#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h6b s GLU 4 N 0.00 4.71 0.00 7.34 -1.05 -1.26 -5.06 118.70 123.38 2h6b s GLU 4 Ca 0.00 1.70 0.00 0.00 -0.15 0.00 0.00 54.97 56.52 2h6b s GLU 4 Cb 0.00 -3.22 0.00 0.00 -0.44 0.00 0.00 34.13 30.47 2h6b s GLU 4 CO 0.00 0.30 0.00 0.41 0.95 0.00 0.00 175.26 176.92 2h6b n GLY 5 N 1.33 0.96 0.18 -3.83 0.00 -1.26 -5.00 105.19 97.58 2h6b n GLY 5 Ca -0.01 -1.65 -0.04 0.00 0.00 0.00 0.00 46.02 44.32 2h6b n GLY 5 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2h6b h LEU 6 N 0.00 0.30 0.00 0.99 5.85 -1.97 -3.42 115.31 117.06 2h6b h LEU 6 Ca 0.00 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2h6b h LEU 6 Cb 0.00 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.94 2h6b h LEU 6 CO 0.00 0.77 0.00 0.61 -0.34 0.00 0.00 178.44 179.48 2h6b n GLY 7 N 0.11 0.03 3.84 3.75 0.00 -1.26 -0.12 105.19 111.53 2h6b n GLY 7 Ca -0.02 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.68 2h6b n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h6b s LYS 8 N -2.00 3.62 -0.11 1.61 1.02 -1.25 -4.71 119.74 117.92 2h6b s LYS 8 Ca 0.00 0.97 -0.04 0.00 0.02 0.00 0.00 55.97 56.92 2h6b s LYS 8 Cb 0.00 -2.08 -0.04 0.00 -0.52 0.00 0.00 37.83 35.19 2h6b s LYS 8 CO 0.00 -0.55 0.03 0.16 -0.92 0.00 0.00 175.35 174.08 2h6b s ASP 9 N -3.32 5.46 -0.10 2.83 -4.77 -1.26 -0.04 116.67 115.47 2h6b s ASP 9 Ca 0.59 0.17 0.02 0.00 -3.30 0.00 0.00 52.55 50.02 2h6b s ASP 9 Cb -0.12 -1.68 0.02 0.00 -1.09 0.00 0.00 42.92 40.04 2h6b s ASP 9 CO 0.40 0.33 -0.13 0.12 0.70 0.00 0.00 175.17 176.59 2h6b s PHE 10 N -0.59 1.75 -1.55 2.11 5.36 0.12 -4.90 117.98 120.27 2h6b s PHE 10 Ca 0.10 -0.78 -0.05 0.00 -0.96 0.00 0.00 56.93 55.25 2h6b s PHE 10 Cb -0.12 -1.29 0.05 0.00 -0.34 0.00 0.00 43.02 41.32 2h6b s PHE 10 CO 0.02 -0.42 0.33 0.00 -1.46 0.00 0.00 175.22 173.70 2h6b n GLY 12 N -2.04 1.39 3.43 0.00 0.00 -1.26 -5.04 105.19 101.67 2h6b n GLY 12 Ca -0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 2h6b n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h6b s ALA 13 N -2.61 2.57 0.22 4.61 0.00 -0.39 -5.12 121.76 121.04 2h6b s ALA 13 Ca 0.00 -0.98 -0.23 0.00 0.00 0.00 0.00 51.96 50.75 2h6b s ALA 13 Cb 0.00 -0.95 -0.08 0.00 0.00 0.00 0.00 23.12 22.09 2h6b s ALA 13 CO 0.00 0.49 0.78 0.42 0.00 0.00 0.00 175.76 177.44 2h6b s ILE 14 N -0.49 4.44 -0.44 0.00 1.01 -1.26 0.11 121.20 124.57 2h6b s ILE 14 Ca 0.06 1.52 -0.09 0.00 0.00 0.00 0.00 60.65 62.14 2h6b s ILE 14 Cb -0.12 -3.98 0.10 0.00 0.01 0.00 0.00 42.46 38.47 2h6b s ILE 14 CO 0.02 0.31 0.30 -0.63 0.00 0.00 0.00 174.94 174.93 2h6b s ILE 15 N -1.40 4.22 0.02 2.92 1.09 0.94 -4.94 121.20 124.04 2h6b s ILE 15 Ca 0.41 -1.57 -0.30 0.00 -1.10 0.00 0.00 60.65 58.09 2h6b s ILE 15 Cb -0.19 -3.67 -0.06 0.00 -1.06 0.00 0.00 42.46 37.49 2h6b s ILE 15 CO 0.23 -0.62 1.36 -2.16 -0.10 0.00 0.00 174.94 173.66 2h6b s PRO 16 N 1.40 4.31 -0.00 2.79 0.04 -1.26 -3.75 135.00 138.52 2h6b s PRO 16 Ca 0.04 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2h6b s PRO 16 Cb -0.24 -3.51 0.00 0.00 0.04 0.00 0.00 34.50 30.79 2h6b s PRO 16 CO 0.01 -0.52 0.75 -0.40 0.04 0.00 0.00 177.00 176.88 2h6b n ASP 17 N 5.05 1.01 -2.70 6.66 5.68 0.83 -1.24 116.55 131.83 2h6b n ASP 17 Ca 0.12 -1.51 -0.07 0.00 -0.50 0.00 0.00 54.79 52.83 2h6b n ASP 17 Cb 0.44 -0.00 0.12 0.00 -1.14 0.00 0.00 41.12 40.53 2h6b n ASP 17 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2h6b n ASN 18 N -0.25 -1.94 -4.77 -1.12 5.15 -0.64 -2.75 115.26 108.94 2h6b n ASN 18 Ca 0.00 -2.61 -0.41 0.00 -0.60 0.00 0.00 54.58 50.96 2h6b n ASN 18 Cb 0.37 1.12 -0.01 0.00 -0.53 0.00 0.00 39.78 40.74 2h6b n ASN 18 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2h6b n PHE 19 N -0.49 2.97 -0.15 1.20 3.01 -1.26 -4.39 117.46 118.35 2h6b n PHE 19 Ca -0.02 0.36 0.00 0.00 1.01 0.00 0.00 57.45 58.80 2h6b n PHE 19 Cb 0.83 -2.57 0.00 0.00 -0.01 0.00 0.00 39.48 37.74 2h6b n PHE 19 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2h6b n PHE 20 N 1.17 0.00 -1.92 1.38 7.35 -1.26 -4.67 117.46 119.51 2h6b n PHE 20 Ca 0.04 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.38 2h6b n PHE 20 Cb 0.38 0.00 0.04 0.00 0.35 0.00 0.00 39.48 40.25 2h6b n PHE 20 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2h6b s PRO 21 N 0.00 2.88 -0.58 -7.13 0.04 -1.26 -4.73 135.00 124.22 2h6b s PRO 21 Ca 0.00 1.68 0.05 0.00 0.04 0.00 0.00 61.00 62.77 2h6b s PRO 21 Cb 0.00 -1.93 0.17 0.00 0.04 0.00 0.00 34.50 32.78 2h6b s PRO 21 CO 0.00 -1.24 0.44 -0.89 0.04 0.00 0.00 177.00 175.35 2h6b n ILE 22 N -1.88 0.43 -0.31 0.56 5.41 0.35 -4.95 119.36 118.98 2h6b n ILE 22 Ca 0.13 -4.27 0.14 0.00 1.00 0.00 0.00 62.75 59.75 2h6b n ILE 22 Cb 0.50 -1.96 0.32 0.00 -0.71 0.00 0.00 39.64 37.79 2h6b n ILE 22 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2h6b h GLU 23 N 5.42 0.42 0.00 0.38 5.08 -1.95 -2.62 114.58 121.31 2h6b h GLU 23 Ca 0.20 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 2h6b h GLU 23 Cb 0.82 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 2h6b h GLU 23 CO 0.57 0.28 -0.09 0.87 -1.00 0.00 0.00 179.01 179.64 2h6b h LYS 24 N 0.44 0.00 0.00 2.33 1.57 -1.97 -1.48 116.57 117.45 2h6b h LYS 24 Ca 0.57 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.35 2h6b h LYS 24 Cb 1.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.38 2h6b h LYS 24 CO -0.51 0.09 -0.00 -0.07 -0.57 0.00 0.00 179.45 178.38 2h6b h LEU 25 N 0.00 0.00 -1.96 2.94 3.38 -1.89 -1.42 115.31 116.37 2h6b h LEU 25 Ca -0.00 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.16 2h6b h LEU 25 Cb 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2h6b h LEU 25 CO 0.01 0.00 0.54 0.03 0.09 0.00 0.00 178.44 179.12 2h6b h ARG 26 N 0.00 0.00 -0.00 1.13 3.08 -1.45 -0.66 114.38 116.48 2h6b h ARG 26 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2h6b h ARG 26 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2h6b h ARG 26 CO 0.00 0.00 -0.06 0.09 -1.07 0.00 0.00 179.97 178.93 2h6b n ASN 27 N -4.01 0.18 -0.03 7.04 5.03 -0.53 -3.88 115.26 119.06 2h6b n ASN 27 Ca 0.13 -0.26 0.02 0.00 0.87 0.00 0.00 54.58 55.34 2h6b n ASN 27 Cb 0.79 -0.20 0.03 0.00 -1.02 0.00 0.00 39.78 39.38 2h6b n ASN 27 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2h6b n TYR 28 N -1.19 0.00 0.22 3.10 4.02 -0.26 -4.81 117.16 118.24 2h6b n TYR 28 Ca 0.13 -0.54 0.05 0.00 -0.01 0.00 0.00 57.90 57.54 2h6b n TYR 28 Cb 0.26 -0.07 0.48 0.00 -0.02 0.00 0.00 39.34 40.00 2h6b n TYR 28 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 2h6b h THR 29 N 0.57 1.15 -0.60 -0.72 1.35 -1.66 -1.14 112.91 111.87 2h6b h THR 29 Ca 0.00 -0.70 0.17 0.00 -0.55 0.00 0.00 66.41 65.33 2h6b h THR 29 Cb 0.69 1.37 -0.02 0.00 -1.73 0.00 0.00 68.15 68.46 2h6b h THR 29 CO 0.00 0.20 0.58 0.06 -0.25 0.00 0.00 175.52 176.11 2h6b h GLN 30 N 0.00 0.00 -0.00 4.72 -0.00 -1.89 0.18 115.11 118.12 2h6b h GLN 30 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2h6b h GLN 30 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.84 2h6b h GLN 30 CO 0.03 0.00 -0.35 -1.33 -0.00 0.00 0.00 178.83 177.17 2h6b n MET 31 N -3.78 0.47 0.00 0.06 2.81 -0.43 -4.90 117.12 111.35 2h6b n MET 31 Ca 0.12 -0.27 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 2h6b n MET 31 Cb 0.81 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.82 2h6b n MET 31 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2h6b n GLY 32 N 1.41 3.83 3.08 3.03 0.00 0.05 -4.75 105.19 111.84 2h6b n GLY 32 Ca 0.09 -2.00 -0.32 0.00 0.00 0.00 0.00 46.02 43.80 2h6b n GLY 32 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2h6b s LEU 33 N 0.00 2.12 -0.18 0.99 2.96 -0.59 -4.93 118.68 119.05 2h6b s LEU 33 Ca 0.00 -0.68 -0.24 0.00 -0.22 0.00 0.00 54.13 52.99 2h6b s LEU 33 Cb 0.00 -1.38 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 2h6b s LEU 33 CO 0.00 -0.04 0.76 -0.63 -1.32 0.00 0.00 176.35 175.12 2h6b s ILE 34 N 1.34 4.93 -0.04 6.68 -1.09 -1.26 -1.05 121.20 130.70 2h6b s ILE 34 Ca 0.03 1.47 0.03 0.00 -2.23 0.00 0.00 60.65 59.96 2h6b s ILE 34 Cb -0.14 -4.07 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 2h6b s ILE 34 CO -0.11 0.06 -0.14 -0.13 -1.23 0.00 0.00 174.94 173.39 2h6b s