#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i3o s PHE 7 N 0.00 -0.41 0.12 3.10 -0.12 -1.26 -5.13 117.98 114.28 3i3o s PHE 7 Ca 0.00 0.12 -0.31 0.00 -0.05 0.00 0.00 56.93 56.69 3i3o s PHE 7 Cb 0.00 0.61 -0.07 0.00 -0.63 0.00 0.00 43.02 42.93 3i3o s PHE 7 CO 0.00 -0.96 1.31 0.08 -0.05 0.00 0.00 175.22 175.60 3i3o s VAL 8 N -3.75 3.52 0.00 -2.49 1.01 -1.26 -4.28 120.40 113.14 3i3o s VAL 8 Ca 0.05 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.15 3i3o s VAL 8 Cb -0.03 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3i3o s VAL 8 CO -0.06 0.11 0.00 0.35 0.00 0.00 0.00 175.10 175.50 3i3o n THR 9 N 3.63 0.00 -4.09 3.92 -2.24 0.87 -4.96 114.28 111.42 3i3o n THR 9 Ca 0.09 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.78 3i3o n THR 9 Cb 0.44 -0.15 -0.09 0.00 -2.10 0.00 0.00 70.33 68.43 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 -1.86 0.96 0.35 -0.78 -1.94 -0.76 -5.02 119.30 110.26 3i3o s MET 10 Ca 0.00 -1.34 -0.27 0.00 -1.71 0.00 0.00 55.69 52.37 3i3o s MET 10 Cb 0.00 0.28 -0.09 0.00 2.01 0.00 0.00 34.83 37.03 3i3o s MET 10 CO 0.00 -0.29 1.14 -2.14 -0.01 0.00 0.00 175.02 173.72 3i3o s PRO 11 N -4.01 4.30 0.12 2.03 0.02 -1.26 -4.45 135.00 131.75 3i3o s PRO 11 Ca 0.21 1.81 -0.32 0.00 0.02 0.00 0.00 61.00 62.72 3i3o s PRO 11 Cb 0.06 -2.87 -0.11 0.00 0.02 0.00 0.00 34.50 31.60 3i3o s PRO 11 CO 0.00 -0.09 1.82 0.00 -0.33 0.00 0.00 177.00 178.40 3i3o n ALA 12 N 0.51 2.09 -3.49 -1.55 0.00 -1.26 -4.49 120.51 112.31 3i3o n ALA 12 Ca 0.02 0.32 -0.11 0.00 0.00 0.00 0.00 53.44 53.67 3i3o n ALA 12 Cb 0.46 -2.57 -0.03 0.00 0.00 0.00 0.00 19.45 17.31 3i3o n ALA 12 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3i3o s GLN 13 N 2.65 0.96 -0.06 0.00 -2.07 -1.26 -5.02 119.66 114.86 3i3o s GLN 13 Ca 0.82 -0.21 -0.19 0.00 -1.82 0.00 0.00 55.36 53.97 3i3o s GLN 13 Cb -0.51 0.45 0.04 0.00 -1.09 0.00 0.00 33.01 31.90 3i3o s GLN 13 CO 0.38 -0.39 0.43 -1.58 -1.32 0.00 0.00 175.29 172.81 3i3o s HIS 14 N -2.74 -0.37 -0.08 9.60 2.46 -1.26 -4.17 115.29 118.73 3i3o s HIS 14 Ca 0.00 0.70 0.04 0.00 0.47 0.00 0.00 55.06 56.27 3i3o s HIS 14 Cb -0.01 0.18 -0.01 0.00 -0.13 0.00 0.00 32.58 32.62 3i3o s HIS 14 CO -0.06 -0.40 -0.22 -0.65 -2.47 0.00 0.00 174.74 170.95 3i3o s GLN 15 N -0.90 2.82 0.00 2.88 -0.21 0.49 -4.95 119.66 119.78 3i3o s GLN 15 Ca -0.10 -0.84 0.13 0.00 0.02 0.00 0.00 55.36 54.58 3i3o s GLN 15 Cb -0.04 -2.30 0.58 0.00 1.00 0.00 0.00 33.01 32.25 3i3o s GLN 15 CO 0.05 0.33 1.40 0.27 -2.12 0.00 0.00 175.29 175.22 3i3o n ASN 16 N 3.13 0.87 -3.94 5.90 0.23 -1.26 -4.33 115.26 115.86 3i3o n ASN 16 Ca -0.18 -1.76 -0.14 0.00 -0.53 0.00 0.00 54.58 51.97 3i3o n ASN 16 Cb 0.52 -0.08 -0.14 0.00 -2.08 0.00 0.00 39.78 38.00 3i3o n ASN 16 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 3i3o s LYS 17 N -1.84 0.30 -0.02 -3.83 2.20 -1.26 -5.15 119.74 110.14 3i3o s LYS 17 Ca 0.22 -0.17 0.05 0.00 -0.36 0.00 0.00 55.97 55.71 3i3o s LYS 17 Cb 0.11 -0.27 -0.01 0.00 -1.51 0.00 0.00 37.83 36.15 3i3o s LYS 17 CO 0.17 0.07 -0.18 -1.14 -0.36 0.00 0.00 175.35 173.91 3i3o s GLN 18 N -0.19 1.56 0.41 4.03 0.74 -1.26 -3.96 119.66 120.99 3i3o s GLN 18 Ca 0.00 -0.64 -0.27 0.00 0.05 0.00 0.00 55.36 54.51 3i3o s GLN 18 Cb -0.02 -1.46 -0.10 0.00 1.10 0.00 0.00 33.01 32.53 3i3o s GLN 18 CO -0.00 0.35 1.46 -2.30 -0.55 0.00 0.00 175.29 174.24 3i3o n PRO 19 N 2.79 2.47 -1.90 1.67 -0.02 -1.26 -5.15 135.00 133.60 3i3o n PRO 19 Ca -0.16 0.87 -0.33 0.00 -2.02 0.00 0.00 63.50 61.87 3i3o n PRO 19 Cb 0.53 -2.64 0.03 0.00 -0.02 0.00 0.00 33.50 31.40 3i3o n PRO 19 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3i3o s GLY 20 N -0.29 2.07 -0.27 -1.23 0.00 -1.25 -5.03 107.32 101.32 3i3o s GLY 20 Ca 0.57 0.39 -0.09 0.00 0.00 0.00 0.00 44.72 45.59 3i3o s GLY 20 CO 0.61 0.72 0.14 -0.42 0.00 0.00 0.00 173.10 174.15 3i3o s ILE 21 N -2.50 4.90 0.22 0.90 -1.09 -1.26 -4.81 121.20 117.56 3i3o s ILE 21 Ca 0.64 0.03 -0.05 0.00 -2.23 0.00 0.00 60.65 59.04 3i3o s ILE 21 Cb -0.17 -3.32 0.07 0.00 -1.58 0.00 0.00 42.46 37.46 3i3o s ILE 21 CO 0.40 0.29 1.67 -0.08 -1.23 0.00 0.00 174.94 176.00 3i3o h GLU 22 N 8.27 0.85 -0.05 2.79 4.81 -1.96 -2.82 114.58 126.47 3i3o h GLU 22 Ca -0.36 -0.29 0.02 0.00 -0.13 0.00 0.00 59.36 58.59 3i3o h GLU 22 Cb 1.18 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 3i3o h GLU 22 CO 0.57 0.92 0.07 0.66 -0.73 0.00 0.00 179.01 180.49 3i3o h SER 23 N 0.77 0.00 0.28 1.04 4.64 -1.98 -0.76 113.55 117.53 3i3o h SER 23 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3i3o h SER 23 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3i3o h SER 23 CO 0.04 0.00 -0.03 0.18 -0.87 0.00 0.00 176.83 176.15 3i3o n LEU 24 N -3.73 0.22 -4.84 5.97 4.77 -1.06 -4.93 117.00 113.39 3i3o n LEU 24 Ca -0.02 0.06 -0.32 0.00 -0.03 0.00 0.00 56.01 55.70 3i3o n LEU 24 Cb 0.16 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.05 3i3o n LEU 24 CO 0.26 0.04 0.52 -0.04 -1.33 0.00 0.00 177.39 176.84 3i3o s MET 25 N -2.31 4.06 -0.16 3.23 -1.94 -0.29 -5.07 119.30 116.82 3i3o s MET 25 Ca 0.36 0.83 -0.05 0.00 -1.71 0.00 0.00 55.69 55.13 3i3o s MET 25 Cb 0.21 -2.32 0.06 0.00 2.01 0.00 0.00 34.83 34.79 3i3o s MET 25 CO 0.42 0.05 0.11 1.21 -0.01 0.00 0.00 175.02 176.80 3i3o s ASN 26 N -2.36 2.03 0.53 3.03 2.47 -1.26 -3.44 114.94 115.94 3i3o s ASN 26 Ca 0.57 -0.46 -0.18 0.00 0.42 0.00 0.00 52.86 53.21 3i3o s ASN 26 Cb -0.10 -0.12 -0.06 0.00 -1.45 0.00 0.00 41.25 39.52 3i3o s ASN 26 CO 0.18 -0.33 1.05 -2.16 -3.72 0.00 0.00 177.10 172.11 3i3o s PRO 27 N 2.18 3.60 0.29 0.43 0.04 -1.26 -4.33 135.00 135.95 3i3o s PRO 27 Ca 0.03 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.06 3i3o s PRO 27 Cb -0.15 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.20 3i3o s PRO 27 CO -0.09 -0.59 1.52 1.28 0.04 0.00 0.00 177.00 179.17 3i3o n LEU 28 N -1.43 4.05 -4.69 -3.56 4.77 -1.22 -4.91 117.00 110.01 3i3o n LEU 28 Ca 0.09 1.16 -0.38 0.00 -0.03 0.00 0.00 56.01 56.85 3i3o n LEU 28 Cb 0.53 -1.55 0.05 0.00 -2.33 0.00 0.00 43.42 40.12 3i3o n LEU 28 CO 0.43 -0.04 0.79 -2.65 -1.33 0.00 0.00 177.39 174.59 3i3o n PRO 29 N 1.86 1.21 -2.85 3.23 -0.02 -1.26 -4.92 135.00 132.24 3i3o n PRO 29 Ca 0.08 0.46 -0.43 0.00 -2.02 0.00 0.00 63.50 61.59 3i3o n PRO 29 Cb 0.36 -2.40 -0.04 0.00 -0.02 0.00 0.00 33.50 31.39 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 -2.98 3.35 0.00 -0.52 -0.21 -1.26 -4.85 119.66 113.18 3i3o s GLN 30 Ca 0.77 -0.24 0.23 0.00 0.02 0.00 0.00 55.36 56.14 3i3o s GLN 30 Cb -0.41 -4.04 0.01 0.00 1.00 0.00 0.00 33.01 29.57 3i3o s GLN 30 CO 0.45 -1.44 1.10 1.97 -2.12 0.00 0.00 175.29 175.26 3i3o n PHE 31 N 7.36 0.00 -3.94 0.91 1.16 -1.26 -1.78 117.46 119.91 3i3o n PHE 31 Ca 0.02 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.47 3i3o n PHE 31 Cb 0.48 -0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 38.20 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 -2.50 0.11 -0.32 3.97 2.12 -1.26 -4.27 118.70 116.55 3i3o s GLU 32 Ca 0.18 -0.07 -0.13 0.00 0.36 0.00 0.00 54.97 55.32 3i3o s GLU 32 Cb 0.18 -0.10 -0.03 0.00 0.26 0.00 0.00 34.13 34.45 3i3o s GLU 32 CO 0.58 0.03 0.25 0.34 -0.54 0.00 0.00 175.26 175.91 3i3o s ASP 33 N -0.08 6.07 0.41 -1.70 2.15 -1.26 -4.92 116.67 117.34 3i3o s ASP 33 Ca -0.00 -0.28 0.12 0.00 0.43 0.00 0.00 52.55 52.82 3i3o s ASP 33 Cb -0.01 -2.14 0.96 0.00 -0.30 0.00 0.00 42.92 41.43 3i3o s ASP 33 CO -0.00 -0.20 1.97 -0.65 -0.17 0.00 0.00 175.17 176.11 3i3o h PRO 34 N 8.45 0.48 0.00 4.34 0.11 -2.03 -1.25 132.00 142.09 3i3o h PRO 34 Ca -0.32 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3i3o h PRO 34 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3i3o h PRO 34 CO 0.62 0.32 0.00 0.09 -0.21 0.00 0.00 178.00 178.82 3i3o n ASN 35 N -4.48 0.00 -4.69 -2.05 3.02 -1.26 -4.86 115.26 100.94 3i3o n ASN 35 Ca 0.11 0.41 -0.42 0.00 -0.03 0.00 0.00 54.58 54.64 3i3o n ASN 35 Cb 0.36 -0.46 -0.03 0.00 -0.61 0.00 0.00 39.78 39.04 3i3o n ASN 35 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3i3o s TYR 36 N -2.93 2.67 -0.22 3.10 5.04 -0.48 -4.99 117.35 119.55 3i3o s TYR 36 Ca 0.13 0.54 -0.03 0.00 -2.44 0.00 0.00 57.07 55.27 3i3o s TYR 36 Cb 0.15 -3.85 -0.00 0.00 0.35 0.00 0.00 41.96 38.60 3i3o s TYR 36 CO 0.40 -3.30 -0.05 0.15 -1.34 0.00 0.00 175.55 171.40 3i3o s LYS 37 N 2.30 3.26 0.68 4.97 1.02 -1.26 -5.04 119.74 125.66 3i3o s LYS 37 Ca 0.70 -0.70 -0.12 0.00 0.02 0.00 0.00 55.97 55.87 3i3o s LYS 37 Cb -0.38 -2.99 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 3i3o s LYS 37 CO 0.30 -0.24 1.06 0.20 -0.92 0.00 0.00 175.35 175.76 3i3o s GLY 38 N 1.45 1.77 -0.12 -3.33 0.00 -1.26 -5.00 107.32 100.83 3i3o s GLY 38 Ca 0.05 0.17 0.16 0.00 0.00 0.00 0.00 44.72 45.10 3i3o s GLY 38 CO -0.04 0.48 1.18 -1.14 0.00 0.00 0.00 173.10 173.58 3i3o n SER 39 N -2.89 0.20 -2.21 1.64 3.41 -1.26 -5.01 113.62 107.50 3i3o n SER 39 Ca 0.08 -2.04 -0.21 0.00 -0.26 0.00 0.00 58.87 56.44 3i3o n SER 39 Cb 0.53 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.44 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 -0.25 -1.61 0.18 4.33 1.02 -1.26 -4.88 120.64 118.18 3i3o n GLU 40 Ca -0.07 1.04 0.06 0.00 -0.02 0.00 0.00 57.16 58.18 3i3o n GLU 40 Cb 0.91 -5.64 0.55 0.00 -0.02 0.00 0.00 31.44 27.24 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 0.00 0.15 -0.23 3.49 1.57 -1.91 -2.90 116.57 116.75 3i3o h LYS 41 Ca -0.48 -0.01 -0.18 0.00 -1.87 0.00 0.00 60.65 58.11 3i3o h LYS 41 Cb 1.36 -0.03 -0.17 0.00 0.08 0.00 0.00 32.23 33.47 3i3o h LYS 41 CO 0.59 0.13 -0.66 1.28 -0.57 0.00 