#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4pbg s THR 2 N 0.00 2.25 0.66 1.12 -4.23 -1.26 -5.10 115.64 109.08 4pbg s THR 2 Ca 0.00 -0.75 -0.11 0.00 -1.18 0.00 0.00 61.69 59.65 4pbg s THR 2 Cb 0.00 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 4pbg s THR 2 CO 0.00 0.00 1.06 -0.54 -0.54 0.00 0.00 174.62 174.60 4pbg s LYS 3 N -4.91 3.22 0.06 3.99 3.01 -1.26 -4.92 119.74 118.92 4pbg s LYS 3 Ca 0.63 0.61 0.02 0.00 -1.01 0.00 0.00 55.97 56.22 4pbg s LYS 3 Cb -0.06 -2.05 -0.03 0.00 -1.01 0.00 0.00 37.83 34.68 4pbg s LYS 3 CO 0.41 -0.81 -0.07 0.95 0.51 0.00 0.00 175.35 176.34 4pbg s THR 4 N -3.27 0.51 0.03 2.17 -4.23 -1.26 -1.29 115.64 108.31 4pbg s THR 4 Ca 0.57 -1.37 0.05 0.00 -1.18 0.00 0.00 61.69 59.76 4pbg s THR 4 Cb -0.11 -0.96 -0.03 0.00 1.34 0.00 0.00 72.50 72.74 4pbg s THR 4 CO 0.53 -0.59 -0.10 -0.76 -0.54 0.00 0.00 174.62 173.16 4pbg s LEU 5 N -2.10 3.01 0.39 4.79 1.43 0.77 -4.87 118.68 122.09 4pbg s LEU 5 Ca -0.03 -0.26 -0.23 0.00 -1.03 0.00 0.00 54.13 52.58 4pbg s LEU 5 Cb -0.04 -1.76 -0.13 0.00 0.03 0.00 0.00 46.19 44.29 4pbg s LEU 5 CO -0.02 0.25 0.56 -0.81 0.23 0.00 0.00 176.35 176.56 4pbg n PRO 6 N 1.37 0.57 0.33 1.29 -0.04 -1.26 -4.81 135.00 132.45 4pbg n PRO 6 Ca -0.15 0.20 0.22 0.00 -0.04 0.00 0.00 63.50 63.74 4pbg n PRO 6 Cb 0.52 -1.47 1.17 0.00 -0.04 0.00 0.00 33.50 33.68 4pbg n PRO 6 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 4pbg h LYS 7 N 0.90 0.00 -0.57 0.54 3.64 -1.98 -2.63 116.57 116.47 4pbg h LYS 7 Ca -0.39 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 58.71 4pbg h LYS 7 Cb 1.40 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 33.05 4pbg h LYS 7 CO 0.53 0.00 0.17 -0.40 -2.27 0.00 0.00 179.45 177.48 4pbg n ASP 8 N -3.11 3.05 -4.79 4.20 5.68 -1.26 -5.01 116.55 115.31 4pbg n ASP 8 Ca -0.03 -3.67 -0.36 0.00 -0.50 0.00 0.00 54.79 50.24 4pbg n ASP 8 Cb 0.09 -0.70 -0.06 0.00 -1.14 0.00 0.00 41.12 39.31 4pbg n ASP 8 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 4pbg s PHE 9 N -3.24 3.61 -0.28 2.11 5.36 -0.99 -4.92 117.98 119.62 4pbg s PHE 9 Ca 0.49 1.68 -0.16 0.00 -0.96 0.00 0.00 56.93 57.98 4pbg s PHE 9 Cb 0.43 -2.86 -0.03 0.00 -0.34 0.00 0.00 43.02 40.22 4pbg s PHE 9 CO 0.04 0.17 0.41 0.42 -1.46 0.00 0.00 175.22 174.80 4pbg s ILE 10 N -1.72 5.14 -0.99 3.12 1.01 -1.00 -4.98 121.20 121.78 4pbg s ILE 10 Ca 0.51 0.56 -0.04 0.00 0.00 0.00 0.00 60.65 61.68 4pbg s ILE 10 Cb -0.16 -3.76 0.25 0.00 0.01 0.00 0.00 42.46 38.80 4pbg s ILE 10 CO 0.21 0.09 0.96 0.49 0.00 0.00 0.00 174.94 176.69 4pbg n PHE 11 N 5.41 4.47 -2.93 3.97 3.72 -1.26 0.15 117.46 130.99 4pbg n PHE 11 Ca -0.07 -3.94 0.00 0.00 -0.05 0.00 0.00 57.45 53.38 4pbg n PHE 11 Cb 0.50 -1.34 0.00 0.00 -0.94 0.00 0.00 39.48 37.70 4pbg n PHE 11 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 4pbg n GLY 12 N 2.32 1.86 3.24 1.37 0.00 -0.19 -2.67 105.19 111.12 4pbg n GLY 12 Ca 0.23 -2.12 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 4pbg n GLY 12 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4pbg s GLY 13 N -2.00 1.10 0.12 -0.02 0.00 -1.15 -2.41 107.32 102.96 4pbg s GLY 13 Ca 0.00 -1.52 0.06 0.00 0.00 0.00 0.00 44.72 43.26 4pbg s GLY 13 CO 0.00 -1.56 -0.15 0.00 0.00 0.00 0.00 173.10 171.39 4pbg s ALA 14 N -3.47 1.54 0.34 3.20 0.00 -0.66 -2.46 121.76 120.26 4pbg s ALA 14 Ca 0.19 -1.31 -0.02 0.00 0.00 0.00 0.00 51.96 50.82 4pbg s ALA 14 Cb 0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 23.12 23.07 4pbg s ALA 14 CO 0.01 0.12 0.46 0.95 0.00 0.00 0.00 175.76 177.30 4pbg s THR 15 N -2.10 0.00 -0.09 0.00 -4.23 -1.12 -1.66 115.64 106.44 4pbg s THR 15 Ca 0.09 -1.63 -0.08 0.00 -1.18 0.00 0.00 61.69 58.89 4pbg s THR 15 Cb -0.05 -2.63 0.02 0.00 1.34 0.00 0.00 72.50 71.18 4pbg s THR 15 CO 0.03 0.00 0.24 0.00 -0.54 0.00 0.00 174.62 174.35 4pbg s ALA 16 N -3.09 -0.59 0.00 3.99 0.00 -1.26 -4.55 121.76 116.26 4pbg s ALA 16 Ca 0.31 0.68 -0.01 0.00 0.00 0.00 0.00 51.96 52.95 4pbg s ALA 16 Cb -0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 4pbg s ALA 16 CO 0.21 -0.12 1.01 0.00 0.00 0.00 0.00 175.76 176.86 4pbg h ALA 17 N 5.80 -0.57 -0.55 0.00 0.00 -1.91 -0.92 119.26 121.10 4pbg h ALA 17 Ca -0.26 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.76 4pbg h ALA 17 Cb 1.19 0.44 -0.09 0.00 0.00 0.00 0.00 17.79 19.33 4pbg h ALA 17 CO 0.36 -0.58 -0.02 -0.92 0.00 0.00 0.00 179.25 178.09 4pbg h TYR 18 N -0.01 -0.08 -0.59 0.00 3.20 -1.94 0.22 116.97 117.77 4pbg h TYR 18 Ca -0.00 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.93 4pbg h TYR 18 Cb 0.01 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 4pbg h TYR 18 CO -0.28 -0.15 0.38 1.96 -1.64 0.00 0.00 178.16 178.43 4pbg h GLN 19 N 0.10 0.75 0.00 1.82 4.20 -1.88 -3.38 115.11 116.71 4pbg h GLN 19 Ca 0.28 -0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.81 4pbg h GLN 19 Cb 0.44 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 4pbg h GLN 19 CO -0.49 0.49 -0.93 0.00 -0.67 0.00 0.00 178.83 177.24 4pbg h ALA 20 N 1.23 0.16 -0.11 3.87 0.00 -0.62 -3.35 119.26 120.45 4pbg h ALA 20 Ca 0.22 -0.92 0.02 0.00 0.00 0.00 0.00 54.91 54.23 4pbg h ALA 20 Cb -0.05 0.61 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 4pbg h ALA 20 CO -0.07 0.59 -0.27 0.93 0.00 0.00 0.00 179.25 180.43 4pbg h GLU 21 N -1.00 -0.25 0.00 0.00 5.08 -0.74 -0.61 114.58 117.07 4pbg h GLU 21 Ca -0.21 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 4pbg h GLU 21 Cb 1.00 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.31 4pbg h GLU 21 CO -0.13 -0.17 0.00 0.41 -1.00 0.00 0.00 179.01 178.12 4pbg n GLY 22 N -1.20 -0.63 3.93 -3.84 0.00 -1.26 -2.17 105.19 100.01 4pbg n GLY 22 Ca -0.03 -1.42 -0.30 0.00 0.00 0.00 0.00 46.02 44.28 4pbg n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4pbg n ALA 23 N 2.72 -2.22 0.30 4.61 0.00 -1.26 -4.84 120.51 119.82 4pbg n ALA 23 Ca 0.00 -0.31 0.16 0.00 0.00 0.00 0.00 53.44 53.29 4pbg n ALA 23 Cb 0.00 -2.23 0.61 0.00 0.00 0.00 0.00 19.45 17.83 4pbg n ALA 23 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 4pbg h THR 24 N -1.94 0.00 -0.59 0.00 1.35 -1.92 -3.19 112.91 106.61 4pbg h THR 24 Ca -0.65 -0.50 -0.33 0.00 -0.55 0.00 0.00 66.41 64.37 4pbg h THR 24 Cb 1.38 1.46 -0.41 0.00 -1.73 0.00 0.00 68.15 68.85 4pbg h THR 24 CO 0.58 0.00 -1.05 1.41 -0.25 0.00 0.00 175.52 176.21 4pbg n HIS 25 N -2.94 1.64 -4.37 4.73 8.25 -1.26 -4.70 115.22 116.57 4pbg n HIS 25 Ca 0.01 -2.26 -0.21 0.00 -0.26 0.00 0.00 57.72 55.00 4pbg n HIS 25 Cb 0.31 -0.26 -0.13 0.00 1.12 0.00 0.00 29.99 31.03 4pbg n HIS 25 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 4pbg s THR 26 N -3.97 1.27 -1.09 1.59 2.01 -1.21 -4.80 115.64 109.44 4pbg s THR 26 Ca 0.33 -1.13 -0.15 0.00 0.31 0.00 0.00 61.69 61.06 4pbg s THR 26 Cb 0.36 -1.15 -0.03 0.00 0.01 0.00 0.00 72.50 71.69 4pbg s THR 26 CO -0.02 0.00 0.84 0.47 -0.69 0.00 0.00 174.62 175.23 4pbg n ASP 27 N 1.73 -5.92 -1.15 3.53 8.00 -1.26 -2.59 116.55 118.90 4pbg n ASP 27 Ca -0.18 -0.88 -0.13 0.00 0.71 0.00 0.00 54.79 54.31 4pbg n ASP 27 Cb 0.54 -4.13 -0.06 0.00 -0.02 0.00 0.00 41.12 37.45 4pbg n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 4pbg n GLY 28 N -1.50 1.24 3.72 0.44 0.00 -1.26 -4.47 105.19 103.35 4pbg n GLY 28 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 4pbg n GLY 28 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 4pbg s LYS 29 N -3.01 4.18 0.39 1.61 2.20 -1.07 -4.71 119.74 119.34 4pbg s LYS 29 Ca 0.00 2.45 -0.12 0.00 -0.36 0.00 0.00 55.97 57.93 4pbg s LYS 29 Cb 0.00 -3.12 -0.07 0.00 -1.51 0.00 0.00 37.83 33.12 4pbg s LYS 29 CO 0.00 -0.65 0.77 0.20 -0.36 0.00 0.00 175.35 175.31 4pbg s GLY 30 N 1.12 2.07 0.64 5.54 0.00 0.56 -4.72 107.32 112.53 4pbg s GLY 30 Ca 0.71 -0.11 -0.18 0.00 0.00 0.00 0.00 44.72 45.15 4pbg s GLY 30 CO 0.32 0.09 1.23 2.56 0.00 0.00 0.00 173.10 177.30 4pbg s PRO 31 N -3.60 2.65 0.22 2.90 0.04 -1.26 -4.83 135.00 131.12 4pbg s PRO 31 Ca 0.52 1.86 0.08 0.00 0.04 0.00 0.00 61.00 63.50 4pbg s PRO 31 Cb -0.10 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 4pbg s PRO 31 CO 0.27 -1.47 -0.14 0.54 0.04 0.00 0.00 177.00 176.25 4pbg s VAL 32 N -1.66 1.78 0.32 -0.36 0.11 -1.26 -0.43 120.40 118.90 4pbg s VAL 32 Ca 0.78 -2.22 0.08 0.00 -2.93 0.00 0.00 61.98 57.69 4pbg s VAL 32 Cb -0.32 -2.11 0.31 0.00 -1.53 0.00 0.00 36.38 32.73 4pbg s VAL 32 CO 0.38 -0.54 1.79 0.00 -3.33 0.00 0.00 175.10 173.39 4pbg h ALA 33 N 2.50 1.76 0.00 1.54 0.00 -1.89 -1.86 119.26 121.31 4pbg h ALA 33 Ca -0.38 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.60 4pbg h ALA 33 Cb 1.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 4pbg h ALA 33 CO 0.62 -0.12 0.00 -1.49 0.00 0.00 0.00 179.25 178.26 4pbg h TRP 34 N 0.71 0.00 0.21 0.00 4.06 -1.94 -2.59 115.95 116.40 4pbg h TRP 34 Ca 0.57 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.51 4pbg h TRP 34 Cb 0.95 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.11 4pbg h TRP 34 CO -0.00 0.00 -0.10 -0.44 -3.56 0.00 0.00 178.44 174.33 4pbg h ASP 35 N 0.00 -0.24 0.21 -3.49 3.32 -1.75 -2.37 116.42 112.11 4pbg h ASP 35 Ca 0.00 -0.06 -0.34 0.00 0.02 0.00 0.00 57.03 56.65 4pbg h ASP 35 Cb 0.11 0.06 0.02 0.00 0.22 0.00 0.00 39.33 39.75 4pbg h ASP 35 CO 0.00 -0.09 -1.59 0.50 -1.72 0.00 0.00 179.24 176.34 4pbg h LYS 36 N -0.37 0.45 0.45 3.56 1.63 -1.72 -3.36 116.57 117.21 4pbg h LYS 36 Ca -0.03 -0.77 -0.01 0.00 -0.85 0.00 0.00 60.65 58.99 4pbg h LYS 36 Cb 0.29 0.29 -0.02 0.00 -0.60 0.00 0.00 32.23 32.18 4pbg h LYS 36 CO 0.05 1.37 -0.40 -0.92 -3.45 0.00 0.00 179.45 176.10 4pbg h TYR 37 N 0.09 -1.08 -0.78 1.91 3.20 -1.51 -1.77 116.97 117.03 4pbg h TYR 37 Ca -0.30 0.00 0.13 0.00 3.14 0.00 0.00 58.73 61.70 4pbg h TYR 37 Cb 2.10 0.42 -0.05 0.00 1.54 0.00 0.00 36.73 40.73 4pbg h TYR 37 CO 0.12 -0.56 0.51 -0.07 -1.64 0.00 0.00 178.16 176.52 4pbg h LEU 38 N -0.85 0.53 -0.72 2.82 3.38 -1.63 0.22 115.31 119.06 4pbg h LEU 38 Ca -0.04 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 4pbg h LEU 38 Cb 0.74 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 4pbg h LEU 38 CO -0.04 0.29 0.09 -0.08 0.09 0.00 0.00 178.44 178.79 4pbg h GLU 39 N 0.57 1.07 0.00 1.13 4.81 -1.58 -0.21 114.58 120.37 4pbg h GLU 39 Ca 0.38 -0.29 -0.08 0.00 -0.13 0.00 0.00 59.36 59.24 4pbg h GLU 39 Cb 0.66 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 4pbg h GLU 39 CO -0.14 0.99 -1.30 -0.25 -0.73 0.00 0.00 179.01 177.58 4pbg n ASP 40 N -4.21 0.76 -0.00 1.04 8.00 -0.58 -4.56 116.55 117.00 4pbg n ASP 40 Ca 0.04 0.31 0.02 0.00 0.71 0.00 0.00 54.79 55.87 4pbg n ASP 40 Cb 0.30 0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 41.85 4pbg n ASP 40 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 4pbg n ASN 41 N -2.73 2.41 -4.15 -2.24 3.02 0.66 -5.07 115.26 107.16 4pbg n ASN 41 Ca -0.05 -0.25 -0.27 0.00 -0.03 0.00 0.00 54.58 53.97 4pbg n ASN 41 Cb 0.69 1.10 -0.06 0.00 -0.61 0.00 0.00 39.78 40.89 4pbg n ASN 41 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 4pbg n TYR 42 N -1.40 0.67 -1.09 3.10 4.02 -0.09 -5.03 117.16 117.34 4pbg n TYR 42 Ca -0.00 -2.39 0.02 0.00 -0.01 0.00 0.00 57.90 55.52 4pbg n TYR 42 Cb 0.08 -0.18 0.27 0.00 -0.02 0.00 0.00 39.34 39.50 4pbg n TYR 42 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 176.86 173.18 4pbg n TRP 43 N -1.04 1.45 -3.85 -0.72 2.14 -1.26 -4.64 117.44 109.52 4pbg n TRP 43 Ca -0.13 -1.09 -0.08 0.00 2.07 0.00 0.00 57.50 58.26 4pbg n TRP 43 Cb 0.59 -0.46 -0.03 0.00 -0.81 0.00 0.00 31.31 30.60 4pbg n TRP 43 CO 0.00 0.00 0.00 1.52 2.07 0.00 0.00 177.69 181.28 4pbg s TYR 44 N -2.95 -0.11 0.34 -2.67 1.13 -1.26 -5.07 117.35 106.75 4pbg s TYR 44 Ca 0.47 -0.31 0.03 0.00 -1.41 0.00 0.00 57.07 55.86 4pbg s TYR 44 Cb 0.39 0.59 -0.04 0.00 -1.10 0.00 0.00 41.96 41.79 4pbg s TYR 44 CO 0.09 -1.15 0.11 0.95 -2.51 0.00 0.00 175.55 173.03 4pbg s THR 45 N -3.92 0.74 -1.56 -3.49 -4.23 -1.26 -4.38 115.64 97.54 4pbg s THR 45 Ca 0.12 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 4pbg s THR 45 Cb -0.04 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.23 4pbg s THR 45 CO 0.05 0.00 0.77 0.00 -0.54 0.00 0.00 174.62 174.91 4pbg n ALA 46 N -0.72 2.49 -2.94 3.99 0.00 -1.26 -4.63 120.51 117.43 4pbg n ALA 46 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.09 4pbg n ALA 46 Cb 0.66 -1.00 -0.15 0.00 0.00 0.00 0.00 19.45 18.95 4pbg n ALA 46 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 4pbg s GLU 47 N -1.56 2.98 0.00 0.00 0.41 -1.26 -3.59 118.70 115.68 4pbg s GLU 47 Ca 0.00 -0.79 0.27 0.00 -0.41 0.00 0.00 54.97 54.04 4pbg s GLU 47 Cb 0.00 -2.40 0.91 0.00 -1.78 0.00 0.00 34.13 30.86 4pbg s GLU 47 CO 0.00 0.31 1.67 -0.35 -0.49 0.00 0.00 175.26 176.39 4pbg n PRO 48 N 3.21 0.59 0.00 0.39 -0.04 -1.26 -5.10 135.00 132.78 4pbg n PRO 48 Ca -0.18 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.00 4pbg n PRO 48 Cb 0.53 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 4pbg n PRO 48 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 4pbg n ALA 49 N -0.96 0.00 -0.57 0.55 0.00 -1.24 -2.27 120.51 116.03 4pbg n ALA 49 Ca 0.11 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.63 4pbg n ALA 49 Cb 0.32 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.12 4pbg n ALA 49 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 4pbg n SER 50 N -2.91 4.86 -4.38 0.00 7.64 -1.10 -4.95 113.62 112.78 4pbg n SER 50 Ca 0.00 -2.62 -0.39 0.00 1.01 0.00 0.00 58.87 56.87 4pbg n SER 50 Cb 0.00 -0.61 -0.06 0.00 -1.01 0.00 0.00 64.21 62.53 4pbg n SER 50 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 4pbg n ASP 51 N 0.81 -2.17 0.10 6.43 2.03 -0.91 -4.81 116.55 118.03 4pbg n ASP 51 Ca 0.25 -1.15 0.15 0.00 0.52 0.00 0.00 54.79 54.56 4pbg n ASP 51 Cb 0.97 -2.13 0.67 0.00 -0.72 0.00 0.00 41.12 39.91 4pbg n ASP 51 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 4pbg h PHE 52 N -1.23 0.00 -0.81 -0.67 3.57 -0.62 -0.88 116.94 116.30 4pbg h PHE 52 Ca -0.60 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.12 4pbg h PHE 52 Cb 1.39 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 40.09 4pbg h PHE 52 CO 0.66 0.00 0.58 -0.92 -2.23 0.00 0.00 178.31 176.40 4pbg h TYR 53 N 0.00 0.10 0.00 0.41 3.20 -1.75 -1.64 116.97 117.29 4pbg h TYR 53 Ca 0.15 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 4pbg h TYR 53 Cb 0.61 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.85 4pbg h TYR 53 CO -0.00 0.03 -1.10 0.72 -1.64 0.00 0.00 178.16 176.17 4pbg n HIS 54 N -4.34 0.00 0.10 -3.82 8.25 -0.76 -4.76 115.22 109.89 4pbg n HIS 54 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 4pbg n HIS 54 Cb 0.83 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.86 4pbg n HIS 54 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 4pbg h LYS 55 N 0.00 0.00 -1.07 -0.41 6.56 -0.83 -3.39 116.57 117.43 4pbg h LYS 55 Ca -0.01 0.00 0.36 0.00 -1.06 0.00 0.00 60.65 59.94 4pbg h LYS 55 Cb 0.34 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 31.91 4pbg h LYS 55 CO 0.00 0.52 0.70 2.48 -2.06 0.00 0.00 179.45 181.09 4pbg n TYR 56 N -3.15 0.45 -0.10 -1.35 4.11 -0.65 0.19 117.16 116.66 4pbg n TYR 56 Ca -0.02 0.46 -0.07 0.00 -0.00 0.00 0.00 57.90 58.26 4pbg n TYR 56 Cb 0.80 -0.85 0.09 0.00 -0.00 0.00 0.00 39.34 39.38 4pbg n TYR 56 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.86 175.86 4pbg h PRO 57 N 0.00 0.80 0.33 -3.48 