ARG 35 N 2.06 1.47 0.06 2.79 0.52 -0.21 -5.01 118.95 120.63 2h6b s ARG 35 Ca 0.35 -0.47 0.06 0.00 -0.52 0.00 0.00 55.73 55.14 2h6b s ARG 35 Cb -0.16 -1.29 -0.04 0.00 0.52 0.00 0.00 34.95 33.98 2h6b s ARG 35 CO 0.12 0.17 -0.11 -0.51 0.02 0.00 0.00 175.30 174.99 2h6b s ASP 36 N 0.18 4.35 -0.01 0.23 1.01 -1.26 -0.97 116.67 120.19 2h6b s ASP 36 Ca -0.05 -0.31 0.00 0.00 0.71 0.00 0.00 52.55 52.90 2h6b s ASP 36 Cb -0.11 -0.87 0.01 0.00 1.01 0.00 0.00 42.92 42.96 2h6b s ASP 36 CO 0.02 0.23 0.00 -0.36 0.21 0.00 0.00 175.17 175.27 2h6b s PHE 37 N -1.08 0.12 0.40 4.23 0.40 0.14 -5.01 117.98 117.17 2h6b s PHE 37 Ca 0.19 0.03 -0.13 0.00 -0.60 0.00 0.00 56.93 56.41 2h6b s PHE 37 Cb -0.11 -0.18 -0.08 0.00 0.51 0.00 0.00 43.02 43.16 2h6b s PHE 37 CO 0.10 -0.05 0.80 0.00 0.70 0.00 0.00 175.22 176.76 2h6b s ALA 38 N 0.49 3.29 -0.03 5.36 0.00 -1.26 -0.66 121.76 128.95 2h6b s ALA 38 Ca -0.04 -0.06 -0.40 0.00 0.00 0.00 0.00 51.96 51.46 2h6b s ALA 38 Cb -0.07 -2.80 -0.19 0.00 0.00 0.00 0.00 23.12 20.07 2h6b s ALA 38 CO -0.01 0.07 1.21 1.17 0.00 0.00 0.00 175.76 178.19 2h6b n LYS 39 N -1.04 0.34 0.00 0.00 4.81 -1.25 -1.51 118.16 119.51 2h6b n LYS 39 Ca 0.03 0.12 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 2h6b n LYS 39 Cb 0.54 -1.67 0.00 0.00 0.02 0.00 0.00 35.03 33.92 2h6b n LYS 39 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2h6b n GLY 40 N 2.07 3.06 3.73 3.14 0.00 0.98 -4.97 105.19 113.20 2h6b n GLY 40 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2h6b n GLY 40 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2h6b n SER 41 N 0.20 2.33 -4.63 1.61 7.64 -0.57 -4.73 113.62 115.47 2h6b n SER 41 Ca 0.00 0.92 -0.43 0.00 1.01 0.00 0.00 58.87 60.38 2h6b n SER 41 Cb 0.00 -1.55 -0.03 0.00 -1.01 0.00 0.00 64.21 61.62 2h6b n SER 41 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2h6b s ALA 42 N -1.33 3.52 0.01 -0.43 0.00 -1.26 -0.97 121.76 121.29 2h6b s ALA 42 Ca 0.75 -0.20 -0.01 0.00 0.00 0.00 0.00 51.96 52.50 2h6b s ALA 42 Cb -0.41 -3.52 -0.27 0.00 0.00 0.00 0.00 23.12 18.92 2h6b s ALA 42 CO 0.47 -1.36 0.87 0.28 0.00 0.00 0.00 175.76 176.02 2h6b h VAL 43 N 5.67 1.17 -3.41 0.00 2.07 -0.23 -3.45 116.25 118.06 2h6b h VAL 43 Ca -0.22 -2.83 -0.35 0.00 0.82 0.00 0.00 66.70 64.12 2h6b h VAL 43 Cb 1.07 2.73 -0.36 0.00 -1.52 0.00 0.00 31.29 33.22 2h6b h VAL 43 CO 0.97 0.81 -0.74 -0.63 0.02 0.00 0.00 177.57 178.00 2h6b s ILE 44 N -2.62 0.02 0.15 4.57 1.01 -0.88 -4.96 121.20 118.49 2h6b s ILE 44 Ca -0.08 0.26 -0.04 0.00 0.00 0.00 0.00 60.65 60.79 2h6b s ILE 44 Cb 0.07 -0.20 -0.05 0.00 0.01 0.00 0.00 42.46 42.29 2h6b s ILE 44 CO 0.85 0.15 0.37 -0.04 0.00 0.00 0.00 174.94 176.27 2h6b s MET 45 N 1.57 3.59 0.58 2.79 -1.94 -1.26 -1.06 119.30 123.57 2h6b s MET 45 Ca -0.02 -0.15 0.35 0.00 -1.71 0.00 0.00 55.69 54.16 2h6b s MET 45 Cb -0.13 -2.85 1.79 0.00 2.01 0.00 0.00 34.83 35.65 2h6b s MET 45 CO -0.03 0.46 2.16 -1.00 -0.01 0.00 0.00 175.02 176.60 2h6b h PRO 46 N 2.66 0.00 -0.21 2.03 0.13 -1.85 -1.47 132.00 133.29 2h6b h PRO 46 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2h6b h PRO 46 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2h6b h PRO 46 CO 0.72 0.04 0.00 0.41 -0.23 0.00 0.00 178.00 178.94 2h6b n GLY 47 N -0.68 0.99 3.78 1.56 0.00 -1.26 -4.27 105.19 105.31 2h6b n GLY 47 Ca -0.02 -0.61 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 2h6b n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2h6b s GLU 48 N -1.74 4.25 -0.35 1.61 2.12 -0.55 -4.98 118.70 119.06 2h6b s GLU 48 Ca 0.35 1.49 -0.14 0.00 0.36 0.00 0.00 54.97 57.03 2h6b s GLU 48 Cb 0.21 -2.60 -0.01 0.00 0.26 0.00 0.00 34.13 31.98 2h6b s GLU 48 CO 0.30 -0.06 0.27 -2.00 -0.54 0.00 0.00 175.26 173.23 2h6b s GLU 49 N -2.40 3.47 -0.18 4.30 2.56 -1.26 -4.92 118.70 120.27 2h6b s GLU 49 Ca 0.56 -0.63 -0.06 0.00 0.00 0.00 0.00 54.97 54.84 2h6b s GLU 49 Cb -0.22 -3.82 -0.03 0.00 2.00 0.00 0.00 34.13 32.06 2h6b s GLU 49 CO 0.27 -0.49 0.03 0.42 -0.56 0.00 0.00 175.26 174.93 2h6b s ILE 50 N 1.79 4.43 -0.25 -3.70 -1.09 -1.26 -4.98 121.20 116.13 2h6b s ILE 50 Ca 0.07 -0.16 0.22 0.00 -2.23 0.00 0.00 60.65 58.55 2h6b s ILE 50 Cb -0.17 -2.99 0.49 0.00 -1.58 0.00 0.00 42.46 38.21 2h6b s ILE 50 CO 0.11 0.45 1.15 0.35 -1.23 0.00 0.00 174.94 175.77 2h6b n THR 51 N 3.73 1.08 -3.91 2.92 -2.24 -1.23 -3.94 114.28 110.69 2h6b n THR 51 Ca -0.17 -2.63 -0.11 0.00 -2.27 0.00 0.00 64.05 58.87 2h6b n THR 51 Cb 0.52 1.26 -0.12 0.00 -2.10 0.00 0.00 70.33 69.89 2h6b n THR 51 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2h6b s SER 52 N -3.46 0.09 0.16 3.42 0.01 -1.15 -4.36 113.70 108.42 2h6b s SER 52 Ca 0.26 -0.21 -0.30 0.00 1.31 0.00 0.00 55.95 57.01 2h6b s SER 52 Cb 0.33 0.08 -0.07 0.00 0.21 0.00 0.00 66.02 66.57 2h6b s SER 52 CO -0.05 -0.16 1.03 -0.04 0.41 0.00 0.00 173.24 174.43 2h6b s MET 53 N -0.73 4.66 -0.26 12.44 1.00 -0.45 -3.91 119.30 132.06 2h6b s MET 53 Ca -0.08 1.59 -0.00 0.00 0.00 0.00 0.00 55.69 57.20 2h6b s MET 53 Cb -0.05 -3.32 0.04 0.00 0.00 0.00 0.00 34.83 31.50 2h6b s MET 53 CO -0.00 0.17 -0.07 0.42 0.00 0.00 0.00 175.02 175.54 2h6b s ILE 54 N -0.24 2.66 -0.10 2.53 1.01 -0.11 -0.41 121.20 126.55 2h6b s ILE 54 Ca 0.48 -1.23 -0.14 0.00 0.00 0.00 0.00 60.65 59.75 2h6b s ILE 54 Cb -0.27 -2.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.74 2h6b s ILE 54 CO 0.33 0.11 0.34 0.12 0.00 0.00 0.00 174.94 175.84 2h6b s PHE 55 N 1.25 3.56 -0.55 3.97 5.36 0.81 -0.21 117.98 132.19 2h6b s PHE 55 Ca -0.03 0.76 -0.19 0.00 -0.96 0.00 0.00 56.93 56.51 2h6b s PHE 55 Cb -0.18 -2.32 0.08 0.00 -0.34 0.00 0.00 43.02 40.26 2h6b s PHE 55 CO -0.05 0.40 0.66 -1.17 -1.46 0.00 0.00 175.22 173.60 2h6b s LEU 56 N -0.12 5.21 -0.06 6.12 0.20 0.02 -0.25 118.68 129.79 2h6b s LEU 56 Ca 0.20 -1.20 -0.17 0.00 0.69 0.00 0.00 54.13 53.65 2h6b s LEU 56 Cb -0.14 -2.36 -0.12 0.00 -0.43 0.00 0.00 46.19 43.13 2h6b s LEU 56 CO 0.08 -1.00 0.68 0.58 -0.29 0.00 0.00 176.35 176.40 2h6b h VAL 57 N 5.89 0.57 -3.30 1.68 2.07 -1.35 0.63 116.25 122.44 2h6b h VAL 57 Ca -0.29 -1.05 -0.15 0.00 0.82 0.00 0.00 66.70 66.03 2h6b h VAL 57 Cb 1.09 0.98 -0.23 0.00 -1.52 0.00 0.00 31.29 31.61 2h6b h VAL 57 CO 1.03 0.16 -0.45 -1.61 0.02 0.00 0.00 177.57 176.72 2h6b s GLU 58 N -3.05 0.39 0.00 1.57 0.41 -0.87 -4.53 118.70 112.63 2h6b s GLU 58 Ca -0.10 -0.03 0.00 0.00 -0.41 0.00 0.00 54.97 54.43 2h6b s GLU 58 Cb 0.00 0.18 0.00 0.00 -1.78 0.00 0.00 34.13 32.53 2h6b s GLU 58 CO 0.36 -0.08 0.00 0.41 -0.49 0.00 0.00 175.26 175.46 2h6b n GLY 59 N 2.17 0.25 3.64 -1.39 0.00 -1.26 0.06 105.19 108.67 2h6b n GLY 59 Ca -0.18 -2.12 -0.08 0.00 0.00 0.00 0.00 46.02 43.65 2h6b n GLY 59 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h6b s LYS 60 N 0.00 0.62 -0.03 1.61 2.20 -1.26 -3.57 119.74 119.31 2h6b s LYS 60 Ca 0.00 0.94 0.04 0.00 -0.36 0.00 0.00 55.97 56.60 2h6b s LYS 60 Cb 0.00 0.19 -0.01 0.00 -1.51 0.00 0.00 37.83 36.51 2h6b s LYS 60 CO 0.00 -0.11 -0.17 0.42 -0.36 0.00 0.00 175.35 175.14 2h6b s ILE 61 N 1.10 1.36 -0.26 5.43 1.01 0.37 -0.70 121.20 129.50 2h6b s ILE 61 Ca -0.06 -0.69 -0.10 0.00 0.00 0.00 0.00 60.65 59.80 2h6b s ILE 61 Cb -0.05 -1.16 -0.05 0.00 0.01 0.00 0.00 42.46 41.21 2h6b s ILE 61 CO -0.12 0.39 0.17 -0.75 0.00 0.00 0.00 174.94 174.62 2h6b s LYS 62 N -0.06 3.96 -0.24 2.79 2.20 -0.30 -0.71 119.74 127.38 2h6b s LYS 62 Ca -0.01 -0.32 -0.03 0.00 -0.36 0.00 0.00 55.97 55.25 2h6b s LYS 62 Cb -0.10 -3.58 0.01 0.00 -1.51 0.00 0.00 37.83 32.65 2h6b s LYS 62 CO 0.01 -0.09 -0.05 -1.17 -0.36 0.00 0.00 175.35 173.69 2h6b s LEU 63 N 1.49 3.05 0.20 5.43 0.20 0.14 -1.32 118.68 127.88 2h6b s LEU 63 Ca 0.07 -0.64 0.10 0.00 0.69 0.00 0.00 54.13 54.36 2h6b s LEU 63 Cb -0.15 -1.70 -0.04 0.00 -0.43 0.00 0.00 46.19 43.86 2h6b s LEU 63 CO 0.08 -0.08 -0.17 -1.81 -0.29 0.00 0.00 176.35 174.08 2h6b s ASP 64 N 1.41 3.79 -0.04 3.68 1.11 0.26 -0.88 116.67 126.00 2h6b s ASP 64 Ca 0.03 -0.76 -0.03 0.00 0.18 0.00 0.00 52.55 51.97 2h6b s ASP 64 Cb -0.15 -0.45 -0.04 0.00 1.07 0.00 0.00 42.92 43.34 2h6b s ASP 64 CO -0.04 0.11 0.13 -0.51 1.18 0.00 0.00 175.17 176.04 2h6b s ILE 65 N -1.76 5.19 -0.16 0.77 2.07 -0.02 -1.15 121.20 126.13 2h6b s ILE 65 Ca 0.23 -0.15 0.00 0.00 -1.41 0.00 0.00 60.65 59.32 2h6b s ILE 65 Cb -0.08 -3.36 0.00 0.00 0.13 0.00 0.00 42.46 39.15 2h6b s ILE 65 CO 0.12 0.41 -0.15 -0.63 -1.91 0.00 0.00 174.94 172.79 2h6b s ILE 66 N -1.20 2.63 0.48 2.00 -1.09 0.32 -1.51 121.20 122.82 2h6b s ILE 66 Ca 0.22 -0.78 -0.02 0.00 -2.23 0.00 0.00 60.65 57.85 2h6b s ILE 66 Cb -0.12 -2.11 -0.01 0.00 -1.58 0.00 0.00 42.46 38.63 2h6b s ILE 66 CO 0.13 0.51 0.73 -0.36 -1.23 0.00 0.00 174.94 174.72 2h6b s PHE 67 N 0.93 3.31 0.37 3.97 0.40 0.22 -4.17 117.98 123.01 2h6b s PHE 67 Ca -0.03 0.43 0.19 0.00 -0.60 0.00 0.00 56.93 56.91 2h6b s PHE 67 Cb -0.15 -2.37 1.00 0.00 0.51 0.00 0.00 43.02 42.02 2h6b s PHE 67 CO -0.02 -0.41 1.92 0.93 0.70 0.00 0.00 175.22 178.35 2h6b h GLU 68 N 0.27 0.00 0.00 0.44 3.07 -1.87 0.30 114.58 116.79 2h6b h GLU 68 Ca -0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.40 2h6b h GLU 68 Cb 1.