 h THR 365 Ca -0.00 -0.54 -0.38 0.00 -0.55 0.00 0.00 66.41 64.93 2ij3 h THR 365 Cb 0.25 1.43 -0.06 0.00 -1.73 0.00 0.00 68.15 68.04 2ij3 h THR 365 CO 0.01 0.07 -2.20 -0.38 -0.25 0.00 0.00 175.52 172.78 2ij3 n ILE 366 N -3.29 1.53 0.76 6.82 2.08 -0.68 -4.72 119.36 121.86 2ij3 n ILE 366 Ca -0.01 -0.28 0.11 0.00 0.56 0.00 0.00 62.75 63.14 2ij3 n ILE 366 Cb 0.27 -1.95 0.05 0.00 -0.75 0.00 0.00 39.64 37.25 2ij3 n ILE 366 CO 0.00 0.00 0.00 0.79 0.56 0.00 0.00 176.55 177.90 2ij3 n TRP 367 N -4.30 0.14 -0.51 1.39 7.02 -0.42 -5.01 117.44 115.74 2ij3 n TRP 367 Ca -0.47 0.04 0.00 0.00 -1.02 0.00 0.00 57.50 56.05 2ij3 n TRP 367 Cb 0.82 -0.30 0.00 0.00 -2.42 0.00 0.00 31.31 29.41 2ij3 n TRP 367 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2ij3 n GLY 368 N 1.43 -3.01 0.14 6.99 0.00 -0.44 -4.67 105.19 105.63 2ij3 n GLY 368 Ca 0.03 -1.87 -0.01 0.00 0.00 0.00 0.00 46.02 44.17 2ij3 n GLY 368 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2ij3 h ASP 369 N 0.00 0.00 -0.10 1.61 3.04 -1.97 -3.35 116.42 115.65 2ij3 h ASP 369 Ca 0.00 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 53.73 2ij3 h ASP 369 Cb 0.00 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.26 2ij3 h ASP 369 CO 0.00 0.60 0.08 -0.90 -2.04 0.00 0.00 179.24 176.98 2ij3 n ASP 370 N -3.75 4.66 0.30 4.15 5.75 -1.26 -4.66 116.55 121.74 2ij3 n ASP 370 Ca -0.01 -2.40 0.16 0.00 -0.01 0.00 0.00 54.79 52.52 2ij3 n ASP 370 Cb 0.62 -0.90 0.93 0.00 -1.03 0.00 0.00 41.12 40.73 2ij3 n ASP 370 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 2ij3 h VAL 371 N 0.67 0.48 0.00 2.12 -1.51 -1.88 -0.46 116.25 115.67 2ij3 h VAL 371 Ca 0.06 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2ij3 h VAL 371 Cb 1.06 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 2ij3 h VAL 371 CO 0.14 0.01 -0.27 -0.62 -1.23 0.00 0.00 177.57 175.61 2ij3 n GLU 372 N -3.75 0.23 -2.56 5.19 -0.58 -1.26 -4.88 120.64 113.03 2ij3 n GLU 372 Ca -0.03 0.13 -0.40 0.00 -0.42 0.00 0.00 57.16 56.44 2ij3 n GLU 372 Cb 0.10 -1.71 -0.05 0.00 -0.57 0.00 0.00 31.44 29.21 2ij3 n GLU 372 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2ij3 s GLU 373 N -3.11 4.69 -0.67 3.49 0.41 -0.18 -4.98 118.70 118.34 2ij3 s GLU 373 Ca 0.09 1.70 -0.23 0.00 -0.41 0.00 0.00 54.97 56.11 2ij3 s GLU 373 Cb 0.14 -3.24 0.06 0.00 -1.78 0.00 0.00 34.13 29.31 2ij3 s GLU 373 CO 0.64 0.26 1.03 0.12 -0.49 0.00 0.00 175.26 176.82 2ij3 s PHE 374 N -0.91 2.60 -0.40 1.61 5.36 -1.26 -4.96 117.98 120.01 2ij3 s PHE 374 Ca 0.45 -0.44 0.01 0.00 -0.96 0.00 0.00 56.93 55.99 2ij3 s PHE 374 Cb -0.30 -4.36 0.13 0.00 -0.34 0.00 0.00 43.02 38.16 2ij3 s PHE 374 CO 0.37 -1.73 0.22 0.50 -1.46 0.00 0.00 175.22 173.12 2ij3 s ARG 375 N 4.40 1.02 0.58 10.12 3.52 -1.26 -4.99 118.95 132.35 2ij3 s ARG 375 Ca 0.25 -1.73 0.28 0.00 -0.13 0.00 0.00 55.73 54.40 2ij3 s ARG 375 Cb -0.15 -1.99 1.71 0.00 -1.56 0.00 0.00 34.95 32.96 2ij3 s ARG 375 CO 0.11 -1.16 2.18 -1.35 -0.81 0.00 0.00 175.30 174.27 2ij3 h PRO 376 N 6.91 0.00 -0.02 5.12 0.11 -1.93 -2.02 132.00 140.16 2ij3 h PRO 376 Ca 0.00 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.12 