#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i3o n THR 9 N 0.00 1.53 -4.19 2.52 -2.24 0.25 -4.98 114.28 107.17 3i3o n THR 9 Ca 0.00 -0.73 -0.12 0.00 -2.27 0.00 0.00 64.05 60.93 3i3o n THR 9 Cb 0.00 -1.06 -0.10 0.00 -2.10 0.00 0.00 70.33 67.07 3i3o n THR 9 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3i3o s MET 10 N -2.53 0.93 0.24 -0.78 1.00 -0.97 -5.04 119.30 112.14 3i3o s MET 10 Ca -0.18 -1.40 -0.30 0.00 0.00 0.00 0.00 55.69 53.80 3i3o s MET 10 Cb 0.07 -0.23 -0.10 0.00 0.00 0.00 0.00 34.83 34.57 3i3o s MET 10 CO 0.75 -0.05 1.50 -2.14 0.00 0.00 0.00 175.02 175.08 3i3o s PRO 11 N -3.86 4.22 -0.10 2.03 0.02 -1.26 -4.28 135.00 131.77 3i3o s PRO 11 Ca 0.16 2.37 -0.29 0.00 0.02 0.00 0.00 61.00 63.26 3i3o s PRO 11 Cb 0.05 -3.10 -0.06 0.00 0.02 0.00 0.00 34.50 31.41 3i3o s PRO 11 CO -0.02 -0.51 1.88 0.00 -0.33 0.00 0.00 177.00 178.02 3i3o s ALA 12 N 0.29 3.31 0.19 -1.55 0.00 -1.26 -4.52 121.76 118.21 3i3o s ALA 12 Ca 0.63 0.91 -0.17 0.00 0.00 0.00 0.00 51.96 53.33 3i3o s ALA 12 Cb -0.44 -3.88 0.03 0.00 0.00 0.00 0.00 23.12 18.83 3i3o s ALA 12 CO 0.41 -1.92 0.51 1.14 0.00 0.00 0.00 175.76 175.89 3i3o s GLN 13 N 4.88 1.35 -0.13 0.00 -2.07 -1.25 -5.01 119.66 117.42 3i3o s GLN 13 Ca 0.84 -0.86 -0.26 0.00 -1.82 0.00 0.00 55.36 53.25 3i3o s GLN 13 Cb -0.34 0.51 0.06 0.00 -1.09 0.00 0.00 33.01 32.15 3i3o s GLN 13 CO 0.35 -0.57 0.64 -1.58 -1.32 0.00 0.00 175.29 172.82 3i3o s HIS 14 N -3.87 -0.65 -0.10 9.60 2.46 -1.26 -4.01 115.29 117.46 3i3o s HIS 14 Ca 0.09 1.33 0.03 0.00 0.47 0.00 0.00 55.06 56.98 3i3o s HIS 14 Cb -0.01 0.32 -0.01 0.00 -0.13 0.00 0.00 32.58 32.75 3i3o s HIS 14 CO -0.03 -0.48 -0.18 -0.65 -2.47 0.00 0.00 174.74 170.92 3i3o s GLN 15 N -0.56 3.01 -0.00 2.88 -0.21 -0.00 -4.95 119.66 119.83 3i3o s GLN 15 Ca -0.07 -0.78 0.03 0.00 0.02 0.00 0.00 55.36 54.56 3i3o s GLN 15 Cb -0.02 -2.42 0.09 0.00 1.00 0.00 0.00 33.01 31.66 3i3o s GLN 15 CO 0.06 0.30 1.00 -1.71 -2.12 0.00 0.00 175.29 172.82 3i3o n ASN 16 N 3.24 0.68 -3.84 5.90 2.85 -1.26 -4.33 115.26 118.50 3i3o n ASN 16 Ca -0.18 -2.02 -0.12 0.00 -0.11 0.00 0.00 54.58 52.15 3i3o n ASN 16 Cb 0.53 -0.14 -0.12 0.00 1.24 0.00 0.00 39.78 41.29 3i3o n ASN 16 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 3i3o s LYS 17 N -1.77 0.28 -0.03 1.20 2.20 -1.26 -5.15 119.74 115.21 3i3o s LYS 17 Ca 0.06 -0.02 0.04 0.00 -0.36 0.00 0.00 55.97 55.69 3i3o s LYS 17 Cb 0.04 0.13 -0.00 0.00 -1.51 0.00 0.00 37.83 36.48 3i3o s LYS 17 CO 0.04 -0.05 -0.15 -1.14 -0.36 0.00 0.00 175.35 173.69 3i3o s GLN 18 N -0.46 1.46 0.35 4.03 0.74 -1.26 -3.81 119.66 120.72 3i3o s GLN 18 Ca -0.05 -0.52 -0.28 0.00 0.05 0.00 0.00 55.36 54.55 3i3o s GLN 18 Cb -0.04 -1.32 -0.10 0.00 1.10 0.00 0.00 33.01 32.65 3i3o s GLN 18 CO 0.01 0.23 1.38 -1.25 -0.55 0.00 0.00 175.29 175.11 3i3o s PRO 19 N -0.01 4.24 0.92 1.67 0.04 -1.26 -5.16 135.00 135.44 3i3o s PRO 19 Ca -0.01 2.35 -0.11 0.00 0.04 0.00 0.00 61.00 63.27 3i3o s PRO 19 Cb -0.10 -3.01 0.15 0.00 0.04 0.00 0.00 34.50 31.58 3i3o s PRO 19 CO 0.01 -0.34 1.09 0.20 0.04 0.00 0.00 177.00 178.00 3i3o s GLY 20 N -0.37 1.63 -0.25 0.56 0.00 -1.25 -5.01 107.32 102.64 3i3o s GLY 20 Ca 0.51 0.11 -0.05 0.00 0.00 0.00 0.00 44.72 45.28 3i3o s GLY 20 CO 0.57 0.60 0.02 -0.42 0.00 0.00 0.00 173.10 173.86 3i3o s ILE 21 N -2.80 3.70 0.32 0.90 1.01 -1.26 -4.88 121.20 118.19 3i3o s ILE 21 Ca 0.65 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.78 3i3o s ILE 21 Cb -0.20 -2.78 0.28 0.00 0.01 0.00 0.00 42.46 39.77 3i3o s ILE 21 CO 0.58 0.28 1.94 -0.08 0.00 0.00 0.00 174.94 177.67 3i3o h GLU 22 N 8.17 0.94 0.00 2.79 4.81 -1.95 -2.42 114.58 126.91 3i3o h GLU 22 Ca -0.37 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 3i3o h GLU 22 Cb 1.15 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.32 3i3o h GLU 22 CO 0.59 0.62 0.00 0.66 -0.73 0.00 0.00 179.01 180.16 3i3o h SER 23 N 0.97 0.00 0.24 1.04 4.64 -1.98 -1.78 113.55 116.68 3i3o h SER 23 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 3i3o h SER 23 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3i3o h SER 23 CO -0.11 0.00 -0.86 0.18 -0.87 0.00 0.00 176.83 175.17 3i3o n LEU 24 N -2.34 0.74 -4.78 5.97 4.77 -0.91 -4.99 117.00 115.46 3i3o n LEU 24 Ca -0.01 -0.23 -0.37 0.00 -0.03 0.00 0.00 56.01 55.36 3i3o n LEU 24 Cb 0.06 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.00 3i3o n LEU 24 CO 0.12 0.16 0.74 -0.04 -1.33 0.00 0.00 177.39 177.04 3i3o s MET 25 N -3.05 4.23 -0.20 3.23 -1.94 -0.67 -5.06 119.30 115.83 3i3o s MET 25 Ca 0.08 1.54 -0.00 0.00 -1.71 0.00 0.00 55.69 55.59 3i3o s MET 25 Cb 0.16 -2.62 0.05 0.00 2.01 0.00 0.00 34.83 34.44 3i3o s MET 25 CO 0.80 -0.09 -0.03 1.21 -0.01 0.00 0.00 175.02 176.90 3i3o s ASN 26 N -1.49 3.28 0.90 3.03 2.47 -1.26 -3.42 114.94 118.44 3i3o s ASN 26 Ca 0.56 -0.92 -0.13 0.00 0.42 0.00 0.00 52.86 52.80 3i3o s ASN 26 Cb -0.23 -0.96 0.13 0.00 -1.45 0.00 0.00 41.25 38.75 3i3o s ASN 26 CO 0.29 -0.23 1.16 -2.16 -3.72 0.00 0.00 177.10 172.44 3i3o s PRO 27 N 1.58 1.25 0.19 0.43 0.04 -1.26 -4.13 135.00 133.10 3i3o s PRO 27 Ca -0.02 0.18 -0.30 0.00 0.04 0.00 0.00 61.00 60.89 3i3o s PRO 27 Cb -0.17 -1.86 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 3i3o s PRO 27 CO -0.07 -2.10 1.38 -0.51 0.04 0.00 0.00 177.00 175.73 3i3o s LEU 28 N -5.93 4.40 0.67 -3.56 1.43 -1.22 -4.95 118.68 109.51 3i3o s LEU 28 Ca 0.64 2.47 -0.17 0.00 -1.03 0.00 0.00 54.13 56.04 3i3o s LEU 28 Cb -0.13 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 3i3o s LEU 28 CO 0.52 -0.62 0.99 -2.65 0.23 0.00 0.00 176.35 174.82 3i3o n PRO 29 N 2.92 0.72 -2.97 1.29 -0.02 -1.26 -4.90 135.00 130.78 3i3o n PRO 29 Ca 0.08 0.30 -0.43 0.00 -2.02 0.00 0.00 63.50 61.42 3i3o n PRO 29 Cb 0.42 -2.22 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 3i3o n PRO 29 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i3o s GLN 30 N -3.09 3.26 0.00 -0.52 -0.21 -1.26 -4.86 119.66 112.98 3i3o s GLN 30 Ca 0.76 -0.48 0.22 0.00 0.02 0.00 0.00 55.36 55.88 3i3o s GLN 30 Cb -0.38 -4.06 -0.04 0.00 1.00 0.00 0.00 33.01 29.53 3i3o s GLN 30 CO 0.48 -1.35 1.05 1.97 -2.12 0.00 0.00 175.29 175.31 3i3o n PHE 31 N 6.92 0.00 -4.09 0.91 1.16 -1.26 -1.81 117.46 119.29 3i3o n PHE 31 Ca -0.01 0.00 -0.16 0.00 -1.87 0.00 0.00 57.45 55.41 3i3o n PHE 31 Cb 0.47 -0.01 -0.15 0.00 -1.61 0.00 0.00 39.48 38.18 3i3o n PHE 31 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 3i3o s GLU 32 N -2.68 0.38 -0.44 3.97 2.12 -1.26 -4.21 118.70 116.58 3i3o s GLU 32 Ca 0.15 -0.12 -0.17 0.00 0.36 0.00 0.00 54.97 55.19 3i3o s GLU 32 Cb 0.17 -0.39 0.04 0.00 0.26 0.00 0.00 34.13 34.21 3i3o s GLU 32 CO 0.68 0.05 0.44 0.34 -0.54 0.00 0.00 175.26 176.23 3i3o s ASP 33 N 0.13 6.18 0.30 -1.70 -1.08 -1.26 -4.94 116.67 114.29 3i3o s ASP 33 Ca -0.01 -0.87 0.03 0.00 -0.52 0.00 0.00 52.55 51.19 3i3o s ASP 33 Cb -0.04 -2.22 0.77 0.00 -1.46 0.00 0.00 42.92 39.97 3i3o s ASP 33 CO -0.00 -0.62 1.63 -0.65 0.52 0.00 0.00 175.17 176.04 3i3o h PRO 34 N 8.76 0.15 0.00 4.34 0.11 -2.02 0.39 132.00 143.72 3i3o h PRO 34 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3i3o h PRO 34 Cb 1.11 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3i3o h PRO 34 CO 0.83 0.10 0.00 0.09 -0.21 0.00 0.00 178.00 178.80 3i3o n ASN 35 N -5.28 0.00 -4.69 -2.05 4.13 -1.26 -4.81 115.26 101.31 3i3o n ASN 35 Ca 0.23 -0.66 -0.42 0.00 1.68 0.00 0.00 54.58 55.41 3i3o n ASN 35 Cb 0.75 -0.09 -0.03 0.00 -1.54 0.00 0.00 39.78 38.87 3i3o n ASN 35 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 3i3o s TYR 36 N -2.18 2.62 -0.20 3.10 5.04 0.14 -4.95 117.35 120.92 3i3o s TYR 36 Ca 0.38 0.55 -0.01 0.00 -2.44 0.00 0.00 57.07 55.55 3i3o s TYR 36 Cb 0.20 -3.83 0.00 0.00 0.35 0.00 0.00 41.96 38.68 3i3o s TYR 36 CO 0.36 -3.21 -0.12 0.15 -1.34 0.00 0.00 175.55 171.39 3i3o s LYS 37 N 2.53 3.20 0.70 4.97 1.02 -1.26 -5.01 119.74 125.89 3i3o s LYS 37 Ca 0.69 -0.72 -0.12 0.00 0.02 0.00 0.00 55.97 55.84 3i3o s LYS 37 Cb -0.36 -2.78 0.02 0.00 -0.52 0.00 0.00 37.83 34.19 3i3o s LYS 37 CO 0.30 -0.18 1.08 0.20 -0.92 0.00 0.00 175.35 175.82 3i3o s GLY 38 N 1.33 1.80 -0.11 -3.33 0.00 -1.26 -5.00 107.32 100.74 3i3o s GLY 38 Ca 0.04 0.25 0.20 0.00 0.00 0.00 0.00 44.72 45.21 3i3o s GLY 38 CO -0.07 0.58 1.17 -1.14 0.00 0.00 0.00 173.10 173.63 3i3o n SER 39 N -3.01 0.58 -2.48 1.64 3.41 -1.26 -5.00 113.62 107.49 3i3o n SER 39 Ca 0.09 -2.03 -0.21 0.00 -0.26 0.00 0.00 58.87 56.46 3i3o n SER 39 Cb 0.53 -0.15 -0.00 0.00 -0.26 0.00 0.00 64.21 64.33 3i3o n SER 39 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i3o n GLU 40 N -0.12 -2.11 0.28 4.33 1.02 -1.26 -4.88 120.64 117.91 3i3o n GLU 40 Ca -0.02 1.00 0.14 0.00 -0.02 0.00 0.00 57.16 58.26 3i3o n GLU 40 Cb 0.95 -5.69 0.86 0.00 -0.02 0.00 0.00 31.44 27.53 3i3o n GLU 40 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3i3o h LYS 41 N -0.18 0.00 -0.13 3.49 1.57 -1.89 -2.88 116.57 116.55 3i3o h LYS 41 Ca -0.50 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.13 3i3o h LYS 41 Cb 1.37 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.44 3i3o h LYS 41 CO 0.58 0.00 -0.80 1.28 -0.57 0.00 0.00 179.45 179.94 3i3o n LEU 42 N -3.99 2.18 -4.66 2.94 4.77 -0.15 -4.59 117.00 113.50 3i3o n LEU 42 Ca -0.03 -3.18 -0.43 0.00 -0.03 0.00 0.00 56.01 52.34 3i3o n LEU 42 Cb 0.10 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 3i3o n LEU 42 CO 0.29 1.10 1.61 1.17 -1.33 0.00 0.00 177.39 180.23 3i3o n LYS 43 N -0.41 2.78 -0.91 3.23 4.81 -0.80 -1.36 118.16 125.50 3i3o n LYS 43 Ca 0.16 1.01 0.00 0.00 -0.87 0.00 0.00 58.31 58.61 3i3o n LYS 43 Cb 0.91 -2.99 0.00 0.00 0.02 0.00 0.00 35.03 32.97 3i3o n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i3o n GLY 44 N 4.59 0.86 3.78 3.14 