0.13 -1.89 0.81 132.00 128.71 4pbg h PRO 57 Ca 0.65 -0.30 -0.02 0.00 -0.87 0.00 0.00 66.00 65.46 4pbg h PRO 57 Cb 2.17 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 33.26 4pbg h PRO 57 CO -0.30 0.92 -0.16 0.28 -0.23 0.00 0.00 178.00 178.51 4pbg h VAL 58 N 0.71 0.69 -0.34 1.56 2.07 -0.59 0.16 116.25 120.51 4pbg h VAL 58 Ca 0.11 -0.41 0.07 0.00 0.82 0.00 0.00 66.70 67.29 4pbg h VAL 58 Cb 0.69 0.90 -0.07 0.00 -1.52 0.00 0.00 31.29 31.29 4pbg h VAL 58 CO 0.05 0.08 -0.10 0.44 0.02 0.00 0.00 177.57 178.06 4pbg h ASP 59 N -0.67 -0.37 -0.50 0.57 3.32 -1.42 -0.81 116.42 116.54 4pbg h ASP 59 Ca -0.05 0.11 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 4pbg h ASP 59 Cb 0.47 0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 4pbg h ASP 59 CO 0.07 -0.13 0.09 -0.07 -1.72 0.00 0.00 179.24 177.48 4pbg h LEU 60 N -0.03 0.84 -0.37 1.55 3.38 -0.77 0.19 115.31 120.10 4pbg h LEU 60 Ca 0.17 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 4pbg h LEU 60 Cb 0.28 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 4pbg h LEU 60 CO -0.36 0.85 0.13 -0.08 0.09 0.00 0.00 178.44 179.07 4pbg h GLU 61 N 0.84 0.56 0.05 1.13 4.81 -0.36 -0.96 114.58 120.65 4pbg h GLU 61 Ca 0.17 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 4pbg h GLU 61 Cb 0.38 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.67 4pbg h GLU 61 CO 0.01 0.56 -0.02 -0.07 -0.73 0.00 0.00 179.01 178.76 4pbg h LEU 62 N 0.45 -0.06 -1.53 1.64 3.38 -0.95 0.24 115.31 118.48 4pbg h LEU 62 Ca 0.12 -0.23 0.25 0.00 0.09 0.00 0.00 57.88 58.11 4pbg h LEU 62 Cb 0.23 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 4pbg h LEU 62 CO -0.01 0.20 0.65 0.00 0.09 0.00 0.00 178.44 179.38 4pbg h ALA 63 N 0.62 2.34 0.11 1.53 0.00 -0.46 0.40 119.26 123.81 4pbg h ALA 63 Ca -0.01 0.03 -0.27 0.00 0.00 0.00 0.00 54.91 54.66 4pbg h ALA 63 Cb 0.28 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.09 4pbg h ALA 63 CO 0.01 -0.68 -1.18 1.49 0.00 0.00 0.00 179.25 178.89 4pbg h GLU 64 N 0.34 0.32 -0.13 0.00 4.81 -0.88 0.16 114.58 119.19 4pbg h GLU 64 Ca 0.53 -0.49 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 4pbg h GLU 64 Cb 1.44 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.98 4pbg h GLU 64 CO -0.20 1.21 -0.08 1.49 -0.73 0.00 0.00 179.01 180.69 4pbg h GLU 65 N 0.12 0.20 -1.10 1.92 4.81 0.19 -3.11 114.58 117.60 4pbg h GLU 65 Ca -0.13 -0.04 -0.65 0.00 -0.13 0.00 0.00 59.36 58.42 4pbg h GLU 65 Cb 1.89 -0.03 -0.34 0.00 0.63 0.00 0.00 28.75 30.90 4pbg h GLU 65 CO 0.20 0.30 0.30 0.66 -0.73 0.00 0.00 179.01 179.74 4pbg n TYR 66 N -4.33 3.08 -2.25 0.92 4.02 -0.18 -4.96 117.16 113.46 4pbg n TYR 66 Ca -0.01 -2.72 -0.11 0.00 -0.01 0.00 0.00 57.90 55.05 4pbg n TYR 66 Cb 0.22 -1.00 -0.01 0.00 -0.02 0.00 0.00 39.34 38.53 4pbg n TYR 66 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 4pbg n GLY 67 N -0.78 -0.22 3.59 2.72 0.00 -1.18 -4.19 105.19 105.13 4pbg n GLY 67 Ca 0.55 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.15 4pbg n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4pbg s VAL 68 N -2.44 4.78 -1.22 1.61 1.01 0.54 -4.80 120.40 119.89 4pbg s VAL 68 Ca 0.00 0.87 0.17 0.00 0.00 0.00 0.00 61.98 63.02 4pbg s VAL 68 Cb 0.00 -4.17 0.57 0.00 0.00 0.00 0.00 36.38 32.78 4pbg s VAL 68 CO 0.00 -0.37 1.49 -0.46 0.00 0.00 0.00 175.10 175.75 4pbg n ASN 69 N 6.30 3.97 -3.63 3.32 6.94 -1.09 -4.46 115.26 126.61 4pbg n ASN 69 Ca 0.02 -2.26 -0.10 0.00 -0.02 0.00 0.00 54.58 52.22 4pbg n ASN 69 Cb 0.48 -0.46 -0.04 0.00 -2.36 0.00 0.00 39.78 37.40 4pbg n ASN 69 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 4pbg s GLY 70 N -1.06 -0.27 -0.29 4.83 0.00 -1.26 -2.22 107.32 107.05 4pbg s GLY 70 Ca 0.42 -0.04 -0.13 0.00 0.00 0.00 0.00 44.72 44.97 4pbg s GLY 70 CO 0.23 -0.29 0.71 -1.50 0.00 0.00 0.00 173.10 172.25 4pbg s ILE 71 N -3.81 -0.49 0.09 0.90 2.07 -0.16 -2.94 121.20 116.86 4pbg s ILE 71 Ca 0.03 0.00 -0.22 0.00 -1.41 0.00 0.00 60.65 59.05 4pbg s ILE 71 Cb 0.02 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.54 4pbg s ILE 71 CO -0.11 0.00 0.66 -0.13 -1.91 0.00 0.00 174.94 173.45 4pbg s ARG 72 N 2.25 4.37 0.07 3.50 0.52 -1.03 -0.09 118.95 128.54 4pbg s ARG 72 Ca -0.08 0.91 -0.05 0.00 -0.52 0.00 0.00 55.73 56.00 4pbg s ARG 72 Cb -0.08 -3.27 -0.02 0.00 0.52 0.00 0.00 34.95 32.10 4pbg s ARG 72 CO -0.19 0.55 0.08 0.42 0.02 0.00 0.00 175.30 176.18 4pbg s ILE 73 N -0.90 0.18 0.09 1.52 1.01 -0.07 -2.79 121.20 120.24 4pbg s ILE 73 Ca 0.32 -1.48 0.06 0.00 0.00 0.00 0.00 60.65 59.56 4pbg s ILE 73 Cb -0.21 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.82 4pbg s ILE 73 CO 0.22 -0.82 -0.17 -0.94 0.00 0.00 0.00 174.94 173.23 4pbg s SER 74 N -2.87 2.04 -0.16 3.58 1.04 -1.26 -1.15 113.70 114.91 4pbg s SER 74 Ca 0.06 -0.65 -0.14 0.00 0.48 0.00 0.00 55.95 55.69 4pbg s SER 74 Cb 0.06 -0.09 -0.05 0.00 0.10 0.00 0.00 66.02 66.05 4pbg s SER 74 CO -0.10 -0.03 0.30 -0.63 0.98 0.00 0.00 173.24 173.76 4pbg s ILE 75 N -1.27 5.30 -0.99 -1.02 1.01 -0.14 -4.44 121.20 119.66 4pbg s ILE 75 Ca 0.02 0.56 -0.23 0.00 0.00 0.00 0.00 60.65 60.99 4pbg s ILE 75 Cb -0.10 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 38.76 4pbg s ILE 75 CO 0.03 0.38 1.59 0.00 0.00 0.00 0.00 174.94 176.94 4pbg s ALA 76 N 0.53 2.42 0.41 9.38 0.00 -1.26 -4.58 121.76 128.66 4pbg s ALA 76 Ca 0.17 -2.05 0.34 0.00 0.00 0.00 0.00 51.96 50.41 4pbg s ALA 76 Cb -0.13 -4.54 1.34 0.00 0.00 0.00 0.00 23.12 19.80 4pbg s ALA 76 CO 0.04 -3.95 1.32 1.87 0.00 0.00 0.00 175.76 175.03 4pbg n TRP 77 N 10.31 0.35 1.47 0.00 -0.00 -1.26 0.13 117.44 128.44 4pbg n TRP 77 Ca 0.35 0.36 0.05 0.00 -0.00 0.00 0.00 57.50 58.26 4pbg n TRP 77 Cb 0.50 -0.77 0.20 0.00 -0.00 0.00 0.00 31.31 31.23 4pbg n TRP 77 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 177.69 176.56 4pbg n SER 78 N -4.08 0.95 -0.02 5.87 3.41 -1.26 -1.71 113.62 116.79 4pbg n SER 78 Ca 0.36 -1.87 0.04 0.00 -0.26 0.00 0.00 58.87 57.14 4pbg n SER 78 Cb 1.48 -0.10 -0.10 0.00 -0.26 0.00 0.00 64.21 65.23 4pbg n SER 78 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 4pbg n ARG 79 N -0.03 0.69 -0.12 4.33 0.63 0.36 -0.32 116.66 122.19 4pbg n ARG 79 Ca 0.09 -0.10 -0.25 0.00 -0.92 0.00 0.00 57.85 56.67 4pbg n ARG 79 Cb 0.17 -1.31 -0.10 0.00 0.45 0.00 0.00 32.46 31.67 4pbg n ARG 79 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 4pbg n ILE 80 N -2.04 1.53 -3.92 5.15 2.08 -1.18 -4.02 119.36 116.95 4pbg n ILE 80 Ca -0.05 -0.18 -0.29 0.00 0.56 0.00 0.00 62.75 62.78 4pbg n ILE 80 Cb 0.44 -1.98 -0.13 0.00 -0.75 0.00 0.00 39.64 37.22 4pbg n ILE 80 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 4pbg s PHE 81 N -2.44 3.37 -1.15 1.39 0.08 -0.69 -0.37 117.98 118.17 4pbg s PHE 81 Ca -0.33 -3.25 0.00 0.00 0.12 0.00 0.00 56.93 53.47 4pbg s PHE 81 Cb 0.10 -2.78 0.00 0.00 -0.57 0.00 0.00 43.02 39.77 4pbg s PHE 81 CO 0.53 -0.65 0.30 -2.30 -0.10 0.00 0.00 175.22 173.00 4pbg n PRO 82 N 2.59 0.00 0.00 0.24 -0.02 -1.24 -0.00 135.00 136.56 4pbg n PRO 82 Ca 0.12 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 4pbg n PRO 82 Cb 0.33 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 4pbg n PRO 82 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 4pbg n THR 83 N -0.80 0.00 0.00 3.45 -2.24 -1.26 -4.39 114.28 109.04 4pbg n THR 83 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 4pbg n THR 83 Cb 0.00 1.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 4pbg n THR 83 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4pbg n GLY 84 N 0.00 2.99 3.71 3.38 0.00 1.00 -4.65 105.19 111.62 4pbg n GLY 84 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 4pbg n GLY 84 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 4pbg s TYR 85 N -2.35 -0.26 0.00 1.61 -0.85 -1.26 -4.84 117.35 109.40 4pbg s TYR 85 Ca 0.00 -0.08 0.00 0.00 -0.52 0.00 0.00 57.07 56.47 4pbg s TYR 85 Cb 0.00 0.64 0.00 0.00 0.38 0.00 0.00 41.96 42.98 4pbg s TYR 85 CO 0.00 -0.98 0.00 0.41 -1.52 0.00 0.00 175.55 173.46 4pbg n GLY 86 N -0.43 1.08 3.75 5.49 0.00 -1.26 -4.90 105.19 108.92 4pbg n GLY 86 Ca -0.08 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 4pbg n GLY 86 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4pbg n GLU 87 N 5.06 2.45 -3.97 1.61 -0.58 -1.26 -5.00 120.64 118.95 4pbg n GLU 87 Ca 0.00 0.86 -0.33 0.00 -0.42 0.00 0.00 57.16 57.27 4pbg n GLU 87 Cb 0.00 -2.54 -0.05 0.00 -0.57 0.00 0.00 31.44 28.27 4pbg n GLU 87 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 4pbg s VAL 88 N -1.12 5.18 -0.50 2.62 1.01 -1.26 -4.44 120.40 121.90 4pbg s VAL 88 Ca 0.55 -0.28 -0.16 0.00 0.00 0.00 0.00 61.98 62.08 4pbg s VAL 88 Cb -0.51 -3.42 0.09 0.00 0.00 0.00 0.00 36.38 32.54 4pbg s VAL 88 CO 0.63 0.31 0.46 0.21 0.00 0.00 0.00 175.10 176.70 4pbg s ASN 89 N -1.95 6.17 0.11 3.32 2.47 0.50 -4.97 114.94 120.58 4pbg s ASN 89 Ca 0.27 -1.44 -0.29 0.00 0.42 0.00 0.00 52.86 51.82 4pbg s ASN 89 Cb -0.12 -2.20 -0.11 0.00 -1.45 0.00 0.00 41.25 37.36 4pbg s ASN 89 CO 0.18 -0.75 1.48 -0.33 -3.72 0.00 0.00 177.10 173.97 4pbg h GLU 90 N 8.83 -0.44 -0.93 0.43 3.07 -1.88 -1.77 114.58 121.88 4pbg h GLU 90 Ca -0.29 0.03 0.26 0.00 -0.50 0.00 0.00 59.36 58.86 4pbg h GLU 90 Cb 1.11 0.10 -0.05 0.00 -0.84 0.00 0.00 28.75 29.07 4pbg h GLU 90 CO 0.94 -0.29 0.65 0.87 -1.40 0.00 0.00 179.01 179.78 4pbg h LYS 91 N -0.45 0.09 0.19 2.33 1.57 -1.91 0.87 116.57 119.25 4pbg h LYS 91 Ca 0.04 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 4pbg h LYS 91 Cb 0.57 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.86 4pbg h LYS 91 CO -0.43 0.06 -0.09 0.78 -0.57 0.00 0.00 179.45 179.20 4pbg h GLY 92 N 0.10 -0.26 0.88 3.86 0.00 -1.47 -1.74 103.07 104.43 4pbg h GLY 92 Ca 0.46 0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.92 4pbg h GLY 92 CO -0.06 -0.10 0.61 -2.08 0.00 0.00 0.00 176.54 174.92 4pbg h VAL 93 N -0.58 1.16 -0.75 4.60 2.07 -0.62 -1.73 116.25 120.40 4pbg h VAL 93 Ca -0.03 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.14 4pbg h VAL 93 Cb 0.43 -0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.01 4pbg h VAL 93 CO 0.04 0.22 0.45 -0.08 0.02 0.00 0.00 177.57 178.22 4pbg h GLU 94 N 1.19 0.82 -0.31 1.57 4.81 -0.83 -2.49 114.58 119.35 4pbg h GLU 94 Ca 0.38 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.58 4pbg h GLU 94 Cb 0.00 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 4pbg h GLU 94 CO -0.12 0.55 0.14 0.35 -0.73 0.00 0.00 179.01 179.20 4pbg h PHE 95 N 0.85 0.26 -0.42 0.92 3.57 -0.38 -2.34 116.94 119.40 4pbg h PHE 95 Ca 0.32 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.76 4pbg h PHE 95 Cb 0.13 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 4pbg h PHE 95 CO -0.05 0.14 -0.05 1.88 -2.23 0.00 0.00 178.31 177.99 4pbg h TYR 96 N 0.30 0.75 -0.64 0.41 0.05 -1.24 -1.63 116.97 114.97 4pbg h TYR 96 Ca 0.13 -0.11 -0.08 0.00 0.05 0.00 0.00 58.73 58.72 4pbg h TYR 96 Cb 0.06 -0.20 -0.03 0.00 1.01 0.00 0.00 36.73 37.57 4pbg h TYR 96 CO -0.11 0.74 0.10 0.45 -1.05 0.00 0.00 178.16 178.29 4pbg h HIS 97 N 0.65 1.12 0.85 4.88 3.86 -1.34 0.24 115.15 125.41 4pbg h HIS 97 Ca 0.12 -0.15 -0.04 0.00 -1.16 0.00 0.00 60.37 59.14 4pbg h HIS 97 Cb 0.49 -0.31 0.01 0.00 1.06 0.00 0.00 27.41 28.65 4pbg h HIS 97 CO 0.02 0.95 -0.41 0.87 0.86 0.00 0.00 177.93 180.22 4pbg h LYS 98 N 0.99 -1.10 -0.67 2.45 1.57 -0.85 -0.88 116.57 118.08 4pbg h LYS 98 Ca 0.20 0.08 0.10 0.00 -1.87 0.00 0.00 60.65 59.15 4pbg h LYS 98 Cb 0.43 0.25 -0.11 0.00 0.08 0.00 0.00 32.23 32.88 4pbg h LYS 98 CO 0.01 -0.73 -0.45 1.25 -0.57 0.00 0.00 179.45 178.96 4pbg h LEU 99 N -1.21 -1.57 -1.07 2.94 5.85 -1.20 0.69 115.31 119.74 4pbg h LEU 99 Ca -0.12 0.26 0.12 0.00 0.84 0.00 0.00 57.88 58.99 4pbg h LEU 99 Cb 0.88 0.72 -0.08 0.00 0.37 0.00 0.00 40.66 42.55 4pbg h LEU 99 CO 0.19 -0.32 0.62 -0.26 -0.34 0.00 0.00 178.44 178.33 4pbg h PHE 100 N -0.18 1.07 -0.59 1.25 0.04 -0.43 -0.27 116.94 117.84 4pbg h PHE 100 Ca 0.20 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.96 4pbg h PHE 100 Cb 0.55 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 38.34 4pbg h PHE 100 CO -0.77 0.42 0.21 0.00 -0.60 0.00 0.00 178.31 177.57 4pbg h ALA 101 N 1.55 0.77 -0.18 2.45 0.00 0.18 -1.92 119.26 122.11 4pbg h ALA 101 Ca 0.49 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 4pbg h ALA 101 Cb 0.54 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 4pbg h ALA 101 CO -0.25 0.41 -0.09 0.93 0.00 0.00 0.00 179.25 180.25 4pbg h GLU 102 N 0.82 0.29 0.32 0.00 4.39 0.59 -0.02 114.58 120.98 4pbg h GLU 102 Ca 0.19 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 4pbg h GLU 102 Cb 0.24 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 4pbg h GLU 102 CO -0.01 0.39 -0.15 0.00 -1.16 0.00 0.00 179.01 178.08 4pbg h HIS 104 N -0.75 0.89 -0.66 0.00 3.86 -1.10 0.11 115.15 117.51 4pbg h HIS 104 Ca -0.04 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.15 4pbg h HIS 104 Cb 0.50 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 4pbg h HIS 104 CO 0.02 0.53 0.27 -0.22 0.86 0.00 0.00 177.93 179.38 4pbg h LYS 105 N 0.93 0.98 -0.39 2.45 3.64 -0.91 -2.40 116.57 120.88 4pbg h LYS 105 Ca 0.29 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 4pbg h LYS 105 Cb 0.02 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 4pbg h LYS 105 CO -0.08 0.82 0.00 0.54 -2.27 0.00 0.00 179.45 178.46 4pbg n ARG 106 N -4.41 1.90 -1.74 1.90 5.12 -0.14 -4.92 116.66 114.37 4pbg n ARG 106 Ca 0.05 -1.35 -0.19 0.00 -1.93 0.00 0.00 57.85 54.42 4pbg n ARG 106 Cb 0.17 -1.31 -0.07 0.00 -1.16 0.00 0.00 32.46 30.09 4pbg n ARG 106 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 4pbg n HIS 107 N 0.58 -0.21 -3.53 -1.55 8.25 0.21 -4.73 115.22 114.24 4pbg n HIS 107 Ca 0.13 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.17 4pbg n HIS 107 Cb 0.33 -3.35 -0.11 0.00 1.12 0.00 0.00 29.99 27.98 4pbg n HIS 107 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 4pbg s VAL 108 N -2.77 5.00 -0.10 1.59 1.01 -0.50 -4.71 120.40 119.91 4pbg s VAL 108 Ca 0.00 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 4pbg s VAL 108 Cb 0.00 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 4pbg s VAL 108 CO 0.00 -0.19 1.47 -0.70 0.00 0.00 0.00 175.10 175.68 4pbg s GLU 109 N 1.64 4.21 -0.05 2.72 2.56 -0.94 -4.18 118.70 124.66 4pbg s GLU 109 Ca 0.04 1.95 -0.30 0.00 0.00 0.00 0.00 54.97 56.66 4pbg s GLU 109 Cb -0.19 -3.88 -0.03 0.00 2.00 0.00 0.00 34.13 32.04 4pbg s GLU 109 CO 0.09 -0.78 1.08 -1.25 -0.56 0.00 0.00 175.26 173.83 4pbg s PRO 110 N 3.78 4.44 -0.33 4.30 0.04 -1.26 -0.99 135.00 144.97 4pbg s PRO 110 Ca 0.65 1.52 -0.06 0.00 0.04 0.00 0.00 61.00 63.14 4pbg s PRO 110 Cb -0.28 -3.51 0.04 0.00 0.04 0.00 0.00 34.50 30.79 4pbg s PRO 110 CO 0.23 -0.29 0.10 -0.06 0.04 0.00 0.00 177.00 177.02 4pbg s PHE 111 N 1.73 3.25 -0.15 0.56 0.40 0.87 -4.11 117.98 120.53 4pbg s PHE 111 Ca 0.52 -1.41 -0.08 0.00 -0.60 0.00 0.00 56.93 55.36 4pbg s PHE 111 Cb -0.22 -2.27 -0.04 0.00 0.51 0.00 0.00 43.02 41.00 4pbg s PHE 111 CO 0.23 -0.72 0.12 0.08 0.70 0.00 0.00 175.22 175.62 4pbg s VAL 112 N 1.40 5.35 -0.13 -0.44 1.01 -0.57 -0.89 120.40 126.12 4pbg s VAL 112 Ca -0.02 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 4pbg s VAL 112 Cb -0.19 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 4pbg s VAL 112 CO 0.03 0.54 -0.08 -0.89 0.00 0.00 0.00 175.10 174.70 4pbg s THR 113 N -0.39 3.54 0.11 3.92 2.01 -0.30 0.40 115.64 124.93 4pbg s THR 113 Ca 0.11 -0.49 -0.03 0.00 0.31 0.00 0.00 61.69 61.59 4pbg s THR 113 Cb -0.12 -2.51 -0.22 0.00 0.01 0.00 0.00 72.50 69.66 4pbg s THR 113 CO 0.01 0.52 1.25 -0.07 -0.69 0.00 0.00 174.62 175.64 4pbg h LEU 114 N 6.49 0.42 -7.60 4.42 3.38 -0.76 -0.34 115.31 121.33 4pbg h LEU 114 Ca -0.31 -0.39 -0.45 0.00 0.09 0.00 0.00 57.88 56.82 4pbg h LEU 114 Cb 1.20 -0.13 -0.37 0.00 0.09 0.00 0.00 40.66 41.44 4pbg h LEU 114 CO 0.59 1.23 -0.78 -2.28 0.09 0.00 0.00 178.44 177.29 4pbg s HIS 115 N -2.99 0.89 -0.48 1.13 5.04 -0.07 -4.39 115.29 114.41 4pbg s HIS 115 Ca -0.04 -0.31 0.04 0.00 -1.54 0.00 0.00 55.06 53.20 4pbg s HIS 115 Cb 0.08 -0.88 0.16 0.00 0.04 0.00 0.00 32.58 31.99 4pbg s HIS 115 CO 0.87 -0.34 0.36 -1.58 -2.34 0.00 0.00 174.74 171.70 4pbg s HIS 116 N 1.66 1.77 -1.96 3.88 2.46 -1.26 -1.23 115.29 120.61 4pbg s HIS 116 Ca 0.01 -2.54 0.00 0.00 0.47 0.00 0.00 55.06 53.00 4pbg s HIS 116 Cb -0.13 -1.46 0.00 0.00 -0.13 0.00 0.00 32.58 30.86 4pbg s HIS 116 CO -0.05 -0.75 0.00 1.19 -2.47 0.00 0.00 174.74 172.66 4pbg n PHE 117 N 2.78 -0.21 -3.28 3.88 3.72 -1.26 -4.88 117.46 118.23 4pbg n PHE 117 Ca 0.24 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.39 4pbg n PHE 117 Cb 0.42 -3.28 -0.08 0.00 -0.94 0.00 0.00 39.48 35.60 4pbg n PHE 117 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 4pbg n ASP 118 N -1.22 0.56 -4.76 4.37 5.75 -1.26 -4.98 116.55 115.00 4pbg n ASP 118 Ca -0.19 -2.74 -0.40 0.00 -0.01 0.00 0.00 54.79 51.45 4pbg n ASP 118 Cb 0.62 -0.63 -0.04 0.00 -1.03 0.00 0.00 41.12 40.04 4pbg n ASP 118 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 4pbg s THR 119 N -1.12 3.37 0.23 2.12 2.01 -1.26 -4.60 115.64 116.39 4pbg s THR 119 Ca 0.35 1.36 -0.31 0.00 0.31 0.00 0.00 61.69 63.40 4pbg s THR 119 Cb 0.14 -3.86 -0.14 0.00 0.01 0.00 0.00 72.50 68.65 4pbg s THR 119 CO -0.12 0.31 1.34 -2.65 -0.69 0.00 0.00 174.62 172.81 4pbg n PRO 120 N 1.07 1.83 -0.26 4.92 -0.02 -1.26 -4.30 135.00 136.97 4pbg n PRO 120 Ca -0.01 0.65 -0.08 0.00 -2.02 0.00 0.00 63.50 62.05 4pbg n PRO 120 Cb 0.44 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 4pbg n PRO 120 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 4pbg h GLU 121 N 3.89 -0.17 -0.97 -0.52 4.22 -1.03 -1.71 114.58 118.29 4pbg h GLU 121 Ca -0.44 0.01 0.32 0.00 0.08 0.00 0.00 59.36 59.33 4pbg h GLU 121 Cb 1.29 0.04 -0.16 0.00 0.50 0.00 0.00 28.75 30.42 4pbg h GLU 121 CO 0.73 -0.11 0.37 0.00 -2.18 0.00 0.00 179.01 177.82 4pbg h ALA 122 N 0.70 1.69 0.13 2.92 0.00 -1.89 0.28 119.26 123.09 4pbg h ALA 122 Ca 0.20 0.25 -0.28 0.00 0.00 0.00 0.00 54.91 55.09 4pbg h ALA 122 Cb 0.55 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.69 4pbg h ALA 122 CO -0.76 -0.66 -1.23 -0.07 0.00 0.00 0.00 179.25 176.53 4pbg h LEU 123 N 0.13 0.51 0.09 0.00 3.38 -1.63 -3.33 115.31 114.46 4pbg h LEU 123 Ca 0.70 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 4pbg h LEU 123 Cb 1.62 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.21 4pbg h LEU 123 CO -0.73 1.39 -0.04 -0.74 0.09 0.00 0.00 178.44 178.40 4pbg h HIS 124 N 0.11 -0.12 0.00 1.13 2.76 0.31 -2.26 115.15 117.08 4pbg h HIS 124 Ca -0.14 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.02 4pbg h HIS 124 Cb 1.94 0.04 0.00 0.00 1.55 0.00 0.00 27.41 30.94 4pbg h HIS 124 CO 0.07 0.05 0.00 0.43 -1.30 0.00 0.00 177.93 177.18 4pbg n SER 125 N -5.08 0.00 -1.97 3.26 7.64 -0.11 -0.96 113.62 116.39 4pbg n SER 125 Ca -0.08 0.45 -0.22 0.00 1.01 0.00 0.00 58.87 60.04 4pbg n SER 125 Cb 0.13 -0.46 0.15 0.00 -1.01 0.00 0.00 64.21 63.02 4pbg n SER 125 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 4pbg n ASN 126 N -1.46 4.35 0.00 6.43 5.15 -0.88 -4.85 115.26 123.99 4pbg n ASN 126 Ca 0.01 -3.71 0.00 0.00 -0.60 0.00 0.00 54.58 50.28 4pbg n ASN 126 Cb 0.03 -0.79 0.00 0.00 -0.53 0.00 0.00 39.78 38.49 4pbg n ASN 126 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 4pbg n GLY 127 N -1.07 0.32 7.00 8.20 0.00 -0.70 -4.62 105.19 114.32 4pbg n GLY 127 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.55 4pbg n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 4pbg n ASP 128 N 0.00 0.00 -0.54 1.61 2.03 -0.13 -0.51 116.55 119.01 4pbg n ASP 128 Ca 0.00 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.41 4pbg n ASP 128 Cb 0.00 0.00 0.37 0.00 -0.72 0.00 0.00 41.12 40.77 4pbg n ASP 128 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 4pbg n PHE 129 N 14.00 0.22 0.10 -0.67 3.01 -1.26 -3.28 117.46 129.58 4pbg n PHE 129 Ca 0.00 -0.11 -0.03 0.00 1.01 0.00 0.00 57.45 58.32 4pbg n PHE 129 Cb 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.47 4pbg n PHE 129 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 4pbg h LEU 130 N 2.12 0.00 -8.71 4.37 3.38 -1.17 -3.42 115.31 111.88 4pbg h LEU 130 Ca 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 4pbg h LEU 130 Cb 0.47 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.13 4pbg h LEU 130 CO 0.00 0.80 0.73 0.21 0.09 0.00 0.00 178.44 180.27 4pbg s ASN 131 N -6.68 6.58 0.37 -0.43 3.84 -1.17 -4.93 114.94 112.53 4pbg s ASN 131 Ca 0.01 0.33 0.23 0.00 0.21 0.00 0.00 52.86 53.64 4pbg s ASN 131 Cb 0.10 -2.49 1.24 0.00 -0.55 0.00 0.00 41.25 39.55 4pbg s ASN 131 CO 0.79 -1.11 1.68 0.03 -2.79 0.00 0.00 177.10 175.70 4pbg h ARG 132 N 9.05 0.00 -0.63 0.43 3.08 -1.87 -1.87 114.38 122.57 4pbg h ARG 132 Ca -0.23 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.73 4pbg h ARG 132 Cb 1.07 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 4pbg h ARG 132 CO 1.06 0.00 0.06 0.93 -1.07 0.00 0.00 179.97 180.95 4pbg h GLU 133 N 0.00 1.08 0.00 0.04 5.08 -1.92 -2.49 114.58 116.38 4pbg h GLU 133 Ca 0.00 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 4pbg h GLU 133 Cb 0.14 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.28 4pbg h GLU 133 CO 0.00 1.02 0.00 -0.91 -1.00 0.00 0.00 179.01 178.12 4pbg h ASN 134 N 0.99 0.00 -0.41 1.42 4.21 -1.59 -1.61 115.58 118.59 4pbg h ASN 134 Ca 0.19 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.67 4pbg h ASN 134 Cb 0.49 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.67 4pbg h ASN 134 CO 0.02 0.00 0.15 0.40 -1.29 0.00 0.00 177.43 176.71 4pbg h ILE 135 N 0.00 1.21 0.29 2.81 2.04 -1.54 -1.61 117.51 120.70 4pbg h ILE 135 Ca 0.00 -0.66 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 4pbg h ILE 135 Cb 0.33 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 4pbg h ILE 135 CO 0.00 0.24 -0.16 -0.33 0.00 0.00 0.00 178.15 177.90 4pbg h GLU 136 N 0.51 -0.40 -0.89 2.37 4.39 -1.37 -1.29 114.58 117.90 4pbg h GLU 136 Ca 0.13 0.03 0.24 0.00 0.34 0.00 0.00 59.36 60.10 4pbg h GLU 136 Cb 0.22 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 28.92 4pbg h GLU 136 CO -0.01 -0.27 0.62 0.45 -1.16 0.00 0.00 179.01 178.64 4pbg h HIS 137 N -0.42 0.17 0.30 4.33 3.86 -1.29 -1.39 115.15 120.71 4pbg h HIS 137 Ca -0.03 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 4pbg h HIS 137 Cb 0.34 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.76 4pbg h HIS 137 CO -0.08 0.04 -0.14 0.35 0.86 0.00 0.00 177.93 178.96 4pbg h PHE 138 N 0.13 -0.38 -0.96 2.45 3.57 -0.25 -2.15 116.94 119.35 4pbg h PHE 138 Ca 0.44 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.11 4pbg h PHE 138 Cb 1.53 0.12 -0.11 0.00 2.79 0.00 0.00 35.95 40.29 4pbg h PHE 138 CO -0.00 -0.05 0.55 0.82 -2.23 0.00 0.00 178.31 177.40 4pbg h ILE 139 N -0.97 0.68 -0.57 1.41 5.03 -0.59 0.38 117.51 122.88 4pbg h ILE 139 Ca -0.04 -0.24 -0.10 0.00 -0.12 0.00 0.00 64.86 64.36 4pbg h ILE 139 Cb 0.49 -0.07 -0.02 0.00 -3.03 0.00 0.00 36.82 34.19 4pbg h ILE 139 CO 0.07 0.13 -0.03 0.44 -0.68 0.00 0.00 178.15 178.07 4pbg h ASP 140 N 0.69 1.02 -0.18 1.72 3.32 -1.37 -0.43 116.42 121.19 4pbg h ASP 140 Ca 0.56 -0.32 -0.08 0.00 0.02 0.00 0.00 57.03 57.21 4pbg h ASP 140 Cb 0.87 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 4pbg h ASP 140 CO -0.40 1.09 -0.13 0.22 -1.72 0.00 0.00 179.24 178.31 4pbg h TYR 141 N 0.92 0.62 0.27 4.55 3.20 -0.04 -1.77 116.97 124.72 4pbg h TYR 141 Ca 0.16 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 4pbg h TYR 141 Cb 0.59 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.70 4pbg h TYR 141 CO 0.04 0.68 -0.13 0.00 -1.64 0.00 0.00 178.16 177.11 4pbg h ALA 142 N 1.34 -0.36 -0.97 1.82 0.00 -0.10 -2.70 119.26 118.30 4pbg h ALA 142 Ca 0.09 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.00 4pbg h ALA 142 Cb 0.53 0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.35 4pbg h ALA 142 CO 0.03 -0.47 0.56 0.00 0.00 0.00 0.00 179.25 179.37 4pbg h ALA 143 N -0.31 1.59 0.93 0.00 0.00 -1.01 0.24 119.26 120.70 4pbg h ALA 143 Ca -0.04 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 4pbg h ALA 143 Cb 0.51 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.28 4pbg h ALA 143 CO 0.06 -0.12 -0.46 0.35 0.00 0.00 0.00 179.25 179.08 4pbg h PHE 144 N 0.67 -1.20 -0.94 0.00 3.57 -1.35 -2.37 116.94 115.32 4pbg h PHE 144 Ca 0.57 -0.03 0.11 0.00 3.53 0.00 0.00 57.97 62.15 4pbg h PHE 144 Cb 0.92 0.40 -0.07 0.00 2.79 0.00 0.00 35.95 39.99 4pbg h PHE 144 CO -0.03 -0.74 0.60 0.00 -2.23 0.00 0.00 178.31 175.91 4pbg h PHE 146 N 0.92 0.22 -0.03 0.00 0.04 -0.44 -1.49 116.94 116.16 4pbg h PHE 146 Ca 0.45 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.21 4pbg h PHE 146 Cb 0.45 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.53 4pbg h PHE 146 CO -0.00 0.17 0.00 1.49 -0.60 0.00 0.00 178.31 179.37 4pbg h GLU 147 N 0.20 0.06 -0.04 1.51 4.57 -1.12 -3.33 114.58 116.44 4pbg h GLU 147 Ca 0.06 -0.02 -0.11 0.00 -1.18 0.00 0.00 59.36 58.11 4pbg h GLU 147 Cb 0.01 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 4pbg h GLU 147 CO -0.01 0.33 -0.49 1.49 -1.18 0.00 0.00 179.01 179.15 4pbg h GLU 148 N -0.23 0.09 -2.45 1.92 4.57 -0.88 -3.38 114.58 114.22 4pbg h GLU 148 Ca 0.01 -0.05 -0.67 0.00 -1.18 0.00 0.00 59.36 57.47 4pbg h GLU 148 Cb 0.30 0.00 -0.37 0.00 -0.16 0.00 0.00 28.75 28.52 4pbg h GLU 148 CO 0.00 0.56 -0.11 1.19 -1.18 0.00 0.00 179.01 179.47 4pbg n PHE 149 N -3.96 3.18 0.59 0.92 3.72 -0.57 -4.83 117.46 116.51 4pbg n PHE 149 Ca -0.02 -3.62 0.07 0.00 -0.05 0.00 0.00 57.45 53.84 4pbg n PHE 149 Cb 0.52 -0.80 0.33 0.00 -0.94 0.00 0.00 39.48 38.59 4pbg n PHE 149 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 4pbg n PRO 150 N 1.02 0.11 0.28 -1.08 -0.04 -1.26 -2.45 135.00 131.58 4pbg n PRO 150 Ca 0.29 0.20 0.17 0.00 -0.04 0.00 0.00 63.50 64.12 4pbg n PRO 150 Cb 0.38 -1.50 0.77 0.00 -0.04 0.00 0.00 33.50 33.11 4pbg n PRO 150 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 4pbg h GLU 151 N 0.00 0.00 -5.54 0.54 3.07 -1.95 -3.43 114.58 107.27 4pbg h GLU 151 Ca 0.00 0.00 -0.60 0.00 -0.50 0.00 0.00 59.36 58.26 4pbg h GLU 151 Cb 0.18 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 27.99 4pbg h GLU 151 CO 0.00 0.03 -0.01 0.08 -1.40 0.00 0.00 179.01 177.71 4pbg s VAL 152 N -3.81 5.09 -0.66 3.13 1.01 -1.02 -4.97 120.40 119.18 4pbg s VAL 152 Ca -0.00 0.98 0.23 0.00 0.00 0.00 0.00 61.98 63.19 4pbg s VAL 152 Cb 0.10 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 32.53 4pbg s VAL 152 CO 0.53 0.16 1.06 0.59 0.00 0.00 0.00 175.10 177.44 4pbg n ASN 153 N 4.89 0.63 -3.81 3.32 3.02 -1.26 -4.71 115.26 117.33 4pbg n ASN 153 Ca -0.04 -0.23 -0.24 0.00 -0.03 0.00 0.00 54.58 54.03 4pbg n ASN 153 Cb 0.50 0.73 -0.17 0.00 -0.61 0.00 0.00 39.78 40.23 4pbg n ASN 153 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 4pbg s TYR 154 N -3.17 0.96 0.08 3.10 2.02 -1.26 -0.33 117.35 118.74 4pbg s TYR 154 Ca 0.04 -0.38 0.09 0.00 -0.37 0.00 0.00 57.07 56.45 4pbg s TYR 154 Cb 0.15 -0.95 -0.03 0.00 -0.40 0.00 0.00 41.96 40.72 4pbg s TYR 154 CO 0.79 -0.40 -0.22 -1.58 -1.57 0.00 0.00 175.55 172.57 4pbg s TRP 155 N 1.88 2.44 0.01 2.71 0.52 0.17 -1.51 118.94 125.17 4pbg s TRP 155 Ca 0.05 -0.32 0.03 0.00 0.02 0.00 0.00 56.10 55.88 4pbg s TRP 155 Cb -0.13 -1.38 -0.01 0.00 -1.15 0.00 0.00 33.47 30.81 4pbg s TRP 155 CO -0.06 0.27 -0.10 0.95 0.02 0.00 0.00 176.95 178.02 4pbg s THR 156 N -0.97 0.78 0.00 2.01 -4.23 0.16 -0.70 115.64 112.70 4pbg s THR 156 Ca 0.14 -0.64 0.00 0.00 -1.18 0.00 0.00 61.69 60.02 4pbg s THR 156 Cb -0.10 -0.69 0.00 0.00 1.34 0.00 0.00 72.50 73.04 4pbg s THR 156 CO 0.06 0.06 0.00 0.35 -0.54 0.00 0.00 174.62 174.55 4pbg n THR 157 N 2.41 0.00 -4.15 3.99 -2.24 -1.11 -1.58 114.28 111.60 4pbg n THR 157 Ca -0.16 0.30 -0.30 0.00 -2.27 0.00 0.00 64.05 61.63 4pbg n THR 157 Cb 0.56 -0.97 -0.08 0.00 -2.10 0.00 0.00 70.33 67.73 4pbg n THR 157 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 4pbg s PHE 158 N -0.61 2.93 -0.28 4.78 0.08 -1.26 -0.90 117.98 122.72 4pbg s PHE 158 Ca 0.00 -0.06 -0.07 0.00 0.12 0.00 0.00 56.93 56.92 4pbg s PHE 158 Cb 0.00 -1.50 -0.00 0.00 -0.57 0.00 0.00 43.02 40.94 4pbg s PHE 158 CO 0.00 0.47 0.08 1.21 -0.10 0.00 0.00 175.22 176.88 4pbg s ASN 159 N -2.34 5.12 -0.64 1.36 2.47 -0.37 -3.23 114.94 117.31 4pbg s ASN 159 Ca 0.25 -0.58 -0.08 0.00 0.42 0.00 0.00 52.86 52.87 4pbg s ASN 159 Cb -0.11 -1.89 0.01 0.00 -1.45 0.00 0.00 41.25 37.81 4pbg s ASN 159 CO 0.17 -0.15 0.65 -0.62 -3.72 0.00 0.00 177.10 173.44 4pbg n GLU 160 N 4.88 -1.72 -0.11 0.43 1.02 0.56 -4.60 120.64 121.10 4pbg n GLU 160 Ca -0.15 1.57 -0.10 0.00 -0.02 0.00 0.00 57.16 58.46 4pbg n GLU 160 Cb 0.49 -4.91 -0.02 0.00 -0.02 0.00 0.00 31.44 26.97 4pbg n GLU 160 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 4pbg h ILE 161 N 0.94 1.22 0.05 -3.67 2.04 -1.87 -2.65 117.51 113.56 4pbg h ILE 161 Ca -0.14 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 64.99 4pbg h ILE 161 Cb 1.09 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 38.21 4pbg h ILE 161 CO 0.27 0.25 -0.42 1.23 0.00 0.00 0.00 178.15 179.48 4pbg h GLY 162 N 0.38 -1.18 1.67 5.37 0.00 -1.92 -1.62 103.07 105.76 4pbg h GLY 162 Ca 0.10 0.64 0.00 0.00 0.00 0.00 0.00 47.33 48.07 4pbg h GLY 162 CO 0.00 -0.30 0.11 -1.05 0.00 0.00 0.00 176.54 175.29 4pbg n PRO 163 N -4.81 0.07 -0.07 4.80 -0.02 -1.16 -0.90 135.00 132.90 4pbg n PRO 163 Ca -0.06 0.53 -0.12 0.00 -2.02 0.00 0.00 63.50 61.83 4pbg n PRO 163 Cb 0.32 -1.84 -0.09 0.00 -0.02 0.00 0.00 33.50 31.87 4pbg n PRO 163 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 4pbg h ILE 164 N 0.00 1.07 -0.81 4.25 1.08 -0.95 -2.46 117.51 119.69 4pbg h ILE 164 Ca 0.00 -1.91 -0.01 0.00 -0.39 0.00 0.00 64.86 62.55 4pbg h ILE 164 Cb 0.21 2.14 -0.04 0.00 -3.07 0.00 0.00 36.82 36.06 4pbg h ILE 164 CO 0.00 0.36 0.47 1.23 -0.69 0.00 0.00 178.15 179.52 4pbg h GLY 165 N -1.00 1.20 0.65 5.37 0.00 -0.72 -0.47 103.07 108.09 4pbg h GLY 165 Ca -0.08 -0.52 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 4pbg h GLY 165 CO -0.05 0.50 -0.31 -1.80 0.00 0.00 0.00 176.54 174.88 4pbg h ASP 166 N 1.13 -0.74 0.71 0.19 3.58 -1.15 0.28 116.42 120.43 4pbg h ASP 166 Ca 0.29 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.77 4pbg h ASP 166 Cb -0.01 0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.23 4pbg h ASP 166 CO -0.05 -0.53 0.00 1.23 -2.88 0.00 0.00 179.24 177.01 4pbg h GLY 167 N -0.87 0.00 0.25 -0.78 0.00 -1.36 0.21 103.07 100.52 4pbg h GLY 167 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.86 4pbg h GLY 167 CO 0.14 0.00 -2.28 -0.18 0.00 0.00 0.00 176.54 174.22 4pbg n GLN 168 N -2.72 0.69 -0.00 4.80 7.27 -0.19 0.76 