2ij3 h PRO 376 Cb 0.95 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 2ij3 h PRO 376 CO 0.41 0.00 0.25 0.93 -0.21 0.00 0.00 178.00 179.38 2ij3 h GLU 377 N 0.00 0.00 -0.78 1.05 3.07 -1.94 -0.09 114.58 115.89 2ij3 h GLU 377 Ca 0.04 0.00 0.23 0.00 -0.50 0.00 0.00 59.36 59.13 2ij3 h GLU 377 Cb 0.22 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 2ij3 h GLU 377 CO -0.00 0.00 0.67 0.00 -1.40 0.00 0.00 179.01 178.28 2ij3 h ARG 378 N 0.00 0.00 -0.52 2.33 3.08 -1.77 -2.21 114.38 115.29 2ij3 h ARG 378 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ij3 h ARG 378 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2ij3 h ARG 378 CO -0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 2ij3 n PHE 379 N -3.92 1.10 -0.35 3.04 3.72 -0.05 -4.58 117.46 116.42 2ij3 n PHE 379 Ca 0.16 -0.62 0.04 0.00 -0.05 0.00 0.00 57.45 56.98 2ij3 n PHE 379 Cb 0.95 -0.18 0.19 0.00 -0.94 0.00 0.00 39.48 39.50 2ij3 n PHE 379 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2ij3 h GLU 380 N 3.21 1.00 -3.07 -1.08 5.08 -1.56 -3.31 114.58 114.85 2ij3 h GLU 380 Ca 0.00 -0.06 -0.62 0.00 -1.00 0.00 0.00 59.36 57.68 2ij3 h GLU 380 Cb 1.23 -0.22 -0.41 0.00 0.50 0.00 0.00 28.75 29.85 2ij3 h GLU 380 CO 0.15 0.66 -0.67 1.21 -1.00 0.00 0.00 179.01 179.36 2ij3 s ASN 381 N -5.76 4.03 0.50 1.42 2.47 -1.26 -4.99 114.94 111.35 2ij3 s ASN 381 Ca -0.12 -3.23 0.17 0.00 0.42 0.00 0.00 52.86 50.10 2ij3 s ASN 381 Cb 0.21 -1.36 1.23 0.00 -1.45 0.00 0.00 41.25 39.88 2ij3 s ASN 381 CO 0.80 -0.18 2.10 -0.65 -3.72 0.00 0.00 177.10 175.45 2ij3 h PRO 382 N 6.07 0.09 0.00 0.43 0.11 -1.89 -2.33 132.00 134.48 2ij3 h PRO 382 Ca 0.06 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 2ij3 h PRO 382 Cb 0.85 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 2ij3 h PRO 382 CO 0.61 0.06 -0.03 0.66 -0.21 0.00 0.00 178.00 179.09 2ij3 h SER 383 N 0.09 0.00 1.59 -2.05 4.64 -1.94 -2.57 113.55 113.30 2ij3 h SER 383 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2ij3 h SER 383 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2ij3 h SER 383 CO -0.01 0.03 -0.15 0.00 -0.87 0.00 0.00 176.83 175.83 2ij3 h ALA 384 N 1.97 0.91 -2.45 5.18 0.00 -1.85 -3.45 119.26 119.57 2ij3 h ALA 384 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 2ij3 h ALA 384 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2ij3 h ALA 384 CO 0.00 0.00 0.51 0.42 0.00 0.00 0.00 179.25 180.18 2ij3 s ILE 385 N -3.18 4.31 0.58 0.00 1.01 -0.97 -4.98 121.20 117.96 2ij3 s ILE 385 Ca 0.08 1.65 -0.20 0.00 0.00 0.00 0.00 60.65 62.18 2ij3 s ILE 385 Cb 0.09 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.45 2ij3 s ILE 385 CO 0.66 0.12 1.11 -2.65 0.00 0.00 0.00 174.94 174.17 2ij3 n PRO 386 N 4.00 1.16 -2.25 2.79 -0.02 -1.26 -4.92 135.00 134.50 2ij3 n PRO 386 Ca 0.08 0.44 -0.36 0.00 -2.02 0.00 0.00 63.50 61.64 2ij3 n PRO 386 Cb 0.48 -2.30 -0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2ij3 n PRO 386 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2ij3 s GLN 387 N -2.80 3.56 0.00 -0.52 -2.07 -1.26 -2.86 119.66 113.72 2ij3 s GLN 387 