0.00 179.45 180.22 3i3o n LEU 42 N -4.48 3.14 -4.67 2.94 4.77 -0.49 -4.60 117.00 113.60 3i3o n LEU 42 Ca -0.01 -3.94 -0.45 0.00 -0.03 0.00 0.00 56.01 51.58 3i3o n LEU 42 Cb 0.11 -0.39 -0.04 0.00 -2.33 0.00 0.00 43.42 40.77 3i3o n LEU 42 CO 0.35 1.51 1.53 1.17 -1.33 0.00 0.00 177.39 180.62 3i3o n LYS 43 N -0.84 2.58 -0.97 3.23 4.81 -0.86 -1.74 118.16 124.37 3i3o n LYS 43 Ca 0.24 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.63 3i3o n LYS 43 Cb 0.81 -2.85 0.00 0.00 0.02 0.00 0.00 35.03 33.02 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 4.42 0.92 3.78 3.14 0.00 -0.21 -4.92 105.19 112.31 3i3o n GLY 44 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.03 4.45 -0.26 1.61 -0.14 -0.71 -4.82 119.74 119.85 3i3o s LYS 45 Ca 0.00 1.38 -0.06 0.00 -1.36 0.00 0.00 55.97 55.93 3i3o s LYS 45 Cb 0.00 -2.70 -0.01 0.00 -1.68 0.00 0.00 37.83 33.44 3i3o s LYS 45 CO 0.00 0.14 0.05 -0.80 -0.76 0.00 0.00 175.35 173.98 3i3o s ASN 46 N -1.61 4.92 -0.02 2.83 0.01 -1.26 0.16 114.94 119.97 3i3o s ASN 46 Ca 0.53 -0.45 0.07 0.00 -0.71 0.00 0.00 52.86 52.29 3i3o s ASN 46 Cb -0.19 -1.86 -0.02 0.00 0.41 0.00 0.00 41.25 39.58 3i3o s ASN 46 CO 0.25 -0.09 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.83 3i3o s VAL 47 N 1.53 2.41 -0.17 1.60 1.01 -0.44 -0.38 120.40 125.96 3i3o s VAL 47 Ca 0.05 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.00 3i3o s VAL 47 Cb -0.16 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.34 3i3o s VAL 47 CO 0.01 0.55 -0.16 -0.22 0.00 0.00 0.00 175.10 175.28 3i3o s LEU 48 N -0.77 2.38 -0.14 3.92 2.96 -0.53 -0.37 118.68 126.14 3i3o s LEU 48 Ca 0.11 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.49 3i3o s LEU 48 Cb -0.10 -1.55 0.02 0.00 0.50 0.00 0.00 46.19 45.07 3i3o s LEU 48 CO 0.00 0.05 -0.12 -0.51 -1.32 0.00 0.00 176.35 174.45 3i3o s ILE 49 N 1.03 1.38 0.08 6.68 2.07 -0.12 -0.68 121.20 131.65 3i3o s ILE 49 Ca -0.01 -0.51 -0.27 0.00 -1.41 0.00 0.00 60.65 58.44 3i3o s ILE 49 Cb -0.15 -1.33 -0.06 0.00 0.13 0.00 0.00 42.46 41.06 3i3o s ILE 49 CO -0.04 0.43 0.85 0.42 -1.91 0.00 0.00 174.94 174.69 3i3o s THR 50 N 1.55 4.61 -1.08 4.00 -4.23 -0.30 -1.67 115.64 118.52 3i3o s THR 50 Ca 0.05 1.83 -0.03 0.00 -1.18 0.00 0.00 61.69 62.35 3i3o s THR 50 Cb -0.13 -4.21 0.00 0.00 1.34 0.00 0.00 72.50 69.51 3i3o s THR 50 CO -0.10 0.35 0.37 0.61 -0.54 0.00 0.00 174.62 175.32 3i3o n GLY 51 N 2.29 -0.15 0.38 3.99 0.00 0.21 -2.96 105.19 108.96 3i3o n GLY 51 Ca -0.01 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.25 -0.03 0.14 -0.02 0.00 -1.11 -3.98 105.19 98.94 3i3o n GLY 52 Ca -0.09 -0.22 0.10 0.00 0.00 0.00 0.00 46.02 45.81 3i3o n GLY 52 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3i3o h ASP 53 N 1.17 0.00 -5.25 1.61 2.03 -1.82 -3.01 116.42 111.15 3i3o h ASP 53 Ca 0.00 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.18 3i3o h ASP 53 Cb 0.28 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.73 3i3o h ASP 53 CO 0.00 0.10 0.01 -0.94 -1.03 0.00 0.00 179.24 177.38 3i3o s SER 54 N -5.65 0.33 0.80 4.15 1.04 -1.26 -4.10 113.70 109.01 3i3o s SER 54 Ca 0.01 -1.20 0.00 0.00 0.48 0.00 0.00 55.95 55.24 3i3o s SER 54 Cb 0.08 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.92 3i3o s SER 54 CO 0.77 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 174.19 3i3o n GLY 55 N -0.51 2.62 0.17 7.32 0.00 -1.26 -2.06 105.19 111.47 3i3o n GLY 55 Ca -0.03 -0.21 -0.07 0.00 0.00 0.00 0.00 46.02 45.70 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 1.05 -0.91 -0.61 2.04 -1.90 -2.47 117.51 114.72 3i3o h ILE 56 Ca 0.00 -0.17 0.07 0.00 1.00 0.00 0.00 64.86 65.77 3i3o h ILE 56 Cb 0.00 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 36.55 3i3o h ILE 56 CO 0.00 0.09 0.59 1.23 0.00 0.00 0.00 178.15 180.06 3i3o h GLY 57 N 0.48 1.33 0.94 5.37 0.00 -1.60 0.18 103.07 109.77 3i3o h GLY 57 Ca 0.15 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 3i3o h GLY 57 CO -0.06 0.27 0.02 -0.09 0.00 0.00 0.00 176.54 176.68 3i3o h ARG 58 N 1.00 0.05 -0.69 4.80 2.43 -1.12 0.70 114.38 121.54 3i3o h ARG 58 Ca 0.40 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.55 3i3o h ARG 58 Cb 0.26 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 3i3o h ARG 58 CO -0.16 0.09 0.35 0.00 -1.51 0.00 0.00 179.97 178.75 3i3o h ALA 59 N 0.95 1.32 -0.09 2.80 0.00 -0.78 -0.89 119.26 122.57 3i3o h ALA 59 Ca 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3i3o h ALA 59 Cb 0.06 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3i3o h ALA 59 CO -0.00 0.54 -0.02 0.28 0.00 0.00 0.00 179.25 180.05 3i3o h VAL 60 N 0.97 1.29 -0.65 0.00 2.07 -0.54 -1.11 116.25 118.28 3i3o h VAL 60 Ca 0.24 -0.93 0.09 0.00 0.82 0.00 0.00 66.70 66.92 3i3o h VAL 60 Cb 0.07 1.72 -0.07 0.00 -1.52 0.00 0.00 31.29 31.49 3i3o h VAL 60 CO -0.04 0.26 0.30 0.28 0.02 0.00 0.00 177.57 178.39 3i3o h SER 61 N -0.14 0.37 -0.17 0.57 0.02 -0.57 0.96 113.55 114.58 3i3o h SER 61 Ca 0.02 0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 3i3o h SER 61 Cb 0.42 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 3i3o h SER 61 CO 0.01 0.22 -0.09 0.40 -1.14 0.00 0.00 176.83 176.23 3i3o h ILE 62 N 0.52 1.31 -0.81 3.27 2.04 -1.06 -1.63 117.51 121.15 3i3o h ILE 62 Ca 0.32 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 3i3o h ILE 62 Cb 0.34 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 3i3o h ILE 62 CO -0.27 0.34 0.49 0.00 0.00 0.00 0.00 178.15 178.71 3i3o h ALA 63 N 0.68 1.03 -0.71 1.87 0.00 -0.91 -0.45 119.26 120.76 3i3o h ALA 63 Ca 0.04 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3i3o h ALA 63 Cb 0.57 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3i3o h ALA 63 CO 0.03 0.50 0.37 0.74 0.00 0.00 0.00 179.25 180.89 3i3o h PHE 64 N 1.11 1.00 -0.57 0.00 -1.00 -0.74 -1.59 116.94 115.14 3i3o h PHE 64 Ca 0.29 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 61.04 3i3o h PHE 64 Cb -0.04 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.18 3i3o h PHE 64 CO -0.00 0.72 0.37 0.00 -1.61 0.00 0.00 178.31 177.78 3i3o h ALA 65 N 1.18 0.73 0.00 2.45 0.00 -0.78 -0.07 119.26 122.77 3i3o h ALA 65 Ca 0.25 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3i3o h ALA 65 Cb 0.07 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3i3o h ALA 65 CO -0.04 0.18 -0.02 0.87 0.00 0.00 0.00 179.25 180.25 3i3o h LYS 66 N 0.78 0.00 -0.33 0.00 1.57 -0.64 -0.31 116.57 117.64 3i3o h LYS 66 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3i3o h LYS 66 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 3i3o h LYS 66 CO -0.04 0.02 0.00 0.39 -0.57 0.00 0.00 179.45 179.24 3i3o n GLU 67 N -3.80 2.02 -0.42 3.15 -0.58 -0.10 -4.35 120.64 116.55 3i3o n GLU 67 Ca -0.03 -1.56 0.00 0.00 -0.42 0.00 0.00 57.16 55.15 3i3o n GLU 67 Cb 0.10 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 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 1.25 0.78 3.86 0.62 0.00 -0.13 -1.40 105.19 110.17 3i3o n GLY 68 Ca 0.16 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.00 3.47 0.08 4.61 0.00 -0.80 -1.04 121.76 126.06 3i3o s ALA 69 Ca 0.00 -0.11 -0.21 0.00 0.00 0.00 0.00 51.96 51.64 3i3o s ALA 69 Cb 0.00 -2.59 -0.07 0.00 0.00 0.00 0.00 23.12 20.46 3i3o s ALA 69 CO 0.00 0.43 0.61 -0.80 0.00 0.00 0.00 175.76 175.99 3i3o s ASN 70 N -2.20 7.11 -0.13 0.00 0.01 0.12 -4.20 114.94 115.65 3i3o s ASN 70 Ca 0.48 1.31 0.02 0.00 -0.71 0.00 0.00 52.86 53.96 3i3o s ASN 70 Cb -0.12 -2.38 0.02 0.00 0.41 0.00 0.00 41.25 39.18 3i3o s ASN 70 CO 0.19 0.24 -0.17 -0.63 -1.51 0.00 0.00 177.10 175.22 3i3o s ILE 71 N -0.97 1.73 -0.29 0.60 -1.09 0.03 -1.32 121.20 119.90 3i3o s ILE 71 Ca 0.30 -0.77 -0.12 0.00 -2.23 0.00 0.00 60.65 57.84 3i3o s ILE 71 Cb -0.20 -1.57 -0.04 0.00 -1.58 0.00 0.00 42.46 39.07 3i3o s ILE 71 CO 0.20 0.49 0.23 0.00 -1.23 0.00 0.00 174.94 174.63 3i3o s ALA 72 N 1.09 3.53 -0.28 9.38 0.00 0.50 -0.83 121.76 135.16 3i3o s ALA 72 Ca -0.03 -1.09 -0.07 0.00 0.00 0.00 0.00 51.96 50.77 3i3o s ALA 72 Cb -0.14 -2.55 -0.01 0.00 0.00 0.00 0.00 23.12 20.42 3i3o s ALA 72 CO -0.05 -0.64 0.08 0.42 0.00 0.00 0.00 175.76 175.57 3i3o s ILE 73 N 1.81 4.13 -0.09 0.00 1.01 0.12 -0.94 121.20 127.24 3i3o s ILE 73 Ca 0.08 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.22 3i3o s ILE 73 Cb -0.16 -3.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.23 3i3o s ILE 73 CO 0.11 0.20 0.14 0.00 0.00 0.00 0.00 174.94 175.38 3i3o s ALA 74 N 1.56 3.85 0.21 9.38 0.00 -0.67 -0.70 121.76 135.38 3i3o s ALA 74 Ca 0.04 -0.69 -0.22 0.00 0.00 0.00 0.00 51.96 51.09 3i3o s ALA 74 Cb -0.16 -1.90 0.05 0.00 0.00 0.00 0.00 23.12 21.11 3i3o s ALA 74 CO 0.03 0.65 0.65 1.52 0.00 0.00 0.00 175.76 178.61 3i3o s TYR 75 N -1.10 -0.40 -0.00 0.00 -0.85 -1.06 0.64 117.35 114.58 3i3o s TYR 75 Ca 0.18 0.09 -0.01 0.00 -0.52 0.00 0.00 57.07 56.82 3i3o s TYR 75 Cb -0.12 0.62 -0.00 0.00 0.38 0.00 0.00 41.96 42.84 3i3o s TYR 75 CO 0.08 -1.00 0.28 1.25 -1.52 0.00 0.00 175.55 174.64 3i3o h LEU 76 N 2.00 -0.02 -0.36 -3.49 5.85 -1.89 -1.09 115.31 116.32 3i3o h LEU 76 Ca -0.28 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.44 3i3o h LEU 76 Cb 1.