117.38 127.99 4pbg n GLN 168 Ca 0.01 0.19 0.01 0.00 0.07 0.00 0.00 57.00 57.28 4pbg n GLN 168 Cb 0.23 -1.60 -0.02 0.00 2.41 0.00 0.00 30.24 31.26 4pbg n GLN 168 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 4pbg n TYR 169 N -3.34 0.00 -0.10 3.69 4.01 0.98 -2.26 117.16 120.15 4pbg n TYR 169 Ca -0.40 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.17 4pbg n TYR 169 Cb 1.02 -0.04 -0.06 0.00 -0.31 0.00 0.00 39.34 39.95 4pbg n TYR 169 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 4pbg n LEU 170 N -1.42 1.73 0.04 7.72 7.94 -0.65 -0.32 117.00 132.04 4pbg n LEU 170 Ca -0.00 0.29 -0.03 0.00 -1.11 0.00 0.00 56.01 55.16 4pbg n LEU 170 Cb 0.06 -0.69 -0.09 0.00 0.53 0.00 0.00 43.42 43.23 4pbg n LEU 170 CO 0.05 0.10 -0.19 0.58 -1.11 0.00 0.00 177.39 176.83 4pbg h VAL 171 N -0.85 0.80 -0.75 1.96 2.07 -0.80 -1.71 116.25 116.98 4pbg h VAL 171 Ca -0.32 -2.40 -0.15 0.00 0.82 0.00 0.00 66.70 64.65 4pbg h VAL 171 Cb 1.21 2.30 -0.03 0.00 -1.52 0.00 0.00 31.29 33.25 4pbg h VAL 171 CO -0.20 0.46 -0.17 0.61 0.02 0.00 0.00 177.57 178.29 4pbg n GLY 172 N 1.41 0.48 0.02 2.17 0.00 -0.79 -4.86 105.19 103.62 4pbg n GLY 172 Ca -0.09 -0.63 0.11 0.00 0.00 0.00 0.00 46.02 45.41 4pbg n GLY 172 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 4pbg n LYS 173 N -2.22 0.34 -4.15 1.61 2.85 0.44 -4.35 118.16 112.68 4pbg n LYS 173 Ca -0.08 -0.07 -0.30 0.00 -1.05 0.00 0.00 58.31 56.81 4pbg n LYS 173 Cb 0.42 -1.55 -0.08 0.00 -0.65 0.00 0.00 35.03 33.17 4pbg n LYS 173 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 4pbg s PHE 174 N -3.25 2.98 0.58 5.58 0.08 0.23 -4.87 117.98 119.30 4pbg s PHE 174 Ca 0.01 -0.03 -0.20 0.00 0.12 0.00 0.00 56.93 56.82 4pbg s PHE 174 Cb 0.15 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 41.02 4pbg s PHE 174 CO 0.86 0.47 1.30 -2.30 -0.10 0.00 0.00 175.22 175.46 4pbg n PRO 175 N 0.64 1.46 0.00 0.24 -0.02 -1.26 -0.45 135.00 135.61 4pbg n PRO 175 Ca -0.11 0.55 0.08 0.00 -2.02 0.00 0.00 63.50 61.99 4pbg n PRO 175 Cb 0.52 -2.52 0.46 0.00 -0.02 0.00 0.00 33.50 31.93 4pbg n PRO 175 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 4pbg n PRO 176 N -1.24 0.63 -2.37 0.52 -0.04 -1.26 -4.76 135.00 126.47 4pbg n PRO 176 Ca 0.12 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.55 4pbg n PRO 176 Cb 0.46 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 4pbg n PRO 176 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4pbg n GLY 177 N 0.23 0.55 3.86 0.55 0.00 0.40 -5.04 105.19 105.75 4pbg n GLY 177 Ca 0.12 -0.66 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 4pbg n GLY 177 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4pbg s ILE 178 N -2.63 4.79 0.01 -0.61 1.01 -0.96 -4.75 121.20 118.06 4pbg s ILE 178 Ca 0.04 0.73 0.05 0.00 0.00 0.00 0.00 60.65 61.47 4pbg s ILE 178 Cb -0.02 -3.62 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 4pbg s ILE 178 CO 0.05 -0.17 -0.15 -0.54 0.00 0.00 0.00 174.94 174.13 4pbg s LYS 179 N -2.99 1.12 -0.06 2.79 1.02 -1.24 -1.88 119.74 118.50 4pbg s LYS 179 Ca 0.51 -0.66 0.00 0.00 0.02 0.00 0.00 55.97 55.85 4pbg s LYS 179 Cb -0.11 -1.12 0.00 0.00 -0.52 0.00 0.00 37.83 36.09 4pbg s LYS 179 CO 0.20 0.29 0.00 0.66 -0.92 0.00 0.00 175.35 175.58 4pbg n TYR 180 N 2.32 0.00 -2.48 3.18 4.01 -0.64 -4.85 117.16 118.70 4pbg n TYR 180 Ca -0.16 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.15 4pbg n TYR 180 Cb 0.55 -1.57 0.00 0.00 -0.31 0.00 0.00 39.34 38.01 4pbg n TYR 180 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 4pbg n ASP 181 N -0.76 4.81 0.00 7.72 -0.08 0.57 -4.77 116.55 124.04 4pbg n ASP 181 Ca -0.01 -2.91 0.04 0.00 -1.51 0.00 0.00 54.79 50.40 4pbg n ASP 181 Cb 0.39 -1.73 0.19 0.00 2.34 0.00 0.00 41.12 42.30 4pbg n ASP 181 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 4pbg n LEU 182 N 8.00 0.00 0.01 -2.67 4.32 -1.26 -1.62 117.00 123.78 4pbg n LEU 182 Ca 0.49 0.48 -0.20 0.00 -0.02 0.00 0.00 56.01 56.76 4pbg n LEU 182 Cb 0.45 -0.48 -0.14 0.00 -1.62 0.00 0.00 43.42 41.63 4pbg n LEU 182 CO 0.78 -0.34 -0.12 0.00 -1.22 0.00 0.00 177.39 176.49 4pbg h ALA 183 N 2.31 0.04 -0.19 -1.18 0.00 -1.86 -3.06 119.26 115.32 4pbg h ALA 183 Ca 0.00 -0.85 -0.01 0.00 0.00 0.00 0.00 54.91 54.05 4pbg h ALA 183 Cb 0.14 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 4pbg h ALA 183 CO 0.00 0.52 0.07 0.87 0.00 0.00 0.00 179.25 180.70 4pbg h LYS 184 N -0.47 0.28 -0.15 0.00 1.57 -1.79 -0.97 116.57 115.04 4pbg h LYS 184 Ca -0.20 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.55 4pbg h LYS 184 Cb 1.59 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.80 4pbg h LYS 184 CO 0.08 0.37 -0.38 0.28 -0.57 0.00 0.00 179.45 179.23 4pbg h VAL 185 N 0.14 0.00 -0.57 0.50 2.07 -1.42 0.20 116.25 117.16 4pbg h VAL 185 Ca 0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.63 4pbg h VAL 185 Cb 0.20 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.93 4pbg h VAL 185 CO -0.00 0.00 0.38 -0.26 0.02 0.00 0.00 177.57 177.71 4pbg h PHE 186 N -0.36 0.60 0.18 1.57 0.04 -1.47 -0.95 116.94 116.55 4pbg h PHE 186 Ca 0.03 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 4pbg h PHE 186 Cb 0.45 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.40 4pbg h PHE 186 CO -0.59 0.34 -0.09 0.37 -0.60 0.00 0.00 178.31 177.75 4pbg h GLN 187 N 0.61 -0.23 -0.85 1.51 5.75 -0.21 -1.99 115.11 119.70 4pbg h GLN 187 Ca 0.24 0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.85 4pbg h GLN 187 Cb 0.17 0.05 -0.06 0.00 1.07 0.00 0.00 27.48 28.72 4pbg h GLN 187 CO -0.07 0.06 0.55 1.03 -2.65 0.00 0.00 178.83 177.75 4pbg h SER 188 N -0.52 0.74 -0.33 -0.69 0.87 -0.15 0.49 113.55 113.95 4pbg h SER 188 Ca -0.02 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.49 4pbg h SER 188 Cb 0.40 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 4pbg h SER 188 CO 0.04 0.43 0.01 0.45 -0.53 0.00 0.00 176.83 177.23 4pbg h HIS 189 N 0.81 0.72 0.03 2.24 3.86 -1.00 0.03 115.15 121.85 4pbg h HIS 189 Ca 0.40 -0.09 -0.06 0.00 -1.16 0.00 0.00 60.37 59.46 4pbg h HIS 189 Cb 0.44 -0.20 0.01 0.00 1.06 0.00 0.00 27.41 28.71 4pbg h HIS 189 CO -0.00 0.68 -0.26 1.25 0.86 0.00 0.00 177.93 180.46 4pbg h HIS 190 N 0.65 0.20 0.11 2.45 6.17 -0.27 -2.97 115.15 121.48 4pbg h HIS 190 Ca 0.13 -0.13 -0.01 0.00 0.71 0.00 0.00 60.37 61.08 4pbg h HIS 190 Cb 0.39 -0.01 0.00 0.00 2.52 0.00 0.00 27.41 30.31 4pbg h HIS 190 CO 0.02 1.04 -0.05 -0.91 0.71 0.00 0.00 177.93 178.73 4pbg h ASN 191 N -0.70 -0.13 -0.55 3.26 4.21 -0.05 -0.98 115.58 120.64 4pbg h ASN 191 Ca -0.04 -0.08 0.05 0.00 1.21 0.00 0.00 56.30 57.44 4pbg h ASN 191 Cb 1.13 0.03 -0.05 0.00 -1.12 0.00 0.00 38.32 38.32 4pbg h ASN 191 CO 0.05 -0.00 0.29 0.24 -1.29 0.00 0.00 177.43 176.71 4pbg h MET 192 N -0.25 0.53 -0.09 0.81 2.86 -1.15 -0.12 114.93 117.52 4pbg h MET 192 Ca -0.02 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 4pbg h MET 192 Cb 0.20 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 4pbg h MET 192 CO 0.03 0.35 -0.13 0.52 1.06 0.00 0.00 176.91 178.73 4pbg h MET 193 N 0.55 0.14 -0.34 1.72 2.86 -1.34 -1.35 114.93 117.16 4pbg h MET 193 Ca 0.25 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.76 4pbg h MET 193 Cb 0.15 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 4pbg h MET 193 CO -0.17 0.28 -0.18 0.28 1.06 0.00 0.00 176.91 178.19 4pbg h VAL 194 N 0.14 1.29 -0.88 -2.22 2.07 0.08 -0.91 116.25 115.81 4pbg h VAL 194 Ca 0.03 -1.30 0.12 0.00 0.82 0.00 0.00 66.70 66.37 4pbg h VAL 194 Cb 0.33 1.41 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 4pbg h VAL 194 CO 0.02 0.42 0.57 0.28 0.02 0.00 0.00 177.57 178.88 4pbg h SER 195 N 0.49 0.72 0.49 0.57 0.02 -0.13 -1.64 113.55 114.07 4pbg h SER 195 Ca 0.07 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 4pbg h SER 195 Cb 0.72 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.15 4pbg h SER 195 CO 0.05 0.40 -0.24 -0.74 -1.14 0.00 0.00 176.83 175.16 4pbg h HIS 196 N 0.78 -0.62 -0.96 3.45 -0.00 -1.06 -2.72 115.15 114.03 4pbg h HIS 196 Ca 0.43 -0.01 0.31 0.00 -0.00 0.00 0.00 60.37 61.09 4pbg h HIS 196 Cb 0.55 0.20 -0.16 0.00 -0.00 0.00 0.00 27.41 28.01 4pbg h HIS 196 CO -0.00 -0.37 0.35 0.00 -0.00 0.00 0.00 177.93 177.91 4pbg h ALA 197 N -1.13 1.65 0.17 5.26 0.00 -0.79 -0.39 119.26 124.02 4pbg h ALA 197 Ca -0.07 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 4pbg h ALA 197 Cb 0.52 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.65 4pbg h ALA 197 CO 0.11 -0.64 -0.08 0.00 0.00 0.00 0.00 179.25 178.65 4pbg h ARG 198 N 0.15 -0.22 -0.52 0.00 3.08 -1.33 -2.29 114.38 113.25 4pbg h ARG 198 Ca 0.68 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.83 4pbg h ARG 198 Cb 1.56 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.63 4pbg h ARG 198 CO -0.73 0.12 0.35 0.00 -1.07 0.00 0.00 179.97 178.65 4pbg h ALA 199 N 0.17 1.99 -0.06 0.04 0.00 -0.79 -0.12 119.26 120.49 4pbg h ALA 199 Ca -0.02 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.64 4pbg h ALA 199 Cb 0.44 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.16 4pbg h ALA 199 CO 0.04 -0.10 -0.87 -0.24 0.00 0.00 0.00 179.25 178.08 4pbg h VAL 200 N 0.38 1.30 -0.12 0.00 3.04 -1.21 -1.05 116.25 118.59 4pbg h VAL 200 Ca 0.23 -2.10 0.03 0.00 -1.01 0.00 0.00 66.70 63.85 4pbg h VAL 200 Cb 0.43 2.26 -0.04 0.00 -2.01 0.00 0.00 31.29 31.94 4pbg h VAL 200 CO -0.06 0.65 -0.10 0.50 -1.01 0.00 0.00 177.57 177.55 4pbg h LYS 201 N 0.37 -0.11 -0.11 4.17 1.63 -0.75 -1.35 116.57 120.42 4pbg h LYS 201 Ca -0.09 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 59.75 4pbg h LYS 201 Cb 1.52 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 33.14 4pbg h LYS 201 CO 0.17 -0.07 -0.08 1.25 -3.45 0.00 0.00 179.45 177.27 4pbg h LEU 202 N -0.11 -0.26 -1.71 5.20 6.46 -0.99 0.74 115.31 124.64 4pbg h LEU 202 Ca 0.08 0.06 0.04 0.00 -0.12 0.00 0.00 57.88 57.93 4pbg h LEU 202 Cb 0.23 0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.27 4pbg h LEU 202 CO -0.19 -0.11 0.26 0.22 -0.62 0.00 0.00 178.44 178.01 4pbg h TYR 203 N -0.09 0.37 0.03 1.25 3.20 -0.84 -2.25 116.97 118.64 4pbg h TYR 203 Ca 0.07 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.83 4pbg h TYR 203 Cb 0.19 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.35 4pbg h TYR 203 CO -0.20 0.21 -0.49 0.87 -1.64 0.00 0.00 178.16 176.91 4pbg h LYS 204 N 0.38 0.27 0.39 1.82 1.79 -0.13 -3.05 116.57 118.04 4pbg h LYS 204 Ca 0.16 -0.34 -0.00 0.00 -2.18 0.00 0.00 60.65 58.29 4pbg h LYS 204 Cb 0.18 0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.91 4pbg h LYS 204 CO -0.04 1.07 -0.45 -0.44 -1.08 0.00 0.00 179.45 178.51 4pbg h ASP 205 N -0.37 -1.26 0.00 0.86 3.32 -0.64 0.11 116.42 118.43 4pbg h ASP 205 Ca -0.07 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.09 4pbg h ASP 205 Cb 1.27 0.43 0.00 0.00 0.22 0.00 0.00 39.33 41.25 4pbg h ASP 205 CO 0.10 -0.59 0.00 0.29 -1.72 0.00 0.00 179.24 177.31 4pbg n LYS 206 N -5.52 0.34 -3.93 3.56 5.02 -0.87 -4.86 118.16 111.89 4pbg n LYS 206 Ca -0.11 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.88 4pbg n LYS 206 Cb 0.42 -1.06 -0.00 0.00 -0.02 0.00 0.00 35.03 34.37 4pbg n LYS 206 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 4pbg n GLY 207 N 0.02 -0.47 3.83 0.72 0.00 0.02 -4.94 105.19 104.38 4pbg n GLY 207 Ca 0.00 0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 4pbg n GLY 207 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 4pbg s TYR 208 N -4.01 3.26 0.13 1.61 1.51 -1.16 -5.02 117.35 113.68 4pbg s TYR 208 Ca 0.28 1.40 -0.12 0.00 -1.01 0.00 0.00 57.07 57.61 4pbg s TYR 208 Cb -0.15 -2.84 -0.04 0.00 -0.11 0.00 0.00 41.96 38.81 4pbg s TYR 208 CO 0.65 -1.03 1.48 1.57 -1.11 0.00 0.00 175.55 177.11 4pbg h LYS 209 N -0.42 0.86 0.00 -0.62 5.09 -1.92 -3.48 116.57 116.09 4pbg h LYS 209 Ca -0.44 -0.42 0.00 0.00 0.09 0.00 0.00 60.65 59.88 4pbg h LYS 209 Cb 1.20 -0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.53 4pbg h LYS 209 CO 0.58 1.06 0.00 0.41 -2.09 0.00 0.00 179.45 179.42 4pbg n GLY 210 N 0.05 -1.15 3.35 0.07 0.00 -1.26 -5.09 105.19 101.16 4pbg n GLY 210 Ca -0.02 -1.37 -0.31 0.00 0.00 0.00 0.00 46.02 44.32 4pbg n GLY 210 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4pbg s GLU 211 N 0.00 2.13 -0.07 1.61 2.02 0.55 -4.99 118.70 119.95 4pbg s GLU 211 Ca 0.00 -0.92 0.05 0.00 0.02 0.00 0.00 54.97 54.12 4pbg s GLU 211 Cb 0.00 -2.09 -0.01 0.00 0.10 0.00 0.00 34.13 32.13 4pbg s GLU 211 CO 0.00 0.56 -0.23 -1.50 0.02 0.00 0.00 175.26 174.11 4pbg s ILE 212 N -0.67 1.94 0.22 -1.63 1.10 -1.26 0.44 121.20 121.34 4pbg s ILE 212 Ca 0.11 -0.98 -0.03 0.00 -0.51 0.00 0.00 60.65 59.23 4pbg s ILE 212 Cb -0.10 -1.65 0.01 0.00 0.15 0.00 0.00 42.46 40.87 4pbg s ILE 212 CO -0.00 0.54 0.33 0.61 -2.11 0.00 0.00 174.94 174.31 4pbg n GLY 213 N 3.16 2.26 3.45 1.50 0.00 0.13 -0.87 105.19 114.82 4pbg n GLY 213 Ca -0.18 -1.44 -0.28 0.00 0.00 0.00 0.00 46.02 44.12 4pbg n GLY 213 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4pbg s VAL 214 N -2.62 2.57 -0.37 1.61 1.01 -1.23 -2.77 120.40 118.61 4pbg s VAL 214 Ca 0.16 -1.77 -0.00 0.00 0.00 0.00 0.00 61.98 60.36 4pbg s VAL 214 Cb -0.01 -2.20 0.10 0.00 0.00 0.00 0.00 36.38 34.27 4pbg s VAL 214 CO 0.11 -0.00 0.12 -0.69 0.00 0.00 0.00 175.10 174.64 4pbg s VAL 215 N -1.37 2.89 -0.01 2.92 1.01 -1.20 -0.11 120.40 124.53 4pbg s VAL 215 Ca 0.19 -2.05 0.01 0.00 0.00 0.00 0.00 61.98 60.13 4pbg s VAL 215 Cb -0.09 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 4pbg s VAL 215 CO 0.10 -0.56 0.02 -1.00 0.00 0.00 0.00 175.10 173.65 4pbg s HIS 216 N 1.08 3.13 -0.20 5.22 3.76 0.20 -0.32 115.29 128.16 4pbg s HIS 216 Ca 0.07 0.12 -0.19 0.00 -0.15 0.00 0.00 55.06 54.91 4pbg s HIS 216 Cb -0.21 -1.70 -0.03 0.00 1.11 0.00 0.00 32.58 31.75 4pbg s HIS 216 CO -0.05 0.48 0.52 0.00 -0.85 0.00 0.00 174.74 174.84 4pbg s ALA 217 N -1.08 3.54 -0.51 -1.40 0.00 -1.26 -0.10 121.76 120.94 4pbg s ALA 217 Ca 0.19 -0.38 0.07 0.00 0.00 0.00 0.00 51.96 51.84 4pbg s ALA 217 Cb -0.12 -2.82 0.24 0.00 0.00 0.00 0.00 23.12 20.42 4pbg s ALA 217 CO 0.10 -0.43 0.59 1.28 0.00 0.00 0.00 175.76 177.30 4pbg n LEU 218 N 4.76 1.71 -4.70 0.00 4.77 -0.93 -4.82 117.00 117.78 4pbg n LEU 218 Ca -0.05 -4.99 -0.42 0.00 -0.03 0.00 0.00 56.01 50.52 4pbg n LEU 218 Cb 0.50 0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 4pbg n LEU 218 CO 0.42 2.02 1.06 -2.16 -1.33 0.00 0.00 177.39 177.40 4pbg s PRO 219 N -1.58 4.32 0.27 3.23 0.04 -1.26 -4.89 135.00 135.13 4pbg s PRO 219 Ca 0.36 1.92 -0.29 0.00 0.04 0.00 0.00 61.00 63.02 4pbg s PRO 219 Cb 0.13 -3.49 -0.10 0.00 0.04 0.00 0.00 34.50 31.09 4pbg s PRO 219 CO -0.09 -0.49 1.37 0.99 0.04 0.00 0.00 177.00 178.83 4pbg s THR 220 N 1.98 2.74 -0.18 1.26 2.01 -1.25 -4.85 115.64 117.34 4pbg s THR 220 Ca 0.62 0.66 -0.02 0.00 0.31 0.00 0.00 61.69 63.27 4pbg s THR 220 Cb -0.31 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 4pbg s THR 220 CO 0.27 0.13 -0.10 -0.54 -0.69 0.00 0.00 174.62 173.68 4pbg s LYS 221 N -0.89 3.32 0.09 4.92 -0.14 -1.26 -0.45 119.74 125.33 4pbg s LYS 221 Ca 0.55 -0.68 0.10 0.00 -1.36 0.00 0.00 55.97 54.58 4pbg s LYS 221 Cb -0.40 -2.80 -0.04 0.00 -1.68 0.00 0.00 37.83 32.91 4pbg s LYS 221 CO 0.47 -0.06 -0.25 0.71 -0.76 0.00 0.00 175.35 175.46 4pbg s TYR 222 N 1.05 2.37 0.33 3.18 2.02 0.99 -4.91 117.35 122.38 4pbg s TYR 222 Ca -0.00 -0.36 -0.26 0.00 -0.37 