Ca 0.75 1.71 0.00 0.00 -1.82 0.00 0.00 55.36 55.99 2ij3 s GLN 387 Cb -0.43 -2.22 0.00 0.00 -1.09 0.00 0.00 33.01 29.27 2ij3 s GLN 387 CO 0.48 -0.70 0.00 0.72 -1.32 0.00 0.00 175.29 174.47 2ij3 n HIS 388 N -0.87 0.00 0.10 9.60 8.25 -1.26 -4.87 115.22 126.17 2ij3 n HIS 388 Ca 0.09 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.50 2ij3 n HIS 388 Cb 0.49 -0.79 0.03 0.00 1.12 0.00 0.00 29.99 30.85 2ij3 n HIS 388 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ij3 h ALA 389 N 0.00 0.66 -3.63 -1.41 0.00 -1.87 -3.43 119.26 109.58 2ij3 h ALA 389 Ca 0.00 -0.71 -0.62 0.00 0.00 0.00 0.00 54.91 53.58 2ij3 h ALA 389 Cb 0.20 -0.11 -0.38 0.00 0.00 0.00 0.00 17.79 17.50 2ij3 h ALA 389 CO 0.00 0.95 -0.77 0.12 0.00 0.00 0.00 179.25 179.55 2ij3 s PHE 390 N -3.24 2.68 -0.33 0.00 5.36 -1.26 -4.53 117.98 116.66 2ij3 s PHE 390 Ca -0.01 -2.05 0.15 0.00 -0.96 0.00 0.00 56.93 54.06 2ij3 s PHE 390 Cb 0.11 -1.87 0.46 0.00 -0.34 0.00 0.00 43.02 41.39 2ij3 s PHE 390 CO 0.80 -0.83 1.06 1.63 -1.46 0.00 0.00 175.22 176.42 2ij3 n LYS 391 N 4.58 2.12 0.19 10.12 5.02 -1.26 -4.87 118.16 134.07 2ij3 n LYS 391 Ca -0.09 -3.71 0.14 0.00 -2.02 0.00 0.00 58.31 52.63 2ij3 n LYS 391 Cb 0.43 -1.70 0.60 0.00 -0.02 0.00 0.00 35.03 34.34 2ij3 n LYS 391 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2ij3 h PRO 392 N 2.69 0.00 -0.33 1.97 0.13 -1.95 -2.64 132.00 131.87 2ij3 h PRO 392 Ca 0.04 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.10 2ij3 h PRO 392 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 2ij3 h PRO 392 CO 0.53 0.00 0.01 1.19 -0.23 0.00 0.00 178.00 179.50 2ij3 n PHE 393 N -2.54 1.13 -4.33 1.56 3.72 -1.26 -4.75 117.46 111.00 2ij3 n PHE 393 Ca 0.01 -1.11 0.00 0.00 -0.05 0.00 0.00 57.45 56.30 2ij3 n PHE 393 Cb 0.23 -0.40 0.00 0.00 -0.94 0.00 0.00 39.48 38.37 2ij3 n PHE 393 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ij3 n GLY 394 N -0.67 -0.07 2.88 1.37 0.00 -1.00 -0.26 105.19 107.44 2ij3 n GLY 394 Ca 0.27 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 2ij3 n GLY 394 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ij3 s ASN 395 N -4.00 -0.02 0.70 1.61 2.47 -1.26 -4.84 114.94 109.60 2ij3 s ASN 395 Ca 0.00 0.08 0.00 0.00 0.42 0.00 0.00 52.86 53.36 2ij3 s ASN 395 Cb 0.00 0.05 0.00 0.00 -1.45 0.00 0.00 41.25 39.85 2ij3 s ASN 395 CO 0.00 -0.05 0.00 0.61 -3.72 0.00 0.00 177.10 173.94 2ij3 n GLY 396 N 3.40 1.62 0.18 1.21 0.00 -1.26 -2.16 105.19 108.17 2ij3 n GLY 396 Ca -0.17 -0.62 0.14 0.00 0.00 0.00 0.00 46.02 45.37 2ij3 n GLY 396 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2ij3 h GLN 397 N 0.00 0.00 -0.64 1.61 3.07 -2.00 -2.03 115.11 115.12 2ij3 h GLN 397 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2ij3 h GLN 397 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 2ij3 h GLN 397 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 178.83 179.46 2ij3 n ARG 398 N -2.49 3.78 -1.41 0.06 5.12 -0.97 -4.97 116.66 115.78 2ij3 n ARG 398 Ca 0.01 -2.53 -0.29 0.00 -1.93 0.00 0.00 57.85 53.11 2ij3 n ARG 398 Cb 0.24 -1.97 0.14 0.00 -1.16 0.00 0.00 32.46 29.71 2ij3 n ARG 