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.32 3i3o h LEU 76 CO 0.32 0.01 0.00 -0.90 -0.34 0.00 0.00 178.44 177.53 3i3o n ASP 77 N -2.15 0.00 -4.05 1.25 5.68 -1.26 -1.80 116.55 114.22 3i3o n ASP 77 Ca -0.00 -1.00 -0.43 0.00 -0.50 0.00 0.00 54.79 52.86 3i3o n ASP 77 Cb 0.01 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 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 3.16 -0.31 0.11 4.71 -1.26 -4.77 120.64 122.27 3i3o n GLU 78 Ca 0.00 -3.11 -0.04 0.00 -0.01 0.00 0.00 57.16 54.00 3i3o n GLU 78 Cb 0.48 -3.23 0.08 0.00 -1.01 0.00 0.00 31.44 27.75 3i3o n GLU 78 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 3i3o h GLU 79 N 6.46 1.18 0.02 3.49 4.39 -1.98 0.02 114.58 128.15 3i3o h GLU 79 Ca 0.47 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 60.04 3i3o h GLU 79 Cb 0.72 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 3i3o h GLU 79 CO 1.66 0.86 -0.05 0.78 -1.16 0.00 0.00 179.01 181.10 3i3o h GLY 80 N 1.18 -0.07 1.00 -3.84 0.00 -1.99 0.11 103.07 99.45 3i3o h GLY 80 Ca 0.30 0.06 -0.05 0.00 0.00 0.00 0.00 47.33 47.64 3i3o h GLY 80 CO -0.05 -0.05 0.17 -0.55 0.00 0.00 0.00 176.54 176.06 3i3o h ASP 81 N -0.10 0.84 -0.71 0.19 3.32 -1.79 -2.25 116.42 115.92 3i3o h ASP 81 Ca 0.01 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 56.79 3i3o h ASP 81 Cb 0.11 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 3i3o h ASP 81 CO -0.04 0.83 0.21 0.00 -1.72 0.00 0.00 179.24 178.53 3i3o h ALA 82 N 1.04 0.93 -0.38 3.45 0.00 -0.85 -1.59 119.26 121.86 3i3o h ALA 82 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3i3o h ALA 82 Cb 0.30 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3i3o h ALA 82 CO -0.00 0.62 0.25 -0.91 0.00 0.00 0.00 179.25 179.20 3i3o h ASN 83 N 1.05 0.44 -0.78 0.00 2.35 -0.58 -0.35 115.58 117.71 3i3o h ASN 83 Ca 0.23 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 3i3o h ASN 83 Cb 0.32 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.54 3i3o h ASN 83 CO -0.01 0.33 0.42 -0.08 -1.65 0.00 0.00 177.43 176.45 3i3o h GLU 84 N 0.51 1.09 -0.35 0.81 4.81 -1.27 -0.86 114.58 119.31 3i3o h GLU 84 Ca 0.14 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3i3o h GLU 84 Cb -0.04 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.11 3i3o h GLU 84 CO -0.03 0.81 0.21 1.15 -0.73 0.00 0.00 179.01 180.42 3i3o h THR 85 N 1.08 1.13 -0.60 0.32 2.02 -0.87 -2.51 112.91 113.49 3i3o h THR 85 Ca 0.27 -0.31 0.11 0.00 0.77 0.00 0.00 66.41 67.25 3i3o h THR 85 Cb 0.04 0.70 -0.08 0.00 -1.74 0.00 0.00 68.15 67.06 3i3o h THR 85 CO -0.04 0.13 0.14 0.50 0.37 0.00 0.00 175.52 176.61 3i3o h LYS 86 N 0.45 0.26 -0.46 6.66 3.64 -0.69 -0.04 116.57 126.40 3i3o h LYS 86 Ca 0.13 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 3i3o h LYS 86 Cb 0.03 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.74 3i3o h LYS 86 CO -0.02 0.17 0.19 1.96 -2.27 0.00 0.00 179.45 179.48 3i3o h GLN 87 N 0.27 0.37 -0.42 1.90 1.08 -0.75 0.85 115.11 118.40 3i3o h GLN 87 Ca 0.31 -0.02 -0.10 0.00 -1.45 0.00 0.00 58.65 57.39 3i3o h GLN 87 Cb 0.46 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 3i3o h GLN 87 CO -0.39 0.24 -0.15 1.88 -0.95 0.00 0.00 178.83 179.46 3i3o h TYR 88 N 0.38 0.87 -0.12 2.96 0.05 -1.02 -1.63 116.97 118.45 3i3o h TYR 88 Ca 0.21 -0.17 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 3i3o h TYR 88 Cb 0.18 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 3i3o h TYR 88 CO -0.14 0.88 0.03 0.28 -1.05 0.00 0.00 178.16 178.16 3i3o h VAL 89 N 0.70 1.20 0.00 -2.88 2.07 -0.41 -2.96 116.25 113.97 3i3o h VAL 89 Ca 0.11 -0.62 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 3i3o h VAL 89 Cb 0.65 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 3i3o h VAL 89 CO 0.05 0.18 -0.12 -0.33 0.02 0.00 0.00 177.57 177.37 3i3o h GLU 90 N -0.00 0.00 -0.17 1.57 5.08 -0.82 -1.43 114.58 118.80 3i3o h GLU 90 Ca 0.04 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.45 3i3o h GLU 90 Cb 0.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3i3o h GLU 90 CO 0.00 0.12 0.14 -0.22 -1.00 0.00 0.00 179.01 178.05 3i3o h LYS 91 N 0.00 0.00 -0.06 2.33 3.64 -1.11 -1.50 116.57 119.87 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 0.52 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 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 -4.20 1.29 -1.01 1.90 -0.58 -0.54 -4.91 120.64 112.59 3i3o n GLU 92 Ca 0.01 -0.43 -0.00 0.00 -0.42 0.00 0.00 57.16 56.32 3i3o n GLU 92 Cb 0.27 -1.35 -0.00 0.00 -0.57 0.00 0.00 31.44 29.78 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 0.94 0.47 3.94 0.62 0.00 -0.56 -4.94 105.19 105.66 3i3o n GLY 93 Ca 0.16 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.94 2.46 0.09 1.61 -7.23 -1.26 -5.08 120.40 109.05 3i3o s VAL 94 Ca 0.00 -1.22 -0.18 0.00 -1.81 0.00 0.00 61.98 58.77 3i3o s VAL 94 Cb 0.00 -2.69 -0.07 0.00 0.56 0.00 0.00 36.38 34.19 3i3o s VAL 94 CO 0.00 0.00 0.56 -0.75 -0.31 0.00 0.00 175.10 174.60 3i3o s LYS 95 N -4.31 4.12 -0.05 4.82 2.47 -1.26 -4.47 119.74 121.05 3i3o s LYS 95 Ca 0.50 0.65 0.02 0.00 -1.56 0.00 0.00 55.97 55.58 3i3o s LYS 95 Cb -0.05 -3.14 0.01 0.00 -1.46 0.00 0.00 37.83 33.19 3i3o s LYS 95 CO 0.30 0.59 -0.11 0.00 0.16 0.00 0.00 175.35 176.29 3i3o s VAL 97 N 0.58 1.83 -0.19 0.00 1.01 -0.01 -4.98 120.40 118.64 3i3o s VAL 97 Ca -0.12 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 60.87 3i3o s VAL 97 Cb -0.14 -1.60 -0.05 0.00 0.00 0.00 0.00 36.38 34.59 3i3o s VAL 97 CO 0.03 0.51 0.17 -0.76 0.00 0.00 0.00 175.10 175.05 3i3o s LEU 98 N 0.46 4.22 -0.56 3.92 1.43 -1.26 -0.71 118.68 126.19 3i3o s LEU 98 Ca -0.17 0.31 0.04 0.00 -1.03 0.00 0.00 54.13 53.28 3i3o s LEU 98 Cb -0.17 -2.16 0.16 0.00 0.03 0.00 0.00 46.19 44.04 3i3o s LEU 98 CO 0.07 0.16 0.38 -0.76 0.23 0.00 0.00 176.35 176.43 3i3o s LEU 99 N 0.37 3.40 0.67 1.79 1.43 0.12 -4.96 118.68 121.51 3i3o s LEU 99 Ca 0.10 -3.32 -0.12 0.00 -1.03 0.00 0.00 54.13 49.76 3i3o s LEU 99 Cb -0.12 -1.18 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 3i3o s LEU 99 CO -0.00 -0.16 1.06 -2.16 0.23 0.00 0.00 176.35 175.32 3i3o s PRO 100 N -0.57 3.02 0.00 1.29 0.04 -1.26 -2.57 135.00 134.95 3i3o s PRO 100 Ca 0.25 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.33 3i3o s PRO 100 Cb -0.08 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.46 3i3o s PRO 100 CO -0.13 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.29 3i3o n GLY 101 N -1.65 3.25 3.49 0.56 0.00 -0.41 -4.88 105.19 105.55 3i3o n GLY 101 Ca 0.08 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 44.06 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 6.29 0.00 1.61 -1.08 -1.26 -4.05 116.67 118.17 3i3o s ASP 102 Ca 0.00 -0.59 0.20 0.00 -0.52 0.00 0.00 52.55 51.64 3i3o s ASP 102 Cb 0.00 -2.36 1.20 0.00 -1.46 0.00 0.00 42.92 40.30 3i3o s ASP 102 CO 0.00 -1.05 1.60 0.18 0.52 0.00 0.00 175.17 176.42 3i3o n LEU 103 N 6.81 0.00 0.00 -1.34 4.77 -1.26 -2.05 117.00 123.92 3i3o n LEU 103 Ca -0.02 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.09 3i3o n LEU 103 Cb 0.47 0.00 0.65 0.00 -2.33 0.00 0.00 43.42 42.21 3i3o n LEU 103 CO 0.59 0.00 0.95 -1.54 -1.33 0.00 0.00 177.39 176.05 3i3o n SER 104 N -0.97 0.00 -4.53 -1.43 3.41 -1.26 -4.55 113.62 104.28 3i3o n SER 104 Ca 0.15 0.02 -0.39 0.00 -0.26 0.00 0.00 58.87 58.39 3i3o n SER 104 Cb 0.07 -0.33 -0.11 0.00 -0.26 0.00 0.00 64.21 63.58 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 -2.65 5.86 0.19 4.04 2.15 -0.87 -4.89 116.67 120.49 3i3o s ASP 105 Ca 0.23 -0.23 -0.13 0.00 0.43 0.00 0.00 52.55 52.85 3i3o s ASP 105 Cb 0.18 -2.08 0.20 0.00 -0.30 0.00 0.00 42.92 40.91 3i3o s ASP 105 CO 0.42 -0.12 1.68 -0.08 -0.17 0.00 0.00 175.17 176.90 3i3o h GLU 106 N 8.39 0.11 -0.98 4.34 4.81 -1.87 -1.78 114.58 127.59 3i3o h GLU 106 Ca -0.34 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.92 3i3o h GLU 106 Cb 1.17 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.47 3i3o h GLU 106 CO 0.59 0.08 0.65 0.37 -0.73 0.00 0.00 179.01 179.96 3i3o h GLN 107 N 0.12 1.22 -0.32 1.92 5.75 -1.95 -1.21 115.11 120.65 3i3o h GLN 107 Ca 0.26 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.62 3i3o h GLN 107 Cb 0.39 -0.28 -0.02 0.00 1.07 0.00 0.00 27.48 28.65 3i3o h GLN 107 CO -0.43 0.81 -0.06 1.25 -2.65 0.00 0.00 178.83 177.75 3i3o h HIS 108 N 1.26 0.55 -0.87 3.99 2.76 -1.63 0.57 115.15 121.77 3i3o h HIS 108 Ca 0.39 -0.07 -0.02 0.00 -2.20 0.00 0.00 60.37 58.47 3i3o h HIS 108 Cb -0.02 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 28.74 3i3o h HIS 108 CO -0.00 0.58 0.48 0.00 -1.30 0.00 0.00 177.93 177.69 3i3o h LYS 110 N 1.22 0.85 -0.60 0.00 1.57 -0.55 -3.24 116.57 115.81 3i3o h LYS 110 Ca 0.31 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3i3o h LYS 110 Cb 0.02 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 3i3o h LYS 110 CO -0.05 0.99 0.28 -0.44 -0.57 0.00 0.00 179.45 179.66 3i3o h ASP 111 N 0.67 0.76 0.33 0.86 3.32 -0.54 -2.28 116.42 119.54 3i3o h ASP 111 Ca 0.10 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 3i3o h ASP 111 Cb 0.71 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 3i3o h ASP 111 CO 0.05 0.65 -0.42 0.16 -1.72 0.00 0.00 179.24 177.96 3i3o h ILE 112 N 0.84 1.31 -0.00 0.35 3.07 -1.37 0.14 117.51 121.85 3i3o h ILE 112 Ca 0.21 -1.52 -0.00 0.00 1.55 0.00 0.00 64.86 65.10 3i3o h ILE 112 Cb 0.10 1.75 0.00 0.00 -0.27 0.00 0.00 36.82 38.39 3i3o h ILE 112 CO -0.03 0.44 -0.01 0.58 -1.05 0.00 0.00 178.15 178.09 3i3o h VAL 113 N 0.10 1.46 -0.36 0.16 2.07 -1.52 -0.78 116.25 117.38 3i3o h VAL 113 Ca 0.01 -1.36 0.07 0.00 0.82 0.00 0.00 66.70 66.24 3i3o h VAL 113 Cb 0.80 2.37 -0.07 0.00 -1.52 0.00 0.00 31.29 32.87 3i3o h VAL 113 CO 0.06 0.36 -0.09 -0.61 0.02 0.00 0.00 177.57 177.30 3i3o h GLN 114 N -0.56 -0.00 -0.64 1.57 4.15 -1.16 -1.76 115.11 116.71 3i3o h GLN 114 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 3i3o h GLN 114 Cb 0.59 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.25 