0.00 0.00 57.07 56.07 4pbg s TYR 222 Cb -0.15 -1.33 -0.10 0.00 -0.40 0.00 0.00 41.96 39.99 4pbg s TYR 222 CO -0.02 0.27 0.95 -1.25 -1.57 0.00 0.00 175.55 173.93 4pbg s PRO 223 N -1.74 4.56 0.10 -1.71 0.04 -1.26 -0.33 135.00 134.66 4pbg s PRO 223 Ca 0.14 1.34 -0.22 0.00 0.04 0.00 0.00 61.00 62.30 4pbg s PRO 223 Cb -0.10 -2.79 -0.11 0.00 0.04 0.00 0.00 34.50 31.54 4pbg s PRO 223 CO 0.05 0.26 1.73 -0.92 0.04 0.00 0.00 177.00 178.16 4pbg h TYR 224 N 3.14 -0.04 -3.65 0.56 3.20 -1.21 -3.36 116.97 115.61 4pbg h TYR 224 Ca -0.47 0.01 -0.66 0.00 3.14 0.00 0.00 58.73 60.75 4pbg h TYR 224 Cb 1.19 0.03 -0.40 0.00 1.54 0.00 0.00 36.73 39.09 4pbg h TYR 224 CO 0.61 -0.03 -0.71 0.34 -1.64 0.00 0.00 178.16 176.73 4pbg s ASP 225 N -5.19 4.72 0.48 -2.11 2.15 -1.26 -4.97 116.67 110.49 4pbg s ASP 225 Ca -0.13 -2.23 0.33 0.00 0.43 0.00 0.00 52.55 50.95 4pbg s ASP 225 Cb 0.07 -1.62 1.45 0.00 -0.30 0.00 0.00 42.92 42.52 4pbg s ASP 225 CO 0.67 -0.37 1.70 1.55 -0.17 0.00 0.00 175.17 178.55 4pbg h PRO 226 N 7.52 0.11 0.00 4.34 0.13 -1.98 0.34 132.00 142.45 4pbg h PRO 226 Ca -0.04 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 4pbg h PRO 226 Cb 1.01 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 4pbg h PRO 226 CO 0.53 0.07 -0.28 0.93 -0.23 0.00 0.00 178.00 179.02 4pbg h GLU 227 N 0.11 0.00 -5.71 0.86 5.08 -1.95 -3.42 114.58 109.55 4pbg h GLU 227 Ca 0.72 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 58.46 4pbg h GLU 227 Cb 2.46 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 31.59 4pbg h GLU 227 CO -0.20 0.28 0.31 1.21 -1.00 0.00 0.00 179.01 179.62 4pbg s ASN 228 N -6.29 6.50 0.57 1.42 3.84 0.12 -4.91 114.94 116.19 4pbg s ASN 228 Ca 0.01 0.24 0.25 0.00 0.21 0.00 0.00 52.86 53.57 4pbg s ASN 228 Cb 0.10 -2.38 1.64 0.00 -0.55 0.00 0.00 41.25 40.07 4pbg s ASN 228 CO 0.66 -0.72 2.22 -0.65 -2.79 0.00 0.00 177.10 175.82 4pbg h PRO 229 N 8.54 0.00 -0.20 0.43 0.11 -1.83 -0.13 132.00 138.92 4pbg h PRO 229 Ca -0.25 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.77 4pbg h PRO 229 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 4pbg h PRO 229 CO 0.90 0.00 -0.28 0.00 -0.21 0.00 0.00 178.00 178.41 4pbg h ALA 230 N 2.00 1.16 0.01 -0.75 0.00 -1.92 -1.22 119.26 118.53 4pbg h ALA 230 Ca 0.00 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 4pbg h ALA 230 Cb 0.01 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.70 4pbg h ALA 230 CO -0.00 0.54 -0.64 -0.44 0.00 0.00 0.00 179.25 178.71 4pbg h ASP 231 N 0.33 0.55 0.18 0.00 3.32 -1.33 -2.85 116.42 116.63 4pbg h ASP 231 Ca 0.05 -0.77 0.01 0.00 0.02 0.00 0.00 57.03 56.34 4pbg h ASP 231 Cb 0.67 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 40.02 4pbg h ASP 231 CO 0.05 1.25 -0.39 0.58 -1.72 0.00 0.00 179.24 179.01 4pbg h VAL 232 N -0.10 0.21 -0.85 -1.35 2.07 -1.24 -1.02 116.25 113.97 4pbg h VAL 232 Ca -0.08 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.61 4pbg h VAL 232 Cb 1.36 0.21 -0.11 0.00 -1.52 0.00 0.00 31.29 31.23 4pbg h VAL 232 CO 0.13 0.00 0.40 -0.09 0.02 0.00 0.00 177.57 178.03 4pbg h ARG 233 N -0.66 0.50 -0.25 1.57 1.12 -1.32 -0.42 114.38 114.93 4pbg h ARG 233 Ca 0.01 -0.03 -0.00 0.00 -1.11 0.00 0.00 59.98 58.85 4pbg h ARG 233 Cb 0.66 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 30.50 4pbg h ARG 233 CO -0.19 0.33 0.15 0.00 -3.11 0.00 0.00 179.97 177.15 4pbg h ALA 234 N 1.61 0.32 -0.65 2.80 0.00 -1.08 -0.59 119.26 121.67 4pbg h ALA 234 Ca 0.49 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.26 4pbg h ALA 234 Cb 0.80 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 4pbg h ALA 234 CO -0.43 -0.16 0.07 0.00 0.00 0.00 0.00 179.25 178.74 4pbg h ALA 235 N 1.03 0.91 -0.32 0.00 0.00 -0.23 -1.32 119.26 119.33 4pbg h ALA 235 Ca 0.09 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.74 4pbg h ALA 235 Cb 0.04 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 4pbg h ALA 235 CO -0.02 0.67 0.16 1.49 0.00 0.00 0.00 179.25 181.55 4pbg h GLU 236 N 1.01 0.33 -0.39 0.00 4.81 -0.75 0.27 114.58 119.85 4pbg h GLU 236 Ca 0.19 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.28 4pbg h GLU 236 Cb 0.47 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 4pbg h GLU 236 CO 0.02 0.22 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.18 4pbg h LEU 237 N 0.34 0.84 -0.37 1.64 3.38 -0.95 -1.06 115.31 119.12 4pbg h LEU 237 Ca 0.13 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 4pbg h LEU 237 Cb 0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 4pbg h LEU 237 CO -0.09 1.06 0.18 -0.08 0.09 0.00 0.00 178.44 179.60 4pbg h GLU 238 N 0.70 0.53 -0.79 1.13 4.57 -0.83 -1.65 114.58 118.25 4pbg h GLU 238 Ca 0.09 -0.08 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 4pbg h GLU 238 Cb 0.79 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.25 4pbg h GLU 238 CO 0.07 0.48 0.40 0.22 -1.18 0.00 0.00 179.01 179.00 4pbg h ASP 239 N 0.46 1.00 -0.93 1.04 3.58 -0.38 -2.09 116.42 119.10 4pbg h ASP 239 Ca 0.13 -0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 4pbg h ASP 239 Cb 0.12 -0.26 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 4pbg h ASP 239 CO -0.02 0.83 0.54 0.40 -2.88 0.00 0.00 179.24 178.11 4pbg h ILE 240 N 1.11 1.26 -0.47 2.25 2.04 -0.61 0.95 117.51 124.05 4pbg h ILE 240 Ca 0.27 -0.60 -0.11 0.00 1.00 0.00 0.00 64.86 65.42 4pbg h ILE 240 Cb 0.07 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.10 4pbg h ILE 240 CO -0.04 0.28 -0.13 0.40 0.00 0.00 0.00 178.15 178.66 4pbg h ILE 241 N 1.30 1.27 0.00 -0.67 2.04 -0.75 -2.88 117.51 117.82 4pbg h ILE 241 Ca 0.33 -1.27 -0.34 0.00 1.00 0.00 0.00 64.86 64.59 4pbg h ILE 241 Cb -0.02 1.11 -0.06 0.00 -0.74 0.00 0.00 36.82 37.11 4pbg h ILE 241 CO -0.06 0.44 -2.08 1.41 0.00 0.00 0.00 178.15 177.85 4pbg n HIS 242 N -4.22 0.47 0.00 1.37 8.25 -0.84 -4.86 115.22 115.39 4pbg n HIS 242 Ca -0.00 0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 4pbg n HIS 242 Cb 0.40 -1.09 0.00 0.00 1.12 0.00 0.00 29.99 30.43 4pbg n HIS 242 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 4pbg n ASN 243 N -2.91 0.00 -0.29 0.41 3.02 0.32 -4.74 115.26 111.08 4pbg n ASN 243 Ca -0.26 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.34 4pbg n ASN 243 Cb 1.11 0.00 0.14 0.00 -0.61 0.00 0.00 39.78 40.42 4pbg n ASN 243 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 4pbg h LYS 244 N 0.00 0.03 -0.14 3.52 1.79 -1.51 -1.85 116.57 118.41 4pbg h LYS 244 Ca 0.00 -0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.50 4pbg h LYS 244 Cb 0.00 -0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 30.58 4pbg h LYS 244 CO 0.00 0.02 -0.54 0.35 -1.08 0.00 0.00 179.45 178.20 4pbg h PHE 245 N 0.03 -1.60 0.74 -1.35 3.57 -1.77 0.14 116.94 116.71 4pbg h PHE 245 Ca 0.43 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.95 4pbg h PHE 245 Cb 0.72 0.72 0.01 0.00 2.79 0.00 0.00 35.95 40.19 4pbg h PHE 245 CO -0.56 -0.54 -0.36 0.82 -2.23 0.00 0.00 178.31 175.44 4pbg h ILE 246 N -0.57 0.27 -0.60 1.41 2.04 -1.75 -2.79 117.51 115.52 4pbg h ILE 246 Ca 0.04 -0.01 0.11 0.00 1.00 0.00 0.00 64.86 65.99 4pbg h ILE 246 Cb 0.68 0.27 -0.12 0.00 -0.74 0.00 0.00 36.82 36.92 4pbg h ILE 246 CO -0.44 0.00 -0.34 -0.07 0.00 0.00 0.00 178.15 177.30 4pbg h LEU 247 N -1.00 -1.18 -0.80 1.44 3.38 -1.24 -0.66 115.31 115.25 4pbg h LEU 247 Ca -0.10 0.23 0.17 0.00 0.09 0.00 0.00 57.88 58.27 4pbg h LEU 247 Cb 0.76 0.58 -0.11 0.00 0.09 0.00 0.00 40.66 41.99 4pbg h LEU 247 CO 0.17 -0.30 0.30 0.44 0.09 0.00 0.00 178.44 179.13 4pbg h ASP 248 N -0.16 0.23 -0.19 -0.43 5.19 -0.63 0.28 116.42 120.71 4pbg h ASP 248 Ca 0.23 0.13 -0.08 0.00 -0.62 0.00 0.00 57.03 56.70 4pbg h ASP 248 Cb 0.55 0.13 -0.02 0.00 0.18 0.00 0.00 39.33 40.18 4pbg h ASP 248 CO -0.69 0.04 -0.14 0.00 -3.12 0.00 0.00 179.24 175.33 4pbg h ALA 249 N 1.62 1.14 0.00 3.45 0.00 -0.89 0.33 119.26 124.91 4pbg h ALA 249 Ca 0.46 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.08 4pbg h ALA 249 Cb 0.79 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.43 4pbg h ALA 249 CO -0.47 0.54 0.00 1.15 0.00 0.00 0.00 179.25 180.47 4pbg h THR 250 N 0.53 0.00 0.00 0.00 2.02 0.70 -3.21 112.91 112.96 4pbg h THR 250 Ca 0.09 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.01 4pbg h THR 250 Cb 0.55 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 4pbg h THR 250 CO 0.04 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.71 4pbg n TYR 251 N -2.32 0.00 0.51 3.16 4.01 -0.79 -4.69 117.16 117.04 4pbg n TYR 251 Ca 0.02 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.89 4pbg n TYR 251 Cb 0.24 0.00 0.33 0.00 -0.31 0.00 0.00 39.34 39.60 4pbg n TYR 251 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 4pbg h LEU 252 N 0.00 0.00 0.00 7.72 3.38 -0.55 -3.44 115.31 122.42 4pbg h LEU 252 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 4pbg h LEU 252 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 4pbg h LEU 252 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 4pbg n GLY 253 N 1.25 1.41 3.70 0.83 0.00 -0.99 -4.90 105.19 106.48 4pbg n GLY 253 Ca 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.99 4pbg n GLY 253 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 4pbg s HIS 254 N -3.07 -0.16 -0.20 1.61 0.00 -1.25 -3.82 115.29 108.40 4pbg s HIS 254 Ca 0.00 -0.23 -0.21 0.00 -3.00 0.00 0.00 55.06 51.63 4pbg s HIS 254 Cb 0.00 0.57 -0.03 0.00 -4.00 0.00 0.00 32.58 29.12 4pbg s HIS 254 CO 0.00 -1.09 0.62 0.71 -1.00 0.00 0.00 174.74 173.98 4pbg s TYR 255 N -3.90 3.37 1.04 0.38 2.02 -1.26 -4.21 117.35 114.78 4pbg s TYR 255 Ca 0.11 0.90 -0.11 0.00 -0.37 0.00 0.00 57.07 57.60 4pbg s TYR 255 Cb -0.04 -2.79 0.21 0.00 -0.40 0.00 0.00 41.96 38.95 4pbg s TYR 255 CO 0.02 -0.18 1.09 -1.54 -1.57 0.00 0.00 175.55 173.38 4pbg s SER 256 N 1.21 1.93 0.21 2.29 1.04 -1.26 -4.65 113.70 114.47 4pbg s SER 256 Ca 0.28 1.90 -0.10 0.00 0.48 0.00 0.00 55.95 58.51 4pbg s SER 256 Cb -0.16 -2.46 0.15 0.00 0.10 0.00 0.00 66.02 63.65 4pbg s SER 256 CO 0.10 -3.67 1.86 0.44 0.98 0.00 0.00 173.24 172.95 4pbg h ASP 257 N -2.26 0.87 -0.62 7.02 3.32 -1.99 0.86 116.42 123.63 4pbg h ASP 257 Ca -0.52 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 56.43 4pbg h ASP 257 Cb 1.30 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 4pbg h ASP 257 CO 0.45 0.66 0.17 0.11 -1.72 0.00 0.00 179.24 178.91 4pbg h LYS 258 N 1.01 0.98 0.00 3.56 1.57 -1.98 0.48 116.57 122.18 4pbg h LYS 258 Ca 0.27 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 4pbg h LYS 258 Cb -0.07 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.10 4pbg h LYS 258 CO -0.05 0.88 -0.00 1.15 -0.57 0.00 0.00 179.45 180.85 4pbg h THR 259 N 0.90 1.00 -0.17 -0.16 2.02 -1.66 -0.15 112.91 114.68 4pbg h THR 259 Ca 0.20 -0.01 -0.11 0.00 0.77 0.00 0.00 66.41 67.25 4pbg h THR 259 Cb 0.32 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 4pbg h THR 259 CO -0.00 0.00 -0.39 0.24 0.37 0.00 0.00 175.52 175.74 4pbg h MET 260 N -0.01 0.38 -0.54 6.66 2.86 -0.71 -0.74 114.93 122.82 4pbg h MET 260 Ca -0.00 -0.18 -0.04 0.00 -2.06 0.00 0.00 59.70 57.42 4pbg h MET 260 Cb 0.01 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 4pbg h MET 260 CO 0.00 0.71 0.19 1.49 1.06 0.00 0.00 176.91 180.36 4pbg h GLU 261 N 0.32 0.83 -0.24 1.72 4.22 -0.56 0.98 114.58 121.85 4pbg h GLU 261 Ca 0.03 -0.17 -0.04 0.00 0.08 0.00 0.00 59.36 59.26 4pbg h GLU 261 Cb 0.83 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 4pbg h GLU 261 CO 0.07 0.75 -0.00 0.78 -2.18 0.00 0.00 179.01 178.42 4pbg h GLY 262 N 0.74 0.47 1.27 1.92 0.00 -0.82 -2.00 103.07 104.65 4pbg h GLY 262 Ca 0.18 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 4pbg h GLY 262 CO -0.01 0.32 0.42 -2.08 0.00 0.00 0.00 176.54 175.19 4pbg h VAL 263 N 0.20 1.20 -0.45 4.60 2.07 -0.90 0.11 116.25 123.09 4pbg h VAL 263 Ca 0.07 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 4pbg h VAL 263 Cb 0.41 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 4pbg h VAL 263 CO 0.01 0.21 0.27 0.78 0.02 0.00 0.00 177.57 178.87 4pbg h ASN 264 N 0.98 0.54 0.80 0.57 -0.26 -0.67 -0.32 115.58 117.22 4pbg h ASN 264 Ca 0.25 -0.05 -0.04 0.00 -0.56 0.00 0.00 56.30 55.90 4pbg h ASN 264 Cb -0.03 -0.14 0.01 0.00 -1.06 0.00 0.00 38.32 37.10 4pbg h ASN 264 CO -0.05 0.43 -0.38 -0.74 -1.06 0.00 0.00 177.43 175.63 4pbg h HIS 265 N 0.60 -1.00 -0.62 1.19 2.76 -0.53 -0.36 115.15 117.20 4pbg h HIS 265 Ca 0.16 -0.02 0.11 0.00 -2.20 0.00 0.00 60.37 58.42 4pbg h HIS 265 Cb -0.01 0.33 -0.08 0.00 1.55 0.00 0.00 27.41 29.20 4pbg h HIS 265 CO -0.03 -0.61 0.18 0.82 -1.30 0.00 0.00 177.93 176.99 4pbg h ILE 266 N -1.17 0.68 -0.18 6.26 2.04 -0.74 -0.85 117.51 123.55 4pbg h ILE 266 Ca -0.11 -0.11 -0.12 0.00 1.00 0.00 0.00 64.86 65.52 4pbg h ILE 266 Cb 0.84 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 4pbg h ILE 266 CO 0.18 0.06 -0.41 -0.07 0.00 0.00 0.00 178.15 177.91 4pbg h LEU 267 N 0.33 0.44 -0.21 1.44 3.38 -1.00 -2.47 115.31 117.22 4pbg h LEU 267 Ca 0.32 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 4pbg h LEU 267 Cb 0.46 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 4pbg h LEU 267 CO -0.37 0.80 0.11 0.00 0.09 0.00 0.00 178.44 179.07 4pbg h ALA 268 N 1.22 0.27 -0.25 1.53 0.00 0.34 1.12 119.26 123.49 4pbg h ALA 268 Ca 0.03 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 4pbg h ALA 268 Cb 0.87 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 4pbg h ALA 268 CO 0.07 -0.19 -0.25 0.93 0.00 0.00 0.00 179.25 179.81 4pbg h GLU 269 N 0.22 0.49 -0.01 0.00 4.39 -1.31 -3.25 114.58 115.11 4pbg h GLU 269 Ca 0.07 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.59 4pbg h GLU 269 Cb 0.09 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 4pbg h GLU 269 CO -0.01 0.70 -0.16 0.09 -1.16 0.00 0.00 179.01 178.47 4pbg n ASN 270 N -4.12 1.78 -0.03 1.42 3.02 -0.94 -4.99 115.26 111.40 4pbg n ASN 270 Ca -0.00 -1.39 0.00 0.00 -0.03 0.00 0.00 54.58 53.16 4pbg n ASN 270 Cb 0.41 0.26 -0.00 0.00 -0.61 0.00 0.00 39.78 39.84 4pbg n ASN 270 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 4pbg n GLY 271 N 0.94 -2.23 0.00 7.41 0.00 0.39 -4.97 105.19 106.72 4pbg n GLY 271 Ca 0.07 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.62 4pbg n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4pbg n GLY 272 N -2.33 3.47 3.05 -0.02 0.00 -1.25 -4.63 105.19 103.48 4pbg n GLY 272 Ca -0.00 -1.87 -0.11 0.00 0.00 0.00 0.00 46.02 44.05 4pbg n GLY 272 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4pbg s GLU 273 N -2.85 0.37 -0.07 1.61 0.41 -1.26 -4.87 118.70 112.03 4pbg s GLU 273 Ca 0.00 -0.34 0.05 0.00 -0.41 0.00 0.00 54.97 54.27 4pbg s GLU 273 Cb 0.00 0.15 -0.01 0.00 -1.78 0.00 0.00 34.13 32.49 4pbg s GLU 273 CO 0.00 -0.08 -0.23 -0.51 -0.49 0.00 0.00 175.26 173.95 4pbg s LEU 274 N -1.12 2.17 -0.80 1.80 1.43 -1.26 -4.88 118.68 116.02 4pbg s LEU 274 Ca -0.12 -0.49 -0.16 0.00 -1.03 0.00 0.00 54.13 52.33 4pbg s LEU 274 Cb -0.07 -1.41 0.18 0.00 0.03 0.00 0.00 46.19 44.92 4pbg s LEU 274 CO 0.01 0.22 0.80 -0.62 0.23 0.00 0.00 176.35 176.99 4pbg s ASP 275 N -0.02 6.62 -0.39 2.29 2.15 -1.26 -5.01 116.67 121.06 4pbg s ASP 275 Ca -0.08 -2.35 -0.05 0.00 0.43 0.00 0.00 52.55 50.50 4pbg s ASP 275 Cb -0.15 -2.26 0.09 0.00 -0.30 0.00 0.00 42.92 40.30 4pbg s ASP 275 CO 0.05 -0.75 0.18 -0.76 -0.17 0.00 0.00 175.17 173.73 4pbg s LEU 