398 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2ij3 s ALA 399 N -2.12 1.62 -0.16 7.54 0.00 -0.77 -4.39 121.76 123.47 2ij3 s ALA 399 Ca 0.45 -0.37 -0.29 0.00 0.00 0.00 0.00 51.96 51.75 2ij3 s ALA 399 Cb 0.31 -3.09 -0.06 0.00 0.00 0.00 0.00 23.12 20.29 2ij3 s ALA 399 CO 0.17 -2.33 2.14 0.00 0.00 0.00 0.00 175.76 175.74 2ij3 h ILE 401 N 6.78 0.33 -0.16 0.00 2.10 -1.91 -2.94 117.51 121.71 2ij3 h ILE 401 Ca -0.43 -0.66 0.00 0.00 1.08 0.00 0.00 64.86 64.86 2ij3 h ILE 401 Cb 1.24 1.49 0.00 0.00 -1.09 0.00 0.00 36.82 38.46 2ij3 h ILE 401 CO 0.96 0.10 0.00 0.61 -1.08 0.00 0.00 178.15 178.74 2ij3 n GLY 402 N -0.24 0.04 0.16 8.18 0.00 -1.26 -4.54 105.19 107.54 2ij3 n GLY 402 Ca -0.01 -0.33 -0.05 0.00 0.00 0.00 0.00 46.02 45.64 2ij3 n GLY 402 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2ij3 h GLN 403 N 1.63 0.14 -0.53 1.61 4.15 -1.86 0.10 115.11 120.34 2ij3 h GLN 403 Ca 0.00 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 2ij3 h GLN 403 Cb 0.36 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 2ij3 h GLN 403 CO 0.00 0.09 0.07 1.96 -1.93 0.00 0.00 178.83 179.02 2ij3 h GLN 404 N 0.14 0.89 0.20 1.69 7.50 -1.80 -1.29 115.11 122.44 2ij3 h GLN 404 Ca 0.19 -0.25 0.01 0.00 0.50 0.00 0.00 58.65 59.10 2ij3 h GLN 404 Cb 0.25 -0.10 -0.02 0.00 0.05 0.00 0.00 27.48 27.66 2ij3 h GLN 404 CO -0.29 0.88 -0.22 0.35 -1.50 0.00 0.00 178.83 178.05 2ij3 h PHE 405 N 0.78 -0.57 -0.37 2.96 3.57 -1.65 0.02 116.94 121.68 2ij3 h PHE 405 Ca 0.16 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.69 2ij3 h PHE 405 Cb 0.43 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 2ij3 h PHE 405 CO 0.03 -0.32 0.20 0.00 -2.23 0.00 0.00 178.31 175.99 2ij3 h ALA 406 N 0.27 0.45 -0.04 2.41 0.00 -0.69 -0.60 119.26 121.05 2ij3 h ALA 406 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2ij3 h ALA 406 Cb 0.44 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2ij3 h ALA 406 CO -0.06 -0.15 -0.61 -0.07 0.00 0.00 0.00 179.25 178.35 2ij3 h LEU 407 N 0.41 0.17 -0.15 0.00 3.38 -1.19 0.05 115.31 117.98 2ij3 h LEU 407 Ca 0.15 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2ij3 h LEU 407 Cb 0.03 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2ij3 h LEU 407 CO -0.08 0.74 -0.07 -0.74 0.09 0.00 0.00 178.44 178.37 2ij3 h HIS 408 N 0.11 0.36 0.18 1.13 2.76 -0.73 -0.80 115.15 118.16 2ij3 h HIS 408 Ca -0.01 -0.09 0.01 0.00 -2.20 0.00 0.00 60.37 58.09 2ij3 h HIS 408 Cb 1.10 -0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.95 2ij3 h HIS 408 CO 0.01 0.64 -0.29 1.49 -1.30 0.00 0.00 177.93 178.48 2ij3 h GLU 409 N -0.02 -0.53 -0.46 5.26 4.57 -1.04 -0.65 114.58 121.71 2ij3 h GLU 409 Ca 0.03 0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.19 2ij3 h GLU 409 Cb 0.55 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.23 2ij3 h GLU 409 CO 0.02 -0.35 0.02 0.00 -1.18 0.00 0.00 179.01 177.52 2ij3 h ALA 410 N 0.11 1.19 -0.11 2.92 0.00 -0.98 -1.41 119.26 120.97 2ij3 h ALA 410 Ca 0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2ij3 h ALA 410 Cb 0.55 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2ij3 