0.00 -0.78 -4.93 105.19 111.84 3i3o n GLY 44 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 3i3o n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i3o s LYS 45 N -0.09 4.59 -0.28 1.61 -0.14 -0.46 -4.85 119.74 120.11 3i3o s LYS 45 Ca 0.00 1.27 -0.09 0.00 -1.36 0.00 0.00 55.97 55.78 3i3o s LYS 45 Cb 0.00 -2.98 -0.02 0.00 -1.68 0.00 0.00 37.83 33.15 3i3o s LYS 45 CO 0.00 0.39 0.14 -0.80 -0.76 0.00 0.00 175.35 174.31 3i3o s ASN 46 N -1.47 5.52 -0.03 2.83 0.01 -1.26 -0.71 114.94 119.84 3i3o s ASN 46 Ca 0.45 -0.31 0.04 0.00 -0.71 0.00 0.00 52.86 52.33 3i3o s ASN 46 Cb -0.20 -2.00 -0.03 0.00 0.41 0.00 0.00 41.25 39.42 3i3o s ASN 46 CO 0.25 -0.11 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.91 3i3o s VAL 47 N 1.65 3.13 -0.19 1.60 1.01 0.05 -0.55 120.40 127.10 3i3o s VAL 47 Ca 0.06 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.24 3i3o s VAL 47 Cb -0.16 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 33.97 3i3o s VAL 47 CO 0.06 0.53 -0.15 -0.22 0.00 0.00 0.00 175.10 175.32 3i3o s LEU 48 N -0.94 2.35 -0.15 3.92 2.96 -0.29 -0.24 118.68 126.29 3i3o s LEU 48 Ca 0.13 -0.57 0.00 0.00 -0.22 0.00 0.00 54.13 53.47 3i3o s LEU 48 Cb -0.11 -1.56 0.02 0.00 0.50 0.00 0.00 46.19 45.05 3i3o s LEU 48 CO 0.02 -0.00 -0.13 -0.51 -1.32 0.00 0.00 176.35 174.41 3i3o s ILE 49 N 1.33 1.50 0.02 6.68 2.07 -0.19 -0.14 121.20 132.47 3i3o s ILE 49 Ca 0.05 -0.61 -0.23 0.00 -1.41 0.00 0.00 60.65 58.45 3i3o s ILE 49 Cb -0.13 -1.43 -0.05 0.00 0.13 0.00 0.00 42.46 40.97 3i3o s ILE 49 CO -0.10 0.43 0.69 0.42 -1.91 0.00 0.00 174.94 174.47 3i3o s THR 50 N 1.51 4.81 -0.86 4.00 -4.23 -0.52 -1.52 115.64 118.82 3i3o s THR 50 Ca 0.05 1.46 -0.01 0.00 -1.18 0.00 0.00 61.69 62.00 3i3o s THR 50 Cb -0.13 -4.03 0.00 0.00 1.34 0.00 0.00 72.50 69.68 3i3o s THR 50 CO -0.10 0.39 0.18 0.61 -0.54 0.00 0.00 174.62 175.16 3i3o n GLY 51 N 2.41 0.00 0.61 3.99 0.00 0.12 -2.41 105.19 109.92 3i3o n GLY 51 Ca -0.04 -0.36 0.04 0.00 0.00 0.00 0.00 46.02 45.65 3i3o n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i3o n GLY 52 N -1.09 0.63 0.09 -0.02 0.00 -1.10 -4.07 105.19 99.63 3i3o n GLY 52 Ca -0.09 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.73 3i3o n GLY 52 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3i3o n ASP 53 N 0.32 0.73 -3.47 1.61 5.75 -1.26 -3.22 116.55 117.01 3i3o n ASP 53 Ca 0.10 0.21 -0.09 0.00 -0.01 0.00 0.00 54.79 55.00 3i3o n ASP 53 Cb 0.30 0.59 -0.01 0.00 -1.03 0.00 0.00 41.12 40.97 3i3o n ASP 53 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3i3o s SER 54 N -4.97 -0.03 0.93 -1.12 1.04 -1.26 -4.15 113.70 104.13 3i3o s SER 54 Ca 0.00 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.50 3i3o s SER 54 Cb 0.11 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.98 3i3o s SER 54 CO 0.79 -1.45 0.00 0.61 0.98 0.00 0.00 173.24 174.18 3i3o n GLY 55 N -0.49 2.76 0.28 7.32 0.00 -1.26 -1.71 105.19 112.09 3i3o n GLY 55 Ca -0.05 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.73 3i3o n GLY 55 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3i3o h ILE 56 N 0.00 1.14 -1.00 -0.61 2.04 -1.90 -2.22 117.51 114.96 3i3o h ILE 56 Ca 0.00 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.58 3i3o h ILE 56 Cb 0.00 0.13 -0.06 0.00 -0.74 0.00 0.00 36.82 36.15 3i3o h ILE 56 CO 0.00 0.17 0.65 1.23 0.00 0.00 0.00 178.15 180.20 3i3o h GLY 57 N 0.93 1.47 0.83 5.37 0.00 -1.57 0.70 103.07 110.80 3i3o h GLY 57 Ca 0.28 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 3i3o h GLY 57 CO -0.08 0.41 -0.01 -0.09 0.00 0.00 0.00 176.54 176.76 3i3o h ARG 58 N 1.24 0.39 -0.67 4.80 2.43 -0.95 -0.75 114.38 120.87 3i3o h ARG 58 Ca 0.40 -0.13 0.07 0.00 -0.81 0.00 0.00 59.98 59.52 3i3o h ARG 58 Cb 0.04 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.49 3i3o h ARG 58 CO -0.14 0.59 0.36 0.00 -1.51 0.00 0.00 179.97 179.27 3i3o h ALA 59 N 0.78 0.91 -0.27 2.80 0.00 -0.86 -2.05 119.26 120.58 3i3o h ALA 59 Ca 0.06 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3i3o h ALA 59 Cb 0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3i3o h ALA 59 CO 0.01 0.00 -0.02 0.28 0.00 0.00 0.00 179.25 179.52 3i3o h VAL 60 N 0.64 1.27 -0.61 0.00 2.07 -0.74 -1.65 116.25 117.23 3i3o h VAL 60 Ca 0.31 -0.98 0.10 0.00 0.82 0.00 0.00 66.70 66.95 3i3o h VAL 60 Cb 0.25 1.37 -0.08 0.00 -1.52 0.00 0.00 31.29 31.31 3i3o h VAL 60 CO -0.21 0.31 0.20 0.28 0.02 0.00 0.00 177.57 178.17 3i3o h SER 61 N 0.27 0.17 -0.15 0.57 0.02 -0.87 0.39 113.55 113.95 3i3o h SER 61 Ca 0.07 0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 61.07 3i3o h SER 61 Cb 0.47 0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.09 3i3o h SER 61 CO 0.02 0.10 -0.07 0.40 -1.14 0.00 0.00 176.83 176.13 3i3o h ILE 62 N 0.37 1.31 -0.71 3.27 2.04 -1.30 -0.88 117.51 121.61 3i3o h ILE 62 Ca 0.31 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 65.06 3i3o h ILE 62 Cb 0.42 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 3i3o h ILE 62 CO -0.34 0.33 0.45 0.00 0.00 0.00 0.00 178.15 178.59 3i3o h ALA 63 N 0.67 0.90 -0.78 1.87 0.00 -1.10 0.05 119.26 120.87 3i3o h ALA 63 Ca 0.03 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3i3o h ALA 63 Cb 0.54 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3i3o h ALA 63 CO 0.02 0.35 0.31 0.74 0.00 0.00 0.00 179.25 180.67 3i3o h PHE 64 N 0.96 1.19 -0.54 0.00 -1.00 -0.83 -1.71 116.94 115.02 3i3o h PHE 64 Ca 0.26 -0.09 -0.03 0.00 2.81 0.00 0.00 57.97 60.92 3i3o h PHE 64 Cb -0.07 -0.36 -0.02 0.00 3.61 0.00 0.00 35.95 39.11 3i3o h PHE 64 CO -0.02 0.91 0.24 0.00 -1.61 0.00 0.00 178.31 177.83 3i3o h ALA 65 N 1.16 0.70 0.00 2.45 0.00 -0.66 -0.52 119.26 122.39 3i3o h ALA 65 Ca 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3i3o h ALA 65 Cb 0.22 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3i3o h ALA 65 CO -0.02 0.29 -0.05 0.87 0.00 0.00 0.00 179.25 180.33 3i3o h LYS 66 N 0.73 0.00 -0.21 0.00 1.57 -0.43 -0.92 116.57 117.31 3i3o h LYS 66 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3i3o h LYS 66 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3i3o h LYS 66 CO -0.02 0.05 0.00 0.39 -0.57 0.00 0.00 179.45 179.30 3i3o n GLU 67 N -3.59 1.79 -0.21 3.15 -0.58 -0.70 -4.27 120.64 116.24 3i3o n GLU 67 Ca -0.02 -1.20 0.00 0.00 -0.42 0.00 0.00 57.16 55.52 3i3o n GLU 67 Cb 0.16 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 3i3o n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i3o n GLY 68 N 1.15 0.76 3.84 0.62 0.00 -0.35 -0.98 105.19 110.23 3i3o n GLY 68 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3i3o n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i3o s ALA 69 N -2.20 3.25 -0.03 4.61 0.00 -0.27 -1.86 121.76 125.26 3i3o s ALA 69 Ca 0.00 0.16 -0.18 0.00 0.00 0.00 0.00 51.96 51.94 3i3o s ALA 69 Cb 0.00 -2.88 -0.05 0.00 0.00 0.00 0.00 23.12 20.18 3i3o s ALA 69 CO 0.00 0.27 0.51 -0.80 0.00 0.00 0.00 175.76 175.75 3i3o s ASN 70 N -2.18 6.86 -0.14 0.00 0.01 0.12 -4.19 114.94 115.41 3i3o s ASN 70 Ca 0.55 1.02 0.02 0.00 -0.71 0.00 0.00 52.86 53.74 3i3o s ASN 70 Cb -0.11 -2.31 0.02 0.00 0.41 0.00 0.00 41.25 39.26 3i3o s ASN 70 CO 0.17 0.15 -0.18 -0.63 -1.51 0.00 0.00 177.10 175.09 3i3o s ILE 71 N -0.26 1.82 -0.30 0.60 -1.09 -0.02 -0.77 121.20 121.18 3i3o s ILE 71 Ca 0.27 -0.82 -0.11 0.00 -2.23 0.00 0.00 60.65 57.77 3i3o s ILE 71 Cb -0.17 -1.64 -0.03 0.00 -1.58 0.00 0.00 42.46 39.03 3i3o s ILE 71 CO 0.14 0.50 0.19 0.00 -1.23 0.00 0.00 174.94 174.54 3i3o s ALA 72 N 1.08 3.46 -0.32 9.38 0.00 0.67 -0.97 121.76 135.05 3i3o s ALA 72 Ca -0.02 -1.21 -0.09 0.00 0.00 0.00 0.00 51.96 50.64 3i3o s ALA 72 Cb -0.14 -2.48 0.01 0.00 0.00 0.00 0.00 23.12 20.50 3i3o s ALA 72 CO -0.06 -0.70 0.14 0.42 0.00 0.00 0.00 175.76 175.57 3i3o s ILE 73 N 1.72 4.38 -0.10 0.00 1.01 0.90 -1.02 121.20 128.09 3i3o s ILE 73 Ca 0.06 -0.64 -0.10 0.00 0.00 0.00 0.00 60.65 59.98 3i3o s ILE 73 Cb -0.16 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 3i3o s ILE 73 CO 0.10 -0.02 0.22 0.00 0.00 0.00 0.00 174.94 175.24 3i3o s ALA 74 N 1.56 3.79 0.23 9.38 0.00 -0.58 -0.50 121.76 135.64 3i3o s ALA 74 Ca 0.03 -0.52 -0.18 0.00 0.00 0.00 0.00 51.96 51.29 3i3o s ALA 74 Cb -0.18 -2.13 0.02 0.00 0.00 0.00 0.00 23.12 20.84 3i3o s ALA 74 CO 0.05 0.50 0.57 1.52 0.00 0.00 0.00 175.76 178.40 3i3o s TYR 75 N -0.79 -0.05 0.00 0.00 -0.85 -1.05 0.14 117.35 114.75 3i3o s TYR 75 Ca 0.17 -0.32 0.00 0.00 -0.52 0.00 0.00 57.07 56.39 3i3o s TYR 75 Cb -0.13 0.44 0.00 0.00 0.38 0.00 0.00 41.96 42.65 3i3o s TYR 75 CO 0.06 -1.02 0.26 -0.11 -1.52 0.00 0.00 175.55 173.22 3i3o n LEU 76 N -0.38 0.64 -0.13 -3.49 7.94 -1.26 -1.16 117.00 119.15 3i3o n LEU 76 Ca -0.07 0.50 0.00 0.00 -1.11 0.00 0.00 56.01 55.33 3i3o n LEU 76 Cb 0.61 -0.35 0.00 0.00 0.53 0.00 0.00 43.42 44.22 3i3o n LEU 76 CO 0.17 -0.35 0.14 -0.90 -1.11 0.00 0.00 177.39 175.34 3i3o n ASP 77 N -1.54 0.00 -4.36 1.96 5.68 -1.26 -1.75 116.55 115.27 3i3o n ASP 77 Ca 0.00 -1.10 -0.43 0.00 -0.50 0.00 0.00 54.79 52.76 3i3o n ASP 77 Cb 0.00 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 3i3o n ASP 77 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3i3o n GLU 78 N 0.00 3.33 -0.27 0.11 -0.58 -1.26 -4.78 120.64 117.18 3i3o n GLU 78 Ca 0.00 -3.57 0.05 0.00 -0.42 0.00 0.00 57.16 53.21 3i3o n GLU 78 Cb 0.52 -3.16 0.27 0.00 -0.57 0.00 0.00 31.44 28.50 3i3o n GLU 78 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3i3o h GLU 79 N 6.97 0.94 -0.08 3.49 4.39 -1.98 0.36 114.58 128.67 3i3o h GLU 79 Ca 0.38 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 60.01 3i3o h GLU 79 Cb 0.82 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 29.26 3i3o h GLU 79 CO 1.40 0.62 -0.01 0.78 -1.16 0.00 0.00 179.01 180.64 3i3o h GLY 