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 2h6b h GLU 68 CO 0.59 0.26 0.00 -0.40 -1.40 0.00 0.00 179.01 178.06 2h6b n ASP 69 N -3.90 0.00 0.00 1.42 5.75 -0.87 -4.88 116.55 114.07 2h6b n ASP 69 Ca -0.02 -1.48 0.00 0.00 -0.01 0.00 0.00 54.79 53.28 2h6b n ASP 69 Cb 0.34 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 2h6b n ASP 69 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2h6b n GLY 70 N 0.49 2.76 3.60 6.12 0.00 0.11 -5.04 105.19 113.23 2h6b n GLY 70 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2h6b n GLY 70 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2h6b n SER 71 N 0.00 0.69 -4.22 1.61 3.41 -1.25 -4.70 113.62 109.16 2h6b n SER 71 Ca 0.00 0.85 -0.25 0.00 -0.26 0.00 0.00 58.87 59.21 2h6b n SER 71 Cb 0.00 -1.36 -0.14 0.00 -0.26 0.00 0.00 64.21 62.45 2h6b n SER 71 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2h6b s GLU 72 N -2.50 1.39 -0.14 4.33 2.12 -1.26 -0.61 118.70 122.04 2h6b s GLU 72 Ca 0.72 -0.85 -0.10 0.00 0.36 0.00 0.00 54.97 55.10 2h6b s GLU 72 Cb -0.45 -1.45 0.04 0.00 0.26 0.00 0.00 34.13 32.53 2h6b s GLU 72 CO 0.50 0.38 0.34 0.21 -0.54 0.00 0.00 175.26 176.15 2h6b s LYS 73 N -0.97 0.36 0.22 4.30 2.47 -0.57 -5.00 119.74 120.54 2h6b s LYS 73 Ca 0.07 0.59 -0.31 0.00 -1.56 0.00 0.00 55.97 54.75 2h6b s LYS 73 Cb -0.08 0.06 -0.11 0.00 -1.46 0.00 0.00 37.83 36.23 2h6b s LYS 73 CO 0.01 -0.11 1.61 -1.17 0.16 0.00 0.00 175.35 175.85 2h6b s LEU 74 N 0.80 4.37 -0.21 5.43 2.96 -1.26 -0.84 118.68 129.92 2h6b s LEU 74 Ca -0.05 2.78 -0.16 0.00 -0.22 0.00 0.00 54.13 56.49 2h6b s LEU 74 Cb -0.06 -3.61 -0.10 0.00 0.50 0.00 0.00 46.19 42.92 2h6b s LEU 74 CO -0.06 -0.88 -0.22 0.18 -1.32 0.00 0.00 176.35 174.05 2h6b n LEU 75 N 3.36 1.91 -3.68 -0.68 4.77 -0.05 -4.89 117.00 117.73 2h6b n LEU 75 Ca 0.12 0.41 -0.08 0.00 -0.03 0.00 0.00 56.01 56.43 2h6b n LEU 75 Cb 0.37 -0.83 -0.02 0.00 -2.33 0.00 0.00 43.42 40.61 2h6b n LEU 75 CO 0.63 0.05 0.49 -0.72 -1.33 0.00 0.00 177.39 176.51 2h6b s TYR 76 N -2.56 -0.31 0.11 -1.77 -0.00 -0.87 -4.83 117.35 107.12 2h6b s TYR 76 Ca -0.29 -0.02 0.03 0.00 -0.00 0.00 0.00 57.07 56.78 2h6b s TYR 76 Cb 0.07 0.64 -0.04 0.00 -0.00 0.00 0.00 41.96 42.63 2h6b s TYR 76 CO 0.44 -1.01 0.16 0.71 -0.00 0.00 0.00 175.55 175.84 2h6b s TYR 77 N -3.73 3.30 -0.10 -3.49 1.51 -0.37 -0.68 117.35 113.78 2h6b s TYR 77 Ca 0.07 0.09 0.02 0.00 -1.01 0.00 0.00 57.07 56.25 2h6b s TYR 77 Cb -0.03 -1.63 0.01 0.00 -0.11 0.00 0.00 41.96 40.20 2h6b s TYR 77 CO -0.01 0.53 -0.16 0.00 -1.11 0.00 0.00 175.55 174.80 2h6b s ALA 78 N -1.57 1.68 0.00 3.71 0.00 0.11 -3.66 121.76 122.03 2h6b s ALA 78 Ca 0.32 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.57 2h6b s ALA 78 Cb -0.12 -0.79 0.00 0.00 0.00 0.00 0.00 23.12 22.22 2h6b s ALA 78 CO 0.25 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.41 2h6b n GLY 79 N 4.06 2.37 3.74 0.00 0.00 -1.11 -0.48 105.19 113.78 2h6b n GLY 79 Ca -0.20 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.34 2h6b n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h6b n GLY 80 N 5.00 1.11 2.99 -0.02 0.00 -1.23 -2.06 105.19 110.97 2h6b n GLY 80 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2h6b n GLY 80 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2h6b n ASN 81 N 1.46 -1.03 -4.80 1.61 3.02 0.21 -4.94 115.26 110.79 2h6b n ASN 81 Ca 0.06 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.28 2h6b n ASN 81 Cb 0.36 -0.82 -0.02 0.00 -0.61 0.00 0.00 39.78 38.69 2h6b n ASN 81 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2h6b s SER 82 N -2.54 6.19 -0.08 6.41 0.01 -0.88 -0.49 113.70 122.32 2h6b s SER 82 Ca 0.00 1.84 0.04 0.00 1.31 0.00 0.00 55.95 59.14 2h6b s SER 82 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2h6b s SER 82 CO 0.00 -0.89 -0.22 -0.22 0.41 0.00 0.00 173.24 172.33 2h6b s LEU 83 N -3.91 2.00 -0.31 2.44 2.96 -1.26 -0.80 118.68 119.79 2h6b s LEU 83 Ca 0.65 -0.49 -0.16 0.00 -0.22 0.00 0.00 54.13 53.91 2h6b s LEU 83 Cb -0.15 -1.27 -0.02 0.00 0.50 0.00 0.00 46.19 45.25 2h6b s LEU 83 CO 0.27 0.15 0.40 -0.63 -1.32 0.00 0.00 176.35 175.23 2h6b s ILE 84 N 0.28 5.14 -0.39 6.68 1.01 0.71 -4.94 121.20 129.68 2h6b s ILE 84 Ca -0.14 0.38 -0.01 0.00 0.00 0.00 0.00 60.65 60.89 2h6b s ILE 84 Cb -0.16 -3.79 0.30 0.00 0.01 0.00 0.00 42.46 38.81 2h6b s ILE 84 CO 0.07 0.00 1.95 0.61 0.00 0.00 0.00 174.94 177.57 2h6b n GLY 85 N 4.78 4.39 2.42 6.18 0.00 -1.26 -0.93 105.19 120.77 2h6b n GLY 85 Ca -0.08 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.28 2h6b n GLY 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h6b n LYS 86 N -0.07 4.09 0.20 1.61 5.02 -1.25 -4.66 118.16 123.10 2h6b n LYS 86 Ca 0.38 -2.97 0.08 0.00 -2.02 0.00 0.00 58.31 53.78 2h6b n LYS 86 Cb 0.71 -2.60 0.37 0.00 -0.02 0.00 0.00 35.03 33.49 2h6b n LYS 86 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2h6b h LEU 87 N 5.72 0.00 -8.60 -0.35 5.85 -1.84 -3.03 115.31 113.05 2h6b h LEU 87 Ca 0.70 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 59.11 2h6b h LEU 87 Cb 0.38 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.26 2h6b h LEU 87 CO 1.44 0.29 -0.71 -0.31 -0.34 0.00 0.00 178.44 178.82 2h6b s TYR 88 N -3.56 1.20 0.37 1.25 1.51 -1.26 -3.98 117.35 112.87 2h6b s TYR 88 Ca 0.01 -0.78 -0.28 0.00 -1.01 0.00 0.00 57.07 55.01 2h6b s TYR 88 Cb 0.10 -0.62 -0.11 0.00 -0.11 0.00 0.00 41.96 41.22 2h6b s TYR 88 CO 0.66 0.04 1.51 -2.14 -1.11 0.00 0.00 175.55 174.52 2h6b s PRO 89 N -3.70 4.10 0.47 -1.71 0.02 -1.25 -4.87 135.00 128.06 2h6b s PRO 89 Ca 0.15 2.59 0.04 0.00 0.02 0.00 0.00 61.00 63.80 2h6b s PRO 89 Cb 0.03 -2.97 -0.03 0.00 0.02 0.00 0.00 34.50 31.54 2h6b s PRO 89 CO -0.00 -0.56 0.06 0.95 -0.33 0.00 0.00 177.00 177.11 2h6b s THR 90 N -0.97 1.59 -2.00 0.99 -4.23 -1.26 -5.00 115.64 104.75 2h6b s THR 90 Ca 0.54 -1.92 0.22 0.00 -1.18 0.00 0.00 61.69 59.35 2h6b s THR 90 Cb -0.47 -2.51 0.61 0.00 1.34 0.00 0.00 72.50 71.48 2h6b s THR 90 CO 0.62 0.00 1.68 0.61 -0.54 0.00 0.00 174.62 176.99 2h6b n GLY 91 N -1.22 -0.71 3.74 3.99 0.00 -1.26 -4.86 105.19 104.87 2h6b n GLY 91 Ca -0.11 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 2h6b n GLY 91 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h6b s ASN 92 N -1.96 5.54 -0.24 1.61 0.01 -1.26 -5.07 114.94 113.57 2h6b s ASN 92 Ca 0.32 0.19 -0.19 0.00 -0.71 0.00 0.00 52.86 52.48 2h6b s ASN 92 Cb 0.15 -1.61 -0.03 0.00 0.41 0.00 0.00 41.25 40.17 2h6b s ASN 92 CO 0.25 0.35 0.54 0.20 -1.51 0.00 0.00 177.10 176.94 2h6b s ASN 93 N -1.15 6.50 -0.10 -1.22 0.01 -1.26 -5.03 114.94 112.69 2h6b s ASN 93 Ca 0.16 0.61 0.01 0.00 -0.71 0.00 0.00 52.86 52.93 2h6b s ASN 93 Cb -0.12 -2.30 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 2h6b s ASN 93 CO 0.06 -0.28 -0.14 -0.63 -1.51 0.00 0.00 177.10 174.60 2h6b s ILE 94 N 2.17 2.97 -0.21 0.60 -1.09 -1.26 -0.53 121.20 123.85 2h6b s ILE 94 Ca 0.23 -0.71 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 2h6b s ILE 94 Cb -0.16 -2.21 0.03 0.00 -1.58 0.00 0.00 42.46 38.54 2h6b s ILE 94 CO 0.09 0.55 -0.15 -0.47 -1.23 0.00 0.00 174.94 173.73 2h6b s TYR 95 N 0.01 2.95 -0.03 3.97 6.04 -0.30 -2.52 117.35 127.46 2h6b s TYR 95 Ca -0.04 -1.77 0.03 0.00 0.04 0.00 0.00 57.07 55.33 2h6b s TYR 95 Cb -0.14 -1.95 0.00 0.00 -1.04 0.00 0.00 