h ALA 410 CO -0.13 0.54 -0.06 1.15 0.00 0.00 0.00 179.25 180.75 2ij3 h THR 411 N 0.69 1.33 -0.10 0.00 2.02 -1.01 -1.38 112.91 114.46 2ij3 h THR 411 Ca 0.14 -1.10 0.04 0.00 0.77 0.00 0.00 66.41 66.26 2ij3 h THR 411 Cb 0.39 1.83 -0.06 0.00 -1.74 0.00 0.00 68.15 68.58 2ij3 h THR 411 CO 0.01 0.31 -0.32 0.25 0.37 0.00 0.00 175.52 176.15 2ij3 h LEU 412 N -0.14 -0.97 -0.14 2.58 5.85 -0.92 -1.14 115.31 120.42 2ij3 h LEU 412 Ca 0.02 0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 2ij3 h LEU 412 Cb 0.52 0.41 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 2ij3 h LEU 412 CO 0.02 -0.36 -0.01 0.58 -0.34 0.00 0.00 178.44 178.32 2ij3 h VAL 413 N -0.41 1.26 -0.85 1.05 2.07 -1.26 -1.06 116.25 117.06 2ij3 h VAL 413 Ca 0.09 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 2ij3 h VAL 413 Cb 0.54 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 2ij3 h VAL 413 CO -0.33 0.26 0.44 0.25 0.02 0.00 0.00 177.57 178.21 2ij3 h LEU 414 N -0.02 1.08 -0.21 2.57 5.85 -1.25 0.17 115.31 123.51 2ij3 h LEU 414 Ca 0.04 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.67 2ij3 h LEU 414 Cb 0.40 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2ij3 h LEU 414 CO 0.01 0.89 0.06 1.23 -0.34 0.00 0.00 178.44 180.29 2ij3 h GLY 415 N 1.19 0.24 1.02 3.75 0.00 -1.04 -0.84 103.07 107.40 2ij3 h GLY 415 Ca 0.30 -0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.55 2ij3 h GLY 415 CO -0.04 0.02 0.30 -0.33 0.00 0.00 0.00 176.54 176.48 2ij3 h MET 416 N 0.15 1.05 -0.42 4.80 2.86 -0.72 -1.00 114.93 121.65 2ij3 h MET 416 Ca 0.09 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 2ij3 h MET 416 Cb 0.07 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 2ij3 h MET 416 CO -0.10 0.86 0.27 0.52 1.06 0.00 0.00 176.91 179.52 2ij3 h MET 417 N 1.01 0.54 -0.09 1.72 2.07 -0.83 -1.86 114.93 117.50 2ij3 h MET 417 Ca 0.24 -0.03 -0.11 0.00 -2.07 0.00 0.00 59.70 57.73 2ij3 h MET 417 Cb 0.19 -0.12 -0.01 0.00 -1.87 0.00 0.00 31.60 29.78 2ij3 h MET 417 CO -0.02 0.36 -0.42 -0.07 1.07 0.00 0.00 176.91 177.83 2ij3 h LEU 418 N 0.56 0.21 -0.52 1.22 3.38 -0.93 -1.95 115.31 117.28 2ij3 h LEU 418 Ca 0.16 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 2ij3 h LEU 418 Cb -0.05 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2ij3 h LEU 418 CO -0.04 0.62 -0.45 0.50 0.09 0.00 0.00 178.44 179.16 2ij3 h LYS 419 N 0.17 0.69 0.00 1.13 3.64 -1.05 -3.37 116.57 117.78 2ij3 h LYS 419 Ca 0.01 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2ij3 h LYS 419 Cb 0.82 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2ij3 h LYS 419 CO 0.06 1.00 -1.60 0.72 -2.27 0.00 0.00 179.45 177.37 2ij3 n HIS 420 N -4.02 0.29 -4.01 1.91 8.25 -0.71 -4.84 115.22 112.08 2ij3 n HIS 420 Ca -0.02 0.08 -0.08 0.00 -0.26 0.00 0.00 57.72 57.44 2ij3 n HIS 420 Cb 0.56 -0.60 -0.11 0.00 1.12 0.00 0.00 29.99 30.97 2ij3 n HIS 420 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2ij3 s PHE 421 N -3.42 0.34 -0.14 4.41 0.08 -0.76 -0.12 117.98 118.36 2ij3 s PHE 421 Ca -0.04 -0.71 -0.07 0.00 0.12 0.00 0.00 56.93 56.23 2ij3 s PHE 421 Cb 0.13 -0.25 -0.04 