3i3o h GLN 114 CO 0.00 -0.00 0.28 1.49 -1.93 0.00 0.00 178.83 178.67 3i3o h GLU 115 N -0.01 0.93 -0.50 1.69 4.57 -0.73 -0.98 114.58 119.56 3i3o h GLU 115 Ca 0.17 -0.15 0.06 0.00 -1.18 0.00 0.00 59.36 58.26 3i3o h GLU 115 Cb 0.27 -0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.64 3i3o h GLU 115 CO -0.37 0.77 0.21 1.15 -1.18 0.00 0.00 179.01 179.59 3i3o h THR 116 N 0.89 0.88 -0.55 0.32 2.02 -0.74 -0.51 112.91 115.22 3i3o h THR 116 Ca 0.22 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.15 3i3o h THR 116 Cb 0.16 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3i3o h THR 116 CO -0.02 0.08 -0.08 0.58 0.37 0.00 0.00 175.52 176.44 3i3o h VAL 117 N 0.42 1.27 0.00 3.16 2.07 -1.02 0.12 116.25 122.26 3i3o h VAL 117 Ca 0.23 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.53 3i3o h VAL 117 Cb 0.21 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3i3o h VAL 117 CO -0.21 0.44 -0.01 -0.09 0.02 0.00 0.00 177.57 177.72 3i3o h ARG 118 N 0.91 -0.02 0.06 1.57 2.43 -0.84 0.16 114.38 118.64 3i3o h ARG 118 Ca 0.15 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.10 3i3o h ARG 118 Cb 0.64 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.21 3i3o h ARG 118 CO 0.04 -0.01 -0.89 1.96 -1.51 0.00 0.00 179.97 179.56 3i3o h GLN 119 N -0.02 0.50 0.00 0.20 1.08 -0.98 -3.35 115.11 112.55 3i3o h GLN 119 Ca 0.00 -0.62 -0.04 0.00 -1.45 0.00 0.00 58.65 56.54 3i3o h GLN 119 Cb 0.02 0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 3i3o h GLN 119 CO -0.01 1.24 -0.95 -0.07 -0.95 0.00 0.00 178.83 178.09 3i3o h LEU 120 N 0.04 0.00 0.00 1.46 3.38 -0.85 -3.48 115.31 115.86 3i3o h LEU 120 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3i3o h LEU 120 Cb 1.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.35 3i3o h LEU 120 CO 0.17 0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.46 3i3o n GLY 121 N 1.22 2.94 3.84 0.83 0.00 0.55 -4.98 105.19 109.60 3i3o n GLY 121 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 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 0.43 -0.04 -0.06 1.61 1.04 -1.24 -4.87 113.70 110.57 3i3o s SER 122 Ca 0.00 -0.72 0.01 0.00 0.48 0.00 0.00 55.95 55.72 3i3o s SER 122 Cb 0.00 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.71 3i3o s SER 122 CO 0.00 -1.12 -0.05 -0.22 0.98 0.00 0.00 173.24 172.82 3i3o s LEU 123 N -3.24 1.23 -0.07 2.42 2.96 -1.26 -4.56 118.68 116.16 3i3o s LEU 123 Ca 0.19 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 3i3o s LEU 123 Cb -0.03 -0.57 -0.06 0.00 0.50 0.00 0.00 46.19 46.03 3i3o s LEU 123 CO 0.06 -0.07 -0.02 0.59 -1.32 0.00 0.00 176.35 175.59 3i3o n ASN 124 N 4.34 3.50 -3.78 3.68 4.13 0.48 -4.53 115.26 123.07 3i3o n ASN 124 Ca -0.19 -0.02 -0.20 0.00 1.68 0.00 0.00 54.58 55.85 3i3o n ASN 124 Cb 0.51 0.28 -0.17 0.00 -1.54 0.00 0.00 39.78 38.86 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 -2.14 0.24 -0.19 2.41 1.01 -0.84 -1.63 121.20 120.05 3i3o s ILE 125 Ca -0.06 0.14 -0.04 0.00 0.00 0.00 0.00 60.65 60.68 3i3o s ILE 125 Cb 0.02 -0.38 -0.02 0.00 0.01 0.00 0.00 42.46 42.09 3i3o s ILE 125 CO 0.21 0.20 -0.02 -0.22 0.00 0.00 0.00 174.94 175.11 3i3o s LEU 126 N 1.55 3.18 -0.32 2.97 2.96 -0.50 -1.46 118.68 127.05 3i3o s LEU 126 Ca -0.02 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.68 3i3o s LEU 126 Cb -0.13 -1.79 0.08 0.00 0.50 0.00 0.00 46.19 44.85 3i3o s LEU 126 CO -0.03 0.08 0.03 -0.69 -1.32 0.00 0.00 176.35 174.42 3i3o s VAL 127 N 0.91 2.63 -0.30 1.68 1.01 0.15 -0.59 120.40 125.90 3i3o s VAL 127 Ca 0.00 -1.88 -0.24 0.00 0.00 0.00 0.00 61.98 59.87 3i3o s VAL 127 Cb -0.14 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.53 3i3o s VAL 127 CO 0.02 -0.36 0.82 0.20 0.00 0.00 0.00 175.10 175.78 3i3o s ASN 128 N 1.22 6.71 0.00 3.32 0.01 -0.16 -1.15 114.94 124.89 3i3o s ASN 128 Ca 0.02 0.73 0.00 0.00 -0.71 0.00 0.00 52.86 52.90 3i3o s ASN 128 Cb -0.20 -2.42 0.00 0.00 0.41 0.00 0.00 41.25 39.03 3i3o s ASN 128 CO -0.05 -0.64 0.00 -3.20 -1.51 0.00 0.00 177.10 171.71 3i3o n ASN 129 N 6.26 0.00 -4.76 -1.22 2.85 -1.21 -0.72 115.26 116.46 3i3o n ASN 129 Ca 0.05 -0.30 -0.35 0.00 -0.11 0.00 0.00 54.58 53.87 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 0.68 -2.11 0.00 0.00 177.26 175.83 3i3o s VAL 130 N 0.00 2.80 -0.11 3.44 -7.23 -1.15 -4.78 120.40 113.36 3i3o s VAL 130 Ca 0.00 0.48 -0.30 0.00 -1.81 0.00 0.00 61.98 60.35 3i3o s VAL 130 Cb 0.00 -3.16 0.11 0.00 0.56 0.00 0.00 36.38 33.89 3i3o s VAL 130 CO 0.00 -0.12 0.93 0.00 -0.31 0.00 0.00 175.10 175.59 3i3o s ALA 131 N -1.72 -1.89 0.14 1.32 0.00 -1.26 -4.71 121.76 113.63 3i3o s ALA 131 Ca 0.75 1.44 0.05 0.00 0.00 0.00 0.00 51.96 54.21 3i3o s ALA 131 Cb -0.28 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.40 3i3o s ALA 131 CO 0.33 -0.38 -0.12 -0.65 0.00 0.00 0.00 175.76 174.93 3i3o s GLN 132 N -1.47 1.07 -0.10 0.00 -0.21 -1.26 -5.00 119.66 112.69 3i3o s GLN 132 Ca -0.02 -1.36 -0.08 0.00 0.02 0.00 0.00 55.36 53.92 3i3o s GLN 132 Cb -0.00 -0.81 0.03 0.00 1.00 0.00 0.00 33.01 33.23 3i3o s GLN 132 CO 0.01 0.13 0.25 1.14 -2.12 0.00 0.00 175.29 174.70 3i3o s GLN 133 N -3.21 0.27 -0.45 2.91 -2.07 -1.26 -4.93 119.66 110.92 3i3o s GLN 133 Ca 0.13 0.39 0.02 0.00 -1.82 0.00 0.00 55.36 54.09 3i3o s GLN 133 Cb -0.01 0.08 0.14 0.00 -1.09 0.00 0.00 33.01 32.12 3i3o s GLN 133 CO 0.02 -0.07 0.25 0.71 -1.32 0.00 0.00 175.29 174.89 3i3o s TYR 134 N 0.40 2.07 0.46 9.60 2.02 -1.26 -4.72 117.35 125.91 3i3o s TYR 134 Ca -0.02 -2.49 -0.25 0.00 -0.37 0.00 0.00 57.07 53.94 3i3o s TYR 134 Cb -0.04 -1.94 -0.08 0.00 -0.40 0.00 0.00 41.96 39.50 3i3o s TYR 134 CO -0.02 -0.78 1.39 -2.30 -1.57 0.00 0.00 175.55 172.28 3i3o n PRO 135 N 3.47 2.14 -3.90 -1.71 -0.02 -1.26 -4.91 135.00 128.80 3i3o n PRO 135 Ca 0.09 0.76 -0.10 0.00 -2.02 0.00 0.00 63.50 62.23 3i3o n PRO 135 Cb 0.35 -2.58 -0.10 0.00 -0.02 0.00 0.00 33.50 31.15 3i3o n PRO 135 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i3o s GLN 136 N -2.44 0.47 0.43 -0.52 -1.52 -0.19 -5.03 119.66 110.85 3i3o s GLN 136 Ca 0.62 -0.50 0.29 0.00 -1.95 0.00 0.00 55.36 53.82 3i3o s GLN 136 Cb -0.46 0.19 1.16 0.00 -0.22 0.00 0.00 33.01 33.68 3i3o s GLN 136 CO 0.57 -0.11 1.86 -0.56 -0.25 0.00 0.00 175.29 176.80 3i3o h GLN 137 N 4.23 0.00 -1.80 2.91 3.07 -1.90 -3.40 115.11 118.22 3i3o h GLN 137 Ca -0.31 0.00 0.27 0.00 0.09 0.00 0.00 58.65 58.69 3i3o h GLN 137 Cb 1.20 0.00 -0.11 0.00 0.08 0.00 0.00 27.48 28.65 3i3o h GLN 137 CO 0.42 0.00 0.69 0.20 0.09 0.00 0.00 178.83 180.23 3i3o s GLY 138 N -3.93 -0.34 0.39 0.06 0.00 -1.26 -4.89 107.32 97.35 3i3o s GLY 138 Ca 0.03 0.48 0.10 0.00 0.00 0.00 0.00 44.72 45.34 3i3o s GLY 138 CO 0.50 0.08 1.95 -2.00 0.00 0.00 0.00 173.10 173.62 3i3o h LEU 139 N 2.00 0.52 -2.07 0.66 5.85 -1.90 -1.83 115.31 118.54 3i3o h LEU 139 Ca -0.28 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.46 3i3o h LEU 139 Cb 1.21 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3i3o h LEU 139 CO 0.27 0.31 0.00 -0.33 -0.34 0.00 0.00 178.44 178.35 3i3o h GLU 140 N 0.58 0.00 -0.46 1.25 5.08 -2.00 -2.09 114.58 116.95 3i3o h GLU 140 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 3i3o h GLU 140 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 3i3o h GLU 140 CO -0.11 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.56 3i3o n TYR 141 N -2.81 0.60 -3.44 4.33 4.02 -0.69 -4.79 117.16 114.39 3i3o n TYR 141 Ca -0.01 -0.30 -0.43 0.00 -0.01 0.00 0.00 57.90 57.14 3i3o n TYR 141 Cb 0.13 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.36 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 -1.40 5.25 0.70 -0.72 1.01 -0.79 -4.96 121.20 120.29 3i3o s ILE 142 Ca 0.38 -0.78 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 3i3o s ILE 142 Cb 0.21 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.70 3i3o s ILE 142 CO 0.28 -0.39 1.06 0.42 0.00 0.00 0.00 174.94 176.32 3i3o s THR 143 N 1.67 3.95 0.26 2.92 -4.23 -1.26 -4.87 115.64 114.07 3i3o s THR 143 Ca 0.05 0.63 -0.04 0.00 -1.18 0.00 0.00 61.69 61.15 3i3o s THR 143 Cb -0.21 -3.47 0.26 0.00 1.34 0.00 0.00 72.50 70.43 3i3o s THR 143 CO 0.09 -0.83 1.90 0.00 -0.54 0.00 0.00 174.62 175.24 3i3o h ALA 144 N -0.68 1.33 -0.40 3.99 0.00 -1.98 -0.12 119.26 121.40 3i3o h ALA 144 Ca -0.45 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.45 3i3o h ALA 144 Cb 1.22 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 3i3o h ALA 144 CO 0.59 0.51 0.22 1.49 0.00 0.00 0.00 179.25 182.06 3i3o h GLU 145 N 1.23 0.44 -0.28 0.00 4.81 -1.99 0.14 114.58 118.92 3i3o h GLU 145 Ca 0.41 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.58 3i3o h GLU 145 Cb 0.05 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3i3o h GLU 145 CO -0.14 0.29 0.05 0.37 -0.73 0.00 0.00 179.01 178.85 3i3o h GLN 146 N 0.45 0.46 -0.20 1.92 4.15 -1.80 -1.31 115.11 118.78 3i3o h GLN 146 Ca 0.16 -0.12 0.05 0.00 0.77 0.00 0.00 58.65 59.51 3i3o h GLN 146 Cb 0.03 -0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.61 3i3o h GLN 146 CO -0.09 0.57 -0.14 1.25 -1.93 0.00 0.00 178.83 178.49 3i3o h LEU 147 N 0.28 -0.46 -0.53 -2.39 5.85 -0.77 0.11 115.31 117.41 3i3o h LEU 147 Ca 0.09 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 3i3o h LEU 147 Cb 0.33 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 3i3o h LEU 147 CO 0.00 -0.18 0.09 -0.33 -0.34 0.00 0.00 178.44 177.68 3i3o h GLU 148 N -0.14 0.87 -0.84 1.25 5.08 -0.91 -2.26 114.58 117.64 3i3o h GLU 148 Ca 0.12 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3i3o h GLU 148 Cb 0.32 