41.96 38.83 2h6b s TYR 95 CO 0.04 -0.80 -0.12 0.00 -1.54 0.00 0.00 175.55 173.13 2h6b s ALA 96 N 1.26 1.10 0.05 3.97 0.00 -0.23 -0.58 121.76 127.33 2h6b s ALA 96 Ca 0.01 -0.45 0.06 0.00 0.00 0.00 0.00 51.96 51.58 2h6b s ALA 96 Cb -0.15 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 2h6b s ALA 96 CO -0.09 0.18 -0.18 0.95 0.00 0.00 0.00 175.76 176.62 2h6b s THR 97 N 0.17 1.43 0.04 0.00 -4.23 -0.44 0.55 115.64 113.16 2h6b s THR 97 Ca -0.04 -1.14 -0.31 0.00 -1.18 0.00 0.00 61.69 59.03 2h6b s THR 97 Cb -0.10 -1.26 -0.06 0.00 1.34 0.00 0.00 72.50 72.42 2h6b s THR 97 CO 0.01 0.10 1.33 0.00 -0.54 0.00 0.00 174.62 175.51 2h6b s ALA 98 N -0.85 3.53 -0.96 3.99 0.00 -0.14 -1.15 121.76 126.17 2h6b s ALA 98 Ca 0.05 0.91 0.23 0.00 0.00 0.00 0.00 51.96 53.15 2h6b s ALA 98 Cb -0.08 -3.53 0.21 0.00 0.00 0.00 0.00 23.12 19.71 2h6b s ALA 98 CO 0.02 -0.70 1.20 -1.33 0.00 0.00 0.00 175.76 174.95 2h6b n MET 99 N 4.62 0.03 -3.81 0.00 2.81 0.12 -0.02 117.12 120.88 2h6b n MET 99 Ca 0.11 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.95 2h6b n MET 99 Cb 0.44 -1.51 -0.02 0.00 -0.71 0.00 0.00 33.22 31.43 2h6b n MET 99 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 2h6b s GLU 100 N -3.02 1.51 0.04 0.03 -1.05 -1.25 -4.82 118.70 110.14 2h6b s GLU 100 Ca 0.09 -0.84 -0.34 0.00 -0.15 0.00 0.00 54.97 53.73 2h6b s GLU 100 Cb 0.17 0.51 -0.13 0.00 -0.44 0.00 0.00 34.13 34.24 2h6b s GLU 100 CO 0.77 -0.69 1.70 -2.30 0.95 0.00 0.00 175.26 175.69 2h6b n PRO 101 N -0.47 2.10 -3.94 -4.83 -0.02 -1.26 -3.97 135.00 122.61 2h6b n PRO 101 Ca -0.05 0.76 -0.17 0.00 -2.02 0.00 0.00 63.50 62.02 2h6b n PRO 101 Cb 0.60 -2.56 -0.16 0.00 -0.02 0.00 0.00 33.50 31.36 2h6b n PRO 101 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2h6b s THR 102 N 2.33 0.18 -0.16 3.45 2.01 0.16 -4.20 115.64 119.41 2h6b s THR 102 Ca 0.85 0.08 -0.05 0.00 0.31 0.00 0.00 61.69 62.89 2h6b s THR 102 Cb -0.70 -0.28 -0.03 0.00 0.01 0.00 0.00 72.50 71.50 2h6b s THR 102 CO 0.45 0.14 -0.01 -0.60 -0.69 0.00 0.00 174.62 173.91 2h6b s ARG 103 N 1.00 3.76 0.14 4.92 3.52 0.11 -0.68 118.95 131.72 2h6b s ARG 103 Ca -0.10 -0.47 0.08 0.00 -0.13 0.00 0.00 55.73 55.11 2h6b s ARG 103 Cb -0.14 -3.00 -0.04 0.00 -1.56 0.00 0.00 34.95 30.21 2h6b s ARG 103 CO -0.02 0.25 -0.17 0.95 -0.81 0.00 0.00 175.30 175.50 2h6b s THR 104 N 0.38 1.66 -0.16 4.11 -4.23 -0.15 -0.92 115.64 116.34 2h6b s THR 104 Ca -0.02 -1.80 0.01 0.00 -1.18 0.00 0.00 61.69 58.70 2h6b s THR 104 Cb -0.14 -1.71 0.02 0.00 1.34 0.00 0.00 72.50 72.01 2h6b s THR 104 CO 0.02 -0.31 -0.19 0.00 -0.54 0.00 0.00 174.62 173.60 2h6b s TRP 106 N 1.15 3.26 -0.35 0.00 0.52 -0.22 -0.13 118.94 123.17 2h6b s TRP 106 Ca 0.00 0.22 -0.04 0.00 0.02 0.00 0.00 56.10 56.31 2h6b s TRP 106 Cb -0.14 -2.38 0.07 0.00 -1.15 0.00 0.00 33.47 29.87 2h6b s TRP 106 CO -0.08 -0.09 0.11 -0.06 0.02 0.00 0.00 176.95 176.85 2h6b s PHE 107 N 1.55 3.38 1.06 -1.98 0.40 0.46 -1.54 117.98 121.30 2h6b s PHE 107 Ca 0.09 -1.93 -0.13 0.00 -0.60 0.00 0.00 56.93 54.35 2h6b s PHE 107 Cb -0.15 -2.59 0.22 0.00 0.51 0.00 0.00 43.02 41.01 2h6b s PHE 107 CO 0.09 -0.85 1.09 -1.54 0.70 0.00 0.00 175.22 174.70 2h6b s SER 108 N 1.55 2.11 0.19 1.36 1.04 -1.26 -1.34 113.70 117.36 2h6b s SER 108 Ca 0.01 1.11 -0.11 0.00 0.48 0.00 0.00 55.95 57.44 2h6b s SER 108 Cb -0.21 -1.73 0.21 0.00 0.10 0.00 0.00 66.02 64.39 2h6b s SER 108 CO -0.01 -3.44 1.76 -0.08 0.98 0.00 0.00 173.24 172.45 2h6b h GLU 109 N -2.10 0.43 -0.77 4.02 4.81 -1.92 -1.95 114.58 117.11 2h6b h GLU 109 Ca -0.54 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 58.67 2h6b h GLU 109 Cb 1.33 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 2h6b h GLU 109 CO 0.54 0.29 0.50 -0.22 -0.73 0.00 0.00 179.01 179.39 2h6b h LYS 110 N 0.45 1.00 0.00 1.92 1.63 -1.97 -0.25 116.57 119.35 2h6b h LYS 110 Ca 0.27 -0.06 -0.09 0.00 -0.85 0.00 0.00 60.65 59.91 2h6b h LYS 110 Cb 0.26 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 2h6b h LYS 110 CO -0.24 0.66 -0.45 0.66 -3.45 0.00 0.00 179.45 176.63 2h6b h SER 111 N 1.03 0.00 -0.38 4.20 4.64 -1.77 -2.36 113.55 118.90 2h6b h SER 111 Ca 0.28 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.45 2h6b h SER 111 Cb -0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 2h6b h SER 111 CO -0.07 0.45 -0.37 -0.07 -0.87 0.00 0.00 176.83 175.90 2h6b h LEU 112 N 0.00 0.99 -0.44 5.97 3.38 -0.68 0.14 115.31 124.67 2h6b h LEU 112 Ca -0.00 -0.46 0.09 0.00 0.09 0.00 0.00 57.88 57.59 2h6b h LEU 112 Cb 0.89 -0.28 -0.09 0.00 0.09 0.00 0.00 40.66 41.27 2h6b h LEU 112 CO 0.06 1.25 -0.13 0.03 0.09 0.00 0.00 178.44 179.74 2h6b h ARG 113 N 0.75 -0.03 -0.42 1.13 3.08 -0.84 0.25 114.38 118.31 2h6b h ARG 113 Ca 0.06 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.15 2h6b h ARG 113 Cb 0.97 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.99 2h6b h ARG 113 CO 0.09 -0.02 0.21 1.15 -1.07 0.00 0.00 179.97 180.33 2h6b h THR 114 N -0.03 0.97 -0.39 2.04 2.02 -1.19 0.32 112.91 116.65 2h6b h THR 114 Ca 0.21 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.25 2h6b h THR 114 Cb 0.35 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2h6b h THR 114 CO -0.47 0.08 0.26 0.58 0.37 0.00 0.00 175.52 176.33 2h6b h VAL 115 N 0.42 1.10 0.00 3.16 2.07 0.16 -2.65 116.25 120.51 2h6b h VAL 115 Ca 0.18 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 2h6b h VAL 115 Cb 0.08 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2h6b h VAL 115 CO -0.12 0.10 -0.33 -0.26 0.02 0.00 0.00 177.57 176.97 2h6b h PHE 116 N 0.52 0.00 -0.22 1.57 0.04 0.01 0.50 116.94 119.37 2h6b h PHE 116 Ca 0.14 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.83 2h6b h PHE 116 Cb -0.06 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.08 2h6b h PHE 116 CO -0.05 0.33 -0.22 0.00 -0.60 0.00 0.00 178.31 177.78 2h6b h ARG 117 N 0.00 0.41 0.21 1.51 3.08 -0.74 -3.01 114.38 115.84 2h6b h ARG 117 Ca -0.00 -0.14 -0.33 0.00 0.07 0.00 0.00 59.98 59.58 2h6b h ARG 117 Cb 0.72 -0.03 0.02 0.00 0.08 0.00 0.00 29.97 30.76 2h6b h ARG 117 CO 0.04 0.61 -1.51 1.15 -1.07 0.00 0.00 179.97 179.19 2h6b h THR 118 N 0.37 1.23 -2.77 2.04 2.02 -0.91 -3.44 112.91 111.45 2h6b h THR 118 Ca 0.06 -2.72 -0.56 0.00 0.77 0.00 0.00 66.41 63.96 2h6b h THR 118 Cb 0.59 2.95 -0.40 0.00 -1.74 0.00 0.00 68.15 69.55 2h6b h THR 118 CO 0.04 0.83 -0.80 -0.62 0.37 0.00 0.00 175.52 175.34 2h6b s ASP 119 N -7.42 3.39 0.44 4.18 -1.08 0.17 -5.00 116.67 111.35 2h6b s ASP 119 Ca -0.10 -1.75 0.15 0.00 -0.52 0.00 0.00 52.55 50.33 2h6b s ASP 119 Cb 0.05 -0.47 1.08 0.00 -1.46 0.00 0.00 42.92 42.12 2h6b s ASP 119 CO 0.91 -0.38 1.98 -0.08 0.52 0.00 0.00 175.17 178.12 2h6b h GLU 120 N 7.74 0.35 0.00 4.34 4.81 -1.78 -2.67 114.58 127.37 2h6b h GLU 120 Ca -0.08 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2h6b h GLU 120 Cb 0.99 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 2h6b h GLU 120 CO 0.38 0.23 -0.01 -0.44 -0.73 0.00 0.00 179.01 178.44 2h6b h ASP 121 N 0.36 0.00 0.39 1.04 3.32 -1.94 -2.63 116.42 116.95 2h6b h ASP 121 Ca 0.28 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.26 2h6b h ASP 121 Cb 0.62 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 2h6b h ASP 121 CO -0.07 0.01 -0.36 -0.03 -1.72 0.00 0.00 179.24 177.07 2h6b h MET 122 N 0.00 0.00 -0.35 3.56 4.05 -1.86 -2.44 114.93 117.90 2h6b h MET 122 Ca -0.00 0.00 0.07 0.00 -0.28 0.00 0.00 59.70 59.49 2h6b h MET 122 Cb 0.22 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 30.95 2h6b h MET 122 CO 0.00 0.36 -0.08 0.82 0.23 0.00 0.00 176.91 178.23 2h6b h ILE 123 N 0.00 0.66 0.00 1.77 2.04 -1.67 -1.67 117.51 118.64 2h6b h ILE 123 Ca -0.00 -0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.69 2h6b h ILE 123 Cb 0.65 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2h6b h ILE 123 CO 0.05 0.00 -0.79 -0.26 0.00 0.00 0.00 178.15 177.14 2h6b h PHE 124 N 0.00 0.00 -0.74 1.37 -1.00 -1.66 -1.63 116.94 113.29 2h6b h PHE 124 Ca 0.17 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.92 2h6b h PHE 124 Cb 0.25 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.78 2h6b h PHE 124 CO -0.32 0.79 0.35 0.93 -1.61 0.00 0.00 178.31 178.46 