276 N 1.04 4.94 0.36 -1.34 1.43 -1.26 -5.04 118.68 118.80 4pbg s LEU 276 Ca 0.19 -1.68 -0.22 0.00 -1.03 0.00 0.00 54.13 51.39 4pbg s LEU 276 Cb -0.13 -1.86 -0.10 0.00 0.03 0.00 0.00 46.19 44.13 4pbg s LEU 276 CO -0.06 -0.48 0.90 -0.13 0.23 0.00 0.00 176.35 176.81 4pbg s ARG 277 N 1.27 4.34 0.41 1.70 3.00 -1.26 -4.97 118.95 123.44 4pbg s ARG 277 Ca 0.03 1.13 0.12 0.00 0.00 0.00 0.00 55.73 57.01 4pbg s ARG 277 Cb -0.22 -2.51 0.85 0.00 0.00 0.00 0.00 34.95 33.07 4pbg s ARG 277 CO -0.01 0.15 1.93 0.22 0.00 0.00 0.00 175.30 177.59 4pbg h ASP 278 N 2.56 0.12 -0.10 0.23 1.82 -2.01 -1.42 116.42 117.63 4pbg h ASP 278 Ca -0.48 -0.02 -0.03 0.00 -0.39 0.00 0.00 57.03 56.10 4pbg h ASP 278 Cb 1.18 -0.03 -0.01 0.00 0.68 0.00 0.00 39.33 41.15 4pbg h ASP 278 CO 0.63 0.31 -0.02 1.05 -1.61 0.00 0.00 179.24 179.60 4pbg h GLU 279 N 0.12 0.30 -0.84 0.28 9.09 -2.00 -2.19 114.58 119.34 4pbg h GLU 279 Ca 0.02 -0.05 -0.01 0.00 0.05 0.00 0.00 59.36 59.37 4pbg h GLU 279 Cb 0.39 -0.05 -0.04 0.00 -1.65 0.00 0.00 28.75 27.40 4pbg h GLU 279 CO 0.03 0.35 0.48 -0.44 0.05 0.00 0.00 179.01 179.48 4pbg h ASP 280 N 0.30 1.03 1.30 3.06 3.32 -1.65 -0.39 116.42 123.39 4pbg h ASP 280 Ca 0.07 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.04 4pbg h ASP 280 Cb 0.24 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.52 4pbg h ASP 280 CO 0.01 0.81 0.00 -0.26 -1.72 0.00 0.00 179.24 178.08 4pbg h PHE 281 N 1.17 0.00 -0.09 4.55 0.04 -1.43 -0.68 116.94 120.51 4pbg h PHE 281 Ca 0.30 0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.86 4pbg h PHE 281 Cb -0.01 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.15 4pbg h PHE 281 CO 0.01 0.00 -0.75 1.96 -0.60 0.00 0.00 178.31 178.93 4pbg h GLN 282 N 0.00 0.66 0.05 1.51 4.20 -0.82 -0.40 115.11 120.31 4pbg h GLN 282 Ca 0.00 -0.60 -0.00 0.00 0.06 0.00 0.00 58.65 58.11 4pbg h GLN 282 Cb 0.65 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.57 4pbg h GLN 282 CO 0.00 1.21 -0.02 0.00 -0.67 0.00 0.00 178.83 179.34 4pbg h ALA 283 N 0.47 -0.07 -0.62 3.87 0.00 -1.02 -1.96 119.26 119.93 4pbg h ALA 283 Ca -0.07 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.74 4pbg h ALA 283 Cb 1.40 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 4pbg h ALA 283 CO 0.15 -0.41 0.37 -0.07 0.00 0.00 0.00 179.25 179.29 4pbg h LEU 284 N -0.33 0.58 -0.81 0.00 3.38 -1.16 -2.41 115.31 114.56 4pbg h LEU 284 Ca -0.01 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 4pbg h LEU 284 Cb 0.29 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 4pbg h LEU 284 CO 0.01 0.40 -0.36 -0.78 0.09 0.00 0.00 178.44 177.80 4pbg h ASP 285 N 0.71 0.48 -0.30 -0.43 3.58 -1.04 -2.27 116.42 117.16 4pbg h ASP 285 Ca 0.26 -0.20 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 4pbg h ASP 285 Cb 0.07 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 4pbg h ASP 285 CO -0.13 0.80 0.12 0.00 -2.88 0.00 0.00 179.24 177.16 4pbg h ALA 286 N 1.22 0.39 -0.01 -0.78 0.00 -0.95 -3.07 119.26 116.06 4pbg h ALA 286 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 4pbg h ALA 286 Cb 0.81 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.48 4pbg h ALA 286 CO 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 179.25 179.29 4pbg n ALA 287 N -2.27 2.64 -0.29 0.00 0.00 -0.94 -4.43 120.51 115.20 4pbg n ALA 287 Ca -0.02 -0.40 0.08 0.00 0.00 0.00 0.00 53.44 53.10 4pbg n ALA 287 Cb 0.14 -1.23 0.30 0.00 0.00 0.00 0.00 19.45 18.66 4pbg n ALA 287 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 4pbg h LYS 288 N 1.83 0.84 -0.32 0.00 2.10 -1.31 -2.11 116.57 117.61 4pbg h LYS 288 Ca 0.00 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 4pbg h LYS 288 Cb 0.42 -0.19 0.00 0.00 -0.90 0.00 0.00 32.23 31.56 4pbg h LYS 288 CO 0.00 0.56 0.00 -0.25 -2.00 0.00 0.00 179.45 177.76 4pbg n ASP 289 N -4.55 3.08 0.07 7.07 9.92 -1.26 -4.49 116.55 126.40 4pbg n ASP 289 Ca 0.16 -1.90 -0.17 0.00 -0.53 0.00 0.00 54.79 52.35 4pbg n ASP 289 Cb 0.34 -0.20 -0.09 0.00 -0.64 0.00 0.00 41.12 40.53 4pbg n ASP 289 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 4pbg h LEU 290 N 3.53 0.70 -9.26 0.64 3.38 -1.63 -3.47 115.31 109.21 4pbg h LEU 290 Ca 0.00 -0.60 -0.68 0.00 0.09 0.00 0.00 57.88 56.69 4pbg h LEU 290 Cb 0.84 -0.22 0.06 0.00 0.09 0.00 0.00 40.66 41.43 4pbg h LEU 290 CO 0.00 1.41 0.40 0.59 0.09 0.00 0.00 178.44 180.93 4pbg n ASN 291 N -3.76 1.48 0.06 -0.43 3.02 -1.25 -4.91 115.26 109.46 4pbg n ASN 291 Ca -0.10 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.58 4pbg n ASN 291 Cb 0.90 -1.17 -0.06 0.00 -0.61 0.00 0.00 39.78 38.84 4pbg n ASN 291 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 4pbg h ASP 292 N 4.32 0.00 -5.06 6.41 3.32 -1.34 -3.47 116.42 120.60 4pbg h ASP 292 Ca -0.47 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 4pbg h ASP 292 Cb 1.34 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.80 4pbg h ASP 292 CO 0.76 0.57 0.09 0.72 -1.72 0.00 0.00 179.24 179.66 4pbg s PHE 293 N -2.93 -0.18 -0.06 4.55 -0.12 -1.26 -4.12 117.98 113.86 4pbg s PHE 293 Ca -0.01 -0.16 0.06 0.00 -0.05 0.00 0.00 56.93 56.76 4pbg s PHE 293 Cb 0.08 0.47 -0.01 0.00 -0.63 0.00 0.00 43.02 42.94 4pbg s PHE 293 CO 0.80 -0.97 -0.24 -1.17 -0.05 0.00 0.00 175.22 173.58 4pbg s LEU 294 N -2.87 2.06 -0.26 -1.99 0.20 0.70 -3.53 118.68 112.98 4pbg s LEU 294 Ca 0.09 -0.51 -0.06 0.00 0.69 0.00 0.00 54.13 54.34 4pbg s LEU 294 Cb -0.02 -1.35 -0.00 0.00 -0.43 0.00 0.00 46.19 44.39 4pbg s LEU 294 CO -0.02 0.23 0.04 -0.83 -0.29 0.00 0.00 176.35 175.48 4pbg s GLY 295 N -0.09 1.73 -0.37 7.98 0.00 0.84 -0.69 107.32 116.72 4pbg s GLY 295 Ca -0.05 -1.32 -0.11 0.00 0.00 0.00 0.00 44.72 43.24 4pbg s GLY 295 CO 0.04 0.56 0.20 -0.42 0.00 0.00 0.00 173.10 173.48 4pbg s ILE 296 N 1.51 4.57 -0.25 0.90 1.01 0.37 0.62 121.20 129.93 4pbg s ILE 296 Ca 0.04 -0.80 -0.20 0.00 0.00 0.00 0.00 60.65 59.68 4pbg s ILE 296 Cb -0.16 -3.53 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 4pbg s ILE 296 CO 0.01 -0.20 0.63 0.20 0.00 0.00 0.00 174.94 175.58 4pbg s ASN 297 N 1.56 6.59 -0.04 3.58 -0.87 0.85 -3.24 114.94 123.37 4pbg s ASN 297 Ca 0.02 0.72 0.00 0.00 -1.57 0.00 0.00 52.86 52.04 4pbg s ASN 297 Cb -0.19 -2.34 0.03 0.00 -0.02 0.00 0.00 41.25 38.73 4pbg s ASN 297 CO 0.07 -0.36 -0.01 -0.47 -2.57 0.00 0.00 177.10 173.76 4pbg s TYR 298 N 2.45 0.42 -0.01 2.20 6.14 -0.60 -2.20 117.35 125.75 4pbg s TYR 298 Ca 0.26 -0.05 0.00 0.00 0.64 0.00 0.00 57.07 57.93 4pbg s TYR 298 Cb -0.16 -0.49 -0.01 0.00 0.42 0.00 0.00 41.96 41.73 4pbg s TYR 298 CO 0.09 -0.16 -0.01 0.66 0.64 0.00 0.00 175.55 176.77 4pbg n TYR 299 N 4.21 0.00 -3.93 4.97 4.02 -1.26 -4.41 117.16 120.76 4pbg n TYR 299 Ca -0.24 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.56 4pbg n TYR 299 Cb 0.50 -0.05 -0.03 0.00 -0.02 0.00 0.00 39.34 39.75 4pbg n TYR 299 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 4pbg s MET 300 N -2.02 1.80 0.47 -0.72 0.23 -1.26 -4.73 119.30 113.06 4pbg s MET 300 Ca -0.02 -1.26 0.07 0.00 -1.03 0.00 0.00 55.69 53.45 4pbg s MET 300 Cb 0.00 0.54 0.00 0.00 -1.53 0.00 0.00 34.83 33.85 4pbg s MET 300 CO 0.03 -0.79 0.36 -1.12 -2.03 0.00 0.00 175.02 171.47 4pbg s SER 301 N -3.02 4.75 -0.01 -1.18 0.01 -1.26 -3.97 113.70 109.01 4pbg s SER 301 Ca 0.18 -1.03 0.01 0.00 1.31 0.00 0.00 55.95 56.42 4pbg s SER 301 Cb -0.03 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 66.09 4pbg s SER 301 CO 0.10 -0.84 -0.01 -1.81 0.41 0.00 0.00 173.24 171.09 4pbg s ASP 302 N -4.16 0.28 -0.05 2.44 1.01 0.41 -4.75 116.67 111.85 4pbg s ASP 302 Ca 0.41 -0.03 -0.02 0.00 0.71 0.00 0.00 52.55 53.62 4pbg s ASP 302 Cb -0.01 -0.07 -0.04 0.00 1.01 0.00 0.00 42.92 43.81 4pbg s ASP 302 CO 0.24 -0.01 0.05 0.26 0.21 0.00 0.00 175.17 175.93 4pbg s TRP 303 N 0.25 3.26 -0.05 4.23 0.51 -1.26 -0.01 118.94 125.88 4pbg s TRP 303 Ca -0.02 0.23 0.04 0.00 -2.12 0.00 0.00 56.10 54.23 4pbg s TRP 303 Cb -0.04 -1.77 -0.00 0.00 -0.81 0.00 0.00 33.47 30.84 4pbg s TRP 303 CO -0.01 0.54 -0.18 -1.64 -0.51 0.00 0.00 176.95 175.15 4pbg s MET 304 N -1.35 1.97 0.07 4.98 -1.94 0.55 -2.98 119.30 120.60 4pbg s MET 304 Ca 0.18 -0.66 0.09 0.00 -1.71 0.00 0.00 55.69 53.60 4pbg s MET 304 Cb -0.12 -1.68 -0.03 0.00 2.01 0.00 0.00 34.83 35.01 4pbg s MET 304 CO 0.08 0.25 -0.25 -1.14 -0.01 0.00 0.00 175.02 173.95 4pbg s GLN 305 N 0.07 1.73 0.64 2.03 0.74 -0.03 -0.74 119.66 124.10 4pbg s GLN 305 Ca -0.05 -1.16 -0.18 0.00 0.05 0.00 0.00 55.36 54.02 4pbg s GLN 305 Cb -0.13 -1.99 -0.01 0.00 1.10 0.00 0.00 33.01 31.98 4pbg s GLN 305 CO 0.03 0.50 1.24 0.00 -0.55 0.00 0.00 175.29 176.50 4pbg s ALA 306 N -0.90 2.39 -0.21 1.58 0.00 -1.26 -1.01 121.76 122.35 4pbg s ALA 306 Ca 0.13 1.05 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 4pbg s ALA 306 Cb -0.10 -3.49 0.07 0.00 0.00 0.00 0.00 23.12 19.60 4pbg s ALA 306 CO 0.04 -1.48 0.50 0.12 0.00 0.00 0.00 175.76 174.94 4pbg s PHE 307 N -1.62 -0.77 -1.67 0.00 5.36 -1.26 -4.62 117.98 113.40 4pbg s PHE 307 Ca 0.78 1.58 0.18 0.00 -0.96 0.00 0.00 56.93 58.51 4pbg s PHE 307 Cb -0.32 0.39 0.43 0.00 -0.34 0.00 0.00 43.02 43.18 4pbg s PHE 307 CO 0.38 -0.42 1.35 -0.40 -1.46 0.00 0.00 175.22 174.67 4pbg n ASP 308 N 4.37 3.31 -2.49 6.13 5.75 -1.26 -4.38 116.55 127.97 4pbg n ASP 308 Ca -0.21 -1.95 -0.04 0.00 -0.01 0.00 0.00 54.79 52.57 4pbg n ASP 308 Cb 0.56 -0.30 0.02 0.00 -1.03 0.00 0.00 41.12 40.37 4pbg n ASP 308 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4pbg n GLY 309 N 1.13 0.73 3.83 6.12 0.00 -1.26 -4.99 105.19 110.75 4pbg n GLY 309 Ca 0.17 -1.97 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 4pbg n GLY 309 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4pbg s GLU 310 N -2.91 2.82 -0.01 1.61 0.41 -1.26 -4.23 118.70 115.13 4pbg s GLU 310 Ca 0.13 0.76 -0.25 0.00 -0.41 0.00 0.00 54.97 55.20 4pbg s GLU 310 Cb -0.01 -1.99 -0.04 0.00 -1.78 0.00 0.00 34.13 30.31 4pbg s GLU 310 CO 0.08 -1.13 0.78 -0.08 -0.49 0.00 0.00 175.26 174.42 4pbg s THR 311 N -3.14 4.88 -0.10 3.63 -1.32 -1.26 -4.66 115.64 113.67 4pbg s THR 311 Ca 0.58 1.64 -0.07 0.00 -1.21 0.00 0.00 61.69 62.63 4pbg s THR 311 Cb -0.13 -4.12 0.03 0.00 -1.51 0.00 0.00 72.50 66.77 4pbg s THR 311 CO 0.54 0.28 0.25 -0.70 -2.21 0.00 0.00 174.62 172.78 4pbg s GLU 312 N 0.49 0.25 -0.08 7.08 2.12 -0.73 -4.97 118.70 122.87 4pbg s GLU 312 Ca 0.41 0.44 -0.02 0.00 0.36 0.00 0.00 54.97 56.15 4pbg s GLU 312 Cb -0.19 0.02 0.04 0.00 0.26 0.00 0.00 34.13 34.25 4pbg s GLU 312 CO 0.22 -0.09 0.04 0.42 -0.54 0.00 0.00 175.26 175.31 4pbg s ILE 313 N 0.67 0.11 -0.16 -3.70 1.01 -1.25 -1.49 121.20 116.38 4pbg s ILE 313 Ca -0.04 0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.76 4pbg s ILE 313 Cb -0.06 -0.41 -0.00 0.00 0.01 0.00 0.00 42.46 42.00 4pbg s ILE 313 CO -0.04 0.11 -0.13 -0.63 0.00 0.00 0.00 174.94 174.25 4pbg s ILE 314 N 2.07 2.82 -0.21 2.92 1.01 0.90 -4.96 121.20 125.75 4pbg s ILE 314 Ca 0.04 -0.72 -0.17 0.00 0.00 0.00 0.00 60.65 59.81 4pbg s ILE 314 Cb -0.13 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 4pbg s ILE 314 CO -0.05 0.51 0.45 -2.28 0.00 0.00 0.00 174.94 173.57 4pbg s HIS 315 N 0.83 3.35 -0.84 3.97 5.65 -1.26 -1.79 115.29 125.20 4pbg s HIS 315 Ca -0.04 0.66 -0.22 0.00 0.25 0.00 0.00 55.06 55.71 4pbg s HIS 315 Cb -0.15 -2.60 0.09 0.00 -1.18 0.00 0.00 32.58 28.73 4pbg s HIS 315 CO -0.00 -0.09 1.16 1.21 -0.65 0.00 0.00 174.74 176.37 4pbg s ASN 316 N 1.18 6.41 -0.01 9.88 2.47 -1.26 -4.83 114.94 128.78 4pbg s ASN 316 Ca 0.21 -1.44 0.19 0.00 0.42 0.00 0.00 52.86 52.24 4pbg s ASN 316 Cb -0.15 -2.46 -0.21 0.00 -1.45 0.00 0.00 41.25 36.98 4pbg s ASN 316 CO 0.09 -1.35 0.57 0.61 -3.72 0.00 0.00 177.10 173.30 4pbg n GLY 317 N 5.72 -1.12 0.16 1.21 0.00 -1.26 -4.25 105.19 105.64 4pbg n GLY 317 Ca 0.15 -0.31 0.15 0.00 0.00 0.00 0.00 46.02 46.01 4pbg n GLY 317 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 4pbg n LYS 318 N -2.64 0.94 -2.11 1.61 4.76 -1.26 -4.56 118.16 114.90 4pbg n LYS 318 Ca -0.12 -0.32 -0.03 0.00 -2.87 0.00 0.00 58.31 54.97 4pbg n LYS 318 Cb 0.80 -1.49 0.02 0.00 -1.84 0.00 0.00 35.03 32.51 4pbg n LYS 318 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 4pbg n GLY 319 N 1.20 0.36 3.07 0.72 0.00 -1.26 -5.02 105.19 104.26 4pbg n GLY 319 Ca 0.17 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 4pbg n GLY 319 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4pbg s GLU 320 N -3.84 1.88 -0.47 1.61 2.02 -0.98 -4.79 118.70 114.13 4pbg s GLU 320 Ca 0.04 -1.98 -0.43 0.00 0.02 0.00 0.00 54.97 52.62 4pbg s GLU 320 Cb -0.01 -3.45 -0.18 0.00 0.10 0.00 0.00 34.13 30.59 4pbg s GLU 320 CO 0.16 -1.04 2.02 1.63 0.02 0.00 0.00 175.26 178.04 4pbg n LYS 321 N 4.24 0.20 0.00 1.61 4.01 -1.15 -0.85 118.16 126.22 4pbg n LYS 321 Ca 0.02 0.06 0.00 0.00 -0.51 0.00 0.00 58.31 57.88 4pbg n LYS 321 Cb 0.40 -1.65 0.00 0.00 -0.51 0.00 0.00 35.03 33.27 4pbg n LYS 321 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 4pbg n GLY 322 N 6.51 0.81 0.15 0.72 0.00 -1.26 -4.97 105.19 107.14 4pbg n GLY 322 Ca 0.47 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.62 4pbg n GLY 322 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 4pbg h SER 323 N 0.00 0.00 -3.88 1.61 4.64 -1.35 -3.45 113.55 111.12 4pbg h SER 323 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 4pbg h SER 323 Cb 0.00 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.15 4pbg h SER 323 CO 0.00 0.00 0.61 -0.44 -0.87 0.00 0.00 176.83 176.13 4pbg s SER 324 N -4.50 6.77 -0.19 4.97 0.01 -1.26 -4.62 113.70 114.88 4pbg s SER 324 Ca 0.05 2.63 -0.07 0.00 1.31 0.00 0.00 55.95 59.87 4pbg s SER 324 Cb 0.10 -2.64 0.09 0.00 0.21 0.00 0.00 66.02 63.77 4pbg s SER 324 CO 0.44 -0.53 0.40 -0.75 0.41 0.00 0.00 173.24 173.21 4pbg s LYS 325 N -1.82 0.30 -0.16 12.44 2.20 -0.74 -4.95 119.74 127.01 4pbg s LYS 325 Ca 0.49 1.00 -0.02 0.00 -0.36 0.00 0.00 55.97 57.08 4pbg s LYS 325 Cb -0.38 0.28 0.05 0.00 -1.51 0.00 0.00 37.83 36.27 4pbg s LYS 325 CO 0.51 -0.25 0.02 -0.47 -0.36 0.00 0.00 175.35 174.80 4pbg s TYR 326 N 2.56 1.01 -0.06 4.03 6.14 -1.26 -0.07 117.35 129.70 4pbg s TYR 326 Ca -0.02 -0.72 -0.05 0.00 0.64 0.00 0.00 57.07 56.92 4pbg s TYR 326 Cb -0.12 -1.00 0.02 0.00 0.42 0.00 0.00 41.96 41.27 4pbg s TYR 326 CO -0.12 -0.55 0.15 1.14 0.64 0.00 0.00 175.55 176.81 4pbg s GLN 327 N 1.86 0.17 -0.05 4.97 -2.07 -0.56 -1.37 119.66 122.61 4pbg s GLN 327 Ca 0.01 0.22 0.01 0.00 -1.82 0.00 0.00 55.36 53.78 4pbg s GLN 327 Cb -0.16 0.07 0.02 0.00 -1.09 0.00 0.00 33.01 31.85 4pbg s GLN 327 CO -0.07 -0.03 -0.07 0.42 -1.32 0.00 0.00 175.29 174.22 4pbg s ILE 328 N 0.15 0.75 0.05 3.63 1.01 -0.11 -1.77 121.20 124.91 4pbg s ILE 328 Ca -0.01 -0.25 -0.31 0.00 0.00 0.00 0.00 60.65 60.09 4pbg s ILE 328 Cb -0.02 -0.74 -0.07 0.00 0.01 0.00 0.00 42.46 41.65 4pbg s ILE 328 CO -0.00 0.27 1.49 -0.75 0.00 0.00 0.00 174.94 175.95 4pbg s LYS 329 N 0.84 4.26 0.00 2.79 2.20 -1.26 -1.09 119.74 127.47 4pbg s LYS 329 Ca -0.12 2.13 0.00 0.00 -0.36 0.00 0.00 55.97 57.62 4pbg s LYS 329 Cb -0.15 -3.50 0.00 0.00 -1.51 0.00 0.00 37.83 32.68 4pbg s LYS 329 CO 0.01 -0.60 0.00 0.41 -0.36 0.00 0.00 175.35 174.81 4pbg n GLY 330 N 3.74 3.39 0.14 5.54 0.00 -1.26 -4.74 105.19 112.00 4pbg n GLY 330 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 4pbg n GLY 330 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 4pbg n VAL 331 N -1.99 0.00 -2.54 