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 3i3o h GLU 148 CO -0.29 0.85 0.54 -0.22 -1.00 0.00 0.00 179.01 178.90 3i3o h LYS 149 N 0.76 1.05 -0.23 2.33 3.64 -0.99 0.51 116.57 123.64 3i3o h LYS 149 Ca 0.16 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 3i3o h LYS 149 Cb 0.40 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 3i3o h LYS 149 CO 0.01 0.69 -0.02 1.15 -2.27 0.00 0.00 179.45 179.02 3i3o h THR 150 N 1.08 1.26 -0.57 1.00 2.02 -0.74 -2.81 112.91 114.16 3i3o h THR 150 Ca 0.32 -0.94 -0.09 0.00 0.77 0.00 0.00 66.41 66.47 3i3o h THR 150 Cb -0.05 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 3i3o h THR 150 CO -0.10 0.29 -0.02 -0.26 0.37 0.00 0.00 175.52 175.81 3i3o h PHE 151 N 0.17 1.09 -0.39 3.16 -1.00 -1.24 -1.04 116.94 117.70 3i3o h PHE 151 Ca 0.06 -0.19 -0.00 0.00 2.81 0.00 0.00 57.97 60.65 3i3o h PHE 151 Cb 0.44 -0.29 -0.02 0.00 3.61 0.00 0.00 35.95 39.69 3i3o h PHE 151 CO 0.04 0.98 0.23 -0.09 -1.61 0.00 0.00 178.31 177.86 3i3o h ARG 152 N 0.92 0.52 0.15 1.51 2.43 -0.77 -0.47 114.38 118.68 3i3o h ARG 152 Ca 0.16 -0.05 -0.29 0.00 -0.81 0.00 0.00 59.98 59.00 3i3o h ARG 152 Cb 0.56 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.01 3i3o h ARG 152 CO 0.03 0.39 -1.29 0.97 -1.51 0.00 0.00 179.97 178.56 3i3o h ILE 153 N 0.51 1.45 0.08 1.20 6.09 -1.52 -1.97 117.51 123.35 3i3o h ILE 153 Ca 0.14 -2.98 -0.26 0.00 -1.37 0.00 0.00 64.86 60.39 3i3o h ILE 153 Cb -0.00 2.96 -0.01 0.00 0.47 0.00 0.00 36.82 40.24 3i3o h ILE 153 CO -0.03 0.87 -1.25 0.78 -3.07 0.00 0.00 178.15 175.46 3i3o h ASN 154 N 0.09 0.25 0.00 2.19 4.21 -1.08 -3.37 115.58 117.87 3i3o h ASN 154 Ca -0.16 -0.29 0.00 0.00 1.21 0.00 0.00 56.30 57.06 3i3o h ASN 154 Cb 2.01 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 39.13 3i3o h ASN 154 CO 0.22 1.23 -0.60 0.00 -1.29 0.00 0.00 177.43 177.00 3i3o n ILE 155 N -3.42 0.00 0.01 2.81 0.13 -0.68 -4.65 119.36 113.56 3i3o n ILE 155 Ca -0.08 0.00 0.02 0.00 -1.10 0.00 0.00 62.75 61.59 3i3o n ILE 155 Cb 1.00 -0.36 0.35 0.00 -0.84 0.00 0.00 39.64 39.80 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 0.50 -0.31 9.51 0.04 -1.08 -1.62 116.94 123.98 3i3o h PHE 156 Ca 0.00 -0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.66 3i3o h PHE 156 Cb 0.60 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.57 3i3o h PHE 156 CO 0.00 0.44 -0.15 0.66 -0.60 0.00 0.00 178.31 178.66 3i3o h SER 157 N 0.50 0.54 -0.75 2.17 4.64 -1.52 0.32 113.55 119.45 3i3o h SER 157 Ca 0.12 -0.15 -0.05 0.00 -0.47 0.00 0.00 61.79 61.24 3i3o h SER 157 Cb 0.18 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 3i3o h SER 157 CO -0.00 0.72 0.28 1.88 -0.87 0.00 0.00 176.83 178.83 3i3o h TYR 158 N 0.50 1.16 0.22 4.77 -1.99 -1.57 0.66 116.97 120.71 3i3o h TYR 158 Ca 0.09 -0.10 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 3i3o h TYR 158 Cb 0.56 -0.34 0.00 0.00 2.00 0.00 0.00 36.73 38.95 3i3o h TYR 158 CO 0.02 0.89 -0.10 0.74 -0.00 0.00 0.00 178.16 179.71 3i3o h PHE 159 N 1.09 -0.27 -0.45 4.88 0.04 -0.75 -2.32 116.94 119.16 3i3o h PHE 159 Ca 0.25 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.96 3i3o h PHE 159 Cb 0.24 0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.46 3i3o h PHE 159 CO 0.02 -0.02 0.07 0.45 -0.60 0.00 0.00 178.31 178.23 3i3o h HIS 160 N -0.49 0.79 -0.33 -0.55 3.86 -0.72 -0.06 115.15 117.65 3i3o h HIS 160 Ca -0.03 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.04 3i3o h HIS 160 Cb 0.37 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 3i3o h HIS 160 CO -0.01 0.75 0.09 0.28 0.86 0.00 0.00 177.93 179.90 3i3o h VAL 161 N 0.60 1.22 -0.40 2.45 2.07 -0.96 -2.58 116.25 118.65 3i3o h VAL 161 Ca 0.13 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.89 3i3o h VAL 161 Cb 0.39 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3i3o h VAL 161 CO 0.01 0.24 0.09 0.74 0.02 0.00 0.00 177.57 178.67 3i3o h THR 162 N 0.37 1.23 -0.54 2.57 2.02 -1.34 -1.26 112.91 115.97 3i3o h THR 162 Ca 0.10 -0.81 0.10 0.00 0.77 0.00 0.00 66.41 66.58 3i3o h THR 162 Cb 0.28 1.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.61 3i3o h THR 162 CO -0.00 0.28 0.06 0.50 0.37 0.00 0.00 175.52 176.73 3i3o h LYS 163 N 0.50 0.18 -0.40 6.66 3.64 -0.99 -0.73 116.57 125.43 3i3o h LYS 163 Ca 0.12 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 3i3o h LYS 163 Cb 0.33 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 3i3o h LYS 163 CO 0.00 0.12 -0.08 0.00 -2.27 0.00 0.00 179.45 177.22 3i3o h ALA 164 N 1.45 1.12 0.00 5.00 0.00 -1.29 -2.82 119.26 122.72 3i3o h ALA 164 Ca 0.27 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3i3o h ALA 164 Cb 0.41 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3i3o h ALA 164 CO -0.40 0.55 -0.26 0.00 0.00 0.00 0.00 179.25 179.14 3i3o h ALA 165 N 1.29 1.27 -0.65 0.00 0.00 0.05 -3.30 119.26 117.91 3i3o h ALA 165 Ca 0.12 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.86 3i3o h ALA 165 Cb 0.51 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3i3o h ALA 165 CO 0.03 0.33 0.43 -0.07 0.00 0.00 0.00 179.25 179.97 3i3o h LEU 166 N 0.00 0.53 0.00 0.00 3.38 -1.00 0.67 115.31 118.90 3i3o h LEU 166 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3i3o h LEU 166 Cb 0.58 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3i3o h LEU 166 CO 0.03 0.34 0.00 -1.54 0.09 0.00 0.00 178.44 177.36 3i3o n SER 167 N -4.48 0.00 -0.00 -0.43 3.41 -1.24 -2.85 113.62 108.02 3i3o n SER 167 Ca 0.10 0.35 0.07 0.00 -0.26 0.00 0.00 58.87 59.13 3i3o n SER 167 Cb 0.27 -0.43 -0.10 0.00 -0.26 0.00 0.00 64.21 63.69 3i3o n SER 167 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3i3o n HIS 168 N -1.43 0.00 -3.44 7.33 8.25 0.20 -4.98 115.22 121.14 3i3o n HIS 168 Ca 0.06 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.16 3i3o n HIS 168 Cb 0.19 -0.17 -0.06 0.00 1.12 0.00 0.00 29.99 31.07 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 -3.37 4.40 0.34 2.41 1.43 -1.04 -4.58 118.68 118.27 3i3o s LEU 169 Ca 0.00 0.99 0.06 0.00 -1.03 0.00 0.00 54.13 54.15 3i3o s LEU 169 Cb 0.11 -2.98 -0.03 0.00 0.03 0.00 0.00 46.19 43.32 3i3o s LEU 169 CO 0.63 0.20 0.22 -0.54 0.23 0.00 0.00 176.35 177.08 3i3o s LYS 170 N -1.62 1.77 0.03 1.70 1.02 -1.26 -4.98 119.74 116.39 3i3o s LYS 170 Ca 0.32 -2.04 -0.38 0.00 0.02 0.00 0.00 55.97 53.89 3i3o s LYS 170 Cb -0.16 0.02 -0.18 0.00 -0.52 0.00 0.00 37.83 37.00 3i3o s LYS 170 CO 0.17 -0.57 1.29 0.94 -0.92 0.00 0.00 175.35 176.26 3i3o n GLN 171 N -0.69 0.79 -0.10 1.68 7.27 -1.20 -1.32 117.38 123.82 3i3o n GLN 171 Ca 0.03 0.29 0.00 0.00 0.07 0.00 0.00 57.00 57.38 3i3o n GLN 171 Cb 0.63 -1.89 0.00 0.00 2.41 0.00 0.00 30.24 31.40 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 2.33 0.96 3.91 1.69 0.00 0.36 -4.99 105.19 109.46 3i3o n GLY 172 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.79 4.79 -0.06 1.61 1.01 -0.43 -4.95 116.67 115.85 3i3o s ASP 173 Ca 0.00 0.64 -0.12 0.00 0.71 0.00 0.00 52.55 53.78 3i3o s ASP 173 Cb 0.00 -1.26 0.02 0.00 1.01 0.00 0.00 42.92 42.69 3i3o s ASP 173 CO 0.00 -1.66 0.28 -0.69 0.21 0.00 0.00 175.17 173.31 3i3o s VAL 174 N -3.36 0.03 -0.06 -1.27 1.01 -0.65 -2.34 120.40 113.77 3i3o s VAL 174 Ca 0.60 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 62.36 3i3o s VAL 174 Cb -0.11 -0.50 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 3i3o s VAL 174 CO 0.47 -0.15 -0.21 -0.63 0.00 0.00 0.00 175.10 174.57 3i3o s ILE 175 N -0.63 1.75 -0.06 2.22 1.01 -0.14 -1.42 121.20 123.95 3i3o s ILE 175 Ca -0.07 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.71 3i3o s ILE 175 Cb -0.04 -1.50 0.01 0.00 0.01 0.00 0.00 42.46 40.94 3i3o s ILE 175 CO 0.02 0.49 -0.12 -0.63 0.00 0.00 0.00 174.94 174.71 3i3o s ILE 176 N 0.00 1.06 -0.11 2.92 1.01 0.25 -1.93 121.20 124.40 3i3o s ILE 176 Ca -0.06 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.15 3i3o s ILE 176 Cb -0.13 -0.97 -0.02 0.00 0.01 0.00 0.00 42.46 41.35 3i3o s ILE 176 CO 0.04 0.33 -0.14 0.20 0.00 0.00 0.00 174.94 175.37 3i3o s ASN 177 N 0.58 4.00 -0.30 3.58 0.01 -0.37 -0.99 114.94 121.44 3i3o s ASN 177 Ca -0.12 -0.30 -0.22 0.00 -0.71 0.00 0.00 52.86 51.51 3i3o s ASN 177 Cb -0.14 -1.41 -0.00 0.00 0.41 0.00 0.00 41.25 40.10 3i3o s ASN 177 CO 0.03 0.21 0.72 -0.89 -1.51 0.00 0.00 177.10 175.66 3i3o s THR 178 N 0.07 4.86 0.00 1.60 2.01 0.11 -1.81 115.64 122.48 3i3o s THR 178 Ca -0.05 1.05 0.00 0.00 0.31 0.00 0.00 61.69 63.00 3i3o s THR 178 Cb -0.15 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.28 3i3o s THR 178 CO 0.04 -0.20 0.00 0.00 -0.69 0.00 0.00 174.62 173.78 3i3o n ALA 179 N 6.06 0.00 -3.62 7.40 0.00 0.33 -4.86 120.51 125.81 3i3o n ALA 179 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.42 3i3o n ALA 179 Cb 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.73 -0.10 0.51 0.00 0.15 -1.26 -4.48 113.70 107.79 3i3o s SER 180 Ca 0.00 0.07 0.19 0.00 0.70 0.00 0.00 55.95 56.91 3i3o s SER 180 Cb 0.00 0.09 1.28 0.00 -1.71 0.00 0.00 66.02 65.68 3i3o s SER 180 CO 0.00 -0.12 2.08 -0.29 1.20 0.00 0.00 173.24 176.12 3i3o h ILE 181 N 2.10 0.91 0.00 6.45 2.10 -1.52 -2.41 117.51 125.15 3i3o h ILE 181 Ca -0.09 -0.02 -0.01 0.00 1.08 0.00 0.00 64.86 65.83 3i3o h ILE 181 Cb 1.17 0.85 -0.00 0.00 -1.09 0.00 0.00 36.82 37.75 3i3o h ILE 181 CO 0.23 0.01 -0.04 -0.37 -1.08 0.00 0.00 178.15 176.90 3i3o h VAL 182 N 0.05 0.26 0.00 2.19 -1.51 -1.86 0.10 116.25 115.48 3i3o h VAL 182 Ca 0.11 -0.29 -0.06 0.00 -1.23 0.00 0.00 66.70 65.23 3i3o h VAL 182 Cb 0.37 1.22 -0.01 0.00 -2.13 0.00 0.00 31.29 30.75 3i3o