0.00 -0.57 0.00 0.00 43.02 42.28 2ij3 s PHE 421 CO 0.87 -0.26 0.11 -0.51 -0.10 0.00 0.00 175.22 175.32 2ij3 s ASP 422 N -1.97 6.10 -0.03 1.36 1.01 0.09 -4.67 116.67 118.56 2ij3 s ASP 422 Ca -0.08 0.32 0.01 0.00 0.71 0.00 0.00 52.55 53.51 2ij3 s ASP 422 Cb -0.04 -1.98 -0.03 0.00 1.01 0.00 0.00 42.92 41.88 2ij3 s ASP 422 CO -0.04 0.32 -0.01 -0.36 0.21 0.00 0.00 175.17 175.29 2ij3 s PHE 423 N -0.50 3.07 -0.11 4.23 0.08 -1.26 -0.60 117.98 122.88 2ij3 s PHE 423 Ca 0.12 0.10 0.02 0.00 0.12 0.00 0.00 56.93 57.28 2ij3 s PHE 423 Cb -0.12 -1.70 0.01 0.00 -0.57 0.00 0.00 43.02 40.65 2ij3 s PHE 423 CO 0.02 0.44 -0.17 -2.00 -0.10 0.00 0.00 175.22 173.41 2ij3 s GLU 424 N -1.31 2.40 -1.40 0.44 2.12 0.42 -4.98 118.70 116.40 2ij3 s GLU 424 Ca 0.17 -0.63 -0.15 0.00 0.36 0.00 0.00 54.97 54.72 2ij3 s GLU 424 Cb -0.11 -2.00 0.03 0.00 0.26 0.00 0.00 34.13 32.30 2ij3 s GLU 424 CO 0.07 -0.04 2.19 -3.47 -0.54 0.00 0.00 175.26 173.47 2ij3 n ASP 425 N 4.12 3.81 0.21 -1.70 2.03 -1.26 -1.55 116.55 122.20 2ij3 n ASP 425 Ca -0.19 -2.83 0.15 0.00 0.52 0.00 0.00 54.79 52.43 2ij3 n ASP 425 Cb 0.51 -1.62 0.66 0.00 -0.72 0.00 0.00 41.12 39.95 2ij3 n ASP 425 CO 0.00 0.00 0.00 1.12 -1.92 0.00 0.00 177.20 176.40 2ij3 h HIS 426 N 6.21 0.00 -0.14 -0.67 2.07 -1.93 -2.57 115.15 118.11 2ij3 h HIS 426 Ca 0.55 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.07 2ij3 h HIS 426 Cb 0.65 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.63 2ij3 h HIS 426 CO 1.44 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 176.55 2ij3 n THR 427 N -2.59 0.29 -3.86 6.12 -2.24 -1.26 -4.98 114.28 105.75 2ij3 n THR 427 Ca 0.00 -0.64 -0.31 0.00 -2.27 0.00 0.00 64.05 60.83 2ij3 n THR 427 Cb 0.19 1.07 0.01 0.00 -2.10 0.00 0.00 70.33 69.50 2ij3 n THR 427 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2ij3 n ASN 428 N 0.80 -2.99 -4.63 3.42 5.15 -0.97 -4.78 115.26 111.26 2ij3 n ASN 428 Ca 0.10 -1.06 -0.52 0.00 -0.60 0.00 0.00 54.58 52.50 2ij3 n ASN 428 Cb 0.39 -2.95 -0.06 0.00 -0.53 0.00 0.00 39.78 36.63 2ij3 n ASN 428 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ij3 n TYR 429 N -4.41 1.76 -3.16 1.20 9.36 -1.26 -4.94 117.16 115.71 2ij3 n TYR 429 Ca -0.19 0.53 -0.42 0.00 3.32 0.00 0.00 57.90 61.15 2ij3 n TYR 429 Cb 0.63 -2.40 -0.07 0.00 -0.63 0.00 0.00 39.34 36.86 2ij3 n TYR 429 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2ij3 s GLU 430 N 1.28 3.53 -0.15 2.98 2.12 -1.26 -5.02 118.70 122.18 2ij3 s GLU 430 Ca 0.87 -0.17 -0.40 0.00 0.36 0.00 0.00 54.97 55.63 2ij3 s GLU 430 Cb -0.92 -3.85 -0.17 0.00 0.26 0.00 0.00 34.13 29.44 2ij3 s GLU 430 CO 0.49 -0.79 1.53 -0.11 -0.54 0.00 0.00 175.26 175.85 2ij3 n LEU 431 N 5.99 1.81 -3.68 2.70 7.94 -1.26 -4.95 117.00 125.55 2ij3 n LEU 431 Ca -0.03 1.11 -0.29 0.00 -1.11 0.00 0.00 56.01 55.69 2ij3 n LEU 431 Cb 0.48 -1.11 -0.15 0.00 0.53 0.00 0.00 43.42 43.17 2ij3 n LEU 431 CO 0.49 -0.81 -0.34 -0.62 -1.11 0.00 0.00 177.39 175.00 2ij3 s ASP 432 N 2.13 3.62 -0.43 1.96 -1.08 -1.26 -5.06 116.67 116.55 2ij3 s ASP 432 Ca 0.94 -1.35 -0.22 0.00 -0.52 0.00 0.00 52.55 51.40 2ij3 s ASP 432 Cb -1.09 -0.65 0.02 0.00 -1.46 0.00 0.00 42.92 39.74 2ij3 s ASP 432 CO 0.60 -0.40 0.70 -0.63 0.52 0.00 0.00 175.17 175.97 2ij3 s ILE 433 N 1.82 4.76 -0.01 4.11 1.01 -1.26 -0.18 121.20 131.44 2ij3 s ILE 433 Ca 0.07 0.34 -0.25 0.00 0.00 0.00 0.00 60.65 60.81 2ij3 s ILE 433 Cb -0.17 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 2ij3 s ILE 433 CO -0.25 -0.60 0.77 -0.75 0.00 0.00 0.00 174.94 174.12 2ij3 s LYS 434 N 3.00 4.48 -0.21 2.79 2.20 -0.27 -4.90 119.74 126.82 2ij3 s LYS 434 Ca 0.26 1.04 -0.05 0.00 -0.36 0.00 0.00 55.97 56.86 2ij3 s LYS 434 Cb -0.13 -3.42 -0.02 0.00 -1.51 0.00 0.00 37.83 32.74 2ij3 s LYS 434 CO 0.20 0.12 0.01 -1.21 -0.36 0.00 0.00 175.35 174.11 2ij3 s GLU 435 N 0.53 3.60 0.00 4.03 2.02 -1.26 -2.47 118.70 125.15 2ij3 s GLU 435 Ca 0.40 -0.52 0.00 0.00 0.02 0.00 0.00 54.97 54.87 2ij3 s GLU 435 Cb -0.19 -3.13 0.00 0.00 0.10 0.00 0.00 34.13 30.91 2ij3 s GLU 435 CO 0.22 -0.05 0.00 0.25 0.02 0.00 0.00 175.26 175.69 2ij3 n THR 436 N 4.45 0.00 0.37 3.63 -2.24 -1.26 -4.91 114.28 114.31 2ij3 n THR 436 Ca -0.17 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.74 2ij3 n THR 436 Cb 0.52 0.00 0.55 0.00 -2.10 0.00 0.00 70.33 69.29 2ij3 n THR 436 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2ij3 h LEU 437 N 0.00 0.00 -8.79 3.22 5.85 -1.96 -3.46 115.31 110.17 2ij3 h LEU 437 Ca 0.00 0.00 -0.40 0.00 0.84 0.00 0.00 57.88 58.32 2ij3 h LEU 437 Cb 0.00 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 40.90 2ij3 h LEU 437 CO 0.00 0.00 -0.46 0.42 -0.34 0.00 0.00 178.44 178.06 2ij3 s THR 438 N -3.41 0.00 0.04 1.05 -4.23 -1.26 -4.67 115.64 103.15 2ij3 s THR 438 Ca 0.03 -1.93 0.03 0.00 -1.18 0.00 0.00 61.69 58.64 2ij3 s THR 438 Cb 0.09 -2.52 -0.04 0.00 1.34 0.00 0.00 72.50 71.37 2ij3 s THR 438 CO 0.43 0.00 0.00 -0.76 -0.54 0.00 0.00 174.62 173.75 2ij3 s LEU 439 N -3.32 3.50 -0.04 4.79 1.43 -0.30 -4.32 118.68 120.42 2ij3 s LEU 439 Ca 0.39 -0.07 -0.23 0.00 -1.03 0.00 0.00 54.13 53.18 2ij3 s LEU 439 Cb 0.03 -2.10 0.05 0.00 0.03 0.00 0.00 46.19 44.20 2ij3 s LEU 439 CO 0.24 0.24 0.51 -1.59 0.23 0.00 0.00 176.35 175.98 2ij3 s LYS 440 N -1.86 0.86 -0.86 1.70 -2.85 -1.03 -4.57 119.74 111.13 2ij3 s LYS 440 Ca 0.22 0.08 -0.25 0.00 -1.00 0.00 0.00 55.97 55.02 2ij3 s LYS 440 Cb -0.12 0.40 0.04 0.00 -2.06 0.00 0.00 37.83 36.09 2ij3 s LYS 440 CO 0.14 -0.25 1.38 -1.25 0.10 0.00 0.00 175.35 175.46 2ij3 s PRO 441 N -1.18 3.34 0.19 1.78 0.04 -1.26 -1.12 135.00 136.80 2ij3 s PRO 441 Ca -0.12 -0.60 -0.31 0.00 0.04 0.00 0.00 61.00 60.01 2ij3 s PRO 441 Cb -0.03 -4.71 -0.10 0.00 0.04 0.00 0.00 34.50 29.70 2ij3 s PRO 441 CO 0.07 -2.21 1.52 -2.00 0.04 0.00 0.00 177.00 174.42 2ij3 s GLU 442 N 5.46 4.23 -0.01 4.56 2.56 0.74 -2.72 118.70 133.52 2ij3 s GLU 442 Ca 0.41 2.34 0.00 0.00 0.00 0.00 0.00 54.97 57.72 2ij3 s GLU 442 Cb -0.05 -3.14 0.00 0.00 2.00 0.00 0.00 34.13 32.95 2ij3 s GLU 442 CO 0.04 -0.54 0.00 0.41 -0.56 0.00 0.00 175.26 174.61 2ij3 n GLY 443 N 3.18 0.43 3.68 -1.50 0.00 -1.26 -4.50 105.19 105.21 2ij3 n GLY 443 Ca 0.11 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2ij3 n GLY 443 