2h6b h GLU 125 N 0.00 1.06 -0.09 1.51 4.39 -1.27 0.12 114.58 120.30 2h6b h GLU 125 Ca -0.01 -0.15 -0.22 0.00 0.34 0.00 0.00 59.36 59.33 2h6b h GLU 125 Cb 1.45 -0.20 0.01 0.00 -0.10 0.00 0.00 28.75 29.92 2h6b h GLU 125 CO 0.10 0.82 -0.79 0.82 -1.16 0.00 0.00 179.01 178.81 2h6b h ILE 126 N 1.06 1.30 -0.51 3.13 2.04 -0.78 -2.20 117.51 121.55 2h6b h ILE 126 Ca 0.26 -2.03 0.10 0.00 1.00 0.00 0.00 64.86 64.19 2h6b h ILE 126 Cb 0.11 2.18 -0.08 0.00 -0.74 0.00 0.00 36.82 38.29 2h6b h ILE 126 CO -0.03 0.63 0.03 -0.26 0.00 0.00 0.00 178.15 178.52 2h6b h PHE 127 N 0.37 0.03 -0.82 1.37 0.04 -1.26 -0.28 116.94 116.40 2h6b h PHE 127 Ca -0.07 0.04 0.05 0.00 2.80 0.00 0.00 57.97 60.79 2h6b h PHE 127 Cb 1.43 0.06 -0.06 0.00 2.20 0.00 0.00 35.95 39.59 2h6b h PHE 127 CO 0.10 -0.08 0.51 0.87 -0.60 0.00 0.00 178.31 179.10 2h6b h LYS 128 N 0.15 0.91 -0.18 1.51 1.57 -0.51 0.22 116.57 120.25 2h6b h LYS 128 Ca 0.26 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 2h6b h LYS 128 Cb 0.38 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2h6b h LYS 128 CO -0.40 0.60 0.00 -0.97 -0.57 0.00 0.00 179.45 178.12 2h6b h ASN 129 N 0.94 0.31 -0.59 0.86 -0.73 -0.65 -1.97 115.58 113.76 2h6b h ASN 129 Ca 0.35 -0.31 0.01 0.00 1.87 0.00 0.00 56.30 58.22 2h6b h ASN 129 Cb 0.13 -0.08 -0.03 0.00 0.27 0.00 0.00 38.32 38.61 2h6b h ASN 129 CO -0.16 0.54 0.39 1.88 -0.37 0.00 0.00 177.43 179.71 2h6b h TYR 130 N 0.07 0.73 -0.69 0.67 0.99 -0.91 -2.54 116.97 115.29 2h6b h TYR 130 Ca 0.05 0.02 -0.06 0.00 2.00 0.00 0.00 58.73 60.74 2h6b h TYR 130 Cb 0.38 -0.25 -0.03 0.00 1.00 0.00 0.00 36.73 37.83 2h6b h TYR 130 CO 0.03 0.46 0.21 1.25 -0.00 0.00 0.00 178.16 180.11 2h6b h LEU 131 N 0.79 1.00 -1.02 3.88 5.85 -0.69 -1.29 115.31 123.83 2h6b h LEU 131 Ca 0.22 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.82 2h6b h LEU 131 Cb -0.08 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 40.62 2h6b h LEU 131 CO -0.05 0.93 0.64 0.71 -0.34 0.00 0.00 178.44 180.34 2h6b h THR 132 N 1.03 1.07 -0.23 1.05 1.35 -1.20 -1.14 112.91 114.85 2h6b h THR 132 Ca 0.23 -0.40 -0.06 0.00 -0.55 0.00 0.00 66.41 65.63 2h6b h THR 132 Cb 0.30 -0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 66.53 2h6b h THR 132 CO -0.01 0.21 -0.09 0.11 -0.25 0.00 0.00 175.52 175.50 2h6b h LYS 133 N 1.15 0.46 -0.21 4.72 1.57 -0.84 -1.53 116.57 121.89 2h6b h LYS 133 Ca 0.44 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 59.02 2h6b h LYS 133 Cb 0.20 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2h6b h LYS 133 CO -0.18 0.72 0.11 0.28 -0.57 0.00 0.00 179.45 179.81 2h6b h VAL 134 N 0.18 1.12 -0.50 0.50 2.07 -1.15 -0.85 116.25 117.61 2h6b h VAL 134 Ca 0.05 -0.34 0.08 0.00 0.82 0.00 0.00 66.70 67.32 2h6b h VAL 134 Cb 0.57 0.96 -0.07 0.00 -1.52 0.00 0.00 31.29 31.24 2h6b h VAL 134 CO 0.03 0.12 0.12 0.00 0.02 0.00 0.00 177.57 177.86 2h6b h ALA 135 N 0.99 0.58 0.72 1.67 0.00 -1.24 -0.02 119.26 121.96 2h6b h ALA 135 Ca 0.07 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2h6b h ALA 135 Cb 0.09 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.00 2h6b h ALA 135 CO -0.01 -0.28 -0.35 -0.92 0.00 0.00 0.00 179.25 177.69 2h6b h TYR 136 N 0.27 -0.90 -0.36 0.00 3.20 -1.13 -2.75 116.97 115.30 2h6b h TYR 136 Ca 0.25 -0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.96 2h6b h TYR 136 Cb 0.32 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 2h6b h TYR 136 CO -0.21 -0.54 -0.32 1.88 -1.64 0.00 0.00 178.16 177.33 2h6b h TYR 137 N -1.07 0.93 -0.40 -3.82 -1.99 -1.01 -1.81 116.97 107.79 2h6b h TYR 137 Ca -0.10 -0.25 0.01 0.00 2.00 0.00 0.00 58.73 60.39 2h6b h TYR 137 Cb 0.77 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 39.27 2h6b h TYR 137 CO -0.01 1.01 0.26 0.00 -0.00 0.00 0.00 178.16 179.42 2h6b h ALA 138 N 0.97 0.51 -0.48 3.88 0.00 -1.13 -1.81 119.26 121.19 2h6b h ALA 138 Ca 0.07 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2h6b h ALA 138 Cb 0.87 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2h6b h ALA 138 CO 0.08 -0.04 0.26 -0.09 0.00 0.00 0.00 179.25 179.46 2h6b h ARG 139 N 0.54 0.50 -0.51 0.00 2.43 -1.44 -1.57 114.38 114.33 2h6b h ARG 139 Ca 0.15 -0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.36 2h6b h ARG 139 Cb -0.06 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.32 2h6b h ARG 139 CO -0.04 0.33 0.17 1.96 -1.51 0.00 0.00 179.97 180.89 2h6b h GLN 140 N 0.52 0.33 -0.15 0.20 1.08 -1.02 -0.92 115.11 115.15 2h6b h GLN 140 Ca 0.20 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.39 2h6b h GLN 140 Cb 0.08 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 2h6b h GLN 140 CO -0.12 0.22 0.10 0.28 -0.95 0.00 0.00 178.83 178.35 2h6b h VAL 141 N 0.34 1.06 -0.07 -0.54 2.07 -1.25 -2.93 116.25 114.92 2h6b h VAL 141 Ca 0.25 -0.13 -0.09 0.00 0.82 0.00 0.00 66.70 67.55 2h6b h VAL 141 Cb 0.28 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2h6b h VAL 141 CO -0.26 0.05 -0.35 0.00 0.02 0.00 0.00 177.57 177.03 2h6b h ALA 142 N 1.03 1.28 -0.02 1.67 0.00 -1.05 -2.93 119.26 119.25 2h6b h ALA 142 Ca 0.06 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 2h6b h ALA 142 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2h6b h ALA 142 CO -0.01 0.51 -0.68 1.49 0.00 0.00 0.00 179.25 180.56 2h6b h GLU 143 N 0.13 0.08 -6.67 0.00 4.81 -1.19 -3.44 114.58 108.29 2h6b h GLU 143 Ca 0.01 -0.06 -0.53 0.00 -0.13 0.00 0.00 59.36 58.66 2h6b h GLU 143 Cb 0.69 0.01 0.05 0.00 0.63 0.00 0.00 28.75 30.13 2h6b h GLU 143 CO 0.05 0.72 0.84 -1.64 -0.73 0.00 0.00 179.01 178.25 2h6b s MET 144 N -3.52 4.23 -0.59 1.92 -1.94 -1.11 -4.93 119.30 113.36 2h6b s MET 144 Ca -0.02 2.36 -0.27 0.00 -1.71 0.00 0.00 55.69 56.05 2h6b s MET 144 Cb 0.12 -3.13 -0.02 0.00 2.01 0.00 0.00 34.83 33.82 2h6b s MET 144 CO 0.78 -0.54 1.82 1.21 -0.01 0.00 0.00 175.02 178.28 2h6b s ASN 145 N 0.80 5.37 0.14 3.03 2.47 -1.26 -4.96 114.94 120.53 2h6b s ASN 145 Ca 0.65 0.38 0.07 0.00 0.42 0.00 0.00 52.86 54.39 2h6b s ASN 145 Cb -0.43 -2.53 -0.04 0.00 -1.45 0.00 0.00 41.25 36.80 2h6b s ASN 145 CO 0.37 -2.29 -0.16 0.42 -3.72 0.00 0.00 177.10 171.72 2h6b s THR 146 N 8.71 1.56 0.13 -5.21 -4.23 -1.26 -1.93 115.64 113.40 2h6b s THR 146 Ca 0.66 -1.78 -0.00 0.00 -1.18 0.00 0.00 61.69 59.39 2h6b s THR 146 Cb -0.13 -1.66 -0.04 0.00 1.34 0.00 0.00 72.50 72.01 2h6b s THR 146 CO 0.22 -0.35 0.03 -0.72 -0.54 0.00 0.00 174.62 173.26 2h6b s TYR 147 N -2.03 0.90 -0.28 3.99 -0.85 0.54 -4.79 117.35 114.83 2h6b s TYR 147 Ca 0.11 -1.16 -0.01 0.00 -0.52 0.00 0.00 57.07 55.50 2h6b s TYR 147 Cb -0.06 -0.52 0.14 0.00 0.38 0.00 0.00 41.96 41.90 2h6b s TYR 147 CO 0.05 -0.43 0.32 1.21 -1.52 0.00 0.00 175.55 175.18 2h6b s ASN 148 N -3.06 1.23 0.44 -0.18 3.04 -1.26 -1.07 114.94 114.07 2h6b s ASN 148 Ca 0.22 -0.52 0.18 0.00 0.04 0.00 0.00 52.86 52.78 2h6b s ASN 148 Cb 0.07 0.68 1.11 0.00 -1.54 0.00 0.00 41.25 41.58 2h6b s ASN 148 CO 0.01 -0.37 1.90 -0.65 -3.04 0.00 0.00 177.10 174.95 2h6b h PRO 149 N 8.24 0.35 -0.12 0.43 0.11 -1.98 -1.65 132.00 137.38 2h6b h PRO 149 Ca -0.13 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.99 2h6b h PRO 149 Cb 1.10 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 2h6b h PRO 149 CO 0.31 0.23 0.11 1.79 -0.21 0.00 0.00 178.00 180.23 2h6b h THR 150 N 0.36 0.66 0.00 -1.15 1.35 -1.96 -1.71 112.91 110.46 2h6b h THR 150 Ca 0.41 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 66.26 2h6b h THR 150 Cb 1.05 0.92 -0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2h6b h THR 150 CO -0.13 0.00 -0.02 0.40 -0.25 0.00 0.00 175.52 175.52 2h6b h ILE 151 N 0.00 0.18 -0.54 6.82 2.04 -1.68 -1.13 117.51 123.21 2h6b h ILE 151 Ca 0.06 -0.20 0.09 0.00 1.00 0.00 0.00 64.86 65.81 2h6b h ILE 151 Cb 0.28 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2h6b h ILE 151 CO -0.00 0.02 0.36 0.03 0.00 0.00 0.00 178.15 178.57 2h6b h ARG 152 N 0.00 0.32 -0.32 2.37 3.08 -1.49 0.39 114.38 118.73 2h6b h ARG 152 Ca -0.00 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 2h6b h ARG 152 Cb 0.16 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 2h6b h ARG 152 CO 0.00 0.21 -0.33 0.82 -1.07 0.00 0.00 179.97 179.60 2h6b h ILE 153 N 0.33 1.29 -0.50 2.04 2.04 -1.38 -0.35 117.51 120.98 2h6b h ILE 153 Ca 0.25 -1.51 -0.03 0.00 1.00 0.00 0.00 64.86 64.57 2h6b h ILE 153 Cb 0.54 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 2h6b h ILE 153 CO -0.06 0.49 0.19 -0.07 0.00 0.00 0.00 178.15 178.70 2h6b h LEU 154 N 0.56 0.70 -0.80 1.44 3.38 -1.44 -1.95 115.31 117.18 2h6b h LEU 154 Ca 0.05 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.86 2h6b h LEU 154 Cb 0.92 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 2h6b h LEU 154 CO 0.08 0.69 0.52 -0.09 0.09 0.00 0.00 178.44 179.73 2h6b h ARG 155 N 0.67 1.00 -0.33 1.13 9.65 -0.74 0.14 114.38 125.90 2h6b h ARG 155 Ca 0.17 -0.06 0.01 0.00 -1.10 0.00 0.00 59.98 59.00 2h6b h ARG 155 Cb 0.22 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.55 2h6b h ARG 155 CO -0.01 0.66 0.19 1.25 2.80 0.00 0.00 179.97 184.86 2h6b h LEU 156 N 1.03 0.31 -0.79 3.80 5.85 -0.86 -1.78 115.31 122.87 2h6b h LEU 156 Ca 0.31 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.99 2h6b h LEU 156 Cb -0.03 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 2h6b h LEU 156 CO -0.10 0.23 0.34 -0.26 -0.34 0.00 0.00 178.44 178.31 2h6b h PHE 157 N 0.39 1.19 -0.73 1.25 0.05 -0.54 -1.03 116.94 117.52 2h6b h PHE 157 Ca 0.13 -0.08 -0.04 0.00 3.82 0.00 0.00 57.97 61.80 2h6b h PHE 157 Cb -0.00 -0.36 -0.03 0.00 2.00 0.00 0.00 35.95 37.55 2h6b h PHE 157 CO -0.07 0.89 0.32 -0.92 -0.18 0.00 0.00 178.31 178.34 2h6b h TYR 158 N 1.14 1.09 -0.37 -0.55 3.20 -0.56 0.97 116.97 121.89 2h6b h TYR 158 Ca 0.27 -0.07 -0.05 0.00 3.14 0.00 0.00 58.73 62.01 2h6b h TYR 158 Cb 0.18 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 2h6b h TYR 158 CO 0.02 0.82 0.02 1.49 -1.64 0.00 0.00 178.16 178.87 2h6b h GLU 159 N 1.04 0.64 -0.44 1.82 4.57 -0.90 0.17 114.58 121.48 2h6b h GLU 159 Ca 0.25 -0.19 -0.07 0.00 -1.18 0.00 0.00 59.36 58.16 2h6b h GLU 159 Cb 0.17 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 2h6b h GLU 159 CO -0.02 0.73 -0.02 -0.07 -1.18 0.00 0.00 179.01 178.45 2h6b h LEU 160 N 0.46 0.70 -0.30 1.64 3.38 -0.94 -2.63 115.31 117.62 2h6b h LEU 160 Ca 0.11 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2h6b h LEU 160 Cb 0.43 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2h6b h LEU 160 CO 0.02 0.78 0.02 0.00 0.09 0.00 0.00 178.44 179.35 2h6b h SER 162 N 0.32 0.00 0.06 0.00 4.64 -0.90 0.26 113.55 117.93 2h6b h SER 162 Ca 0.09 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.07 2h6b h SER 162 Cb 0.39 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.44 2h6b h SER 162 CO 0.01 0.14 -1.92 -1.54 -0.87 0.00 0.00 176.83 172.66 2h6b n SER 163 N -3.38 2.02 -0.39 4.97 3.41 -1.00 -4.71 113.62 114.54 2h6b n SER 163 Ca -0.00 0.23 0.08 0.00 -0.26 0.00 0.00 58.87 58.92 2h6b n SER 163 Cb 0.34 -0.83 -0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2h6b n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2h6b n GLN 164 N -3.78 1.61 -2.54 4.33 6.02 0.57 -5.03 117.38 118.56 2h6b n GLN 164 Ca -0.36 -0.84 -0.42 0.00 -0.01 0.00 0.00 57.00 55.37 2h6b n GLN 164 Cb 0.93 -1.30 -0.03 0.00 1.02 0.00 0.00 30.24 30.85 2h6b n GLN 164 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2h6b s GLY 165 N -1.98 2.53 -0.24 1.08 0.00 0.91 -4.60 107.32 105.02 2h6b s GLY 165 Ca 0.14 0.68 -0.10 0.00 0.00 0.00 0.00 44.72 45.44 2h6b s GLY 165 CO 0.43 1.94 0.14 0.54 0.00 0.00 0.00 173.10 176.14 2h6b s LYS 166 N 1.27 3.98 -0.01 2.90 -0.14 -0.29 -4.85 119.74 122.60 2h6b s LYS 166 Ca 0.55 -0.32 -0.30 0.00 -1.36 0.00 0.00 55.97 54.55 2h6b s LYS 166 Cb -0.25 -3.48 -0.07 0.00 -1.68 0.00 0.00 37.83 32.35 2h6b s LYS 166 CO 0.27 0.02 1.77 0.50 -0.76 0.00 0.00 175.35 177.15 2h6b s ARG 167 N 1.14 4.17 -0.24 1.68 6.06 -1.26 -0.51 118.95 129.98 2h6b s ARG 167 Ca 0.07 2.36 0.00 0.00 -2.50 0.00 0.00 55.73 55.66 2h6b s ARG 167 Cb -0.14 -4.02 0.06 0.00 0.06 0.00 0.00 34.95 30.92 2h6b s ARG 167 CO 0.05 -0.88 -0.02 0.08 -2.50 0.00 0.00 175.30 172.03 2h6b s VAL 168 N 4.07 1.35 0.00 7.11 1.01 0.02 -4.95 120.40 129.01 2h6b s VAL 168 Ca 0.79 -1.18 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2h6b s VAL 168 Cb -0.37 -1.70 0.00 0.00 0.00 0.00 0.00 36.38 34.30 2h6b s VAL 168 CO 0.34 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.87 2h6b n GLY 169 N 4.73 3.35 0.97 4.51 0.00 -1.26 -1.04 105.19 116.45 2h6b n GLY 169 Ca -0.10 -0.17 0.04 0.00 0.00 0.00 0.00 46.02 45.79 2h6b n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2h6b n ASP 170 N 3.57 2.72 -4.60 1.61 8.00 -1.26 -4.91 116.55 121.68 2h6b n ASP 170 Ca 0.00 -2.29 -0.27 0.00 0.71 0.00 0.00 54.79 52.94 2h6b n ASP 170 Cb 0.00 -0.47 -0.10 0.00 -0.02 0.00 0.00 41.12 40.52 2h6b n ASP 170 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2h6b s THR 171 N -1.72 2.17 -0.05 -3.53 -4.23 -0.21 -4.74 115.64 103.33 2h6b s THR 171 Ca 0.24 -2.05 0.04 0.00 -1.18 0.00 0.00 61.69 58.74 2h6b s THR 171 Cb 0.17 -2.85 -0.00 0.00 1.34 0.00 0.00 72.50 71.16 2h6b s THR 171 CO 0.10 -0.09 -0.18 -0.31 -0.54 0.00 0.00 174.62 173.59 2h6b s TYR 172 N -2.65 1.85 -0.18 3.99 1.51 -0.34 -0.80 117.35 120.74 2h6b s TYR 172 Ca 0.34 -0.58 -0.02 0.00 -1.01 0.00 0.00 57.07 55.80 2h6b s TYR 172 Cb 0.06 -1.25 -0.01 0.00 -0.11 0.00 0.00 41.96 40.64 2h6b s TYR 172 CO 0.18 -0.21 -0.09 -1.21 -1.11 0.00 0.00 175.55 173.11 2h6b s GLU 173 N 0.13 3.37 -0.23 -0.62 2.02 0.33 -0.77 118.70 122.92 2h6b s GLU 173 Ca -0.07 -0.65 -0.06 0.00 0.02 0.00 0.00 54.97 54.20 2h6b s GLU 173 Cb -0.13 -2.83 -0.03 0.00 0.10 0.00 0.00 34.13 31.24 2h6b s GLU 173 CO 0.03 -0.02 0.04 0.42 0.02 0.00 0.00 175.26 175.75 2h6b s ILE 174 N 0.98 4.13 -0.62 -1.63 1.01 0.11 -1.13 121.20 124.05 2h6b s ILE 174 Ca -0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 60.65 60.24 2h6b s ILE 174 Cb -0.15 -2.91 0.14 0.00 0.01 0.00 0.00 42.46 39.56 2h6b s ILE 174 CO -0.01 0.38 0.61 -0.89 0.00 0.00 0.00 174.94 175.03 2h6b s THR 175 N 1.35 5.21 -0.25 2.92 2.01 -1.26 0.11 115.64 125.72 2h6b s THR 175 Ca 0.05 -1.60 -0.27 0.00 0.31 0.00 0.00 61.69 60.17 2h6b s THR 175 Cb -0.15 -4.40 0.15 0.00 0.01 0.00 0.00 72.50 68.11 2h6b s THR 175 CO 0.02 -0.96 1.17 0.00 -0.69 0.00 0.00 174.62 174.15 2h6b s MET 176 N 1.54 0.36 -0.10 4.92 0.23 -0.50 -5.00 119.30 120.75 2h6b s MET 176 Ca 0.08 0.26 -0.23 0.00 -1.03 0.00 0.00 55.69 54.77 2h6b s MET 176 Cb -0.24 0.17 -0.03 0.00 -1.53 0.00 0.00 34.83 33.20 2h6b s MET 176 CO 0.01 -0.08 0.70 -1.25 -2.03 0.00 0.00 175.02 172.37 2h6b s PRO 177 N -0.40 4.38 -0.23 3.16 0.04 -1.26 -3.64 135.00 137.05 2h6b s PRO 177 Ca 0.04 0.84 -0.03 0.00 0.04 0.00 0.00 61.00 61.89 2h6b s PRO 177 Cb -0.03 -3.49 0.10 0.00 0.04 0.00 0.00 34.50 31.13 2h6b s PRO 177 CO -0.06 -0.04 0.23 -1.17 0.04 0.00 0.00 177.00 176.00 2h6b s LEU 178 N 1.16 -0.08 0.63 -3.56 2.96 -1.26 -5.05 118.68 113.48 2h6b s LEU 178 Ca 0.36 -0.44 -0.15 0.00 -0.22 0.00 0.00 54.13 53.68 2h6b s LEU 178 Cb -0.17 0.34 -0.02 0.00 0.50 0.00 0.00 46.19 46.84 2h6b s LEU 178 CO 0.16 -0.35 1.08 -0.94 -1.32 0.00 0.00 176.35 174.98 2h6b s SER 179 N 2.31 5.48 0.31 3.68 1.04 -1.26 -4.90 113.70 120.35 2h6b s SER 179 Ca 0.08 1.87 0.03 0.00 0.48 0.00 0.00 55.95 58.41 2h6b s SER 179 Cb -0.15 -2.54 0.63 0.00 0.10 0.00 0.00 66.02 64.06 2h6b s SER 179 CO -0.19 -1.38 1.86 1.56 0.98 0.00 0.00 173.24 176.07 2h6b h GLN 180 N 0.18 0.89 0.25 4.02 4.20 -1.98 -1.49 115.11 121.17 2h6b h GLN 180 Ca -0.47 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.18 2h6b h GLN 180 Cb 1.23 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.81 2h6b h GLN 180 CO 0.56 0.59 -0.12 -0.22 -0.67 0.00 0.00 178.83 178.97 2h6b h LYS 181 N 0.92 -0.32 -0.91 1.46 3.64 -1.93 -1.60 116.57 117.83 2h6b h LYS 181 Ca 0.47 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.93 2h6b h LYS 181 Cb 0.52 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.35 2h6b h LYS 181 CO -0.23 -0.20 0.58 0.77 -2.27 0.00 0.00 179.45 178.09 2h6b h SER 182 N -0.35 0.91 -0.44 4.20 0.02 -1.89 -1.01 113.55 114.99 2h6b h SER 182 Ca -0.03 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2h6b h SER 182 Cb 0.27 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2h6b h SER 182 CO 0.06 0.58 0.26 0.40 -1.14 0.00 0.00 176.83 