h VAL 182 CO -0.01 0.04 -0.28 0.00 -1.23 0.00 0.00 177.57 176.09 3i3o h ALA 183 N 1.96 1.43 0.04 5.19 0.00 -1.66 0.19 119.26 126.40 3i3o h ALA 183 Ca -0.00 -0.25 -0.37 0.00 0.00 0.00 0.00 54.91 54.29 3i3o h ALA 183 Cb 0.22 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 3i3o h ALA 183 CO 0.01 0.35 -2.24 0.66 0.00 0.00 0.00 179.25 178.03 3i3o n TYR 184 N -4.05 0.48 -0.05 0.00 4.01 0.16 -4.61 117.16 113.09 3i3o n TYR 184 Ca -0.02 0.12 0.01 0.00 -0.16 0.00 0.00 57.90 57.85 3i3o n TYR 184 Cb 0.34 -1.07 -0.16 0.00 -0.31 0.00 0.00 39.34 38.14 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 -3.21 0.68 0.00 -0.72 1.02 -0.05 -5.06 120.64 113.30 3i3o n GLU 185 Ca -0.36 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 56.67 3i3o n GLU 185 Cb 1.04 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.95 3i3o n GLU 185 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i3o n GLY 186 N 1.50 -2.42 3.08 0.62 0.00 0.66 -5.02 105.19 103.61 3i3o n GLY 186 Ca -0.17 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.29 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 -4.12 0.01 0.52 1.61 3.84 -1.26 -4.77 114.94 110.77 3i3o s ASN 187 Ca 0.00 0.60 0.35 0.00 0.21 0.00 0.00 52.86 54.01 3i3o s ASN 187 Cb 0.00 1.20 1.69 0.00 -0.55 0.00 0.00 41.25 43.59 3i3o s ASN 187 CO 0.00 -0.26 2.04 1.05 -2.79 0.00 0.00 177.10 177.14 3i3o h GLU 188 N 8.18 0.00 -0.13 0.43 4.11 -1.97 -2.16 114.58 123.05 3i3o h GLU 188 Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.26 3i3o h GLU 188 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3i3o h GLU 188 CO 0.20 0.00 0.00 0.25 0.07 0.00 0.00 179.01 179.53 3i3o n THR 189 N -2.83 0.21 -2.88 -1.06 -2.24 -1.26 -4.56 114.28 99.66 3i3o n THR 189 Ca -0.01 -0.60 -0.16 0.00 -2.27 0.00 0.00 64.05 61.01 3i3o n THR 189 Cb 0.16 1.19 -0.00 0.00 -2.10 0.00 0.00 70.33 69.58 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 1.02 1.81 -0.05 3.22 4.77 -0.81 -1.02 117.00 125.93 3i3o n LEU 190 Ca 0.12 -4.55 -0.11 0.00 -0.03 0.00 0.00 56.01 51.43 3i3o n LEU 190 Cb 0.46 0.36 -0.05 0.00 -2.33 0.00 0.00 43.42 41.86 3i3o n LEU 190 CO 0.11 1.99 0.79 0.40 -1.33 0.00 0.00 177.39 179.35 3i3o h ILE 191 N 2.17 1.22 -0.16 -0.08 2.04 -1.80 0.16 117.51 121.06 3i3o h ILE 191 Ca 0.04 -0.72 -0.02 0.00 1.00 0.00 0.00 64.86 65.16 3i3o h ILE 191 Cb 1.01 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 3i3o h ILE 191 CO 0.56 0.22 0.00 -2.24 0.00 0.00 0.00 178.15 176.70 3i3o h ASP 192 N 0.08 0.27 -0.58 1.72 2.03 -1.93 -1.97 116.42 116.05 3i3o h ASP 192 Ca 0.05 -0.30 0.08 0.00 -0.73 0.00 0.00 57.03 56.13 3i3o h ASP 192 Cb 0.31 -0.07 -0.06 0.00 -0.83 0.00 0.00 39.33 38.67 3i3o h ASP 192 CO 0.00 0.51 0.24 0.22 -1.03 0.00 0.00 179.24 179.18 3i3o h TYR 193 N 0.03 0.43 -0.55 4.15 3.20 -1.90 -1.32 116.97 121.01 3i3o h TYR 193 Ca 0.05 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.86 3i3o h TYR 193 Cb 0.37 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 3i3o h TYR 193 CO 0.03 0.14 0.02 0.66 -1.64 0.00 0.00 178.16 177.37 3i3o h SER 194 N 0.44 0.89 -1.00 -2.11 4.64 -0.58 -1.52 113.55 114.33 3i3o h SER 194 Ca 0.28 -0.23 0.03 0.00 -0.47 0.00 0.00 61.79 61.41 3i3o h SER 194 Cb 0.30 -0.24 -0.06 0.00 -0.31 0.00 0.00 62.40 62.10 3i3o h SER 194 CO -0.26 0.95 0.66 0.00 -0.87 0.00 0.00 176.83 177.30 3i3o h ALA 195 N 1.15 1.31 -0.36 5.18 0.00 -0.85 0.86 119.26 126.55 3i3o h ALA 195 Ca 0.16 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3i3o h ALA 195 Cb 0.49 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3i3o h ALA 195 CO 0.02 0.57 -0.10 1.79 0.00 0.00 0.00 179.25 181.53 3i3o h THR 196 N 1.28 1.24 -0.20 0.00 1.35 -0.28 -1.33 112.91 114.97 3i3o h THR 196 Ca 0.39 -1.06 -0.16 0.00 -0.55 0.00 0.00 66.41 65.03 3i3o h THR 196 Cb -0.03 1.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.46 3i3o h THR 196 CO -0.12 0.36 -0.52 0.11 -0.25 0.00 0.00 175.52 175.10 3i3o h LYS 197 N 0.58 0.58 -0.85 4.72 1.79 -0.57 -1.67 116.57 121.15 3i3o h LYS 197 Ca 0.10 -0.35 -0.02 0.00 -2.18 0.00 0.00 60.65 58.21 3i3o h LYS 197 Cb 0.52 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.16 3i3o h LYS 197 CO 0.03 0.96 0.47 0.78 -1.08 0.00 0.00 179.45 180.61 3i3o h GLY 198 N 1.04 1.27 1.01 3.86 0.00 -0.63 -1.70 103.07 107.92 3i3o h GLY 198 Ca 0.01 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 46.77 3i3o h GLY 198 CO 0.10 0.55 0.51 0.00 0.00 0.00 0.00 176.54 177.70 3i3o h ALA 199 N 1.25 1.05 -0.69 3.60 0.00 -0.90 -1.94 119.26 121.61 3i3o h ALA 199 Ca 0.30 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 3i3o h ALA 199 Cb 0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3i3o h ALA 199 CO -0.05 0.49 0.33 0.82 0.00 0.00 0.00 179.25 180.84 3i3o h ILE 200 N 1.12 1.23 -0.04 0.00 2.04 -1.01 0.53 117.51 121.38 3i3o h ILE 200 Ca 0.30 -0.66 0.01 0.00 1.00 0.00 0.00 64.86 65.51 3i3o h ILE 200 Cb -0.07 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 3i3o h ILE 200 CO -0.06 0.27 -0.03 0.58 0.00 0.00 0.00 178.15 178.91 3i3o h VAL 201 N 0.97 0.90 -0.42 1.67 2.07 -0.97 0.64 116.25 121.12 3i3o h VAL 201 Ca 0.24 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.65 3i3o h VAL 201 Cb 0.13 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3i3o h VAL 201 CO -0.03 0.00 -0.19 0.00 0.02 0.00 0.00 177.57 177.37 3i3o h ALA 202 N 0.99 0.88 -0.60 1.67 0.00 -1.16 -2.12 119.26 118.92 3i3o h ALA 202 Ca 0.03 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.64 3i3o h ALA 202 Cb 0.08 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 3i3o h ALA 202 CO -0.06 0.63 0.31 0.35 0.00 0.00 0.00 179.25 180.47 3i3o h PHE 203 N 0.71 0.56 -0.16 0.00 3.57 -0.65 0.07 116.94 121.04 3i3o h PHE 203 Ca 0.10 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 3i3o h PHE 203 Cb 0.70 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 3i3o h PHE 203 CO 0.04 0.25 0.08 1.15 -2.23 0.00 0.00 178.31 177.60 3i3o h THR 204 N 0.57 1.12 0.00 4.41 2.02 -0.55 0.50 112.91 120.98 3i3o h THR 204 Ca 0.28 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 67.14 3i3o h THR 204 Cb 0.21 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 3i3o h THR 204 CO -0.20 0.11 -0.07 0.03 0.37 0.00 0.00 175.52 175.76 3i3o h ARG 205 N 0.14 -0.12 -0.30 6.66 3.08 -1.02 -1.61 114.38 121.20 3i3o h ARG 205 Ca 0.06 0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 3i3o h ARG 205 Cb 0.10 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3i3o h ARG 205 CO -0.01 -0.08 -0.06 0.77 -1.07 0.00 0.00 179.97 179.52 3i3o h SER 206 N -0.13 0.58 0.10 7.04 0.02 -0.86 -2.89 113.55 117.42 3i3o h SER 206 Ca 0.03 -0.36 -0.08 0.00 -0.84 0.00 0.00 61.79 60.54 3i3o h SER 206 Cb 0.16 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3i3o h SER 206 CO -0.07 0.81 -0.26 0.25 -1.14 0.00 0.00 176.83 176.41 3i3o h LEU 207 N 0.35 0.27 -0.88 5.07 5.85 -0.89 -1.89 115.31 123.20 3i3o h LEU 207 Ca 0.08 -0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.73 3i3o h LEU 207 Cb 0.55 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.45 3i3o h LEU 207 CO 0.03 0.54 0.58 0.77 -0.34 0.00 0.00 178.44 180.02 3i3o h SER 208 N 0.25 0.99 -0.30 1.25 4.64 -1.09 -1.01 113.55 118.28 3i3o h SER 208 Ca 0.04 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.20 3i3o h SER 208 Cb 0.60 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 3i3o h SER 208 CO 0.04 0.70 -0.33 1.56 -0.87 0.00 0.00 176.83 177.93 3i3o h GLN 209 N 1.16 0.82 -0.50 4.77 4.20 -1.32 -1.92 115.11 122.31 3i3o h GLN 209 Ca 0.34 -0.39 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 3i3o h GLN 209 Cb -0.08 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 3i3o h GLN 209 CO -0.09 1.03 0.01 1.03 -0.67 0.00 0.00 178.83 180.14 3i3o h SER 210 N 0.69 0.81 -0.02 1.46 0.87 -0.55 -3.27 113.55 113.55 3i3o h SER 210 Ca 0.07 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 3i3o h SER 210 Cb 0.88 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 3i3o h SER 210 CO 0.08 0.87 -0.30 0.18 -0.53 0.00 0.00 176.83 177.13 3i3o n LEU 211 N -4.21 2.24 -0.26 2.23 4.77 -0.46 -4.54 117.00 116.78 3i3o n LEU 211 Ca 0.03 -0.84 -0.02 0.00 -0.03 0.00 0.00 56.01 55.14 3i3o n LEU 211 Cb 0.30 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.55 3i3o n LEU 211 CO 0.42 0.40 1.16 1.62 -1.33 0.00 0.00 177.39 179.66 3i3o h VAL 212 N 2.98 1.23 0.00 4.08 3.04 -1.40 -0.61 116.25 125.58 3i3o h VAL 212 Ca 0.00 -0.58 0.00 0.00 -1.01 0.00 0.00 66.70 65.11 3i3o h VAL 212 Cb 0.78 0.16 0.00 0.00 -2.01 0.00 0.00 31.29 30.22 3i3o h VAL 212 CO 0.00 0.26 0.00 0.00 -1.01 0.00 0.00 177.57 176.82 3i3o n GLN 213 N -4.35 0.18 0.00 4.17 6.02 -1.26 -1.89 117.38 120.26 3i3o n GLN 213 Ca 0.08 0.26 0.14 0.00 -0.01 0.00 0.00 57.00 57.47 3i3o n GLN 213 Cb 0.10 -1.76 0.59 0.00 1.02 0.00 0.00 30.24 30.19 3i3o n GLN 213 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3i3o n LYS 214 N -2.09 1.51 -1.52 -1.09 5.02 -0.26 -4.94 118.16 114.79 3i3o n LYS 214 Ca 0.04 -0.78 -0.06 0.00 -2.02 0.00 0.00 58.31 55.50 3i3o n LYS 214 Cb 0.33 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 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 1.15 0.58 3.41 0.72 0.00 -0.79 -3.21 105.19 107.05 3i3o n GLY 215 Ca 0.20 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.25 3.91 0.19 -0.61 1.01 -1.10 -0.48 121.20 121.87 3i3o s ILE 216 Ca 0.00 -0.32 -0.13 0.00 0.00 0.00 0.00 60.65 60.20 3i3o s ILE 216 Cb 0.00 -2.79 -0.07 0.00 0.01 0.00 0.00 42.46 39.61 3i3o s ILE 216 CO 0.00 0.40 0.57 -0.13 0.00 0.00 0.00 174.94 175.78 3i3o