1.61 0.31 -0.84 -4.90 118.33 109.98 4pbg n VAL 331 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.54 4pbg n VAL 331 Cb 0.00 -1.16 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 4pbg n VAL 331 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 4pbg n GLY 332 N 2.38 -1.34 3.23 2.92 0.00 -0.25 -4.51 105.19 107.61 4pbg n GLY 332 Ca 0.00 -1.36 -0.19 0.00 0.00 0.00 0.00 46.02 44.47 4pbg n GLY 332 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 4pbg s ARG 333 N -1.96 1.00 -0.09 1.61 1.70 -0.18 -0.94 118.95 120.09 4pbg s ARG 333 Ca 0.00 -1.17 -0.17 0.00 -0.47 0.00 0.00 55.73 53.92 4pbg s ARG 333 Cb 0.00 -0.95 -0.05 0.00 -0.57 0.00 0.00 34.95 33.38 4pbg s ARG 333 CO 0.00 0.19 0.45 1.03 -1.08 0.00 0.00 175.30 175.89 4pbg s ARG 334 N -2.39 4.23 -0.10 3.89 0.52 -0.47 -0.85 118.95 123.78 4pbg s ARG 334 Ca 0.06 0.42 -0.01 0.00 -0.52 0.00 0.00 55.73 55.69 4pbg s ARG 334 Cb -0.07 -3.38 0.03 0.00 0.52 0.00 0.00 34.95 32.05 4pbg s ARG 334 CO 0.03 0.30 -0.05 0.08 0.02 0.00 0.00 175.30 175.69 4pbg s VAL 335 N 0.16 0.81 0.28 3.52 1.01 -1.16 -4.69 120.40 120.33 4pbg s VAL 335 Ca 0.25 -0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.78 4pbg s VAL 335 Cb -0.15 -0.87 -0.10 0.00 0.00 0.00 0.00 36.38 35.25 4pbg s VAL 335 CO 0.11 0.33 1.34 0.00 0.00 0.00 0.00 175.10 176.88 4pbg s ALA 336 N 1.79 3.54 1.08 5.51 0.00 -1.26 -4.42 121.76 128.00 4pbg s ALA 336 Ca 0.05 1.25 -0.12 0.00 0.00 0.00 0.00 51.96 53.13 4pbg s ALA 336 Cb -0.12 -3.50 0.24 0.00 0.00 0.00 0.00 23.12 19.73 4pbg s ALA 336 CO -0.07 -0.64 1.06 -2.14 0.00 0.00 0.00 175.76 173.97 4pbg s PRO 337 N -1.09 -0.24 0.09 0.00 0.02 -1.26 -4.95 135.00 127.57 4pbg s PRO 337 Ca 0.53 0.88 -0.25 0.00 0.02 0.00 0.00 61.00 62.19 4pbg s PRO 337 Cb -0.40 -1.63 -0.15 0.00 0.02 0.00 0.00 34.50 32.34 4pbg s PRO 337 CO 0.47 -3.28 1.72 -0.44 -0.33 0.00 0.00 177.00 175.14 4pbg h ASP 338 N -2.30 -0.16 -0.08 2.53 3.32 -2.03 -3.35 116.42 114.35 4pbg h ASP 338 Ca -0.57 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.41 4pbg h ASP 338 Cb 1.32 0.05 -0.11 0.00 0.22 0.00 0.00 39.33 40.80 4pbg h ASP 338 CO 0.51 -0.11 -0.63 -1.22 -1.72 0.00 0.00 179.24 176.07 4pbg n TYR 339 N -5.17 0.29 -2.65 4.55 4.01 -1.26 -5.04 117.16 111.89 4pbg n TYR 339 Ca -0.08 -1.42 -0.38 0.00 -0.16 0.00 0.00 57.90 55.86 4pbg n TYR 339 Cb 0.10 -0.24 -0.05 0.00 -0.31 0.00 0.00 39.34 38.83 4pbg n TYR 339 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 4pbg s VAL 340 N -2.86 3.91 0.08 -0.72 -7.23 -1.26 -4.96 120.40 107.36 4pbg s VAL 340 Ca 0.38 1.64 -0.31 0.00 -1.81 0.00 0.00 61.98 61.89 4pbg s VAL 340 Cb 0.38 -3.94 -0.07 0.00 0.56 0.00 0.00 36.38 33.31 4pbg s VAL 340 CO -0.08 0.18 1.28 -2.84 -0.31 0.00 0.00 175.10 173.34 4pbg s PRO 341 N -1.98 4.38 0.29 4.82 0.02 -1.26 -4.88 135.00 136.40 4pbg s PRO 341 Ca 0.50 1.90 0.04 0.00 0.02 0.00 0.00 61.00 63.47 4pbg s PRO 341 Cb -0.23 -3.30 -0.06 0.00 0.02 0.00 0.00 34.50 30.93 4pbg s PRO 341 CO 0.29 -0.34 0.02 -0.98 -0.33 0.00 0.00 177.00 175.66 4pbg s ARG 342 N 1.09 1.56 0.34 5.54 1.70 -1.26 0.12 118.95 128.04 4pbg s ARG 342 Ca 0.61 -1.83 0.01 0.00 -0.47 0.00 0.00 55.73 54.05 4pbg s ARG 342 Cb -0.33 -0.89 0.01 0.00 -0.57 0.00 0.00 34.95 33.17 4pbg s ARG 342 CO 0.30 -0.11 0.06 0.25 -1.08 0.00 0.00 175.30 174.71 4pbg n THR 343 N -0.60 0.00 0.28 4.99 -2.24 -0.96 -4.92 114.28 110.83 4pbg n THR 343 Ca -0.04 -1.56 0.18 0.00 -2.27 0.00 0.00 64.05 60.37 4pbg n THR 343 Cb 0.65 0.21 0.93 0.00 -2.10 0.00 0.00 70.33 70.02 4pbg n THR 343 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 4pbg h ASP 344 N 0.73 0.00 -0.55 3.42 3.32 -1.92 1.73 116.42 123.16 4pbg h ASP 344 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 4pbg h ASP 344 Cb 0.84 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.39 4pbg h ASP 344 CO 0.44 0.00 0.00 0.79 -1.72 0.00 0.00 179.24 178.75 4pbg n TRP 345 N -3.27 0.72 -0.96 4.55 8.01 -1.26 -2.33 117.44 122.90 4pbg n TRP 345 Ca -0.01 -0.36 0.00 0.00 -1.31 0.00 0.00 57.50 55.82 4pbg n TRP 345 Cb 0.29 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.59 4pbg n TRP 345 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 4pbg n ASP 346 N 1.51 -3.40 -4.66 -0.99 8.00 0.59 -4.85 116.55 112.74 4pbg n ASP 346 Ca 0.22 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.29 4pbg n ASP 346 Cb 0.60 -1.55 -0.02 0.00 -0.02 0.00 0.00 41.12 40.12 4pbg n ASP 346 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 4pbg s TRP 347 N -1.83 2.48 0.12 1.24 0.52 -1.26 -4.57 118.94 115.64 4pbg s TRP 347 Ca 0.00 0.67 -0.30 0.00 0.02 0.00 0.00 56.10 56.48 4pbg s TRP 347 Cb 0.00 -3.68 -0.06 0.00 -1.15 0.00 0.00 33.47 28.58 4pbg s TRP 347 CO 0.00 -2.60 1.05 0.42 0.02 0.00 0.00 176.95 175.84 4pbg s ILE 348 N 3.72 4.23 -0.24 2.03 1.01 -1.26 -2.27 121.20 128.43 4pbg s ILE 348 Ca 0.62 1.81 -0.20 0.00 0.00 0.00 0.00 60.65 62.88 4pbg s ILE 348 Cb -0.27 -4.15 -0.02 0.00 0.01 0.00 0.00 42.46 38.03 4pbg s ILE 348 CO 0.21 0.26 0.62 -0.63 0.00 0.00 0.00 174.94 175.40 4pbg s ILE 349 N 0.16 5.00 -0.46 2.92 1.01 0.12 -4.25 121.20 125.70 4pbg s ILE 349 Ca 0.50 1.14 0.07 0.00 0.00 0.00 0.00 60.65 62.36 4pbg s ILE 349 Cb -0.26 -3.93 0.19 0.00 0.01 0.00 0.00 42.46 38.46 4pbg s ILE 349 CO 0.31 0.06 0.69 -0.47 0.00 0.00 0.00 174.94 175.53 4pbg s TYR 350 N 2.31 -1.64 0.27 3.97 5.04 -1.26 -4.31 117.35 121.73 4pbg s TYR 350 Ca 0.27 -0.15 -0.02 0.00 -2.44 0.00 0.00 57.07 54.73 4pbg s TYR 350 Cb -0.16 0.31 0.43 0.00 0.35 0.00 0.00 41.96 42.89 4pbg s TYR 350 CO 0.09 -1.20 1.88 -1.35 -1.34 0.00 0.00 175.55 173.63 4pbg h PRO 351 N 5.96 1.12 -0.17 4.97 0.11 -1.93 -2.31 132.00 139.76 4pbg h PRO 351 Ca 0.05 -0.07 0.05 0.00 0.11 0.00 0.00 66.00 66.14 4pbg h PRO 351 Cb 1.15 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 4pbg h PRO 351 CO 0.05 0.74 0.33 1.49 -0.21 0.00 0.00 178.00 180.40 4pbg h GLU 352 N 1.16 0.00 -0.00 1.05 4.57 -1.96 -0.51 114.58 118.88 4pbg h GLU 352 Ca 0.44 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.55 4pbg h GLU 352 Cb 0.21 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 4pbg h GLU 352 CO -0.19 0.00 -0.35 0.78 -1.18 0.00 0.00 179.01 178.07 4pbg h GLY 353 N 0.00 0.01 0.87 1.92 0.00 -1.84 -2.57 103.07 101.46 4pbg h GLY 353 Ca 0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 4pbg h GLY 353 CO -0.00 0.01 0.03 -2.00 0.00 0.00 0.00 176.54 174.58 4pbg h LEU 354 N 0.01 0.44 -0.19 3.11 5.85 -1.28 -1.79 115.31 121.46 4pbg h LEU 354 Ca -0.00 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.47 4pbg h LEU 354 Cb 0.63 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 4pbg h LEU 354 CO 0.05 0.60 0.02 0.22 -0.34 0.00 0.00 178.44 178.99 4pbg h TYR 355 N 0.27 0.03 -0.75 1.25 5.03 -1.59 -1.06 116.97 120.14 4pbg h TYR 355 Ca 0.08 0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.47 4pbg h TYR 355 Cb 0.35 0.02 -0.05 0.00 1.55 0.00 0.00 36.73 38.60 4pbg h TYR 355 CO 0.02 -0.00 0.49 -0.44 -1.32 0.00 0.00 178.16 176.92 4pbg h ASP 356 N 0.09 0.70 -0.27 -2.11 5.19 -1.32 -0.75 116.42 117.96 4pbg h ASP 356 Ca 0.09 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.39 4pbg h ASP 356 Cb 0.09 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 39.45 4pbg h ASP 356 CO -0.13 0.45 -0.28 1.56 -3.12 0.00 0.00 179.24 177.72 4pbg h GLN 357 N 0.80 0.66 -0.38 3.56 1.08 -0.69 -1.79 115.11 118.35 4pbg h GLN 357 Ca 0.32 -0.36 -0.04 0.00 -1.45 0.00 0.00 58.65 57.13 4pbg h GLN 357 Cb 0.25 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 4pbg h GLN 357 CO -0.11 0.96 0.06 0.82 -0.95 0.00 0.00 178.83 179.61 4pbg h ILE 358 N 0.39 1.19 0.00 2.54 2.04 -0.64 -0.49 117.51 122.54 4pbg h ILE 358 Ca 0.04 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.20 4pbg h ILE 358 Cb 0.85 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 4pbg h ILE 358 CO 0.07 0.25 -0.24 0.23 0.00 0.00 0.00 178.15 178.46 4pbg n MET 359 N -4.31 0.21 -0.06 2.37 2.81 -0.34 -2.58 117.12 115.22 4pbg n MET 359 Ca 0.02 0.12 -0.19 0.00 -1.81 0.00 0.00 57.70 55.85 4pbg n MET 359 Cb 0.21 -1.69 -0.13 0.00 -0.71 0.00 0.00 33.22 30.90 4pbg n MET 359 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 4pbg h ARG 360 N 0.00 0.07 -0.54 0.03 1.12 -0.39 -2.90 114.38 111.76 4pbg h ARG 360 Ca 0.00 -0.12 0.02 0.00 -1.11 0.00 0.00 59.98 58.76 4pbg h ARG 360 Cb 0.68 0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 30.65 4pbg h ARG 360 CO 0.00 1.06 0.34 0.28 -3.11 0.00 0.00 179.97 178.54 4pbg h VAL 361 N -0.81 1.10 -0.92 0.20 2.07 -1.23 0.15 116.25 116.81 4pbg h VAL 361 Ca -0.20 -0.24 0.09 0.00 0.82 0.00 0.00 66.70 67.18 4pbg h VAL 361 Cb 1.31 0.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 4pbg h VAL 361 CO -0.05 0.13 0.59 0.50 0.02 0.00 0.00 177.57 178.76 4pbg h LYS 362 N 0.69 0.92 0.08 1.57 3.64 -1.62 0.45 116.57 122.31 4pbg h LYS 362 Ca 0.21 -0.06 -0.33 0.00 -1.27 0.00 0.00 60.65 59.21 4pbg h LYS 362 Cb -0.03 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.55 4pbg h LYS 362 CO -0.07 0.61 -1.78 -0.91 -2.27 0.00 0.00 179.45 175.03 4pbg h ASN 363 N 0.95 0.27 1.01 4.20 2.35 -1.21 -3.19 115.58 119.95 4pbg h ASN 363 Ca 0.42 -0.53 -0.18 0.00 -0.55 0.00 0.00 56.30 55.46 4pbg h ASN 363 Cb 0.36 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.61 4pbg h ASN 363 CO -0.18 1.46 -1.05 0.44 -1.65 0.00 0.00 177.43 176.45 4pbg h ASP 364 N 0.05 0.00 -2.32 5.81 5.19 -0.57 -3.40 116.42 121.17 4pbg h ASP 364 Ca -0.33 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.49 4pbg h ASP 364 Cb 2.02 0.00 -0.38 0.00 0.18 0.00 0.00 39.33 41.15 4pbg h ASP 364 CO 0.10 0.74 -0.98 -1.22 -3.12 0.00 0.00 179.24 174.77 4pbg n TYR 365 N -3.16 -0.56 0.31 4.55 4.01 0.16 -4.97 117.16 117.50 4pbg n TYR 365 Ca -0.04 -3.41 0.17 0.00 -0.16 0.00 0.00 57.90 54.45 4pbg n TYR 365 Cb 0.87 0.09 0.99 0.00 -0.31 0.00 0.00 39.34 40.98 4pbg n TYR 365 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 4pbg h PRO 366 N 5.27 0.00 -0.95 -0.72 0.11 -1.68 -2.58 132.00 131.45 4pbg h PRO 366 Ca 0.22 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.30 4pbg h PRO 366 Cb 0.89 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.98 4pbg h PRO 366 CO 0.41 0.00 0.05 0.27 -0.21 0.00 0.00 178.00 178.52 4pbg n ASN 367 N -3.67 2.36 0.18 -2.05 6.94 -1.26 -4.08 115.26 113.69 4pbg n ASN 367 Ca -0.03 -2.22 0.03 0.00 -0.02 0.00 0.00 54.58 52.34 4pbg n ASN 367 Cb 0.09 -0.55 0.32 0.00 -2.36 0.00 0.00 39.78 37.28 4pbg n ASN 367 CO 0.00 0.00 0.00 0.10 -1.03 0.00 0.00 177.26 176.33 4pbg h TYR 368 N 0.52 0.00 0.00 -2.53 -0.00 -1.80 -3.47 116.97 109.70 4pbg h TYR 368 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.78 4pbg h TYR 368 Cb 0.99 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.72 4pbg h TYR 368 CO 0.24 0.43 0.00 1.63 -0.00 0.00 0.00 178.16 180.45 4pbg n LYS 369 N -3.78 0.00 -3.83 0.10 5.02 -1.26 -4.36 118.16 110.06 4pbg n LYS 369 Ca -0.01 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.16 4pbg n LYS 369 Cb 0.49 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.39 4pbg n LYS 369 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 4pbg s LYS 370 N 0.00 0.37 -0.06 1.97 2.20 -1.26 -4.81 119.74 118.15 4pbg s LYS 370 Ca 0.00 -0.03 0.04 0.00 -0.36 0.00 0.00 55.97 55.62 4pbg s LYS 370 Cb 0.00 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.48 4pbg s LYS 370 CO 0.00 -0.07 -0.18 0.42 -0.36 0.00 0.00 175.35 175.15 4pbg s ILE 371 N -0.59 1.58 -0.04 5.43 1.01 0.28 -0.21 121.20 128.65 4pbg s ILE 371 Ca -0.07 -0.77 0.06 0.00 0.00 0.00 0.00 60.65 59.87 4pbg s ILE 371 Cb -0.04 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 41.05 4pbg s ILE 371 CO 0.01 0.45 -0.23 -0.31 0.00 0.00 0.00 174.94 174.86 4pbg s TYR 372 N 0.23 2.17 -1.09 3.97 2.02 0.14 -0.77 117.35 124.01 4pbg s TYR 372 Ca -0.10 -0.54 -0.16 0.00 -0.37 0.00 0.00 57.07 55.90 4pbg s TYR 372 Cb -0.14 -1.42 0.15 0.00 -0.40 0.00 0.00 41.96 40.15 4pbg s TYR 372 CO 0.04 -0.13 1.32 0.42 -1.57 0.00 0.00 175.55 175.63 4pbg s ILE 373 N -0.30 4.83 -1.20 2.71 -1.09 -0.23 -0.48 121.20 125.44 4pbg s ILE 373 Ca 0.02 -2.11 0.02 0.00 -2.23 0.00 0.00 60.65 56.34 4pbg s ILE 373 Cb -0.11 -4.87 0.02 0.00 -1.58 0.00 0.00 42.46 35.91 4pbg s ILE 373 CO 0.01 -1.60 0.96 0.35 -1.23 0.00 0.00 174.94 173.43 4pbg n THR 374 N 5.13 1.52 -3.63 2.92 -2.24 -1.20 0.69 114.28 117.47 4pbg n THR 374 Ca 0.32 0.38 -0.01 0.00 -2.27 0.00 0.00 64.05 62.47 4pbg n THR 374 Cb 0.46 -1.35 -0.06 0.00 -2.10 0.00 0.00 70.33 67.27 4pbg n THR 374 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 4pbg s ASN 376 N 1.32 -0.59 0.00 0.00 3.04 -1.08 -1.55 114.94 116.08 4pbg s ASN 376 Ca -0.09 1.06 0.00 0.00 0.04 0.00 0.00 52.86 53.87 4pbg s ASN 376 Cb -0.03 1.13 0.00 0.00 -1.54 0.00 0.00 41.25 40.81 4pbg s ASN 376 CO -0.14 -0.18 0.00 0.61 -3.04 0.00 0.00 177.10 174.36 4pbg n GLY 377 N 2.92 0.81 3.17 1.21 0.00 -1.26 -0.88 105.19 111.16 4pbg n GLY 377 Ca -0.15 -0.85 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 4pbg n GLY 377 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 4pbg s LEU 378 N 0.00 2.92 -0.21 0.99 2.96 -1.26 -4.96 118.68 119.12 4pbg s LEU 378 Ca 0.00 -0.84 -0.14 0.00 -0.22 0.00 0.00 54.13 52.93 4pbg s LEU 378 Cb 0.00 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 4pbg s LEU 378 CO 0.00 -0.09 0.31 -0.83 -1.32 0.00 0.00 176.35 174.42 4pbg s GLY 379 N 1.30 2.07 -0.05 7.98 0.00 -1.26 -4.56 107.32 112.80 4pbg s GLY 379 Ca 0.01 -0.63 -0.29 0.00 0.00 0.00 0.00 44.72 43.81 4pbg s GLY 379 CO -0.07 0.64 0.91 -2.52 0.00 0.00 0.00 173.10 172.07 4pbg s TYR 380 N 1.14 -0.36 -0.76 1.90 -0.85 -0.06 -4.83 117.35 113.52 4pbg s TYR 380 Ca 0.15 0.34 -0.26 0.00 -0.52 0.00 0.00 57.07 56.79 4pbg s TYR 380 Cb -0.14 0.51 -0.06 0.00 0.38 0.00 0.00 41.96 42.65 4pbg s TYR 380 CO 0.06 -0.49 2.09 0.21 -1.52 0.00 0.00 175.55 175.90 4pbg s LYS 381 N -2.56 2.30 0.88 -3.49 2.47 -1.25 -3.56 119.74 114.53 4pbg s LYS 381 Ca 0.03 0.31 -0.11 0.00 -1.56 0.00 0.00 55.97 54.64 4pbg s LYS 381 Cb -0.01 -4.78 0.12 0.00 -1.46 0.00 0.00 37.83 31.70 4pbg s LYS 381 CO -0.06 -3.45 1.09 -0.51 0.16 0.00 0.00 175.35 172.59 4pbg s ASP 382 N 9.21 3.62 -0.22 1.43 1.01 -1.26 -5.02 116.67 125.44 4pbg s ASP 382 Ca 0.78 1.47 -0.02 0.00 0.71 0.00 0.00 52.55 55.48 4pbg s ASP 382 Cb -0.11 -2.16 0.00 0.00 1.01 0.00 0.00 42.92 41.67 4pbg s ASP 382 CO 0.10 -2.54 -0.08 -0.70 0.21 0.00 0.00 175.17 172.16 4pbg s GLU 383 N -4.96 3.19 -0.57 8.23 2.12 -1.26 -5.06 118.70 120.39 4pbg s GLU 383 Ca 0.63 -0.74 -0.27 0.00 0.36 0.00 0.00 54.97 54.95 4pbg s GLU 383 Cb -0.17 -2.92 -0.00 0.00 0.26 0.00 0.00 34.13 31.30 4pbg s GLU 383 CO 0.57 -0.24 1.61 0.12 -0.54 0.00 0.00 175.26 176.77 4pbg s PHE 384 N 1.41 2.00 -0.03 5.30 5.36 -1.26 -4.45 117.98 126.31 4pbg s PHE 384 Ca 0.05 0.55 0.01 0.00 -0.96 0.00 0.00 56.93 56.58 4pbg s PHE 384 Cb -0.14 -4.27 0.02 0.00 -0.34 0.00 0.00 43.02 38.28 4pbg s PHE 384 CO -0.05 -2.23 -0.02 0.14 -1.46 0.00 0.00 175.22 171.60 4pbg s VAL 385 N 7.23 0.28 -1.40 3.12 -7.23 0.15 -4.81 120.40 117.74 4pbg s VAL 385 Ca 0.59 -0.01 -0.04 0.00 -1.81 0.00 0.00 61.98 60.71 4pbg s VAL 385 Cb -0.13 -0.33 0.00 0.00 0.56 0.00 0.00 36.38 36.48 4pbg s VAL 385 CO 0.23 0.15 0.56 0.47 -0.31 0.00 0.00 175.10 176.20 4pbg n ASP 386 N 3.88 -5.69 0.00 4.85 8.00 -1.26 -1.61 116.55 124.72 4pbg n ASP 386 Ca -0.24 -0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.00 