176.99 2h6b h ILE 183 N 1.05 1.14 -0.48 3.27 2.04 -0.96 -1.59 117.51 121.97 2h6b h ILE 183 Ca 0.40 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.99 2h6b h ILE 183 Cb 0.17 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 2h6b h ILE 183 CO -0.17 0.14 0.19 1.23 0.00 0.00 0.00 178.15 179.54 2h6b h GLY 184 N 0.58 0.65 1.00 5.37 0.00 -0.80 -2.24 103.07 107.64 2h6b h GLY 184 Ca 0.16 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 2h6b h GLY 184 CO -0.03 0.03 0.34 0.83 0.00 0.00 0.00 176.54 177.71 2h6b h GLU 185 N 0.37 0.96 -0.34 4.80 5.08 -0.91 0.20 114.58 124.75 2h6b h GLU 185 Ca 0.23 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 2h6b h GLU 185 Cb 0.22 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2h6b h GLU 185 CO -0.22 0.75 -0.02 0.82 -1.00 0.00 0.00 179.01 179.34 2h6b h ILE 186 N 0.93 1.26 -0.00 3.13 2.04 -1.24 -3.22 117.51 120.41 2h6b h ILE 186 Ca 0.23 -1.01 0.00 0.00 1.00 0.00 0.00 64.86 65.08 2h6b h ILE 186 Cb 0.09 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2h6b h ILE 186 CO -0.03 0.33 -0.42 0.35 0.00 0.00 0.00 178.15 178.38 2h6b n THR 187 N -4.50 0.00 -3.33 -0.27 -2.24 -0.85 -4.97 114.28 98.12 2h6b n THR 187 Ca -0.02 -0.05 -0.18 0.00 -2.27 0.00 0.00 64.05 61.53 2h6b n THR 187 Cb 0.29 0.35 0.07 0.00 -2.10 0.00 0.00 70.33 68.94 2h6b n THR 187 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h6b n GLY 188 N 1.44 -0.28 3.13 3.38 0.00 0.61 -4.99 105.19 108.46 2h6b n GLY 188 Ca 0.08 0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 2h6b n GLY 188 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2h6b s VAL 189 N -3.29 1.10 0.19 1.61 -7.23 -0.67 -5.05 120.40 107.06 2h6b s VAL 189 Ca 0.28 -0.86 -0.32 0.00 -1.81 0.00 0.00 61.98 59.27 2h6b s VAL 189 Cb -0.12 -0.97 -0.15 0.00 0.56 0.00 0.00 36.38 35.69 2h6b s VAL 189 CO 0.62 0.11 1.14 1.57 -0.31 0.00 0.00 175.10 178.22 2h6b n HIS 190 N 2.19 1.28 -0.36 2.82 -0.00 -1.26 -4.37 115.22 115.51 2h6b n HIS 190 Ca -0.17 0.68 0.27 0.00 -0.00 0.00 0.00 57.72 58.50 2h6b n HIS 190 Cb 0.55 -2.27 0.53 0.00 -0.00 0.00 0.00 29.99 28.79 2h6b n HIS 190 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2h6b h HIS 191 N 3.16 0.75 -0.08 1.57 2.76 -1.92 -1.56 115.15 119.82 2h6b h HIS 191 Ca -0.42 0.03 -0.19 0.00 -2.20 0.00 0.00 60.37 57.58 2h6b h HIS 191 Cb 1.34 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 30.10 2h6b h HIS 191 CO 0.53 -0.10 -0.76 0.28 -1.30 0.00 0.00 177.93 176.57 2h6b h VAL 192 N 0.29 1.37 -0.53 5.26 2.07 -1.96 -1.20 116.25 121.55 2h6b h VAL 192 Ca 0.71 -2.15 -0.12 0.00 0.82 0.00 0.00 66.70 65.96 2h6b h VAL 192 Cb 1.85 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 33.74 2h6b h VAL 192 CO -0.46 0.65 -0.13 0.74 0.02 0.00 0.00 177.57 178.39 2h6b h THR 193 N 0.31 1.27 -0.34 2.57 2.02 -1.68 -2.73 112.91 114.33 2h6b h THR 193 Ca -0.04 -1.29 0.01 0.00 0.77 0.00 0.00 66.41 65.86 2h6b h THR 193 Cb 1.35 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.75 2h6b h THR 193 CO 0.13 0.45 0.22 0.58 0.37 0.00 0.00 175.52 177.27 2h6b h VAL 194 N 0.89 1.07 -0.46 3.16 2.07 -1.07 0.23 116.25 122.14 2h6b h VAL 194 Ca 0.13 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.59 2h6b h VAL 194 Cb 0.70 0.59 -0.08 0.00 -1.52 0.00 0.00 31.29 30.97 2h6b h VAL 194 CO 0.05 0.08 -0.09 0.28 0.02 0.00 0.00 177.57 177.91 2h6b h SER 195 N 0.44 -0.38 -0.75 0.57 0.02 -1.16 -0.76 113.55 111.54 2h6b h SER 195 Ca 0.13 0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.19 2h6b h SER 195 Cb -0.04 0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 2h6b h SER 195 CO -0.04 -0.13 0.39 0.03 -1.14 0.00 0.00 176.83 175.93 2h6b h ARG 196 N 0.02 1.06 -0.21 3.45 3.08 -1.15 -0.27 114.38 120.36 2h6b h ARG 196 Ca 0.22 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.14 2h6b h ARG 196 Cb 0.34 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 2h6b h ARG 196 CO -0.45 0.81 0.11 0.28 -1.07 0.00 0.00 179.97 179.65 2h6b h VAL 197 N 1.05 1.00 -0.37 2.04 2.07 -0.43 -1.52 116.25 120.09 2h6b h VAL 197 Ca 0.26 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.58 2h6b h VAL 197 Cb 0.08 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2h6b h VAL 197 CO -0.04 0.04 -0.25 -0.07 0.02 0.00 0.00 177.57 177.28 2h6b h LEU 198 N 0.23 0.76 -0.53 2.57 3.38 -1.01 -1.49 115.31 119.22 2h6b h LEU 198 Ca 0.09 -0.28 0.07 0.00 0.09 0.00 0.00 57.88 57.84 2h6b h LEU 198 Cb 0.01 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.50 2h6b h LEU 198 CO -0.05 0.97 0.22 0.00 0.09 0.00 0.00 178.44 179.67 2h6b h ALA 199 N 1.08 0.67 -0.33 1.53 0.00 -0.87 -1.97 119.26 119.37 2h6b h ALA 199 Ca 0.09 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2h6b h ALA 199 Cb 0.75 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2h6b h ALA 199 CO 0.06 -0.17 0.19 0.00 0.00 0.00 0.00 179.25 179.33 2h6b h LEU 201 N 0.42 0.94 -0.07 0.00 3.38 -1.04 -0.96 115.31 117.97 2h6b h LEU 201 Ca 0.12 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 2h6b h LEU 201 Cb 0.03 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2h6b h LEU 201 CO -0.02 0.58 -0.19 0.50 0.09 0.00 0.00 178.44 179.40 2h6b h LYS 202 N 1.05 0.26 -0.07 1.13 3.64 -0.67 0.25 116.57 122.16 2h6b h LYS 202 Ca 0.43 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.64 2h6b h LYS 202 Cb 0.27 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2h6b h LYS 202 CO -0.18 0.79 -0.02 -0.09 -2.27 0.00 0.00 179.45 177.67 2h6b h ARG 203 N -0.23 -0.01 -0.09 1.90 1.12 -1.03 -2.07 114.38 113.98 2h6b h ARG 203 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 2h6b h ARG 203 Cb 0.80 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.76 2h6b h ARG 203 CO 0.04 -0.01 0.00 0.39 -3.11 0.00 0.00 179.97 177.28 2h6b n GLU 204 N -5.14 0.99 -3.71 0.20 -0.58 -0.40 -4.90 120.64 107.11 2h6b n GLU 204 Ca -0.05 0.00 -0.24 0.00 -0.42 0.00 0.00 57.16 56.45 2h6b n GLU 204 Cb 0.07 -1.04 0.05 0.00 -0.57 0.00 0.00 31.44 29.95 2h6b n GLU 204 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2h6b n ASN 205 N -0.46 -3.71 -0.11 1.62 3.02 -0.78 -4.90 115.26 109.95 2h6b n ASN 205 Ca 0.00 -0.71 -0.20 0.00 -0.03 0.00 0.00 54.58 53.63 2h6b n ASN 205 Cb 0.02 -4.38 -0.09 0.00 -0.61 0.00 0.00 39.78 34.72 2h6b n ASN 205 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2h6b n ILE 206 N -4.56 1.51 -3.61 2.41 2.08 0.83 -4.05 119.36 113.97 2h6b n ILE 206 Ca -0.11 -0.08 -0.12 0.00 0.56 0.00 0.00 62.75 62.99 2h6b n ILE 206 Cb 0.60 -2.08 -0.07 0.00 -0.75 0.00 0.00 39.64 37.35 2h6b n ILE 206 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 2h6b s LEU 207 N -7.82 -0.58 -0.13 1.39 0.20 -0.98 -0.47 118.68 110.29 2h6b s LEU 207 Ca -0.30 1.01 0.01 0.00 0.69 0.00 0.00 54.13 55.54 2h6b s LEU 207 Cb 0.08 2.19 0.02 0.00 -0.43 0.00 0.00 46.19 48.04 2h6b s LEU 207 CO 0.49 -0.27 -0.16 -0.62 -0.29 0.00 0.00 176.35 175.50 2h6b s ASP 208 N -0.06 2.63 -0.42 3.68 2.15 0.22 -1.93 116.67 122.94 2h6b s ASP 208 Ca -0.01 -0.48 -0.13 0.00 0.43 0.00 0.00 52.55 52.37 2h6b s ASP 208 Cb -0.04 -1.18 0.04 0.00 -0.30 0.00 0.00 42.92 41.45 2h6b s ASP 208 CO -0.00 -0.01 0.29 -0.75 -0.17 0.00 0.00 175.17 174.53 2h6b s LYS 209 N 1.21 2.88 0.58 4.34 2.36 -1.26 -0.38 119.74 129.47 2h6b s LYS 209 Ca -0.01 -1.17 0.10 0.00 -2.55 0.00 0.00 55.97 52.33 2h6b s LYS 209 Cb -0.14 -3.92 0.09 0.00 -1.05 0.00 0.00 37.83 32.81 2h6b s LYS 209 CO -0.06 -0.83 0.80 0.15 1.55 0.00 0.00 175.35 176.97 2h6b s LYS 210 N 1.60 2.27 0.20 4.03 1.02 0.11 -5.02 119.74 123.95 2h6b s LYS 210 Ca 0.04 -1.64 -0.11 0.00 0.02 0.00 0.00 55.97 54.27 2h6b s LYS 210 Cb -0.21 -2.64 0.17 0.00 -0.52 0.00 0.00 37.83 34.63 2h6b s LYS 210 CO 0.07 -0.89 1.83 1.57 -0.92 0.00 0.00 175.35 177.01 2h6b h LYS 211 N 0.15 0.72 0.00 1.68 2.10 -1.94 -3.30 116.57 115.97 2h6b h LYS 211 Ca -0.30 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 2h6b h LYS 211 Cb 1.29 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 2h6b h LYS 211 CO 0.41 0.48 0.00 0.09 -2.00 0.00 0.00 179.45 178.42 2h6b n ASN 212 N -4.73 1.04 -3.90 7.07 3.02 -1.26 -4.10 115.26 112.40 2h6b n ASN 212 Ca 0.06 -1.35 -0.11 0.00 -0.03 0.00 0.00 54.58 53.16 2h6b n ASN 212 Cb 0.10 