s ARG 217 N 1.33 3.94 -0.13 2.79 0.52 -0.99 -4.09 118.95 122.32 3i3o s ARG 217 Ca 0.04 0.46 -0.02 0.00 -0.52 0.00 0.00 55.73 55.69 3i3o s ARG 217 Cb -0.15 -2.80 0.04 0.00 0.52 0.00 0.00 34.95 32.57 3i3o s ARG 217 CO 0.01 0.40 0.01 0.08 0.02 0.00 0.00 175.30 175.82 3i3o s VAL 218 N -1.62 0.49 0.22 3.52 1.01 -1.26 -0.97 120.40 121.79 3i3o s VAL 218 Ca 0.42 -0.21 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 3i3o s VAL 218 Cb -0.13 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 3i3o s VAL 218 CO 0.20 0.06 0.12 0.20 0.00 0.00 0.00 175.10 175.67 3i3o s ASN 219 N 1.90 0.47 0.23 3.32 0.01 -0.81 -0.17 114.94 119.89 3i3o s ASN 219 Ca 0.02 -1.39 0.02 0.00 -0.71 0.00 0.00 52.86 50.81 3i3o s ASN 219 Cb -0.14 0.31 -0.05 0.00 0.41 0.00 0.00 41.25 41.78 3i3o s ASN 219 CO -0.07 -0.80 0.05 -0.83 -1.51 0.00 0.00 177.10 173.94 3i3o s GLY 220 N -3.20 1.58 -0.07 0.66 0.00 0.56 -1.23 107.32 105.62 3i3o s GLY 220 Ca 0.38 -1.78 0.03 0.00 0.00 0.00 0.00 44.72 43.35 3i3o s GLY 220 CO 0.12 -1.60 -0.15 0.14 0.00 0.00 0.00 173.10 171.62 3i3o s VAL 221 N -3.66 1.33 -0.53 1.40 1.01 -0.75 -1.26 120.40 117.94 3i3o s VAL 221 Ca 0.33 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 3i3o s VAL 221 Cb 0.07 -1.18 0.14 0.00 0.00 0.00 0.00 36.38 35.41 3i3o s VAL 221 CO 0.10 0.40 0.33 0.00 0.00 0.00 0.00 175.10 175.93 3i3o s ALA 222 N 0.49 3.39 0.51 5.51 0.00 0.43 -0.51 121.76 131.57 3i3o s ALA 222 Ca -0.13 -2.97 -0.19 0.00 0.00 0.00 0.00 51.96 48.66 3i3o s ALA 222 Cb -0.15 -2.52 -0.07 0.00 0.00 0.00 0.00 23.12 20.37 3i3o s ALA 222 CO 0.04 -1.98 1.05 -2.14 0.00 0.00 0.00 175.76 172.74 3i3o s PRO 223 N 0.40 3.65 0.00 0.00 0.02 -1.26 -2.23 135.00 135.58 3i3o s PRO 223 Ca 0.13 1.36 0.00 0.00 0.02 0.00 0.00 61.00 62.51 3i3o s PRO 223 Cb -0.22 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.23 3i3o s PRO 223 CO -0.04 -0.55 0.00 0.41 -0.33 0.00 0.00 177.00 176.49 3i3o n GLY 224 N -0.35 1.53 3.62 0.52 0.00 -0.58 -1.66 105.19 108.28 3i3o n GLY 224 Ca 0.09 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 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 2.72 3.87 -0.07 1.61 0.04 -1.26 -4.92 135.00 136.99 3i3o s PRO 225 Ca 0.00 1.01 0.03 0.00 0.04 0.00 0.00 61.00 62.08 3i3o s PRO 225 Cb 0.00 -3.86 -0.02 0.00 0.04 0.00 0.00 34.50 30.66 3i3o s PRO 225 CO 0.00 -1.17 -0.17 0.42 0.04 0.00 0.00 177.00 176.11 3i3o s ILE 226 N 4.32 2.73 -0.62 0.56 -1.09 -1.26 -0.21 121.20 125.62 3i3o s ILE 226 Ca 0.52 -0.82 -0.27 0.00 -2.23 0.00 0.00 60.65 57.85 3i3o s ILE 226 Cb -0.13 -2.07 -0.01 0.00 -1.58 0.00 0.00 42.46 38.67 3i3o s ILE 226 CO 0.24 0.57 1.74 0.86 -1.23 0.00 0.00 174.94 177.12 3i3o s TRP 227 N -0.26 1.80 0.23 3.97 -0.00 -0.40 -4.85 118.94 119.43 3i3o s TRP 227 Ca 0.01 0.63 -0.03 0.00 -0.00 0.00 0.00 56.10 56.71 3i3o s TRP 227 Cb -0.13 -4.20 -0.03 0.00 -0.00 0.00 0.00 33.47 29.11 3i3o s TRP 227 CO 0.03 -2.27 0.24 0.95 -0.00 0.00 0.00 176.95 175.89 3i3o s THR 228 N 8.31 0.00 0.57 5.86 -4.23 -1.26 -4.39 115.64 120.50 3i3o s THR 228 Ca 0.61 -1.86 0.36 0.00 -1.18 0.00 0.00 61.69 59.63 3i3o s THR 228 Cb -0.12 -2.45 0.39 0.00 1.34 0.00 0.00 72.50 71.66 3i3o s THR 228 CO 0.20 0.00 2.27 -0.65 -0.54 0.00 0.00 174.62 175.90 3i3o h PRO 229 N 2.46 0.00 -0.04 3.99 0.11 -1.90 -2.23 132.00 134.38 3i3o h PRO 229 Ca -0.32 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.80 3i3o h PRO 229 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 3i3o h PRO 229 CO 0.47 0.02 0.04 1.25 -0.21 0.00 0.00 178.00 179.56 3i3o h LEU 230 N 0.00 0.00 0.13 2.35 5.85 -1.94 -2.82 115.31 118.88 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 0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 3i3o h LEU 230 CO 0.00 0.00 -0.06 0.40 -0.34 0.00 0.00 178.44 178.44 3i3o h ILE 231 N 0.00 0.00 0.00 4.05 1.08 -1.73 -2.45 117.51 118.47 3i3o h ILE 231 Ca 0.02 -0.85 -0.03 0.00 -0.39 0.00 0.00 64.86 63.60 3i3o h ILE 231 Cb 0.09 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 33.84 3i3o h ILE 231 CO -0.00 0.00 -0.15 1.55 -0.69 0.00 0.00 178.15 178.86 3i3o h PRO 232 N -1.03 0.00 0.00 2.37 0.13 -1.73 -0.28 132.00 131.47 3i3o h PRO 232 Ca -0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.11 3i3o h PRO 232 Cb 0.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.26 3i3o h PRO 232 CO 0.03 0.15 -0.02 0.66 -0.23 0.00 0.00 178.00 178.59 3i3o h SER 233 N 0.00 0.00 0.00 1.44 4.64 -1.60 0.14 113.55 118.17 3i3o h SER 233 Ca -0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.06 3i3o h SER 233 Cb 0.48 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.53 3i3o h SER 233 CO 0.02 0.02 -1.88 -1.54 -0.87 0.00 0.00 176.83 172.58 3i3o n SER 234 N -3.11 1.73 -4.89 4.97 3.41 -0.92 -4.52 113.62 110.29 3i3o n SER 234 Ca 0.03 0.10 -0.29 0.00 -0.26 0.00 0.00 58.87 58.45 3i3o n SER 234 Cb 0.49 -0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 64.02 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 -2.30 3.49 0.70 7.33 0.08 -0.14 -4.61 117.98 122.54 3i3o s PHE 235 Ca -0.22 0.84 -0.11 0.00 0.12 0.00 0.00 56.93 57.57 3i3o s PHE 235 Cb 0.07 -2.29 0.01 0.00 -0.57 0.00 0.00 43.02 40.24 3i3o s PHE 235 CO 0.30 -0.06 1.06 0.16 -0.10 0.00 0.00 175.22 176.59 3i3o s ASP 236 N -3.42 5.37 0.28 1.36 3.84 -1.26 -4.71 116.67 118.13 3i3o s ASP 236 Ca 0.48 1.58 0.03 0.00 -0.00 0.00 0.00 52.55 54.63 3i3o s ASP 236 Cb -0.10 -2.45 0.69 0.00 -1.38 0.00 0.00 42.92 39.67 3i3o s ASP 236 CO 0.34 -1.45 1.70 -0.33 -0.00 0.00 0.00 175.17 175.44 3i3o h GLU 237 N -0.72 0.40 0.07 2.11 5.08 -1.94 0.05 114.58 119.63 3i3o h GLU 237 Ca -0.44 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 57.89 3i3o h GLU 237 Cb 1.21 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.37 3i3o h GLU 237 CO 0.57 0.26 -0.04 0.87 -1.00 0.00 0.00 179.01 179.68 3i3o h LYS 238 N 0.41 -0.10 -0.59 2.33 6.56 -1.93 -1.51 116.57 121.75 3i3o h LYS 238 Ca 0.54 0.01 -0.04 0.00 -1.06 0.00 0.00 60.65 60.10 3i3o h LYS 238 Cb 0.99 0.02 -0.03 0.00 -0.57 0.00 0.00 32.23 32.65 3i3o h LYS 238 CO -0.51 0.31 0.22 -0.22 -2.06 0.00 0.00 179.45 177.19 3i3o h LYS 239 N -0.53 0.87 -0.53 3.15 1.63 -1.81 -2.39 116.57 116.96 3i3o h LYS 239 Ca -0.01 -0.15 0.02 0.00 -0.85 0.00 0.00 60.65 59.67 3i3o h LYS 239 Cb 0.45 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.90 3i3o h LYS 239 CO 0.02 0.73 0.32 0.28 -3.45 0.00 0.00 179.45 177.35 3i3o h VAL 240 N 0.86 1.06 -0.04 2.00 2.07 -0.90 -2.33 116.25 118.97 3i3o h VAL 240 Ca 0.20 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.51 3i3o h VAL 240 Cb 0.20 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3i3o h VAL 240 CO -0.02 0.12 0.04 0.77 0.02 0.00 0.00 177.57 178.50 3i3o h SER 241 N 0.64 0.00 -0.34 0.57 4.64 -0.74 -1.80 113.55 116.51 3i3o h SER 241 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3i3o h SER 241 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3i3o h SER 241 CO -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.87 3i3o n GLN 242 N -3.87 2.89 -1.67 4.77 6.02 -1.00 -0.09 117.38 124.42 3i3o n GLN 242 Ca -0.02 -2.14 -0.46 0.00 -0.01 0.00 0.00 57.00 54.37 3i3o n GLN 242 Cb 0.13 -1.33 -0.04 0.00 1.02 0.00 0.00 30.24 30.02 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 0.43 2.33 -0.77 1.08 7.35 -0.68 -1.79 117.46 125.41 3i3o n PHE 243 Ca 0.13 0.22 0.00 0.00 -0.76 0.00 0.00 57.45 57.04 3i3o n PHE 243 Cb 0.48 -2.57 0.00 0.00 0.35 0.00 0.00 39.48 37.74 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 3.53 0.89 0.26 7.13 0.00 -1.26 -4.16 105.19 111.59 3i3o n GLY 244 Ca 0.17 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.63 1.61 4.64 -1.63 -2.16 113.55 115.38 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 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3i3o h SER 245 CO 0.00 0.03 0.00 0.59 -0.87 0.00 0.00 176.83 176.58 3i3o n ASN 246 N -3.13 4.56 -4.95 4.97 4.13 -1.26 -4.64 115.26 114.95 3i3o n ASN 246 Ca 0.01 -2.41 -0.24 0.00 1.68 0.00 0.00 54.58 53.62 3i3o n ASN 246 Cb 0.35 -0.57 -0.03 0.00 -1.54 0.00 0.00 39.78 37.99 3i3o n ASN 246 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 3i3o s VAL 247 N -1.82 5.26 0.40 2.41 -7.23 -1.23 -5.00 120.40 113.19 3i3o s VAL 247 Ca 0.49 -0.84 0.11 0.00 -1.81 0.00 0.00 61.98 59.93 3i3o s VAL 247 Cb 0.31 -3.78 0.32 0.00 0.56 0.00 0.00 36.38 33.79 3i3o s VAL 247 CO 0.24 -0.20 1.95 -0.65 -0.31 0.00 0.00 175.10 176.13 3i3o h PRO 248 N 1.72 0.55 0.00 4.82 0.11 -1.83 0.32 132.00 137.69 3i3o h PRO 248 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3i3o h PRO 248 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3i3o h PRO 248 CO 0.65 0.37 0.00 -1.33 -0.21 0.00 0.00 178.00 177.48 3i3o n MET 249 N -4.49 0.02 -2.67 1.05 2.81 -0.40 -4.91 117.12 108.54 3i3o n MET 249 Ca 0.12 0.16 -0.17 0.00 -1.81 0.00 0.00 57.70 56.00 3i3o n MET 249 Cb 0.35 -1.53 0.02 0.00 -0.71 0.00 0.00 33.22 31.35 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 -1.56 -2.98 -3.50 0.03 6.02 0.11 -4.99 117.38 110.51 3i3o n GLN 250 Ca 0.05 0.73 -0.17 0.00 -0.01 0.00 0.00 57.00 57.60 3i3o n GLN 250 Cb 0.25 -5.15 -0.05 0.00 1.02 0.00 0.00 30.24 26.31 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 -5.23 1.09 0.72 -1.09 1.70 -0.81 -4.69 118.95 110.64 3i3o s ARG 251 Ca 0.16 0.13 -0.11 0.00 -0.47 0.00 0.00 55.73 55.44 3i3o s ARG 251 Cb -0.07 0.51 0.02 0.00 -0.57 0.00 0.00 34.95 34.84 3i3o s ARG 251 CO 0.20 -0.37 1.07 -1.25 -1.08 0.00 0.00 175.30 173.87 3i3o s PRO 252 N -1.64 2.70 0.55 3.89 0.04 -1.25 -4.77 135.00 134.53 3i3o s PRO 252 Ca -0.09 0.99 -0.12 