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ij3 s PHE 444 N -1.84 2.16 0.04 1.61 5.36 -1.10 -4.98 117.98 119.23 2ij3 s PHE 444 Ca 0.00 0.21 0.03 0.00 -0.96 0.00 0.00 56.93 56.21 2ij3 s PHE 444 Cb 0.00 -3.97 -0.02 0.00 -0.34 0.00 0.00 43.02 38.69 2ij3 s PHE 444 CO 0.00 -4.01 -0.10 0.14 -1.46 0.00 0.00 175.22 169.79 2ij3 s VAL 445 N 3.28 0.77 0.18 3.12 -7.23 -1.26 -1.52 120.40 117.73 2ij3 s VAL 445 Ca 0.75 -1.00 -0.05 0.00 -1.81 0.00 0.00 61.98 59.87 2ij3 s VAL 445 Cb -0.38 -0.76 -0.03 0.00 0.56 0.00 0.00 36.38 35.78 2ij3 s VAL 445 CO 0.32 -0.20 0.20 0.68 -0.31 0.00 0.00 175.10 175.79 2ij3 s VAL 446 N -1.09 0.04 -0.03 1.32 -7.23 -0.89 -4.64 120.40 107.89 2ij3 s VAL 446 Ca -0.04 -1.73 0.04 0.00 -1.81 0.00 0.00 61.98 58.44 2ij3 s VAL 446 Cb -0.09 -2.18 -0.03 0.00 0.56 0.00 0.00 36.38 34.65 2ij3 s VAL 446 CO 0.01 -0.19 -0.14 -0.54 -0.31 0.00 0.00 175.10 173.93 2ij3 s LYS 447 N -4.06 2.43 -0.21 4.82 1.02 -0.60 -0.20 119.74 122.93 2ij3 s LYS 447 Ca 0.27 -0.75 0.02 0.00 0.02 0.00 0.00 55.97 55.53 2ij3 s LYS 447 Cb 0.05 -2.35 0.04 0.00 -0.52 0.00 0.00 37.83 35.04 2ij3 s LYS 447 CO 0.06 0.61 -0.16 0.00 -0.92 0.00 0.00 175.35 174.94 2ij3 s ALA 448 N -0.80 2.41 -0.26 5.17 0.00 -1.26 -0.44 121.76 126.58 2ij3 s ALA 448 Ca 0.13 -1.44 -0.16 0.00 0.00 0.00 0.00 51.96 50.48 2ij3 s ALA 448 Cb -0.11 -1.35 -0.03 0.00 0.00 0.00 0.00 23.12 21.63 2ij3 s ALA 448 CO 0.02 -0.71 0.45 0.21 0.00 0.00 0.00 175.76 175.73 2ij3 s LYS 449 N 1.22 4.05 0.37 0.00 2.47 0.23 -4.91 119.74 123.17 2ij3 s LYS 449 Ca -0.01 0.19 -0.28 0.00 -1.56 0.00 0.00 55.97 54.31 2ij3 s LYS 449 Cb -0.16 -3.65 -0.11 0.00 -1.46 0.00 0.00 37.83 32.45 2ij3 s LYS 449 CO -0.10 -0.31 1.48 0.45 0.16 0.00 0.00 175.35 177.03 2ij3 s SER 450 N 1.58 6.39 0.00 1.43 0.15 -1.26 -0.73 113.70 121.26 2ij3 s SER 450 Ca 0.18 3.01 0.24 0.00 0.70 0.00 0.00 55.95 60.08 2ij3 s SER 450 Cb -0.16 -2.66 0.98 0.00 -1.71 0.00 0.00 66.02 62.47 2ij3 s SER 450 CO 0.09 -0.84 1.69 0.29 1.20 0.00 0.00 173.24 175.67 2ij3 n LYS 451 N 0.63 1.60 -2.78 5.44 5.02 0.82 -4.85 118.16 124.04 2ij3 n LYS 451 Ca 0.01 -0.89 -0.21 0.00 -2.02 0.00 0.00 58.31 55.20 2ij3 n LYS 451 Cb 0.39 -1.43 0.01 0.00 -0.02 0.00 0.00 35.03 33.99 2ij3 n LYS 451 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2ij3 n LYS 452 N 0.09 -3.50 -3.27 1.97 4.76 -1.26 -4.99 118.16 111.97 2ij3 n LYS 452 Ca 0.18 0.91 -0.39 0.00 -2.87 0.00 0.00 58.31 56.14 2ij3 n LYS 452 Cb 0.31 -5.69 -0.07 0.00 -1.84 0.00 0.00 35.03 27.74 2ij3 n LYS 452 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ij3 s ILE 453 N -3.09 5.12 0.75 -0.18 1.01 -1.26 -5.06 121.20 118.49 2ij3 s ILE 453 Ca 0.18 0.93 -0.11 0.00 0.00 0.00 0.00 60.65 61.65 2ij3 s ILE 453 Cb -0.08 -3.83 0.04 0.00 0.01 0.00 0.00 42.46 38.60 2ij3 s ILE 453 CO 0.22 0.20 1.08 -2.84 0.00 0.00 0.00 174.94 173.60 2ij3 s PRO 454 N 1.51 2.47 0.00 2.79 0.02 -1.26 -5.01 135.00 135.52 2ij3 s PRO 454 Ca 0.24 0.99 0.11 0.00 0.02 0.00 0.00 61.00 62.35 2ij3 s PRO 454 Cb -0.15 -1.93 0.08 0.00 0.02 0.00 0.00 34.50 32.52 2ij3 s PRO 454 CO 0.09 -1.44 0.83 1.28 -0.33 0.00 0.00 177.00 177.44