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.15 2h6b n ASN 212 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2h6b s LYS 213 N -0.35 0.27 -0.17 3.52 2.20 -1.24 -1.41 119.74 122.57 2h6b s LYS 213 Ca 0.00 -0.30 0.00 0.00 -0.36 0.00 0.00 55.97 55.31 2h6b s LYS 213 Cb 0.00 0.11 0.01 0.00 -1.51 0.00 0.00 37.83 36.43 2h6b s LYS 213 CO 0.00 -0.05 -0.16 0.42 -0.36 0.00 0.00 175.35 175.20 2h6b s ILE 214 N -0.89 2.52 -0.25 5.43 1.01 0.12 0.04 121.20 129.18 2h6b s ILE 214 Ca -0.10 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 59.65 2h6b s ILE 214 Cb -0.06 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 2h6b s ILE 214 CO 0.00 0.51 0.14 -0.63 0.00 0.00 0.00 174.94 174.96 2h6b s ILE 215 N 1.07 5.04 -0.37 2.92 1.01 0.49 0.06 121.20 131.42 2h6b s ILE 215 Ca -0.01 0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.59 2h6b s ILE 215 Cb -0.14 -3.36 0.01 0.00 0.01 0.00 0.00 42.46 38.97 2h6b s ILE 215 CO -0.05 0.32 0.24 -0.69 0.00 0.00 0.00 174.94 174.76 2h6b s VAL 216 N 1.36 5.04 0.05 2.92 1.01 0.05 0.70 120.40 131.53 2h6b s VAL 216 Ca 0.06 -0.52 0.09 0.00 0.00 0.00 0.00 61.98 61.61 2h6b s VAL 216 Cb -0.15 -3.70 -0.22 0.00 0.00 0.00 0.00 36.38 32.31 2h6b s VAL 216 CO 0.06 -0.14 1.02 1.88 0.00 0.00 0.00 175.10 177.92 2h6b h TYR 217 N 8.50 0.03 -2.37 5.22 -1.99 -1.02 -0.88 116.97 124.46 2h6b h TYR 217 Ca -0.29 -0.02 -0.56 0.00 2.00 0.00 0.00 58.73 59.86 2h6b h TYR 217 Cb 1.13 -0.00 -0.37 0.00 2.00 0.00 0.00 36.73 39.49 2h6b h TYR 217 CO 0.60 1.02 -0.91 1.21 -0.00 0.00 0.00 178.16 180.08 2h6b s ASN 218 N -6.48 1.77 0.17 3.88 3.84 -0.85 -4.71 114.94 112.56 2h6b s ASN 218 Ca -0.02 -2.69 -0.15 0.00 0.21 0.00 0.00 52.86 50.21 2h6b s ASN 218 Cb 0.09 -0.30 0.09 0.00 -0.55 0.00 0.00 41.25 40.58 2h6b s ASN 218 CO 0.82 -0.21 1.77 0.25 -2.79 0.00 0.00 177.10 176.95 2h6b h LEU 219 N 6.10 0.28 -0.43 3.21 5.85 -1.84 0.39 115.31 128.87 2h6b h LEU 219 Ca 0.19 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 2h6b h LEU 219 Cb 0.94 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 2h6b h LEU 219 CO 0.32 0.20 0.24 1.23 -0.34 0.00 0.00 178.44 180.09 2h6b h GLY 220 N 0.41 0.63 1.00 3.75 0.00 -1.99 0.17 103.07 107.04 2h6b h GLY 220 Ca 0.19 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.21 2h6b h GLY 220 CO -0.14 0.27 0.26 -2.09 0.00 0.00 0.00 176.54 174.83 2h6b h GLU 221 N 0.56 0.91 -0.04 4.80 4.81 -1.92 -1.42 114.58 122.27 2h6b h GLU 221 Ca 0.15 -0.16 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2h6b h GLU 221 Cb 0.04 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 2h6b h GLU 221 CO -0.03 0.76 -0.12 1.25 -0.73 0.00 0.00 179.01 180.14 2h6b h LEU 222 N 0.85 -0.37 -0.06 1.64 5.85 -0.42 0.92 115.31 123.73 2h6b h LEU 222 Ca 0.21 0.06 0.04 0.00 0.84 0.00 0.00 57.88 59.03 2h6b h LEU 222 Cb 0.18 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2h6b h LEU 222 CO -0.02 -0.17 -0.29 0.50 -0.34 0.00 0.00 178.44 178.12 2h6b h LYS 223 N -0.19 -0.39 -0.18 1.25 3.64 -0.51 0.28 116.57 120.47 2h6b h LYS 223 Ca 0.06 0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.29 2h6b h LYS 223 Cb 0.27 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2h6b h LYS 223 CO -0.15 -0.26 -0.60 0.45 -2.27 0.00 0.00 179.45 176.61 2h6b h HIS 224 N -0.40 0.78 -0.90 1.91 3.86 -1.01 -1.42 115.15 117.97 2h6b h HIS 224 Ca 0.08 -0.29 0.06 0.00 -1.16 0.00 0.00 60.37 59.06 2h6b h HIS 224 Cb 0.52 -0.14 -0.06 0.00 1.06 0.00 0.00 27.41 28.79 2h6b h HIS 224 CO -0.35 1.06 0.58 -0.07 0.86 0.00 0.00 177.93 180.02 2h6b h LEU 225 N 0.45 0.90 -0.93 2.43 3.38 -0.66 -2.49 115.31 118.39 2h6b h LEU 225 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2h6b h LEU 225 Cb 1.17 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2h6b h LEU 225 CO 0.12 0.58 0.00 0.77 0.09 0.00 0.00 178.44 180.00 2h6b h SER 226 N 1.02 0.00 1.46 -0.43 4.64 0.59 -3.09 113.55 117.74 2h6b h SER 226 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 2h6b h SER 226 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2h6b h SER 226 CO -0.14 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.20 2h6b n GLU 227 N -2.57 0.26 -0.94 4.77 1.02 -0.77 -4.68 120.64 117.73 2h6b n GLU 227 Ca 0.02 0.22 -0.32 0.00 -0.02 0.00 0.00 57.16 57.06 2h6b n GLU 227 Cb 0.27 -1.81 0.14 0.00 -0.02 0.00 0.00 31.44 30.03 2h6b n GLU 227 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2h6b s GLN 228 N -3.11 1.43 0.00 3.49 -0.21 -1.17 -5.12 119.66 114.97 2h6b s GLN 228 Ca 0.11 1.57 0.00 0.00 0.02 0.00 0.00 55.36 57.06 2h6b s GLN 228 Cb 0.12 -1.77 0.00 0.00 1.00 0.00 0.00 33.01 32.36 2h6b s GLN 228 CO 0.59 -2.33 0.00 0.25 -2.12 0.00 0.00 175.29 171.68 2h6b n THR 229 N -3.77 0.00 0.00 -0.19 -2.24 -1.26 -5.00 114.28 101.82 2h6b n THR 229 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2h6b n THR 229 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2h6b n THR 229 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2h6b n SER 239 N 0.00 0.00 -4.45 3.42 7.64 -1.19 -4.79 113.62 114.25 2h6b n SER 239 Ca 0.00 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.50 2h6b n SER 239 Cb 0.00 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.08 2h6b n SER 239 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2h6b s VAL 240 N 0.00 4.62 -0.43 0.44 1.01 -0.81 -4.97 120.40 120.26 2h6b s VAL 240 Ca 0.00 -0.36 -0.28 0.00 0.00 0.00 0.00 61.98 61.33 2h6b s VAL 240 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 33.06 2h6b s VAL 240 CO 0.00 0.10 1.54 -0.62 0.00 0.00 0.00 175.10 176.12 2h6b s ASP 241 N 1.62 6.12 0.18 3.32 -1.08 -1.26 -0.34 116.67 125.24 2h6b s ASP 241 Ca 0.05 0.83 0.01 0.00 -0.52 0.00 0.00 52.55 52.91 2h6b s ASP 241 Cb -0.17 -2.54 0.08 0.00 -1.46 0.00 0.00 42.92 38.83 2h6b s ASP 241 CO 0.06 -1.61 1.44 0.11 0.52 0.00 0.00 175.17 175.69 2h6b h LYS 242 N 11.57 0.32 0.20 4.34 1.57 -1.51 -1.59 116.57 131.48 2h6b h LYS 242 Ca -0.29 -0.27 0.01 0.00 -1.87 0.00 0.00 60.65 58.23 2h6b h LYS 242 Cb 1.12 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.47 2h6b h LYS 242 CO 1.10 0.93 -0.27 1.25 -0.57 0.00 0.00 179.45 181.88 2h6b h LEU 243 N 0.21 -0.75 -0.71 2.94 5.85 -1.91 -0.31 115.31 120.63 2h6b h LEU 243 Ca -0.03 0.08 0.11 0.00 0.84 0.00 0.00 57.88 58.88 2h6b h LEU 243 Cb 1.33 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 42.54 2h6b h LEU 243 CO 0.12 -0.38 0.31 0.00 -0.34 0.00 0.00 178.44 178.16 2h6b h ALA 244 N 0.14 0.98 -0.47 1.25 0.00 -1.92 -1.30 119.26 117.95 2h6b h ALA 244 Ca 0.01 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2h6b h ALA 244 Cb 0.52 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2h6b h ALA 244 CO -0.11 -0.14 0.14 0.00 0.00 0.00 0.00 179.25 179.14 2h6b h ALA 245 N 1.48 0.62 -0.81 0.00 0.00 -0.93 0.21 119.26 119.83 2h6b h ALA 245 Ca 0.37 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2h6b h ALA 245 Cb 0.48 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2h6b h ALA 245 CO -0.33 0.29 0.53 0.00 0.00 0.00 0.00 179.25 179.73 2h6b h ALA 246 N 0.99 1.05 0.00 0.00 0.00 -0.70 -3.13 119.26 117.47 2h6b h ALA 246 Ca 0.15 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 2h6b h ALA 246 Cb 0.29 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2h6b h ALA 246 CO -0.00 0.39 -0.54 -0.07 0.00 0.00 0.00 179.25 179.03 2h6b h LEU 247 N 1.05 0.00 -2.08 0.00 3.38 -0.90 -3.39 115.31 113.37 2h6b h LEU 247 Ca 0.31 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.37 2h6b h LEU 247 Cb -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2h6b h LEU 247 CO -0.09 0.54 0.27 -0.78 0.09 0.00 0.00 178.44 178.47 2h6b h ASP 248 N 0.00 0.00 -0.68 -0.43 3.58 -0.90 -1.68 116.42 116.31 2h6b h ASP 248 Ca -0.01 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.27 2h6b h ASP 248 Cb 1.20 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 42.14 2h6b h ASP 248 CO 0.07 0.00 0.21 1.41 -2.88 0.00 0.00 179.24 178.05 2h6b n HIS 249 N -4.12 2.30 0.00 0.28 8.25 -1.26 -4.93 115.22 115.74 2h6b n HIS 249 Ca 0.05 -1.13 0.00 0.00 -0.26 0.00 0.00 57.72 56.38 2h6b n HIS 249 Cb 0.44 -0.64 0.00 0.00 1.12 0.00 0.00 29.99 30.90 2h6b n HIS 249 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59