0.00 0.04 0.00 0.00 61.00 61.83 3i3o s PRO 252 Cb -0.00 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 3i3o s PRO 252 CO 0.06 -1.28 0.96 0.20 0.04 0.00 0.00 177.00 176.98 3i3o s GLY 253 N -3.70 1.77 0.03 0.56 0.00 0.70 -4.87 107.32 101.82 3i3o s GLY 253 Ca 0.59 -0.08 -0.04 0.00 0.00 0.00 0.00 44.72 45.18 3i3o s GLY 253 CO 0.55 0.17 0.25 1.20 0.00 0.00 0.00 173.10 175.27 3i3o s GLN 254 N -4.70 3.53 0.44 2.90 -1.52 -1.26 -1.28 119.66 117.77 3i3o s GLN 254 Ca 0.55 -0.19 0.21 0.00 -1.95 0.00 0.00 55.36 53.98 3i3o s GLN 254 Cb -0.11 -3.05 1.18 0.00 -0.22 0.00 0.00 33.01 30.81 3i3o s GLN 254 CO 0.45 0.63 1.83 -1.35 -0.25 0.00 0.00 175.29 176.59 3i3o h PRO 255 N 3.66 0.31 0.00 2.91 0.11 -1.74 0.12 132.00 137.36 3i3o h PRO 255 Ca -0.48 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 3i3o h PRO 255 Cb 1.18 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3i3o h PRO 255 CO 0.69 0.21 -0.10 0.10 -0.21 0.00 0.00 178.00 178.68 3i3o h TYR 256 N 0.32 0.00 0.00 0.65 -0.00 -1.53 -1.39 116.97 115.02 3i3o h TYR 256 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.24 3i3o h TYR 256 Cb 1.42 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.15 3i3o h TYR 256 CO -0.00 0.10 0.00 0.93 -0.00 0.00 0.00 178.16 179.19 3i3o h GLU 257 N 0.00 0.00 0.00 0.10 5.08 -1.05 -3.01 114.58 115.70 3i3o h GLU 257 Ca -0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 3i3o h GLU 257 Cb 0.34 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 3i3o h GLU 257 CO 0.01 0.00 -1.41 -0.07 -1.00 0.00 0.00 179.01 176.54 3i3o h LEU 258 N 0.00 0.00 -0.96 1.33 4.07 -1.32 -3.41 115.31 115.02 3i3o h LEU 258 Ca 0.00 0.00 0.08 0.00 0.08 0.00 0.00 57.88 58.04 3i3o h LEU 258 Cb 0.43 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.10 3i3o h LEU 258 CO 0.00 0.71 0.61 0.00 -1.08 0.00 0.00 178.44 178.68 3i3o h ALA 259 N 1.29 1.37 0.00 1.53 0.00 -1.53 -2.40 119.26 119.52 3i3o h ALA 259 Ca -0.18 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3i3o h ALA 259 Cb 1.70 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 3i3o h ALA 259 CO 0.06 0.31 -0.16 -1.35 0.00 0.00 0.00 179.25 178.12 3i3o h PRO 260 N 1.05 0.00 -0.42 0.00 0.11 -1.79 -0.72 132.00 130.23 3i3o h PRO 260 Ca 0.44 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.50 3i3o h PRO 260 Cb 0.29 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 3i3o h PRO 260 CO -0.21 0.16 0.07 0.00 -0.21 0.00 0.00 178.00 177.81 3i3o h ALA 261 N 1.84 0.56 -0.57 -0.75 0.00 -1.72 0.18 119.26 118.80 3i3o h ALA 261 Ca -0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3i3o h ALA 261 Cb 0.31 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3i3o h ALA 261 CO 0.02 0.27 0.14 1.88 0.00 0.00 0.00 179.25 181.56 3i3o h TYR 262 N 0.55 0.96 -0.34 0.00 0.05 -1.40 -1.45 116.97 115.34 3i3o h TYR 262 Ca 0.13 -0.11 0.02 0.00 0.05 0.00 0.00 58.73 58.81 3i3o h TYR 262 Cb 0.37 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 37.81 3i3o h TYR 262 CO 0.03 0.82 0.19 0.28 -1.05 0.00 0.00 178.16 178.43 3i3o h VAL 263 N 0.82 1.02 -0.25 -2.88 2.07 -0.83 0.76 116.25 116.97 3i3o h VAL 263 Ca 0.18 -0.13 0.06 0.00 0.82 0.00 0.00 66.70 67.63 3i3o h VAL 263 Cb 0.34 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 30.65 3i3o h VAL 263 CO 0.00 0.07 -0.16 0.22 0.02 0.00 0.00 177.57 177.72 3i3o h TYR 264 N 0.38 -0.41 0.00 1.57 3.20 -0.79 -1.90 116.97 119.03 3i3o h TYR 264 Ca 0.13 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 3i3o h TYR 264 Cb 0.02 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 3i3o h TYR 264 CO -0.08 -0.24 -0.38 -0.07 -1.64 0.00 0.00 178.16 175.75 3i3o h LEU 265 N -0.15 0.00 0.00 2.82 3.38 -0.89 -3.18 115.31 117.29 3i3o h LEU 265 Ca 0.14 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 3i3o h LEU 265 Cb 0.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3i3o h LEU 265 CO -0.34 0.38 -0.83 0.00 0.09 0.00 0.00 178.44 177.74 3i3o h ALA 266 N 1.62 0.66 -1.45 1.53 0.00 -0.57 -3.46 119.26 117.60 3i3o h ALA 266 Ca -0.00 -0.57 -0.43 0.00 0.00 0.00 0.00 54.91 53.90 3i3o h ALA 266 Cb 0.70 0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.56 3i3o h ALA 266 CO 0.05 0.71 -0.19 -1.54 0.00 0.00 0.00 179.25 178.28 3i3o s SER 267 N -6.20 5.48 0.00 0.00 1.04 -0.74 -4.90 113.70 108.39 3i3o s SER 267 Ca 0.02 -0.38 0.09 0.00 0.48 0.00 0.00 55.95 56.16 3i3o s SER 267 Cb 0.08 -0.58 0.52 0.00 0.10 0.00 0.00 66.02 66.14 3i3o s SER 267 CO 0.77 -0.93 1.08 -1.54 0.98 0.00 0.00 173.24 173.59 3i3o n SER 268 N -2.02 0.00 0.28 7.02 3.41 -1.26 -2.17 113.62 118.87 3i3o n SER 268 Ca 0.09 -0.11 0.14 0.00 -0.26 0.00 0.00 58.87 58.73 3i3o n SER 268 Cb 0.59 -0.12 0.80 0.00 -0.26 0.00 0.00 64.21 65.22 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 -0.49 4.04 3.32 -1.91 -2.94 116.42 118.45 3i3o h ASP 269 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 3i3o h ASP 269 Cb 0.03 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 39.40 3i3o h ASP 269 CO 0.00 0.08 -0.16 -1.54 -1.72 0.00 0.00 179.24 175.90 3i3o n SER 270 N -3.61 3.46 0.10 6.45 3.41 -0.92 -4.81 113.62 117.70 3i3o n SER 270 Ca -0.02 -3.80 0.20 0.00 -0.26 0.00 0.00 58.87 54.99 3i3o n SER 270 Cb 0.20 -0.61 0.75 0.00 -0.26 0.00 0.00 64.21 64.30 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 1.35 0.00 -0.42 4.04 4.64 -1.70 0.08 113.55 121.53 3i3o h SER 271 Ca 0.28 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.58 3i3o h SER 271 Cb 1.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.60 3i3o h SER 271 CO 0.57 0.00 0.02 0.00 -0.87 0.00 0.00 176.83 176.55 3i3o n TYR 272 N -3.75 1.51 -4.08 4.77 9.36 -1.26 -4.92 117.16 118.80 3i3o n TYR 272 Ca 0.07 -0.87 -0.33 0.00 3.32 0.00 0.00 57.90 60.09 3i3o n TYR 272 Cb 0.58 -0.43 -0.15 0.00 -0.63 0.00 0.00 39.34 38.71 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 -2.84 2.24 -0.04 2.97 1.01 0.01 -5.10 120.40 118.66 3i3o s VAL 273 Ca 0.48 -1.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.15 3i3o s VAL 273 Cb 0.38 -2.08 0.03 0.00 0.00 0.00 0.00 36.38 34.71 3i3o s VAL 273 CO 0.12 0.33 0.38 0.28 0.00 0.00 0.00 175.10 176.21 3i3o s THR 274 N 1.25 0.04 -0.04 3.92 -1.32 -1.26 -4.71 115.64 113.52 3i3o s THR 274 Ca 0.00 -0.34 0.00 0.00 -1.21 0.00 0.00 61.69 60.15 3i3o s THR 274 Cb -0.16 -0.67 0.00 0.00 -1.51 0.00 0.00 72.50 70.16 3i3o s THR 274 CO -0.09 -0.19 0.00 0.61 -2.21 0.00 0.00 174.62 172.74 3i3o n GLY 275 N 1.40 0.47 3.93 6.08 0.00 0.76 -4.98 105.19 112.85 3i3o n GLY 275 Ca -0.20 -0.22 -0.19 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.58 2.67 -0.06 1.61 -1.52 -1.26 -4.64 119.66 115.87 3i3o s GLN 276 Ca 0.00 -1.40 0.02 0.00 -1.95 0.00 0.00 55.36 52.03 3i3o s GLN 276 Cb 0.00 -2.53 0.01 0.00 -0.22 0.00 0.00 33.01 30.27 3i3o s GLN 276 CO 0.00 -0.19 -0.11 1.41 -0.25 0.00 0.00 175.29 176.15 3i3o s MET 277 N -4.20 1.58 -0.29 2.91 1.75 -1.26 -0.32 119.30 119.46 3i3o s MET 277 Ca 0.50 -0.37 -0.10 0.00 -1.25 0.00 0.00 55.69 54.47 3i3o s MET 277 Cb -0.06 -1.33 -0.03 0.00 2.84 0.00 0.00 34.83 36.25 3i3o s MET 277 CO 0.30 0.00 0.16 0.42 -0.65 0.00 0.00 175.02 175.25 3i3o s ILE 278 N 0.72 4.86 -0.37 10.11 -1.09 -0.39 -4.95 121.20 130.09 3i3o s ILE 278 Ca -0.14 -0.13 -0.17 0.00 -2.23 0.00 0.00 60.65 57.99 3i3o s ILE 278 Cb -0.16 -3.37 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 3i3o s ILE 278 CO 0.03 0.19 0.43 -1.00 -1.23 0.00 0.00 174.94 173.36 3i3o s HIS 279 N 1.68 3.18 -0.58 3.97 3.76 -1.26 -0.43 115.29 125.62 3i3o s HIS 279 Ca 0.06 -0.08 0.04 0.00 -0.15 0.00 0.00 55.06 54.93 3i3o s HIS 279 Cb -0.16 -2.82 0.15 0.00 1.11 0.00 0.00 32.58 30.85 3i3o s HIS 279 CO 0.08 -0.56 0.35 0.08 -0.85 0.00 0.00 174.74 173.84 3i3o s VAL 280 N 2.17 2.50 0.00 -0.90 1.01 -0.95 -4.91 120.40 119.32 3i3o s VAL 280 Ca 0.14 -3.57 0.00 0.00 0.00 0.00 0.00 61.98 58.55 3i3o s VAL 280 Cb -0.16 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.52 3i3o s VAL 280 CO 0.13 -0.90 0.87 -0.46 0.00 0.00 0.00 175.10 174.74 3i3o n ASN 281 N 2.73 0.00 -0.16 3.32 0.23 -1.26 -1.52 115.26 118.59 3i3o n ASN 281 Ca 0.12 -1.74 -0.02 0.00 -0.53 0.00 0.00 54.58 52.40 3i3o n ASN 281 Cb 0.34 -0.15 -0.01 0.00 -2.08 0.00 0.00 39.78 37.88 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 0.56 0.00 4.83 0.00 -1.26 -3.93 105.19 105.39 3i3o n GLY 282 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.42 0.90 3.67 -0.02 0.00 -1.26 -1.27 105.19 104.78 3i3o n GLY 283 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 3.93 0.00 1.61 1.01 -1.25 -4.72 120.40 118.98 3i3o s VAL 284 Ca 0.00 1.16 -0.30 0.00 0.00 0.00 0.00 61.98 62.84 3i3o s VAL 284 Cb 0.00 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 3i3o s VAL 284 CO 0.00 -0.08 1.02 -0.63 0.00 0.00 0.00 175.10 175.40 3i3o s ILE 285 N 3.50 4.73 -0.12 2.22 -1.09 -1.26 -4.94 121.20 124.25 3i3o s ILE 285 Ca 0.63 1.96 0.17 0.00 -2.23 0.00 0.00 60.65 61.19 3i3o s ILE 285 Cb -0.28 -4.26 0.42 0.00 -1.58 0.00 0.00 42.46 36.77 3i3o s ILE 285 CO 0.22 0.14 1.20 1.33 -1.23 0.00 0.00 174.94 176.60 3i3o n VAL 286 N 3.94 1.26 -3.14 2.92 0.24 -1.26 -4.96 118.33 117.33 3i3o n VAL 286 Ca 0.07 -2.28 -0.21 0.00 -2.04 0.00 0.00 64.34 59.87 3i3o n VAL 286 Cb 0.50 0.29 0.01 0.00 -1.47 0.00 0.00 33.84 33.17 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 -0.42 -4.38 0.00 -1.34 5.15 -1.26 -5.04 115.26 107.97 3i3o n ASN 287 Ca 0.13 -0.28 0.16 0.00 -0.60 0.00 0.00 54.58 53.99 3i3o n ASN 287 Cb 0.89 -3.61 0.93 0.00 -0.53 0.00 0.00 39.78 37.46 3i3o n ASN 287 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27