80 N 0.96 0.17 1.05 -3.84 0.00 -1.99 0.25 103.07 99.68 3i3o h GLY 80 Ca 0.37 -0.13 -0.06 0.00 0.00 0.00 0.00 47.33 47.51 3i3o h GLY 80 CO -0.14 0.12 0.22 -0.55 0.00 0.00 0.00 176.54 176.20 3i3o h ASP 81 N -0.15 1.07 -0.41 0.19 3.32 -1.79 -2.12 116.42 116.52 3i3o h ASP 81 Ca 0.02 -0.21 -0.09 0.00 0.02 0.00 0.00 57.03 56.77 3i3o h ASP 81 Cb 0.38 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3i3o h ASP 81 CO 0.01 1.00 -0.10 0.00 -1.72 0.00 0.00 179.24 178.43 3i3o h ALA 82 N 1.11 0.57 -0.71 3.45 0.00 -0.81 -1.82 119.26 121.05 3i3o h ALA 82 Ca 0.24 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.84 3i3o h ALA 82 Cb 0.31 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3i3o h ALA 82 CO -0.01 0.44 0.46 -0.97 0.00 0.00 0.00 179.25 179.18 3i3o h ASN 83 N 0.62 0.80 -0.36 0.00 -1.24 -0.40 -0.72 115.58 114.27 3i3o h ASN 83 Ca 0.11 -0.02 -0.03 0.00 0.71 0.00 0.00 56.30 57.07 3i3o h ASN 83 Cb 0.62 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.46 3i3o h ASN 83 CO 0.04 0.58 0.12 -0.08 -1.29 0.00 0.00 177.43 176.80 3i3o h GLU 84 N 0.95 0.56 -0.78 6.67 4.81 -1.21 -1.85 114.58 123.72 3i3o h GLU 84 Ca 0.26 -0.11 0.04 0.00 -0.13 0.00 0.00 59.36 59.41 3i3o h GLU 84 Cb -0.10 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.15 3i3o h GLU 84 CO -0.06 0.57 0.49 1.15 -0.73 0.00 0.00 179.01 180.43 3i3o h THR 85 N 0.44 1.10 -0.92 0.32 2.02 -1.16 -2.03 112.91 112.68 3i3o h THR 85 Ca 0.12 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 67.00 3i3o h THR 85 Cb 0.23 0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 66.66 3i3o h THR 85 CO -0.01 0.17 0.60 0.50 0.37 0.00 0.00 175.52 177.16 3i3o h LYS 86 N 0.95 1.15 -0.60 6.66 3.64 -0.49 -1.05 116.57 126.83 3i3o h LYS 86 Ca 0.32 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.54 3i3o h LYS 86 Cb 0.05 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 3i3o h LYS 86 CO -0.13 0.76 0.01 1.96 -2.27 0.00 0.00 179.45 179.78 3i3o h GLN 87 N 1.18 1.03 -0.52 1.90 1.08 -0.65 0.09 115.11 119.22 3i3o h GLN 87 Ca 0.36 -0.32 -0.12 0.00 -1.45 0.00 0.00 58.65 57.12 3i3o h GLN 87 Cb -0.04 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 3i3o h GLN 87 CO -0.10 1.01 -0.14 1.88 -0.95 0.00 0.00 178.83 180.53 3i3o h TYR 88 N 0.95 1.14 -0.26 2.96 0.05 -0.98 -1.49 116.97 119.33 3i3o h TYR 88 Ca 0.17 -0.25 -0.03 0.00 0.05 0.00 0.00 58.73 58.68 3i3o h TYR 88 Cb 0.53 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.99 3i3o h TYR 88 CO 0.04 1.07 0.05 0.28 -1.05 0.00 0.00 178.16 178.55 3i3o h VAL 89 N 0.89 1.22 0.00 -2.88 2.07 -0.86 -3.01 116.25 113.68 3i3o h VAL 89 Ca 0.13 -0.75 -0.04 0.00 0.82 0.00 0.00 66.70 66.87 3i3o h VAL 89 Cb 0.71 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 3i3o h VAL 89 CO 0.05 0.24 -0.17 -0.33 0.02 0.00 0.00 177.57 177.39 3i3o h GLU 90 N 0.25 0.00 -0.35 1.57 5.08 -0.90 -1.68 114.58 118.55 3i3o h GLU 90 Ca 0.08 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.54 3i3o h GLU 90 Cb 0.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3i3o h GLU 90 CO 0.00 0.17 0.27 -0.22 -1.00 0.00 0.00 179.01 178.23 3i3o h LYS 91 N 0.00 0.00 -0.05 2.33 3.64 -1.12 -0.91 116.57 120.46 3i3o h LYS 91 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3i3o h LYS 91 Cb 0.63 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 3i3o h LYS 91 CO 0.02 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.59 3i3o n GLU 92 N -4.31 1.29 -1.09 1.90 -0.58 -0.63 -4.90 120.64 112.32 3i3o n GLU 92 Ca 0.05 -0.43 -0.03 0.00 -0.42 0.00 0.00 57.16 56.34 3i3o n GLU 92 Cb 0.44 -1.37 -0.01 0.00 -0.57 0.00 0.00 31.44 29.93 3i3o n GLU 92 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i3o n GLY 93 N 0.96 0.63 3.78 0.62 0.00 -0.34 -4.93 105.19 105.91 3i3o n GLY 93 Ca 0.16 -0.84 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 3i3o n GLY 93 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i3o s VAL 94 N -2.11 2.57 0.22 1.61 -7.23 -1.26 -5.08 120.40 109.12 3i3o s VAL 94 Ca 0.00 -1.57 -0.21 0.00 -1.81 0.00 0.00 61.98 58.38 3i3o s VAL 94 Cb 0.00 -3.00 -0.08 0.00 0.56 0.00 0.00 36.38 33.86 3i3o s VAL 94 CO 0.00 -0.04 0.75 -0.75 -0.31 0.00 0.00 175.10 174.75 3i3o s LYS 95 N -3.97 4.34 -0.06 4.82 2.20 -1.26 -4.49 119.74 121.32 3i3o s LYS 95 Ca 0.43 0.96 0.01 0.00 -0.36 0.00 0.00 55.97 57.01 3i3o s LYS 95 Cb 0.00 -2.96 0.02 0.00 -1.51 0.00 0.00 37.83 33.39 3i3o s LYS 95 CO 0.24 0.43 -0.05 0.00 -0.36 0.00 0.00 175.35 175.60 3i3o s VAL 97 N 1.17 2.10 -0.19 0.00 1.01 -0.14 -5.00 120.40 119.35 3i3o s VAL 97 Ca -0.07 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 3i3o s VAL 97 Cb -0.14 -1.82 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 3i3o s VAL 97 CO -0.01 0.55 0.20 -0.76 0.00 0.00 0.00 175.10 175.08 3i3o s LEU 98 N 0.56 4.22 -0.55 3.92 1.43 -1.26 -0.07 118.68 126.92 3i3o s LEU 98 Ca -0.13 0.34 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 3i3o s LEU 98 Cb -0.17 -2.22 0.16 0.00 0.03 0.00 0.00 46.19 44.00 3i3o s LEU 98 CO 0.04 0.13 0.39 -0.76 0.23 0.00 0.00 176.35 176.38 3i3o s LEU 99 N 0.47 3.26 0.71 1.79 1.43 0.35 -4.95 118.68 121.75 3i3o s LEU 99 Ca 0.12 -3.33 -0.11 0.00 -1.03 0.00 0.00 54.13 49.78 3i3o s LEU 99 Cb -0.12 -1.12 0.02 0.00 0.03 0.00 0.00 46.19 45.00 3i3o s LEU 99 CO 0.01 -0.15 1.07 -2.16 0.23 0.00 0.00 176.35 175.34 3i3o s PRO 100 N -0.57 2.78 0.00 1.29 0.04 -1.26 -2.51 135.00 134.76 3i3o s PRO 100 Ca 0.26 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.31 3i3o s PRO 100 Cb -0.06 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.51 3i3o s PRO 100 CO -0.14 -1.23 0.00 0.41 0.04 0.00 0.00 177.00 176.08 3i3o n GLY 101 N -1.79 3.42 3.55 0.56 0.00 -0.31 -4.88 105.19 105.74 3i3o n GLY 101 Ca 0.08 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 3i3o n GLY 101 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i3o s ASP 102 N 0.00 6.38 0.00 1.61 -1.08 -1.26 -4.01 116.67 118.31 3i3o s ASP 102 Ca 0.00 -0.05 0.16 0.00 -0.52 0.00 0.00 52.55 52.15 3i3o s ASP 102 Cb 0.00 -2.32 0.95 0.00 -1.46 0.00 0.00 42.92 40.08 3i3o s ASP 102 CO 0.00 -0.67 1.61 0.18 0.52 0.00 0.00 175.17 176.81 3i3o n LEU 103 N 6.15 0.11 -0.00 -1.34 4.77 -1.26 -2.69 117.00 122.73 3i3o n LEU 103 Ca -0.01 -0.05 0.14 0.00 -0.03 0.00 0.00 56.01 56.06 3i3o n LEU 103 Cb 0.48 -0.01 0.64 0.00 -2.33 0.00 0.00 43.42 42.21 3i3o n LEU 103 CO 0.51 0.02 0.97 -1.54 -1.33 0.00 0.00 177.39 176.02 3i3o n SER 104 N -0.68 0.01 -4.60 -1.43 3.41 -1.26 -4.53 113.62 104.53 3i3o n SER 104 Ca 0.12 0.38 -0.38 0.00 -0.26 0.00 0.00 58.87 58.74 3i3o n SER 104 Cb 0.07 -0.46 -0.11 0.00 -0.26 0.00 0.00 64.21 63.46 3i3o n SER 104 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i3o s ASP 105 N -2.92 6.03 0.23 4.04 2.15 -1.10 -4.89 116.67 120.21 3i3o s ASP 105 Ca 0.17 0.01 -0.08 0.00 0.43 0.00 0.00 52.55 53.08 3i3o s ASP 105 Cb 0.19 -2.12 0.39 0.00 -0.30 0.00 0.00 42.92 41.08 3i3o s ASP 105 CO 0.52 -0.02 1.66 -0.08 -0.17 0.00 0.00 175.17 177.07 3i3o h GLU 106 N 8.18 0.15 -0.74 4.34 4.81 -1.89 -2.16 114.58 127.26 3i3o h GLU 106 Ca -0.36 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.85 3i3o h GLU 106 Cb 1.19 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.50 3i3o h GLU 106 CO 0.57 0.10 0.41 0.37 -0.73 0.00 0.00 179.01 179.73 3i3o h GLN 107 N 0.15 1.03 -0.35 1.92 5.75 -1.95 -1.83 115.11 119.82 3i3o h GLN 107 Ca 0.38 -0.12 -0.04 0.00 -0.15 0.00 0.00 58.65 58.72 3i3o h GLN 107 Cb 0.64 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.97 3i3o h GLN 107 CO -0.56 0.76 0.06 1.25 -2.65 0.00 0.00 178.83 177.69 3i3o h HIS 108 N 1.02 0.53 -0.89 3.99 2.76 -1.70 -0.34 115.15 120.53 3i3o h HIS 108 Ca 0.26 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.37 3i3o h HIS 108 Cb 0.03 -0.16 -0.04 0.00 1.55 0.00 0.00 27.41 28.79 3i3o h HIS 108 CO -0.00 0.49 0.48 0.00 -1.30 0.00 0.00 177.93 177.60 3i3o h LYS 110 N 1.24 0.77 -0.85 0.00 1.57 -0.85 -3.28 116.57 115.17 3i3o h LYS 110 Ca 0.31 -0.40 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 3i3o h LYS 110 Cb 0.03 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 3i3o h LYS 110 CO -0.05 1.03 0.50 -0.44 -0.57 0.00 0.00 179.45 179.92 3i3o h ASP 111 N 0.54 1.04 -0.01 0.86 3.32 -0.65 -2.33 116.42 119.19 3i3o h ASP 111 Ca 0.05 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 3i3o h ASP 111 Cb 0.88 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 3i3o h ASP 111 CO 0.08 0.81 -0.12 0.16 -1.72 0.00 0.00 179.24 178.45 3i3o h ILE 112 N 1.18 1.19 -0.16 0.35 3.07 -1.36 0.62 117.51 122.39 3i3o h ILE 112 Ca 0.30 -0.81 -0.05 0.00 1.55 0.00 0.00 64.86 65.85 3i3o h ILE 112 Cb -0.02 1.19 -0.00 0.00 -0.27 0.00 0.00 36.82 37.71 3i3o h ILE 112 CO -0.05 0.26 -0.11 0.58 -1.05 0.00 0.00 178.15 177.77 3i3o h VAL 113 N 0.27 1.33 -0.71 0.16 2.07 -1.54 -0.36 116.25 117.47 3i3o h VAL 113 Ca 0.05 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 3i3o h VAL 113 Cb 0.38 1.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 3i3o h VAL 113 CO 0.02 0.36 0.34 -0.61 0.02 0.00 0.00 177.57 177.70 3i3o h GLN 114 N 0.02 1.02 -0.27 1.57 4.15 -1.05 -1.43 115.11 119.12 3i3o h GLN 114 Ca 0.03 -0.15 -0.15 0.00 0.77 0.00 0.00 58.65 59.15 3i3o h GLN 114 Cb 0.61 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 3i3o h GLN 114 CO 0.03 0.80 -0.44 1.49 -1.93 0.00 0.00 178.83 178.79 3i3o h GLU 115 N 0.99 0.69 -0.35 1.69 4.57 -0.88 -0.38 114.58 120.90 3i3o h GLU 115 Ca 0.24 -0.37 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 3i3o h GLU 115 Cb 0.12 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 3i3o h GLU 115 CO -0.03 0.99 0.19 1.15 -1.18 0.00 0.00 179.01 180.12 3i3o h THR 116 N 0.55 1.14 -0.60 0.32 2.02 -0.63 -1.17 112.91 114.55 3i3o h THR 116 Ca 0.04 -0.38 -0.08 0.00 0.77 0.00 0.00 66.41 66.75 3i3o h THR 116 Cb 0.98 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 3i3o h THR 116 CO 0.09 0.15 0.05 0.58 0.37 0.00 0.00 175.52 176.76 3i3o h VAL 117 N 0.44 1.26 -0.33 3.16 2.07 -1.14 0.71 116.25 122.41 3i3o h VAL 117 Ca 0.12 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.59 3i3o h VAL 117 Cb 0.07 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 3i3o h VAL 117 CO -0.02 0.39 0.20 -0.09 0.02 0.00 0.00 177.57 178.07 3i3o h ARG 118 N 0.93 0.45 0.21 1.57 2.43 -0.77 0.96 114.38 120.16 3i3o h ARG 118 Ca 0.18 -0.04 -0.30 0.00 -0.81 0.00 0.00 59.98 59.01 3i3o h ARG 118 Cb 0.47 -0.09 0.03 0.00 -0.42 0.00 0.00 29.97 29.95 3i3o h ARG 118 CO 0.02 0.34 -1.34 1.96 -1.51 0.00 0.00 179.97 179.43 3i3o h GLN 119 N 0.43 0.44 0.00 0.20 1.08 -1.03 -3.36 115.11 112.87 3i3o h GLN 119 Ca 0.12 -0.76 -0.08 0.00 -1.45 0.00 0.00 58.65 56.48 3i3o h GLN 119 Cb 0.00 0.28 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 3i3o h GLN 119 CO -0.02 1.36 -1.23 1.28 -0.95 0.00 0.00 178.83 179.27 3i3o n LEU 120 N -3.82 0.82 0.00 1.46 4.77 0.22 -4.98 117.00 115.48 3i3o n LEU 120 Ca -0.18 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3i3o n LEU 120 Cb 1.02 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.11 3i3o n LEU 120 CO 0.55 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3i3o n GLY 121 N 1.29 3.07 3.86 -0.72 0.00 0.33 -4.99 105.19 108.03 3i3o n GLY 121 Ca -0.05 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 3i3o n GLY 121 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i3o s SER 122 N -0.11 -0.01 -0.07 1.61 1.04 -1.24 -4.89 113.70 110.03 3i3o s SER 122 Ca 0.00 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.74 3i3o s SER 122 Cb 0.00 0.53 0.02 0.00 0.10 0.00 0.00 66.02 66.67 3i3o s SER 122 CO 0.00 -1.05 -0.04 -0.22 0.98 0.00 0.00 173.24 172.91 3i3o s LEU 123 N -3.34 1.11 -0.11 2.42 2.96 -1.26 -4.54 118.68 115.92 3i3o s LEU 123 Ca 0.20 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 3i3o s LEU 123 Cb -0.03 -0.54 -0.09 0.00 0.50 0.00 0.00 46.19 46.03 3i3o s LEU 123 CO 0.06 -0.10 -0.07 0.59 -1.32 0.00 0.00 176.35 175.51 3i3o n ASN 124 N 4.50 3.00 -3.87 3.68 4.13 0.29 -4.53 115.26 122.45 3i3o n ASN 124 Ca -0.17 -0.05 -0.22 0.00 1.68 0.00 0.00 54.58 55.82 3i3o n ASN 124 Cb 0.51 0.06 -0.17 0.00 -1.54 0.00 0.00 39.78 38.63 3i3o n ASN 124 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3i3o s ILE 125 N -2.23 0.61 -0.16 2.41 1.01 -0.92 -1.46 121.20 120.46 3i3o s ILE 125 Ca -0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 3i3o s ILE 125 Cb 0.04 -0.65 -0.01 0.00 0.01 0.00 0.00 42.46 41.84 3i3o s ILE 125 CO 0.30 0.26 -0.11 -0.22 0.00 0.00 0.00 174.94 175.17 3i3o s LEU 126 N 1.25 2.75 -0.28 2.97 2.96 -0.48 -1.14 118.68 126.72 3i3o s LEU 126 Ca -0.05 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 53.49 3i3o s LEU 126 Cb -0.14 -1.65 0.05 0.00 0.50 0.00 0.00 46.19 44.95 3i3o s LEU 126 CO -0.02 0.10 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.39 3i3o s VAL 127 N 0.73 2.78 -0.32 1.68 1.01 0.80 -0.96 120.40 126.13 3i3o s VAL 127 Ca -0.05 -1.38 -0.22 0.00 0.00 0.00 0.00 61.98 60.32 3i3o s VAL 127 Cb -0.15 -2.58 -0.00 0.00 0.00 0.00 0.00 36.38 33.65 3i3o s VAL 127 CO 0.02 -0.04 0.74 0.20 0.00 0.00 0.00 175.10 176.01 3i3o s ASN 128 N 1.23 6.59 0.00 3.32 0.01 0.07 -1.44 114.94 124.72 3i3o s ASN 128 Ca -0.05 0.52 0.00 0.00 -0.71 0.00 0.00 52.86 52.62 3i3o s ASN 128 Cb -0.19 -2.38 0.00 0.00 0.41 0.00 0.00 41.25 39.09 3i3o s ASN 128 CO -0.02 -0.60 0.00 -3.20 -1.51 0.00 0.00 177.10 171.77 3i3o n ASN 129 N 6.15 0.00 -4.76 -1.22 2.85 -1.14 -0.40 115.26 116.73 3i3o n ASN 129 Ca 0.02 -0.11 -0.39 0.00 -0.11 0.00 0.00 54.58 53.99 3i3o n ASN 129 Cb 0.48 0.00 0.03 0.00 1.24 0.00 0.00 39.78 41.53 3i3o n ASN 129 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 3i3o s VAL 130 N 0.00 2.06 -0.04 3.44 0.11 -1.01 -4.77 120.40 120.19 3i3o s VAL 130 Ca 0.00 0.05 -0.29 0.00 -2.93 0.00 0.00 61.98 58.81 3i3o s VAL 130 Cb 0.00 -3.03 0.09 0.00 -1.53 0.00 0.00 36.38 31.91 3i3o s VAL 130 CO 0.00 0.00 0.78 0.00 -3.33 0.00 0.00 175.10 172.55 3i3o s ALA 131 N -1.24 -1.79 0.09 1.54 0.00 -1.26 -4.68 121.76 114.42 3i3o s ALA 131 Ca 0.65 1.22 0.05 0.00 0.00 0.00 0.00 51.96 53.88 3i3o s ALA 131 Cb -0.43 0.00 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 3i3o s ALA 131 CO 0.53 -0.46 -0.14 -0.65 0.00 0.00 0.00 175.76 175.05 3i3o s GLN 132 N -1.82 0.89 -0.04 0.00 -0.21 -1.26 -5.01 119.66 112.22 3i3o s GLN 132 Ca -0.05 -1.07 -0.03 0.00 0.02 0.00 0.00 55.36 54.23 3i3o s GLN 132 Cb -0.00 -0.81 0.01 0.00 1.00 0.00 0.00 33.01 33.21 3i3o s GLN 132 CO 0.02 0.17 0.09 1.14 -2.12 0.00 0.00 175.29 174.59 3i3o s GLN 133 N -2.18 0.09 -0.36 2.91 -2.07 -1.26 -4.94 119.66 111.85 3i3o s GLN 133 Ca 0.03 0.16 0.01 0.00 -1.82 0.00 0.00 55.36 53.73 3i3o s GLN 133 Cb -0.07 0.00 0.11 0.00 -1.09 0.00 0.00 33.01 31.97 3i3o s GLN 133 CO 0.02 -0.04 0.15 0.71 -1.32 0.00 0.00 175.29 174.81 3i3o s TYR 134 N 0.24 1.88 0.52 9.60 2.02 -1.26 -4.75 117.35 125.60 3i3o s TYR 134 Ca -0.02 -2.06 -0.22 0.00 -0.37 0.00 0.00 57.07 54.40 3i3o s TYR 134 Cb -0.03 -1.82 -0.06 0.00 -0.40 0.00 0.00 41.96 39.66 3i3o s TYR 134 CO -0.01 -0.85 1.31 -2.14 -1.57 0.00 0.00 175.55 172.30 3i3o s PRO 135 N 1.09 3.33 0.05 -1.71 0.02 -1.26 -4.90 135.00 131.62 3i3o s PRO 135 Ca 0.13 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.28 3i3o s PRO 135 Cb -0.20 -2.32 -0.03 0.00 0.02 0.00 0.00 34.50 31.97 3i3o s PRO 135 CO -0.14 -1.00 -0.05 -0.65 -0.33 0.00 0.00 177.00 174.83 3i3o s GLN 136 N -2.83 0.55 0.08 5.54 -1.52 -0.50 -5.04 119.66 115.93 3i3o s GLN 136 Ca 0.69 -0.92 0.25 0.00 -1.95 0.00 0.00 55.36 53.42 3i3o s GLN 136 Cb -0.37 -0.08 0.98 0.00 -0.22 0.00 0.00 33.01 33.32 3i3o s GLN 136 CO 0.45 -0.02 1.78 0.00 -0.25 0.00 0.00 175.29 177.24 3i3o n GLN 137 N 0.94 0.08 -3.64 2.91 10.64 -1.26 -4.48 117.38 122.57 3i3o n GLN 137 Ca -0.19 0.15 -0.01 0.00 -1.83 0.00 0.00 57.00 55.12 3i3o n GLN 137 Cb 0.57 -1.61 -0.01 0.00 -0.86 0.00 0.00 30.24 28.33 3i3o n GLN 137 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 3i3o s GLY 138 N -3.20 -0.36 0.29 2.61 0.00 -1.26 -4.96 107.32 100.44 3i3o s GLY 138 Ca 0.11 0.69 -0.00 0.00 0.00 0.00 0.00 44.72 45.52 3i3o s GLY 138 CO 0.48 0.16 1.92 -2.00 0.00 0.00 0.00 173.10 173.66 3i3o h LEU 139 N 2.00 0.94 -2.21 0.66 5.85 -1.90 -1.59 115.31 119.06 3i3o h LEU 139 Ca -0.26 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.46 3i3o h LEU 139 Cb 1.21 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3i3o h LEU 139 CO 0.27 0.62 0.06 -0.33 -0.34 0.00 0.00 178.44 178.73 3i3o h GLU 140 N 1.08 0.00 -0.54 1.25 5.08 -2.00 -1.67 114.58 117.78 3i3o h GLU 140 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3i3o h GLU 140 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3i3o h GLU 140 CO -0.13 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.54 3i3o n TYR 141 N -2.71 0.71 -3.39 4.33 4.02 -0.60 -4.82 117.16 114.69 3i3o n TYR 141 Ca -0.02 -0.35 -0.42 0.00 -0.01 0.00 0.00 57.90 57.09 3i3o n TYR 141 Cb 0.12 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.34 3i3o n TYR 141 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3i3o s ILE 142 N -1.29 5.16 0.78 -0.72 1.01 -0.63 -5.00 121.20 120.51 3i3o s ILE 142 Ca 0.42 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.67 3i3o s ILE 142 Cb 0.23 -3.93 0.06 0.00 0.01 0.00 0.00 42.46 38.83 3i3o s ILE 142 CO 0.31 -0.27 1.09 0.42 0.00 0.00 0.00 174.94 176.49 3i3o s THR 143 N 1.98 3.23 0.31 2.92 -4.23 -1.26 -4.90 115.64 113.69 3i3o s THR 143 Ca 0.10 0.40 0.01 0.00 -1.18 0.00 0.00 61.69 61.02 3i3o s THR 143 Cb -0.17 -3.16 0.18 0.00 1.34 0.00 0.00 72.50 70.69 3i3o s THR 143 CO 0.12 -0.52 1.88 0.00 -0.54 0.00 0.00 174.62 175.56 3i3o h ALA 144 N -1.01 1.33 -0.53 3.99 0.00 -1.99 -1.59 119.26 119.46 3i3o h ALA 144 Ca -0.46 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.27 3i3o h ALA 144 Cb 1.26 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3i3o h ALA 144 CO 0.59 0.48 0.31 0.93 0.00 0.00 0.00 179.25 181.56 3i3o h GLU 145 N 0.70 0.72 -0.20 0.00 3.07 -1.99 -0.86 114.58 116.02 3i3o h GLU 145 Ca 0.16 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.93 3i3o h GLU 145 Cb 0.24 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 3i3o h GLU 145 CO -0.01 0.53 0.05 0.37 -1.40 0.00 0.00 179.01 178.55 3i3o h GLN 146 N 0.70 0.32 0.03 2.33 4.15 -1.81 -1.36 115.11 119.46 3i3o h GLN 146 Ca 0.19 -0.07 0.03 0.00 0.77 0.00 0.00 58.65 59.56 3i3o h GLN 146 Cb -0.00 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.60 3i3o h GLN 146 CO -0.03 0.43 -0.25 1.25 -1.93 0.00 0.00 178.83 178.30 3i3o h LEU 147 N 0.14 -0.72 -0.76 -2.39 5.85 -1.10 0.32 115.31 116.65 3i3o h LEU 147 Ca 0.06 0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 3i3o h LEU 147 Cb 0.25 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 3i3o h LEU 147 CO -0.00 -0.32 -0.34 -0.33 -0.34 0.00 0.00 178.44 177.11 3i3o h GLU 148 N -0.40 0.54 -0.47 1.25 5.08 -1.18 -1.46 114.58 117.94 3i3o h GLU 148 Ca 0.05 -0.25 -0.08 0.00 -1.00 0.00 0.00 59.36 58.08 3i3o h GLU 148 Cb 0.47 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 3i3o h GLU 148 CO -0.20 0.82 -0.04 -0.22 -1.00 0.00 0.00 179.01 178.37 3i3o h LYS 149 N 0.46 0.85 -0.17 2.33 3.64 -1.03 0.11 116.57 122.76 3i3o h LYS 149 Ca 0.05 -0.29 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 3i3o h LYS 149 Cb 0.82 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 3i3o h LYS 149 CO 0.07 0.92 0.09 1.15 -2.27 0.00 0.00 179.45 179.41 3i3o h THR 150 N 0.70 1.10 -0.57 1.00 2.02 -0.61 -2.00 112.91 114.56 3i3o h THR 150 Ca 0.13 -0.28 -0.08 0.00 0.77 0.00 0.00 66.41 66.94 3i3o h THR 150 Cb 0.56 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 3i3o h THR 150 CO 0.03 0.10 0.04 -0.26 0.37 0.00 0.00 175.52 175.80 3i3o h PHE 151 N 0.18 1.05 -0.61 3.16 -1.00 -1.21 -0.25 116.94 118.25 3i3o h PHE 151 Ca 0.06 -0.17 0.01 0.00 2.81 0.00 0.00 57.97 60.68 3i3o h PHE 151 Cb 0.07 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.32 3i3o h PHE 151 CO -0.04 0.94 0.40 -0.09 -1.61 0.00 0.00 178.31 177.91 3i3o h ARG 152 N 0.86 0.81 0.20 1.51 2.43 -0.56 -0.48 114.38 119.15 3i3o h ARG 152 Ca 0.16 -0.05 -0.32 0.00 -0.81 0.00 0.00 59.98 58.96 3i3o h ARG 152 Cb 0.49 -0.18 0.02 0.00 -0.42 0.00 0.00 29.97 29.88 3i3o h ARG 152 CO 0.02 0.54 -1.54 0.97 -1.51 0.00 0.00 179.97 178.45 3i3o h ILE 153 N 0.83 1.11 0.00 1.20 6.09 -1.39 -2.15 117.51 123.19 3i3o h ILE 153 Ca 0.22 -2.56 -0.19 0.00 -1.37 0.00 0.00 64.86 60.96 3i3o h ILE 153 Cb -0.09 2.89 -0.03 0.00 0.47 0.00 0.00 36.82 40.06 3i3o h ILE 153 CO -0.05 0.81 -0.92 0.78 -3.07 0.00 0.00 178.15 175.71 3i3o h ASN 154 N 0.02 0.00 0.00 2.19 4.21 -0.99 -3.35 115.58 117.66 3i3o h ASN 154 Ca -0.30 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.21 3i3o h ASN 154 Cb 2.04 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.24 3i3o h ASN 154 CO 0.19 0.92 -0.53 0.00 -1.29 0.00 0.00 177.43 176.71 3i3o n ILE 155 N -3.44 0.00 -0.04 2.81 0.13 -0.73 -4.63 119.36 113.46 3i3o n ILE 155 Ca -0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 62.75 61.64 3i3o n ILE 155 Cb 0.87 -0.34 0.28 0.00 -0.84 0.00 0.00 39.64 39.61 3i3o n ILE 155 CO 0.00 0.00 0.00 -0.26 2.80 0.00 0.00 176.55 179.09 3i3o h PHE 156 N 0.00 0.62 -0.49 9.51 0.04 -1.14 -1.69 116.94 123.80 3i3o h PHE 156 Ca 0.00 -0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.65 3i3o h PHE 156 Cb 0.53 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 3i3o h PHE 156 CO 0.00 0.56 0.02 0.66 -0.60 0.00 0.00 178.31 178.95 3i3o h SER 157 N 0.59 0.76 -0.71 2.17 4.64 -1.52 -0.61 113.55 118.87 3i3o h SER 157 Ca 0.13 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3i3o h SER 157 Cb 0.27 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.13 3i3o h SER 157 CO 0.00 0.81 0.46 1.88 -0.87 0.00 0.00 176.83 179.11 3i3o h TYR 158 N 0.75 0.91 -0.03 4.77 -1.99 -1.57 0.65 116.97 120.46 3i3o h TYR 158 Ca 0.15 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.89 3i3o h TYR 158 Cb 0.42 -0.31 -0.00 0.00 2.00 0.00 0.00 36.73 38.84 3i3o h TYR 158 CO 0.02 0.59 0.01 0.74 -0.00 0.00 0.00 178.16 179.52 3i3o h PHE 159 N 0.97 0.04 -0.32 4.88 0.04 -0.72 -2.50 116.94 119.33 3i3o h PHE 159 Ca 0.26 -0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.92 3i3o h PHE 159 Cb -0.08 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.05 3i3o h PHE 159 CO -0.02 0.24 -0.20 0.45 -0.60 0.00 0.00 178.31 178.18 3i3o h HIS 160 N -0.16 0.81 -0.10 -0.55 3.86 -0.91 -0.87 115.15 117.23 3i3o h HIS 160 Ca 0.01 -0.22 -0.01 0.00 -1.16 0.00 0.00 60.37 58.99 3i3o h HIS 160 Cb 0.22 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.50 3i3o h HIS 160 CO -0.00 0.93 0.01 0.28 0.86 0.00 0.00 177.93 180.02 3i3o h VAL 161 N 0.46 1.22 -0.53 2.45 2.07 -0.98 -1.53 116.25 119.41 3i3o h VAL 161 Ca 0.07 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3i3o h VAL 161 Cb 0.74 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 3i3o h VAL 161 CO 0.06 0.20 0.34 0.74 0.02 0.00 0.00 177.57 178.92 3i3o h THR 162 N -0.07 1.15 -0.52 2.57 2.02 -1.48 -0.80 112.91 115.78 3i3o h THR 162 Ca 0.03 -0.32 0.02 0.00 0.77 0.00 0.00 66.41 66.91 3i3o h THR 162 Cb 0.30 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 3i3o h THR 162 CO 0.00 0.15 0.33 0.50 0.37 0.00 0.00 175.52 176.87 3i3o h LYS 163 N 0.72 0.64 -0.65 6.66 3.64 -1.09 -1.14 116.57 125.35 3i3o h LYS 163 Ca 0.19 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 3i3o h LYS 163 Cb -0.04 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 3i3o h LYS 163 CO -0.04 0.43 0.19 0.00 -2.27 0.00 0.00 179.45 177.75 3i3o h ALA 164 N 1.21 1.11 0.00 5.00 0.00 -0.96 -2.73 119.26 122.90 3i3o h ALA 164 Ca 0.20 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3i3o h ALA 164 Cb -0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3i3o h ALA 164 CO -0.07 0.61 -0.19 0.00 0.00 0.00 0.00 179.25 179.60 3i3o h ALA 165 N 1.24 1.38 -0.64 0.00 0.00 -0.38 -3.30 119.26 117.56 3i3o h ALA 165 Ca 0.21 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.05 3i3o h ALA 165 Cb 0.30 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3i3o h ALA 165 CO -0.01 0.24 0.43 -0.07 0.00 0.00 0.00 179.25 179.84 3i3o h LEU 166 N 0.00 0.40 -2.55 0.00 3.38 -0.90 0.22 115.31 115.86 3i3o h LEU 166 Ca -0.00 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3i3o h LEU 166 Cb 0.42 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 3i3o h LEU 166 CO 0.02 0.24 -0.01 0.28 0.09 0.00 0.00 178.44 179.06 3i3o h SER 167 N 0.45 0.00 0.00 -0.43 0.02 -1.75 -3.15 113.55 108.69 3i3o h SER 167 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 3i3o h SER 167 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 3i3o h SER 167 CO -0.09 0.01 -0.81 1.41 -1.14 0.00 0.00 176.83 176.21 3i3o n HIS 168 N -3.59 0.00 -3.26 3.45 8.25 0.71 -4.99 115.22 115.78 3i3o n HIS 168 Ca -0.03 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.06 3i3o n HIS 168 Cb 0.10 -0.05 -0.06 0.00 1.12 0.00 0.00 29.99 31.09 3i3o n HIS 168 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3i3o s LEU 169 N -2.87 4.41 0.00 2.41 1.43 -0.89 -4.54 118.68 118.64 3i3o s LEU 169 Ca 0.03 1.23 0.04 0.00 -1.03 0.00 0.00 54.13 54.41 3i3o s LEU 169 Cb 0.10 -3.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.10 3i3o s LEU 169 CO 0.56 0.15 0.16 0.29 0.23 0.00 0.00 176.35 177.75 3i3o n LYS 170 N 1.13 0.56 -1.65 1.70 5.02 -1.26 -4.98 118.16 118.68 3i3o n LYS 170 Ca -0.06 -3.41 -0.47 0.00 -2.02 0.00 0.00 58.31 52.35 3i3o n LYS 170 Cb 0.51 1.97 -0.04 0.00 -0.02 0.00 0.00 35.03 37.46 3i3o n LYS 170 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 3i3o n GLN 171 N -0.87 1.88 0.00 1.97 7.27 -1.22 -1.06 117.38 125.35 3i3o n GLN 171 Ca -0.04 0.68 0.00 0.00 0.07 0.00 0.00 57.00 57.71 3i3o n GLN 171 Cb 0.61 -2.36 0.00 0.00 2.41 0.00 0.00 30.24 30.89 3i3o n GLN 171 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3i3o n GLY 172 N 2.73 0.76 3.91 1.69 0.00 -0.24 -5.00 105.19 109.03 3i3o n GLY 172 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 3i3o n GLY 172 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i3o s ASP 173 N -2.35 5.50 -0.02 1.61 1.01 -0.22 -4.95 116.67 117.24 3i3o s ASP 173 Ca 0.00 0.77 -0.08 0.00 0.71 0.00 0.00 52.55 53.95 3i3o s ASP 173 Cb 0.00 -1.70 0.01 0.00 1.01 0.00 0.00 42.92 42.24 3i3o s ASP 173 CO 0.00 -1.16 0.18 -0.69 0.21 0.00 0.00 175.17 173.70 3i3o s VAL 174 N -3.08 0.05 -0.06 -1.27 1.01 -0.54 -1.93 120.40 114.58 3i3o s VAL 174 Ca 0.55 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 62.14 3i3o s VAL 174 Cb -0.11 -0.40 -0.00 0.00 0.00 0.00 0.00 36.38 35.87 3i3o s VAL 174 CO 0.46 -0.24 -0.20 -0.63 0.00 0.00 0.00 175.10 174.50 3i3o s ILE 175 N -0.88 1.64 -0.08 2.22 1.01 -0.08 -1.38 121.20 123.66 3i3o s ILE 175 Ca -0.10 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.75 3i3o s ILE 175 Cb -0.05 -1.42 0.01 0.00 0.01 0.00 0.00 42.46 41.02 3i3o s ILE 175 CO 0.01 0.47 -0.13 -0.63 0.00 0.00 0.00 174.94 174.66 3i3o s ILE 176 N 0.11 1.26 -0.17 2.92 1.01 -0.13 -2.04 121.20 124.14 3i3o s ILE 176 Ca -0.07 -0.53 -0.02 0.00 0.00 0.00 0.00 60.65 60.03 3i3o s ILE 176 Cb -0.14 -1.15 -0.01 0.00 0.01 0.00 0.00 42.46 41.17 3i3o s ILE 176 CO 0.04 0.39 -0.09 0.20 0.00 0.00 0.00 174.94 175.47 3i3o s ASN 177 N 0.78 4.17 -0.29 3.58 0.01 -0.63 -0.75 114.94 121.82 3i3o s ASN 177 Ca -0.12 -0.34 -0.28 0.00 -0.71 0.00 0.00 52.86 51.41 3i3o s ASN 177 Cb -0.16 -1.67 0.01 0.00 0.41 0.00 0.00 41.25 39.84 3i3o s ASN 177 CO 0.02 0.09 1.01 -0.89 -1.51 0.00 0.00 177.10 175.82 3i3o s THR 178 N 0.83 4.61 0.00 1.60 2.01 0.46 -1.81 115.64 123.34 3i3o s THR 178 Ca -0.03 1.74 0.00 0.00 0.31 0.00 0.00 61.69 63.71 3i3o s THR 178 Cb -0.15 -4.33 0.00 0.00 0.01 0.00 0.00 72.50 68.03 3i3o s THR 178 CO 0.01 -0.34 0.00 0.00 -0.69 0.00 0.00 174.62 173.60 3i3o n ALA 179 N 6.58 0.00 -3.58 7.40 0.00 0.67 -4.86 120.51 126.72 3i3o n ALA 179 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.47 3i3o n ALA 179 Cb 0.47 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.88 3i3o n ALA 179 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3i3o s SER 180 N -0.92 -0.26 0.54 0.00 0.15 -1.26 -4.47 113.70 107.48 3i3o s SER 180 Ca 0.00 0.17 0.26 0.00 0.70 0.00 0.00 55.95 57.08 3i3o s SER 180 Cb 0.00 0.24 1.44 0.00 -1.71 0.00 0.00 66.02 65.99 3i3o s SER 180 CO 0.00 -0.33 1.99 -0.29 1.20 0.00 0.00 173.24 175.82 3i3o h ILE 181 N 2.23 0.66 0.00 6.45 2.10 -1.47 -2.56 117.51 124.92 3i3o h ILE 181 Ca -0.15 0.00 -0.03 0.00 1.08 0.00 0.00 64.86 65.76 3i3o h ILE 181 Cb 1.18 0.73 -0.00 0.00 -1.09 0.00 0.00 36.82 37.64 3i3o h ILE 181 CO 0.28 0.00 -0.13 -0.37 -1.08 0.00 0.00 178.15 176.85 3i3o h VAL 182 N 0.00 0.60 -0.01 2.19 -1.51 -1.85 -0.46 116.25 115.22 3i3o h VAL 182 Ca 0.23 -0.58 -0.06 0.00 -1.23 0.00 0.00 66.70 65.07 3i3o h VAL 182 Cb 0.99 1.37 -0.01 0.00 -2.13 0.00 0.00 31.29 31.51 3i3o h VAL 182 CO -0.00 0.13 -0.26 0.00 -1.23 0.00 0.00 177.57 176.20 3i3o h ALA 183 N 1.87 1.56 0.05 5.19 0.00 -1.69 0.17 119.26 126.40 3i3o h ALA 183 Ca -0.00 -0.24 -0.36 0.00 0.00 0.00 0.00 54.91 54.31 3i3o h ALA 183 Cb 0.36 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 3i3o h ALA 183 CO 0.02 0.33 -2.15 0.66 0.00 0.00 0.00 179.25 178.11 3i3o n TYR 184 N -4.22 0.66 0.41 0.00 4.01 -0.42 -4.60 117.16 113.00 3i3o n TYR 184 Ca -0.02 0.17 0.08 0.00 -0.16 0.00 0.00 57.90 57.97 3i3o n TYR 184 Cb 0.32 -1.10 -0.12 0.00 -0.31 0.00 0.00 39.34 38.13 3i3o n TYR 184 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3i3o n GLU 185 N -3.24 0.97 -0.41 -0.72 -0.58 -0.31 -5.06 120.64 111.28 3i3o n GLU 185 Ca -0.34 -0.08 0.05 0.00 -0.42 0.00 0.00 57.16 56.37 3i3o n GLU 185 Cb 1.05 -1.36 -0.03 0.00 -0.57 0.00 0.00 31.44 30.53 3i3o n GLU 185 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i3o n GLY 186 N 1.45 -2.70 2.94 0.62 0.00 0.58 -5.01 105.19 103.07 3i3o n GLY 186 Ca 0.00 -1.35 -0.08 0.00 0.00 0.00 0.00 46.02 44.60 3i3o n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3i3o s ASN 187 N -5.07 0.09 0.64 1.61 3.84 -1.26 -4.75 114.94 110.05 3i3o s ASN 187 Ca 0.00 0.27 0.38 0.00 0.21 0.00 0.00 52.86 53.72 3i3o s ASN 187 Cb 0.00 1.21 2.10 0.00 -0.55 0.00 0.00 41.25 44.02 3i3o s ASN 187 CO 0.00 -0.30 2.25 1.05 -2.79 0.00 0.00 177.10 177.32 3i3o h GLU 188 N 8.17 0.00 -0.00 0.43 4.11 -1.98 -1.58 114.58 123.73 3i3o h GLU 188 Ca -0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.23 3i3o h GLU 188 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3i3o h GLU 188 CO 0.27 0.00 -0.78 0.25 0.07 0.00 0.00 179.01 178.82 3i3o n THR 189 N -3.31 0.00 -2.93 -1.06 -2.24 -1.26 -4.54 114.28 98.94 3i3o n THR 189 Ca -0.02 -0.03 -0.21 0.00 -2.27 0.00 0.00 64.05 61.52 3i3o n THR 189 Cb 0.15 0.80 -0.02 0.00 -2.10 0.00 0.00 70.33 69.16 3i3o n THR 189 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3i3o n LEU 190 N -1.32 2.66 -0.08 3.22 4.77 -0.60 -1.42 117.00 124.24 3i3o n LEU 190 Ca 0.05 -5.07 -0.12 0.00 -0.03 0.00 0.00 56.01 50.84 3i3o n LEU 190 Cb 0.35 0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.48 3i3o n LEU 190 CO 0.39 2.20 0.66 0.40 -1.33 0.00 0.00 177.39 179.70 3i3o h ILE 191 N 2.17 1.30 -0.18 -0.08 2.04 -1.79 0.79 117.51 121.77 3i3o h ILE 191 Ca 0.11 -1.20 -0.04 0.00 1.00 0.00 0.00 64.86 64.72 3i3o h ILE 191 Cb 0.84 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.48 3i3o h ILE 191 CO 0.65 0.37 -0.06 -2.24 0.00 0.00 0.00 178.15 176.88 3i3o h ASP 192 N 0.23 0.35 -0.47 1.72 2.03 -1.92 -1.99 116.42 116.37 3i3o h ASP 192 Ca 0.05 -0.38 0.08 0.00 -0.73 0.00 0.00 57.03 56.05 3i3o h ASP 192 Cb 0.63 -0.10 -0.07 0.00 -0.83 0.00 0.00 39.33 38.96 3i3o h ASP 192 CO 0.04 0.66 0.08 0.22 -1.03 0.00 0.00 179.24 179.20 3i3o h TYR 193 N 0.05 0.12 -0.61 4.15 3.20 -1.91 -1.15 116.97 120.82 3i3o h TYR 193 Ca 0.04 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 3i3o h TYR 193 Cb 0.51 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 3i3o h TYR 193 CO 0.06 -0.02 0.20 0.66 -1.64 0.00 0.00 178.16 177.42 3i3o h SER 194 N 0.20 0.83 -0.59 -2.11 4.64 -0.80 -1.13 113.55 114.60 3i3o h SER 194 Ca 0.23 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.40 3i3o h SER 194 Cb 0.31 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 3i3o h SER 194 CO -0.32 0.78 0.28 0.00 -0.87 0.00 0.00 176.83 176.70 3i3o h ALA 195 N 1.34 1.33 -0.39 5.18 0.00 -0.54 0.12 119.26 126.29 3i3o h ALA 195 Ca 0.20 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3i3o h ALA 195 Cb 0.23 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3i3o h ALA 195 CO -0.01 0.52 -0.14 1.79 0.00 0.00 0.00 179.25 181.40 3i3o h THR 196 N 0.88 1.26 -0.10 0.00 1.35 -0.40 -1.54 112.91 114.36 3i3o h THR 196 Ca 0.21 -1.18 -0.19 0.00 -0.55 0.00 0.00 66.41 64.70 3i3o h THR 196 Cb 0.12 1.11 -0.00 0.00 -1.73 0.00 0.00 68.15 67.65 3i3o h THR 196 CO -0.03 0.40 -0.73 0.11 -0.25 0.00 0.00 175.52 175.02 3i3o h LYS 197 N 0.64 0.48 -0.59 4.72 1.79 -0.58 -1.73 116.57 121.30 3i3o h LYS 197 Ca 0.11 -0.39 -0.04 0.00 -2.18 0.00 0.00 60.65 58.15 3i3o h LYS 197 Cb 0.60 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.31 3i3o h LYS 197 CO 0.04 1.02 0.20 0.78 -1.08 0.00 0.00 179.45 180.41 3i3o h GLY 198 N 1.14 0.94 0.87 3.86 0.00 -0.54 -2.03 103.07 107.31 3i3o h GLY 198 Ca -0.03 -0.50 0.03 0.00 0.00 0.00 0.00 47.33 46.83 3i3o h GLY 198 CO 0.13 0.47 0.47 0.00 0.00 0.00 0.00 176.54 177.61 3i3o h ALA 199 N 1.37 0.97 -0.51 3.60 0.00 -0.95 -2.39 119.26 121.36 3i3o h ALA 199 Ca 0.20 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3i3o h ALA 199 Cb 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3i3o h ALA 199 CO -0.01 0.26 0.20 0.82 0.00 0.00 0.00 179.25 180.52 3i3o h ILE 200 N 0.92 1.22 -0.12 0.00 2.04 -1.01 0.06 117.51 120.61 3i3o h ILE 200 Ca 0.30 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.48 3i3o h ILE 200 Cb 0.02 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3i3o h ILE 200 CO -0.11 0.26 0.07 0.58 0.00 0.00 0.00 178.15 178.94 3i3o h VAL 201 N 0.68 1.01 -0.56 1.67 2.07 -1.07 0.15 116.25 120.20 3i3o h VAL 201 Ca 0.17 -0.05 -0.07 0.00 0.82 0.00 0.00 66.70 67.57 3i3o h VAL 201 Cb 0.21 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3i3o h VAL 201 CO -0.01 0.03 0.07 0.00 0.02 0.00 0.00 177.57 177.67 3i3o h ALA 202 N 1.05 1.06 -0.62 1.67 0.00 -1.34 -1.68 119.26 119.41 3i3o h ALA 202 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3i3o h ALA 202 Cb -0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3i3o h ALA 202 CO -0.02 0.60 0.39 0.35 0.00 0.00 0.00 179.25 180.57 3i3o h PHE 203 N 0.86 0.79 -0.42 0.00 3.57 -0.67 0.18 116.94 121.25 3i3o h PHE 203 Ca 0.17 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 3i3o h PHE 203 Cb 0.41 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3i3o h PHE 203 CO 0.03 0.52 0.17 1.15 -2.23 0.00 0.00 178.31 177.94 3i3o h THR 204 N 0.84 1.20 0.04 4.41 2.02 -0.29 -0.05 112.91 121.08 3i3o h THR 204 Ca 0.22 -0.62 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 3i3o h THR 204 Cb -0.06 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 3i3o h THR 204 CO -0.05 0.23 -0.02 0.03 0.37 0.00 0.00 175.52 176.08 3i3o h ARG 205 N 0.54 -0.05 -0.22 6.66 3.08 -0.84 -1.37 114.38 122.18 3i3o h ARG 205 Ca 0.14 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 3i3o h ARG 205 Cb 0.19 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 3i3o h ARG 205 CO -0.01 0.12 0.02 0.77 -1.07 0.00 0.00 179.97 179.80 3i3o h SER 206 N -0.22 0.35 -0.48 7.04 0.02 -0.56 -2.99 113.55 116.70 3i3o h SER 206 Ca -0.01 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.63 3i3o h SER 206 Cb 0.20 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 3i3o h SER 206 CO 0.01 0.54 0.17 0.25 -1.14 0.00 0.00 176.83 176.66 3i3o h LEU 207 N 0.15 0.74 -0.76 5.07 5.85 -1.03 -1.70 115.31 123.63 3i3o h LEU 207 Ca 0.06 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.74 3i3o h LEU 207 Cb 0.34 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 3i3o h LEU 207 CO 0.01 0.70 0.44 0.77 -0.34 0.00 0.00 178.44 180.01 3i3o h SER 208 N 0.78 0.65 0.35 1.25 4.64 -1.13 -0.03 113.55 120.06 3i3o h SER 208 Ca 0.18 0.03 -0.18 0.00 -0.47 0.00 0.00 61.79 61.35 3i3o h SER 208 Cb 0.23 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3i3o h SER 208 CO -0.01 0.40 -0.75 1.56 -0.87 0.00 0.00 176.83 177.17 3i3o h GLN 209 N 0.78 0.33 -0.45 4.77 1.08 -1.30 -2.20 115.11 118.11 3i3o h GLN 209 Ca 0.34 -0.28 -0.07 0.00 -1.45 0.00 0.00 58.65 57.20 3i3o h GLN 209 Cb 0.23 0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 3i3o h GLN 209 CO -0.20 0.93 0.00 1.03 -0.95 0.00 0.00 178.83 179.64 3i3o h SER 210 N 0.22 0.71 -0.01 1.46 0.87 -0.48 -3.26 113.55 113.07 3i3o h SER 210 Ca -0.03 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 3i3o h SER 210 Cb 1.32 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 3i3o h SER 210 CO 0.12 0.78 -0.50 0.18 -0.53 0.00 0.00 176.83 176.88 3i3o n LEU 211 N -4.23 1.94 -0.12 2.23 4.77 -0.11 -4.56 117.00 116.93 3i3o n LEU 211 Ca 0.02 -0.73 0.02 0.00 -0.03 0.00 0.00 56.01 55.29 3i3o n LEU 211 Cb 0.29 -0.00 0.32 0.00 -2.33 0.00 0.00 43.42 41.70 3i3o n LEU 211 CO 0.41 0.37 1.20 1.62 -1.33 0.00 0.00 177.39 179.66 3i3o h VAL 212 N 2.26 1.16 0.00 4.08 3.04 -1.44 -0.95 116.25 124.40 3i3o h VAL 212 Ca 0.00 -0.29 -0.01 0.00 -1.01 0.00 0.00 66.70 65.39 3i3o h VAL 212 Cb 0.74 0.27 -0.00 0.00 -2.01 0.00 0.00 31.29 30.29 3i3o h VAL 212 CO 0.00 0.15 -0.04 1.56 -1.01 0.00 0.00 177.57 178.23 3i3o h GLN 213 N 0.82 0.00 -0.04 4.17 4.20 -1.81 -2.18 115.11 120.26 3i3o h GLN 213 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 3i3o h GLN 213 Cb -0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.69 3i3o h GLN 213 CO -0.05 0.04 0.00 1.63 -0.67 0.00 0.00 178.83 179.79 3i3o n LYS 214 N -3.13 1.39 -1.78 1.46 5.02 -0.38 -4.92 118.16 115.83 3i3o n LYS 214 Ca 0.02 -0.58 -0.08 0.00 -2.02 0.00 0.00 58.31 55.64 3i3o n LYS 214 Cb 0.40 -1.43 -0.02 0.00 -0.02 0.00 0.00 35.03 33.96 3i3o n LYS 214 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i3o n GLY 215 N 1.05 0.44 3.46 0.72 0.00 -0.82 -3.41 105.19 106.64 3i3o n GLY 215 Ca 0.19 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 3i3o n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i3o s ILE 216 N -2.37 3.96 0.20 -0.61 1.01 -1.12 -1.08 121.20 121.19 3i3o s ILE 216 Ca 0.00 -0.32 -0.07 0.00 0.00 0.00 0.00 60.65 60.26 3i3o s ILE 216 Cb 0.00 -2.78 -0.06 0.00 0.01 0.00 0.00 42.46 39.63 3i3o s ILE 216 CO 0.00 0.44 0.48 -0.13 0.00 0.00 0.00 174.94 175.73 3i3o s ARG 217 N 0.85 3.70 -0.05 2.79 0.52 -0.82 -4.08 118.95 121.87 3i3o s ARG 217 Ca 0.00 0.08 -0.02 0.00 -0.52 0.00 0.00 55.73 55.28 3i3o s ARG 217 Cb -0.14 -2.73 0.03 0.00 0.52 0.00 0.00 34.95 32.63 3i3o s ARG 217 CO 0.02 0.36 0.06 0.08 0.02 0.00 0.00 175.30 175.84 3i3o s VAL 218 N -1.79 -0.06 0.27 3.52 1.01 -1.26 -0.91 120.40 121.19 3i3o s VAL 218 Ca 0.44 0.37 -0.02 0.00 0.00 0.00 0.00 61.98 62.77 3i3o s VAL 218 Cb -0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 3i3o s VAL 218 CO 0.24 0.16 0.31 0.20 0.00 0.00 0.00 175.10 176.02 3i3o s ASN 219 N 2.15 0.59 0.20 3.32 0.01 -0.87 0.33 114.94 120.67 3i3o s ASN 219 Ca 0.05 -1.40 -0.01 0.00 -0.71 0.00 0.00 52.86 50.80 3i3o s ASN 219 Cb -0.12 0.53 -0.04 0.00 0.41 0.00 0.00 41.25 42.02 3i3o s ASN 219 CO -0.04 -1.06 0.11 -0.83 -1.51 0.00 0.00 177.10 173.78 3i3o s GLY 220 N -3.19 1.41 -0.04 0.66 0.00 0.57 -1.61 107.32 105.10 3i3o s GLY 220 Ca 0.34 -1.69 0.05 0.00 0.00 0.00 0.00 44.72 43.42 3i3o s GLY 220 CO 0.17 -1.42 -0.20 0.14 0.00 0.00 0.00 173.10 171.79 3i3o s VAL 221 N -4.09 1.62 -0.58 1.40 1.01 -0.75 -1.34 120.40 117.67 3i3o s VAL 221 Ca 0.37 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 3i3o s VAL 221 Cb 0.07 -1.38 0.15 0.00 0.00 0.00 0.00 36.38 35.22 3i3o s VAL 221 CO 0.11 0.46 0.36 0.00 0.00 0.00 0.00 175.10 176.03 3i3o s ALA 222 N -0.07 3.46 0.56 5.51 0.00 -0.06 -0.24 121.76 130.92 3i3o s ALA 222 Ca -0.03 -3.23 -0.17 0.00 0.00 0.00 0.00 51.96 48.53 3i3o s ALA 222 Cb -0.12 -2.46 -0.05 0.00 0.00 0.00 0.00 23.12 20.49 3i3o s ALA 222 CO 0.02 -2.06 1.06 -2.14 0.00 0.00 0.00 175.76 172.64 3i3o s PRO 223 N -0.10 3.46 0.00 0.00 0.02 -1.26 -2.41 135.00 134.71 3i3o s PRO 223 Ca 0.17 1.29 0.00 0.00 0.02 0.00 0.00 61.00 62.48 3i3o s PRO 223 Cb -0.22 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.25 3i3o s PRO 223 CO -0.02 -0.71 0.00 0.41 -0.33 0.00 0.00 177.00 176.35 3i3o n GLY 224 N -0.64 1.62 3.64 0.52 0.00 -0.55 -1.57 105.19 108.20 3i3o n GLY 224 Ca 0.09 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 43.93 3i3o n GLY 224 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i3o s PRO 225 N 2.95 3.94 -0.10 1.61 0.04 -1.26 -4.93 135.00 137.25 3i3o s PRO 225 Ca 0.00 1.49 0.04 0.00 0.04 0.00 0.00 61.00 62.57 3i3o s PRO 225 Cb 0.00 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.62 3i3o s PRO 225 CO 0.00 -1.10 -0.23 0.42 0.04 0.00 0.00 177.00 176.13 3i3o s ILE 226 N 4.50 1.98 -0.54 0.56 -1.09 -1.26 -0.82 121.20 124.54 3i3o s ILE 226 Ca 0.62 -0.97 -0.26 0.00 -2.23 0.00 0.00 60.65 57.80 3i3o s ILE 226 Cb -0.21 -1.72 -0.04 0.00 -1.58 0.00 0.00 42.46 38.91 3i3o s ILE 226 CO 0.24 0.54 2.10 0.86 -1.23 0.00 0.00 174.94 177.46 3i3o s TRP 227 N 0.41 1.40 0.19 3.97 -0.00 -0.77 -4.84 118.94 119.30 3i3o s TRP 227 Ca -0.18 1.11 -0.07 0.00 -0.00 0.00 0.00 56.10 56.97 3i3o s TRP 227 Cb -0.18 -3.87 -0.02 0.00 -0.00 0.00 0.00 33.47 29.41 3i3o s TRP 227 CO 0.08 -2.48 0.26 0.95 -0.00 0.00 0.00 176.95 175.76 3i3o s THR 228 N 10.32 0.04 0.17 5.86 -4.23 -1.26 -4.42 115.64 122.12 3i3o s THR 228 Ca 0.82 -1.61 0.32 0.00 -1.18 0.00 0.00 61.69 60.04 3i3o s THR 228 Cb -0.15 -2.11 0.32 0.00 1.34 0.00 0.00 72.50 71.89 3i3o s THR 228 CO 0.24 -0.17 1.97 1.55 -0.54 0.00 0.00 174.62 177.67 3i3o h PRO 229 N 2.53 0.00 0.00 3.99 0.13 -1.90 -1.82 132.00 134.93 3i3o h PRO 229 Ca -0.32 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.76 3i3o h PRO 229 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 3i3o h PRO 229 CO 0.48 0.00 -0.25 1.25 -0.23 0.00 0.00 178.00 179.24 3i3o h LEU 230 N 0.00 0.00 0.29 1.56 5.85 -1.93 -2.96 115.31 118.12 3i3o h LEU 230 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3i3o h LEU 230 Cb 0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.04 3i3o h LEU 230 CO 0.00 0.25 -0.14 0.40 -0.34 0.00 0.00 178.44 178.61 3i3o h ILE 231 N 0.00 0.00 0.00 4.05 1.08 -1.65 -2.82 117.51 118.17 3i3o h ILE 231 Ca -0.00 -0.46 -0.01 0.00 -0.39 0.00 0.00 64.86 64.00 3i3o h ILE 231 Cb 0.54 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.29 3i3o h ILE 231 CO 0.03 0.00 -0.06 1.55 -0.69 0.00 0.00 178.15 178.99 3i3o h PRO 232 N -0.86 0.00 0.00 2.37 0.13 -1.70 -0.87 132.00 131.07 3i3o h PRO 232 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 3i3o h PRO 232 Cb 0.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.43 3i3o h PRO 232 CO 0.07 0.06 0.00 -1.13 -0.23 0.00 0.00 178.00 176.76 3i3o n SER 233 N -3.17 0.78 -0.02 1.44 3.41 -1.12 -0.82 113.62 114.11 3i3o n SER 233 Ca 0.01 0.61 -0.05 0.00 -0.26 0.00 0.00 58.87 59.17 3i3o n SER 233 Cb 0.34 -0.80 -0.02 0.00 -0.26 0.00 0.00 64.21 63.47 3i3o n SER 233 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3i3o n SER 234 N -2.26 0.70 -4.85 4.04 3.41 -1.06 -4.45 113.62 109.15 3i3o n SER 234 Ca 0.04 0.05 -0.32 0.00 -0.26 0.00 0.00 58.87 58.38 3i3o n SER 234 Cb 0.37 -0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 64.13 3i3o n SER 234 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3i3o s PHE 235 N -2.09 3.37 0.95 7.33 0.08 -0.35 -4.55 117.98 122.72 3i3o s PHE 235 Ca -0.07 1.27 -0.12 0.00 0.12 0.00 0.00 56.93 58.14 3i3o s PHE 235 Cb 0.02 -2.59 0.16 0.00 -0.57 0.00 0.00 43.02 40.05 3i3o s PHE 235 CO 0.09 0.03 1.09 0.16 -0.10 0.00 0.00 175.22 176.48 3i3o s ASP 236 N -2.36 2.96 0.45 1.36 -4.77 -1.26 -4.68 116.67 108.36 3i3o s ASP 236 Ca 0.55 1.54 0.16 0.00 -3.30 0.00 0.00 52.55 51.50 3i3o s ASP 236 Cb -0.10 -2.21 1.03 0.00 -1.09 0.00 0.00 42.92 40.56 3i3o s ASP 236 CO 0.18 -2.97 1.99 1.05 0.70 0.00 0.00 175.17 176.12 3i3o h GLU 237 N -1.78 0.00 0.00 2.11 9.09 -1.94 -1.19 114.58 120.88 3i3o h GLU 237 Ca -0.51 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 58.87 3i3o h GLU 237 Cb 1.29 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.39 3i3o h GLU 237 CO 0.53 0.19 -0.67 -0.22 0.05 0.00 0.00 179.01 178.89 3i3o h LYS 238 N 0.00 0.00 -0.08 1.06 1.63 -1.92 -2.66 116.57 114.60 3i3o h LYS 238 Ca -0.00 0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.61 3i3o h LYS 238 Cb 0.36 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.00 3i3o h LYS 238 CO 0.03 0.08 -0.67 -0.22 -3.45 0.00 0.00 179.45 175.22 3i3o h LYS 239 N 0.00 0.59 -0.64 1.90 1.63 -1.82 -3.08 116.57 115.15 3i3o h LYS 239 Ca -0.02 -0.53 0.06 0.00 -0.85 0.00 0.00 60.65 59.31 3i3o h LYS 239 Cb 1.11 0.13 -0.06 0.00 -0.60 0.00 0.00 32.23 32.81 3i3o h LYS 239 CO 0.01 1.15 0.33 0.28 -3.45 0.00 0.00 179.45 177.78 3i3o h VAL 240 N 0.22 0.93 0.00 2.00 2.07 -1.25 -0.08 116.25 120.13 3i3o h VAL 240 Ca -0.06 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 3i3o h VAL 240 Cb 1.32 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3i3o h VAL 240 CO 0.14 0.11 -0.03 0.77 0.02 0.00 0.00 177.57 178.57 3i3o h SER 241 N 0.61 0.00 -0.02 0.57 4.64 -1.50 -2.74 113.55 115.11 3i3o h SER 241 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3i3o h SER 241 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3i3o h SER 241 CO -0.20 0.03 -0.23 0.00 -0.87 0.00 0.00 176.83 175.56 3i3o n GLN 242 N -3.18 1.58 -1.57 4.77 6.02 -0.83 0.87 117.38 125.03 3i3o n GLN 242 Ca -0.01 -1.08 -0.54 0.00 -0.01 0.00 0.00 57.00 55.36 3i3o n GLN 242 Cb 0.25 -1.31 -0.07 0.00 1.02 0.00 0.00 30.24 30.13 3i3o n GLN 242 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3i3o n PHE 243 N 0.27 1.29 -0.89 1.08 7.35 -0.10 -1.79 117.46 124.66 3i3o n PHE 243 Ca 0.08 0.75 0.00 0.00 -0.76 0.00 0.00 57.45 57.52 3i3o n PHE 243 Cb 0.39 -2.27 0.00 0.00 0.35 0.00 0.00 39.48 37.95 3i3o n PHE 243 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3i3o n GLY 244 N 2.28 0.61 0.24 7.13 0.00 -1.26 -4.22 105.19 109.97 3i3o n GLY 244 Ca 0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.36 3i3o n GLY 244 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i3o h SER 245 N 0.00 0.00 0.46 1.61 4.64 -1.64 -1.88 113.55 116.75 3i3o h SER 245 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3i3o h SER 245 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3i3o h SER 245 CO 0.00 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.50 3i3o n ASN 246 N -3.05 0.00 -4.89 4.97 6.94 -1.26 -4.63 115.26 113.34 3i3o n ASN 246 Ca 0.02 0.01 -0.24 0.00 -0.02 0.00 0.00 54.58 54.35 3i3o n ASN 246 Cb 0.41 -0.31 -0.04 0.00 -2.36 0.00 0.00 39.78 37.49 3i3o n ASN 246 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 3i3o s VAL 247 N -2.61 4.91 0.41 3.53 -7.23 -1.24 -5.00 120.40 113.18 3i3o s VAL 247 Ca 0.21 -1.02 0.10 0.00 -1.81 0.00 0.00 61.98 59.45 3i3o s VAL 247 Cb 0.15 -3.59 0.30 0.00 0.56 0.00 0.00 36.38 33.80 3i3o s VAL 247 CO 0.36 -0.22 2.00 -0.65 -0.31 0.00 0.00 175.10 176.28 3i3o h PRO 248 N 1.80 0.51 0.00 4.82 0.11 -1.82 0.43 132.00 137.85 3i3o h PRO 248 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3i3o h PRO 248 Cb 1.22 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3i3o h PRO 248 CO 0.64 0.34 0.00 -1.33 -0.21 0.00 0.00 178.00 177.43 3i3o n MET 249 N -4.47 0.22 -3.82 1.05 2.81 -0.33 -4.89 117.12 107.68 3i3o n MET 249 Ca 0.08 0.13 -0.30 0.00 -1.81 0.00 0.00 57.70 55.80 3i3o n MET 249 Cb 0.23 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.26 3i3o n MET 249 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 3i3o n GLN 250 N -1.31 -4.70 -3.51 0.03 6.02 0.15 -4.95 117.38 109.10 3i3o n GLN 250 Ca 0.08 0.55 -0.16 0.00 -0.01 0.00 0.00 57.00 57.47 3i3o n GLN 250 Cb 0.15 -5.39 -0.05 0.00 1.02 0.00 0.00 30.24 25.97 3i3o n GLN 250 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 3i3o s ARG 251 N -6.52 1.03 0.76 -1.09 1.70 -0.71 -4.72 118.95 109.41 3i3o s ARG 251 Ca 0.62 0.09 -0.11 0.00 -0.47 0.00 0.00 55.73 55.86 3i3o s ARG 251 Cb -0.32 0.48 0.05 0.00 -0.57 0.00 0.00 34.95 34.60 3i3o s ARG 251 CO 0.76 -0.35 1.08 -1.25 -1.08 0.00 0.00 175.30 174.46 3i3o s PRO 252 N -1.71 2.36 0.51 3.89 0.04 -1.24 -4.78 135.00 134.07 3i3o s PRO 252 Ca -0.07 0.79 -0.06 0.00 0.04 0.00 0.00 61.00 61.70 3i3o s PRO 252 Cb -0.00 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 3i3o s PRO 252 CO 0.04 -1.46 0.83 0.20 0.04 0.00 0.00 177.00 176.65 3i3o s GLY 253 N -3.81 1.53 0.04 0.56 0.00 -0.00 -4.87 107.32 100.77 3i3o s GLY 253 Ca 0.60 -0.46 -0.02 0.00 0.00 0.00 0.00 44.72 44.84 3i3o s GLY 253 CO 0.55 -0.27 0.23 1.20 0.00 0.00 0.00 173.10 174.81 3i3o s GLN 254 N -4.83 3.48 0.40 2.90 -1.52 -1.26 -1.84 119.66 116.98 3i3o s GLN 254 Ca 0.49 -0.32 0.18 0.00 -1.95 0.00 0.00 55.36 53.76 3i3o s GLN 254 Cb -0.10 -3.04 1.08 0.00 -0.22 0.00 0.00 33.01 30.73 3i3o s GLN 254 CO 0.46 0.62 1.80 -1.35 -0.25 0.00 0.00 175.29 176.57 3i3o h PRO 255 N 3.36 0.40 0.00 2.91 0.11 -1.75 0.86 132.00 137.90 3i3o h PRO 255 Ca -0.47 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3i3o h PRO 255 Cb 1.17 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 3i3o h PRO 255 CO 0.72 0.27 -0.11 0.10 -0.21 0.00 0.00 178.00 178.78 3i3o h TYR 256 N 0.42 0.00 0.00 0.65 -0.00 -1.53 -1.06 116.97 115.45 3i3o h TYR 256 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.28 3i3o h TYR 256 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.09 3i3o h TYR 256 CO -0.00 0.11 0.00 0.39 -0.00 0.00 0.00 178.16 178.65 3i3o n GLU 257 N -3.62 0.02 -0.02 0.10 1.02 0.30 -2.54 120.64 115.90 3i3o n GLU 257 Ca -0.02 0.24 -0.03 0.00 -0.02 0.00 0.00 57.16 57.33 3i3o n GLU 257 Cb 0.23 -1.54 -0.12 0.00 -0.02 0.00 0.00 31.44 29.99 3i3o n GLU 257 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3i3o n LEU 258 N -1.57 0.56 -0.34 -4.62 7.99 -0.41 -4.58 117.00 114.03 3i3o n LEU 258 Ca 0.04 0.25 -0.02 0.00 -0.01 0.00 0.00 56.01 56.27 3i3o n LEU 258 Cb 0.19 0.19 0.11 0.00 -0.11 0.00 0.00 43.42 43.80 3i3o n LEU 258 CO 0.15 0.27 1.25 0.00 -1.51 0.00 0.00 177.39 177.55 3i3o h ALA 259 N 1.28 1.17 0.00 -1.18 0.00 -1.49 -2.77 119.26 116.28 3i3o h ALA 259 Ca -0.27 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 3i3o h ALA 259 Cb 1.78 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 3i3o h ALA 259 CO 0.04 0.50 -0.15 -1.35 0.00 0.00 0.00 179.25 178.29 3i3o h PRO 260 N 1.19 0.00 -0.86 0.00 0.11 -1.81 -1.21 132.00 129.43 3i3o h PRO 260 Ca 0.35 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.45 3i3o h PRO 260 Cb -0.07 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.00 3i3o h PRO 260 CO -0.09 0.15 0.50 0.00 -0.21 0.00 0.00 178.00 178.34 3i3o h ALA 261 N 1.85 1.10 -0.42 -0.75 0.00 -1.79 0.85 119.26 120.10 3i3o h ALA 261 Ca -0.00 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 3i3o h ALA 261 Cb 0.29 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3i3o h ALA 261 CO 0.02 0.58 -0.32 1.88 0.00 0.00 0.00 179.25 181.41 3i3o h TYR 262 N 1.19 1.10 -0.47 0.00 0.05 -1.28 -1.91 116.97 115.65 3i3o h TYR 262 Ca 0.31 -0.30 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 3i3o h TYR 262 Cb -0.02 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.46 3i3o h TYR 262 CO 0.00 1.12 0.28 0.28 -1.05 0.00 0.00 178.16 178.80 3i3o h VAL 263 N 0.79 1.15 -0.04 -2.88 2.07 -0.99 0.14 116.25 116.49 3i3o h VAL 263 Ca 0.08 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.28 3i3o h VAL 263 Cb 0.90 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3i3o h VAL 263 CO 0.08 0.15 -0.09 0.22 0.02 0.00 0.00 177.57 177.95 3i3o h TYR 264 N 0.63 -0.23 0.00 1.57 3.20 -0.71 -1.96 116.97 119.47 3i3o h TYR 264 Ca 0.17 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.96 3i3o h TYR 264 Cb -0.00 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 3i3o h TYR 264 CO -0.03 -0.14 -0.41 -0.07 -1.64 0.00 0.00 178.16 175.87 3i3o h LEU 265 N -0.14 0.00 0.01 2.82 3.38 -1.07 -3.19 115.31 117.12 3i3o h LEU 265 Ca 0.05 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.79 3i3o h LEU 265 Cb 0.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3i3o h LEU 265 CO -0.12 0.41 -1.07 0.00 0.09 0.00 0.00 178.44 177.75 3i3o h ALA 266 N 1.59 0.29 -1.60 1.53 0.00 -0.48 -3.46 119.26 117.12 3i3o h ALA 266 Ca -0.00 -0.88 -0.46 0.00 0.00 0.00 0.00 54.91 53.57 3i3o h ALA 266 Cb 0.80 -0.09 0.07 0.00 0.00 0.00 0.00 17.79 18.56 3i3o h ALA 266 CO 0.05 1.11 0.06 -1.54 0.00 0.00 0.00 179.25 178.94 3i3o s SER 267 N -6.89 4.73 0.00 0.00 1.04 -0.76 -4.89 113.70 106.93 3i3o s SER 267 Ca -0.01 -0.17 0.19 0.00 0.48 0.00 0.00 55.95 56.45 3i3o s SER 267 Cb 0.09 -0.42 1.08 0.00 0.10 0.00 0.00 66.02 66.87 3i3o s SER 267 CO 0.84 -1.58 1.58 -1.54 0.98 0.00 0.00 173.24 173.53 3i3o n SER 268 N -2.66 0.00 0.32 7.02 3.41 -1.26 -2.52 113.62 117.93 3i3o n SER 268 Ca 0.12 -0.31 0.21 0.00 -0.26 0.00 0.00 58.87 58.63 3i3o n SER 268 Cb 0.60 -0.14 1.09 0.00 -0.26 0.00 0.00 64.21 65.50 3i3o n SER 268 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3i3o h ASP 269 N 0.00 0.00 -0.33 4.04 3.32 -1.91 -2.43 116.42 119.11 3i3o h ASP 269 Ca 0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 3i3o h ASP 269 Cb 0.09 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.49 3i3o h ASP 269 CO 0.00 0.01 -0.35 -1.54 -1.72 0.00 0.00 179.24 175.64 3i3o n SER 270 N -3.20 2.91 0.17 6.45 3.41 -1.05 -4.84 113.62 117.47 3i3o n SER 270 Ca -0.02 -3.83 0.18 0.00 -0.26 0.00 0.00 58.87 54.94 3i3o n SER 270 Cb 0.11 -0.55 0.76 0.00 -0.26 0.00 0.00 64.21 64.27 3i3o n SER 270 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3i3o h SER 271 N 1.29 0.00 -0.37 4.04 4.64 -1.63 -0.46 113.55 121.05 3i3o h SER 271 Ca 0.19 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.47 3i3o h SER 271 Cb 1.35 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.42 3i3o h SER 271 CO 0.38 0.00 0.02 0.00 -0.87 0.00 0.00 176.83 176.36 3i3o n TYR 272 N -3.41 1.30 -4.07 4.77 9.36 -1.26 -4.93 117.16 118.92 3i3o n TYR 272 Ca 0.04 -0.94 -0.32 0.00 3.32 0.00 0.00 57.90 60.00 3i3o n TYR 272 Cb 0.55 -0.40 -0.16 0.00 -0.63 0.00 0.00 39.34 38.70 3i3o n TYR 272 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 3i3o s VAL 273 N -2.87 1.93 -0.07 2.97 1.01 -0.18 -5.10 120.40 118.08 3i3o s VAL 273 Ca 0.46 -1.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.26 3i3o s VAL 273 Cb 0.37 -1.86 0.03 0.00 0.00 0.00 0.00 36.38 34.92 3i3o s VAL 273 CO 0.10 0.34 0.32 0.28 0.00 0.00 0.00 175.10 176.14 3i3o s THR 274 N 1.30 0.03 0.00 3.92 -1.32 -1.26 -4.69 115.64 113.62 3i3o s THR 274 Ca 0.01 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.27 3i3o s THR 274 Cb -0.15 -0.53 0.00 0.00 -1.51 0.00 0.00 72.50 70.31 3i3o s THR 274 CO -0.10 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 172.80 3i3o n GLY 275 N 2.18 0.56 3.80 6.08 0.00 0.15 -4.96 105.19 112.99 3i3o n GLY 275 Ca -0.17 -0.35 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 3i3o n GLY 275 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i3o s GLN 276 N -0.75 2.34 -0.06 1.61 -1.52 -1.26 -4.68 119.66 115.34 3i3o s GLN 276 Ca 0.00 -1.75 0.03 0.00 -1.95 0.00 0.00 55.36 51.68 3i3o s GLN 276 Cb 0.00 -2.13 0.01 0.00 -0.22 0.00 0.00 33.01 30.67 3i3o s GLN 276 CO 0.00 -0.18 -0.13 1.41 -0.25 0.00 0.00 175.29 176.14 3i3o s MET 277 N -4.01 1.76 -0.29 2.91 1.75 -1.26 -0.32 119.30 119.84 3i3o s MET 277 Ca 0.43 -0.45 -0.11 0.00 -1.25 0.00 0.00 55.69 54.31 3i3o s MET 277 Cb 0.01 -1.45 -0.04 0.00 2.84 0.00 0.00 34.83 36.19 3i3o s MET 277 CO 0.24 0.06 0.18 0.42 -0.65 0.00 0.00 175.02 175.26 3i3o s ILE 278 N 0.58 5.07 -0.41 10.11 -1.09 -0.45 -4.94 121.20 130.07 3i3o s ILE 278 Ca -0.14 -0.01 -0.20 0.00 -2.23 0.00 0.00 60.65 58.07 3i3o s ILE 278 Cb -0.15 -3.46 0.02 0.00 -1.58 0.00 0.00 42.46 37.28 3i3o s ILE 278 CO 0.04 0.20 0.60 -1.00 -1.23 0.00 0.00 174.94 173.55 3i3o s HIS 279 N 1.72 3.11 -0.53 3.97 3.76 -1.26 -0.88 115.29 125.18 3i3o s HIS 279 Ca 0.07 0.02 0.04 0.00 -0.15 0.00 0.00 55.06 55.04 3i3o s HIS 279 Cb -0.16 -3.19 0.14 0.00 1.11 0.00 0.00 32.58 30.48 3i3o s HIS 279 CO 0.09 -0.75 0.29 0.08 -0.85 0.00 0.00 174.74 173.60 3i3o s VAL 280 N 2.66 2.27 0.00 -0.90 1.01 -1.01 -4.92 120.40 119.51 3i3o s VAL 280 Ca 0.21 -3.27 0.00 0.00 0.00 0.00 0.00 61.98 58.92 3i3o s VAL 280 Cb -0.15 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.67 3i3o s VAL 280 CO 0.17 -0.87 0.72 -0.46 0.00 0.00 0.00 175.10 174.65 3i3o n ASN 281 N 3.02 0.00 -0.05 3.32 0.23 -1.26 -1.48 115.26 119.04 3i3o n ASN 281 Ca 0.09 -1.49 -0.01 0.00 -0.53 0.00 0.00 54.58 52.64 3i3o n ASN 281 Cb 0.34 -0.10 -0.00 0.00 -2.08 0.00 0.00 39.78 37.93 3i3o n ASN 281 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3i3o n GLY 282 N 0.00 0.46 0.00 4.83 0.00 -1.26 -3.90 105.19 105.32 3i3o n GLY 282 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 3i3o n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i3o n GLY 283 N -2.85 1.03 3.68 -0.02 0.00 -1.26 -1.19 105.19 104.57 3i3o n GLY 283 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3i3o n GLY 283 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i3o s VAL 284 N -2.00 4.36 -0.10 1.61 1.01 -1.25 -4.70 120.40 119.33 3i3o s VAL 284 Ca 0.00 1.66 -0.29 0.00 0.00 0.00 0.00 61.98 63.35 3i3o s VAL 284 Cb 0.00 -4.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 3i3o s VAL 284 CO 0.00 -0.06 0.97 -0.63 0.00 0.00 0.00 175.10 175.38 3i3o s ILE 285 N 2.67 4.82 -0.16 2.22 -1.09 -1.26 -4.94 121.20 123.46 3i3o s ILE 285 Ca 0.54 1.97 0.15 0.00 -2.23 0.00 0.00 60.65 61.07 3i3o s ILE 285 Cb -0.22 -4.28 0.43 0.00 -1.58 0.00 0.00 42.46 36.80 3i3o s ILE 285 CO 0.18 0.04 1.20 1.33 -1.23 0.00 0.00 174.94 176.46 3i3o n VAL 286 N 4.46 1.60 -2.95 2.92 0.24 -1.26 -4.94 118.33 118.39 3i3o n VAL 286 Ca 0.07 -2.67 -0.19 0.00 -2.04 0.00 0.00 64.34 59.52 3i3o n VAL 286 Cb 0.49 0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.95 3i3o n VAL 286 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3i3o n ASN 287 N -0.64 -4.28 0.00 -1.34 5.15 -1.26 -5.03 115.26 107.85 3i3o n ASN 287 Ca 0.16 -0.15 0.14 0.00 -0.60 0.00 0.00 54.58 54.13 3i3o n ASN 287 Cb 0.83 -3.55 0.83 0.00 -0.53 0.00 0.00 39.78 37.36 3i3o n ASN 287 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27