4pbg n ASP 386 Cb 0.52 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.11 4pbg n ASP 386 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 4pbg n ASN 387 N -2.08 -4.22 -0.20 -2.24 3.02 -1.26 -4.93 115.26 103.35 4pbg n ASN 387 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 4pbg n ASN 387 Cb 0.61 -1.93 0.00 0.00 -0.61 0.00 0.00 39.78 37.85 4pbg n ASN 387 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 4pbg n THR 388 N -2.48 0.00 -3.69 3.41 -1.04 -0.64 -4.64 114.28 105.21 4pbg n THR 388 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 4pbg n THR 388 Cb 0.23 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.63 4pbg n THR 388 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 4pbg s VAL 389 N -0.96 -0.22 -1.37 12.58 1.01 -1.26 -0.68 120.40 129.51 4pbg s VAL 389 Ca 0.00 0.14 -0.08 0.00 0.00 0.00 0.00 61.98 62.04 4pbg s VAL 389 Cb 0.00 -0.57 0.10 0.00 0.00 0.00 0.00 36.38 35.91 4pbg s VAL 389 CO 0.00 0.06 2.29 -1.22 0.00 0.00 0.00 175.10 176.23 4pbg n TYR 390 N 4.65 2.75 -1.31 5.22 4.01 -1.26 -1.88 117.16 129.35 4pbg n TYR 390 Ca -0.18 -2.86 -0.42 0.00 -0.16 0.00 0.00 57.90 54.27 4pbg n TYR 390 Cb 0.53 -2.03 -0.04 0.00 -0.31 0.00 0.00 39.34 37.49 4pbg n TYR 390 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 4pbg n ASP 391 N 3.07 3.09 0.13 7.72 5.75 -1.26 -4.64 116.55 130.40 4pbg n ASP 391 Ca 0.57 -2.71 -0.02 0.00 -0.01 0.00 0.00 54.79 52.61 4pbg n ASP 391 Cb 0.29 -1.28 0.17 0.00 -1.03 0.00 0.00 41.12 39.27 4pbg n ASP 391 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 4pbg h ASP 392 N 7.22 0.06 -0.80 -1.12 3.32 -1.98 -2.61 116.42 120.51 4pbg h ASP 392 Ca 0.48 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.45 4pbg h ASP 392 Cb 0.64 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 40.14 4pbg h ASP 392 CO 1.92 0.64 0.32 1.23 -1.72 0.00 0.00 179.24 181.64 4pbg h GLY 393 N 1.72 1.28 0.98 2.75 0.00 -2.00 -0.52 103.07 107.28 4pbg h GLY 393 Ca -0.01 -0.69 -0.10 0.00 0.00 0.00 0.00 47.33 46.53 4pbg h GLY 393 CO 0.08 0.65 -0.16 -0.09 0.00 0.00 0.00 176.54 177.03 4pbg h ARG 394 N 1.16 0.76 -0.12 4.80 2.43 -1.89 -0.02 114.38 121.50 4pbg h ARG 394 Ca 0.27 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 4pbg h ARG 394 Cb 0.21 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 4pbg h ARG 394 CO -0.02 0.94 0.01 0.82 -1.51 0.00 0.00 179.97 180.21 4pbg h ILE 395 N 0.55 1.08 -0.08 1.20 2.04 -1.05 -0.26 117.51 120.98 4pbg h ILE 395 Ca 0.09 -0.27 -0.14 0.00 1.00 0.00 0.00 64.86 65.53 4pbg h ILE 395 Cb 0.70 0.97 0.01 0.00 -0.74 0.00 0.00 36.82 37.75 4pbg h ILE 395 CO 0.05 0.09 -0.51 -0.78 0.00 0.00 0.00 178.15 177.01 4pbg h ASP 396 N 0.17 0.59 0.01 1.72 3.58 -0.54 -1.28 116.42 120.66 4pbg h ASP 396 Ca 0.04 -0.66 -0.00 0.00 0.42 0.00 0.00 57.03 56.83 4pbg h ASP 396 Cb 0.10 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 40.97 4pbg h ASP 396 CO -0.00 1.16 -0.00 0.22 -2.88 0.00 0.00 179.24 177.73 4pbg h TYR 397 N 0.06 -0.01 -0.14 0.28 5.03 -0.62 -0.88 116.97 120.69 4pbg h TYR 397 Ca -0.04 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.26 4pbg h TYR 397 Cb 1.16 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.44 4pbg h TYR 397 CO 0.12 0.00 0.06 0.28 -1.32 0.00 0.00 178.16 177.30 4pbg h VAL 398 N -0.02 1.15 -0.70 1.81 2.07 -1.07 -2.44 116.25 117.04 4pbg h VAL 398 Ca -0.00 -0.44 0.06 0.00 0.82 0.00 0.00 66.70 67.14 4pbg h VAL 398 Cb 0.01 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 4pbg h VAL 398 CO 0.00 0.13 0.46 0.50 0.02 0.00 0.00 177.57 178.69 4pbg h LYS 399 N 0.07 0.71 -0.35 1.57 3.64 -1.12 0.87 116.57 121.97 4pbg h LYS 399 Ca 0.05 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.23 4pbg h LYS 399 Cb 0.16 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 4pbg h LYS 399 CO -0.00 0.47 -0.36 1.96 -2.27 0.00 0.00 179.45 179.24 4pbg h GLN 400 N 0.73 0.86 -0.24 1.90 4.20 -0.87 -2.87 115.11 118.81 4pbg h GLN 400 Ca 0.30 -0.46 -0.16 0.00 0.06 0.00 0.00 58.65 58.39 4pbg h GLN 400 Cb 0.25 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.05 4pbg h GLN 400 CO -0.10 1.10 -0.47 0.45 -0.67 0.00 0.00 178.83 179.14 4pbg h HIS 401 N 0.65 0.94 -0.27 2.96 3.86 -0.74 -3.05 115.15 119.51 4pbg h HIS 401 Ca 0.05 -0.34 0.06 0.00 -1.16 0.00 0.00 60.37 58.98 4pbg h HIS 401 Cb 0.95 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 29.23 4pbg h HIS 401 CO 0.07 1.13 0.19 -0.07 0.86 0.00 0.00 177.93 180.11 4pbg h LEU 402 N 0.49 0.09 -0.53 2.43 3.38 -0.90 0.17 115.31 120.45 4pbg h LEU 402 Ca 0.01 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 4pbg h LEU 402 Cb 1.08 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 4pbg h LEU 402 CO 0.11 0.06 -0.54 -0.33 0.09 0.00 0.00 178.44 177.83 4pbg h GLU 403 N 0.10 0.56 -0.08 1.13 5.08 -1.45 -1.31 114.58 118.62 4pbg h GLU 403 Ca 0.12 -0.35 -0.13 0.00 -1.00 0.00 0.00 59.36 58.00 4pbg h GLU 403 Cb 0.36 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 4pbg h GLU 403 CO -0.01 0.96 -0.54 0.28 -1.00 0.00 0.00 179.01 178.69 4pbg h VAL 404 N 0.43 1.36 0.20 3.13 2.07 -0.60 -2.44 116.25 120.40 4pbg h VAL 404 Ca 0.01 -1.84 -0.01 0.00 0.82 0.00 0.00 66.70 65.68 4pbg h VAL 404 Cb 1.08 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.76 4pbg h VAL 404 CO 0.10 0.54 -0.09 -0.07 0.02 0.00 0.00 177.57 178.07 4pbg h LEU 405 N 0.18 -0.22 -1.72 2.57 3.38 -1.10 0.57 115.31 118.97 4pbg h LEU 405 Ca 0.00 -0.18 0.17 0.00 0.09 0.00 0.00 57.88 57.96 4pbg h LEU 405 Cb 1.02 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 4pbg h LEU 405 CO 0.08 0.06 0.66 -1.28 0.09 0.00 0.00 178.44 178.06 4pbg h SER 406 N -0.52 0.00 0.00 -0.43 0.87 -1.07 0.44 113.55 112.84 4pbg h SER 406 Ca -0.03 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.35 4pbg h SER 406 Cb 0.39 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 4pbg h SER 406 CO 0.04 0.00 -1.02 0.44 -0.53 0.00 0.00 176.83 175.76 4pbg h ASP 407 N 0.00 0.00 -0.15 6.23 3.32 -0.94 -3.01 116.42 121.88 4pbg h ASP 407 Ca 0.27 -0.56 0.04 0.00 0.02 0.00 0.00 57.03 56.80 4pbg h ASP 407 Cb 1.60 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.14 4pbg h ASP 407 CO -0.00 1.38 0.14 0.00 -1.72 0.00 0.00 179.24 179.04 4pbg h ALA 408 N -0.44 1.85 0.16 3.45 0.00 0.74 0.75 119.26 125.78 4pbg h ALA 408 Ca -0.28 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 4pbg h ALA 408 Cb 1.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 4pbg h ALA 408 CO -0.17 -0.22 -0.08 0.82 0.00 0.00 0.00 179.25 179.60 4pbg h ILE 409 N 0.00 0.95 -0.66 0.00 2.04 -0.32 -0.04 117.51 119.48 4pbg h ILE 409 Ca 0.07 -1.02 0.15 0.00 1.00 0.00 0.00 64.86 65.06 4pbg h ILE 409 Cb 0.36 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 4pbg h ILE 409 CO -0.00 0.22 0.45 0.00 0.00 0.00 0.00 178.15 178.82 4pbg h ALA 410 N -0.09 2.25 -0.19 1.87 0.00 -0.98 -0.49 119.26 121.63 4pbg h ALA 410 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 4pbg h ALA 410 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 4pbg h ALA 410 CO 0.04 -0.43 0.00 -0.25 0.00 0.00 0.00 179.25 178.61 4pbg n ASP 411 N -4.44 2.54 0.00 0.00 9.92 0.10 -4.86 116.55 119.81 4pbg n ASP 411 Ca 0.12 -2.30 0.00 0.00 -0.53 0.00 0.00 54.79 52.08 4pbg n ASP 411 Cb 0.54 -0.55 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 4pbg n ASP 411 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 4pbg n GLY 412 N 0.22 0.79 3.74 0.44 0.00 -0.20 -5.03 105.19 105.15 4pbg n GLY 412 Ca 0.09 -0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 4pbg n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4pbg s ALA 413 N -2.00 3.53 -1.21 4.61 0.00 -0.04 -5.01 121.76 121.65 4pbg s ALA 413 Ca 0.00 -0.26 -0.19 0.00 0.00 0.00 0.00 51.96 51.51 4pbg s ALA 413 Cb 0.00 -2.55 0.07 0.00 0.00 0.00 0.00 23.12 20.64 4pbg s ALA 413 CO 0.00 0.08 1.63 1.21 0.00 0.00 0.00 175.76 178.68 4pbg s ASN 414 N 0.37 6.76 -0.18 0.00 2.47 -1.26 -4.23 114.94 118.87 4pbg s ASN 414 Ca 0.23 -2.22 -0.07 0.00 0.42 0.00 0.00 52.86 51.22 4pbg s ASN 414 Cb -0.15 -2.56 -0.04 0.00 -1.45 0.00 0.00 41.25 37.05 4pbg s ASN 414 CO 0.09 -1.23 0.07 -0.69 -3.72 0.00 0.00 177.10 171.62 4pbg s VAL 415 N 4.20 4.86 -0.36 -5.21 1.01 -1.26 -0.55 120.40 123.09 4pbg s VAL 415 Ca 0.51 -0.01 0.04 0.00 0.00 0.00 0.00 61.98 62.52 4pbg s VAL 415 Cb 0.02 -3.19 -0.00 0.00 0.00 0.00 0.00 36.38 33.21 4pbg s VAL 415 CO 0.02 0.47 0.40 0.29 0.00 0.00 0.00 175.10 176.29 4pbg n LYS 416 N 3.42 2.55 -3.61 2.72 4.76 0.05 -4.94 118.16 123.11 4pbg n LYS 416 Ca -0.17 -0.39 -0.02 0.00 -2.87 0.00 0.00 58.31 54.86 4pbg n LYS 416 Cb 0.52 -0.89 -0.02 0.00 -1.84 0.00 0.00 35.03 32.81 4pbg n LYS 416 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 4pbg s GLY 417 N -0.83 -0.31 -0.03 0.72 0.00 -1.26 -2.39 107.32 103.24 4pbg s GLY 417 Ca 0.03 1.48 0.03 0.00 0.00 0.00 0.00 44.72 46.26 4pbg s GLY 417 CO 0.10 0.46 -0.10 -0.47 0.00 0.00 0.00 173.10 173.10 4pbg s TYR 418 N -2.28 0.99 -0.23 1.90 5.04 0.12 -1.06 117.35 121.83 4pbg s TYR 418 Ca 0.11 -0.24 0.02 0.00 -2.44 0.00 0.00 57.07 54.52 4pbg s TYR 418 Cb 0.01 -0.69 0.05 0.00 0.35 0.00 0.00 41.96 41.67 4pbg s TYR 418 CO -0.04 -0.10 -0.13 -0.06 -1.34 0.00 0.00 175.55 173.88 4pbg s PHE 419 N 0.15 2.94 -0.13 4.97 0.40 0.22 -1.02 117.98 125.51 4pbg s PHE 419 Ca -0.03 -1.99 -0.28 0.00 -0.60 0.00 0.00 56.93 54.04 4pbg s PHE 419 Cb -0.08 -1.86 -0.01 0.00 0.51 0.00 0.00 43.02 41.58 4pbg s PHE 419 CO 0.00 -0.83 0.94 -1.50 0.70 0.00 0.00 175.22 174.54 4pbg s ILE 420 N 1.22 4.82 -0.31 0.64 2.07 -1.01 -2.62 121.20 126.00 4pbg s ILE 420 Ca -0.04 1.89 -0.21 0.00 -1.41 0.00 0.00 60.65 60.89 4pbg s ILE 420 Cb -0.17 -4.25 -0.01 0.00 0.13 0.00 0.00 42.46 38.16 4pbg s ILE 420 CO -0.08 0.01 0.65 0.86 -1.91 0.00 0.00 174.94 174.47 4pbg s TRP 421 N 2.10 3.21 0.26 3.50 -0.11 -0.06 -1.65 118.94 126.20 4pbg s TRP 421 Ca 0.44 0.61 0.06 0.00 1.22 0.00 0.00 56.10 58.44 4pbg s TRP 421 Cb -0.17 -3.03 -0.05 0.00 -1.50 0.00 0.00 33.47 28.71 4pbg s TRP 421 CO 0.15 -0.49 -0.06 -1.54 -4.62 0.00 0.00 176.95 170.40 4pbg s SER 422 N 1.64 2.52 0.14 5.86 1.04 -1.20 -4.05 113.70 119.65 4pbg s SER 422 Ca 0.26 -1.18 -0.18 0.00 0.48 0.00 0.00 55.95 55.34 4pbg s SER 422 Cb -0.15 -0.12 -0.03 0.00 0.10 0.00 0.00 66.02 65.82 4pbg s SER 422 CO 0.12 -0.36 1.78 0.25 0.98 0.00 0.00 173.24 176.01 4pbg h LEU 423 N 2.36 0.36 -8.80 2.42 5.85 -1.40 -2.58 115.31 113.52 4pbg h LEU 423 Ca -0.39 -0.03 -0.33 0.00 0.84 0.00 0.00 57.88 57.96 4pbg h LEU 423 Cb 1.23 -0.09 -0.14 0.00 0.37 0.00 0.00 40.66 42.02 4pbg h LEU 423 CO 0.66 0.28 -0.64 0.00 -0.34 0.00 0.00 178.44 178.40 4pbg s MET 424 N -6.09 1.28 0.11 1.25 0.23 -1.26 -2.24 119.30 112.59 4pbg s MET 424 Ca -0.13 -1.66 -0.31 0.00 -1.03 0.00 0.00 55.69 52.56 4pbg s MET 424 Cb 0.10 -0.35 -0.08 0.00 -1.53 0.00 0.00 34.83 32.96 4pbg s MET 424 CO 0.71 -0.19 1.47 -0.51 -2.03 0.00 0.00 175.02 174.48 4pbg s ASP 425 N -3.26 6.73 0.10 -1.18 1.01 -0.46 -4.24 116.67 115.37 4pbg s ASP 425 Ca 0.30 2.41 0.02 0.00 0.71 0.00 0.00 52.55 56.00 4pbg s ASP 425 Cb 0.07 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 4pbg s ASP 425 CO 0.09 -0.73 -0.07 0.68 0.21 0.00 0.00 175.17 175.34 4pbg s VAL 426 N 1.40 0.75 0.62 -1.27 -7.23 -1.26 -4.68 120.40 108.72 4pbg s VAL 426 Ca 0.67 -1.80 -0.15 0.00 -1.81 0.00 0.00 61.98 58.89 4pbg s VAL 426 Cb -0.39 -1.52 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 4pbg s VAL 426 CO 0.30 -0.76 1.06 0.72 -0.31 0.00 0.00 175.10 176.11 4pbg s PHE 427 N -3.17 2.96 0.07 2.82 -0.12 -1.26 -4.79 117.98 114.50 4pbg s PHE 427 Ca 0.09 1.50 -0.07 0.00 -0.05 0.00 0.00 56.93 58.40 4pbg s PHE 427 Cb 0.02 -3.00 -0.05 0.00 -0.63 0.00 0.00 43.02 39.35 4pbg s PHE 427 CO -0.03 -1.20 0.35 0.45 -0.05 0.00 0.00 175.22 174.74 4pbg s SER 428 N -2.92 6.55 0.12 1.98 0.15 -0.05 -4.87 113.70 114.66 4pbg s SER 428 Ca 0.63 0.66 -0.22 0.00 0.70 0.00 0.00 55.95 57.71 4pbg s SER 428 Cb -0.16 -2.12 -0.04 0.00 -1.71 0.00 0.00 66.02 61.98 4pbg s SER 428 CO 0.40 0.17 1.68 -0.50 1.20 0.00 0.00 173.24 176.20 4pbg h TRP 429 N 3.60 -0.31 -0.19 3.44 4.06 -1.96 -3.09 115.95 121.50 4pbg h TRP 429 Ca -0.49 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.48 4pbg h TRP 429 Cb 1.19 0.15 0.00 0.00 -1.00 0.00 0.00 29.16 29.50 4pbg h TRP 429 CO 0.66 -0.19 0.00 -1.13 -3.56 0.00 0.00 178.44 174.22 4pbg n SER 430 N -5.27 2.47 -0.08 -3.49 3.41 -1.26 -4.60 113.62 104.81 4pbg n SER 430 Ca -0.04 -1.74 0.05 0.00 -0.26 0.00 0.00 58.87 56.88 4pbg n SER 430 Cb 0.19 -0.12 0.07 0.00 -0.26 0.00 0.00 64.21 64.09 4pbg n SER 430 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 4pbg n ASN 431 N 0.61 1.90 -0.70 4.04 4.13 -1.24 -4.64 115.26 119.37 4pbg n ASN 431 Ca 0.09 -2.52 0.00 0.00 1.68 0.00 0.00 54.58 53.83 4pbg n ASN 431 Cb 0.36 -0.24 0.00 0.00 -1.54 0.00 0.00 39.78 38.36 4pbg n ASN 431 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 4pbg n GLY 432 N -0.93 -0.97 0.00 7.41 0.00 -1.17 -3.98 105.19 105.56 4pbg n GLY 432 Ca 0.08 -1.06 0.15 0.00 0.00 0.00 0.00 46.02 45.19 4pbg n GLY 432 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 4pbg n TYR 433 N -1.40 0.00 0.09 1.61 4.02 -1.26 -0.87 117.16 119.34 4pbg n TYR 433 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.77 4pbg n TYR 433 Cb 0.00 -0.16 -0.12 0.00 -0.02 0.00 0.00 39.34 39.04 4pbg n TYR 433 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 4pbg h GLU 434 N 0.00 0.16 -5.56 -0.72 4.39 -1.93 -3.41 114.58 107.52 4pbg h GLU 434 Ca 0.00 -0.26 -0.69 0.00 0.34 0.00 0.00 59.36 58.75 4pbg h GLU 434 Cb 0.15 0.09 -0.11 0.00 -0.10 0.00 0.00 28.75 28.79 4pbg h GLU 434 CO 0.00 1.11 1.95 0.21 -1.16 0.00 0.00 179.01 181.12 4pbg s LYS 435 N -2.74 4.01 0.26 2.33 2.20 -1.26 -3.90 119.74 120.65 4pbg s LYS 435 Ca -0.02 -2.14 -0.29 0.00 -0.36 0.00 0.00 55.97 53.16 4pbg s LYS 435 Cb 0.09 -5.40 -0.09 0.00 -1.51 0.00 0.00 37.83 30.91 4pbg s LYS 435 CO 0.85 -2.12 0.94 1.03 -0.36 0.00 0.00 175.35 175.70 4pbg s ARG 436 N 3.51 4.78 0.00 4.03 0.52 -1.23 -4.65 118.95 125.91 4pbg s ARG 436 Ca 0.51 1.46 0.00 0.00 -0.52 0.00 0.00 55.73 57.17 4pbg s ARG 436 Cb 0.02 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.34 4pbg s ARG 436 CO 0.05 0.45 0.00 0.66 0.02 0.00 0.00 175.30 176.48 4pbg n TYR 437 N 1.24 0.00 -1.40 -0.53 4.02 -1.26 -0.89 117.16 118.35 4pbg n TYR 437 Ca -0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.53 4pbg n TYR 437 Cb 0.48 0.00 0.10 0.00 -0.02 0.00 0.00 39.34 39.90 4pbg n TYR 437 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 4pbg s GLY 438 N -0.75 2.42 0.16 2.72 0.00 -1.25 -3.27 107.32 107.34 4pbg s GLY 438 Ca 0.00 0.96 0.08 0.00 0.00 0.00 0.00 44.72 45.76 4pbg s GLY 438 CO 0.00 1.38 1.34 1.41 0.00 0.00 0.00 173.10 177.23 4pbg h LEU 439 N -0.30 0.00 -8.59 0.66 3.38 -1.02 -3.44 115.31 106.00 4pbg h LEU 439 Ca -0.48 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 56.79 4pbg h LEU 439 Cb 1.31 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.76 4pbg h LEU 439 CO 0.49 0.90 -0.89 -0.36 0.09 0.00 0.00 178.44 178.67 4pbg s PHE 440 N -2.86 2.33 -0.24 1.13 0.40 -1.01 -1.94 117.98 115.79 4pbg s PHE 440 Ca 0.01 -0.47 -0.21 0.00 -0.60 0.00 0.00 56.93 55.65 4pbg s PHE 440 Cb 0.10 -1.51 -0.02 0.00 0.51 0.00 0.00 43.02 42.11 4pbg s PHE 440 CO 0.80 -0.06 0.67 -0.47 0.70 0.00 0.00 175.22 176.87 4pbg s TYR 441 N -0.55 3.31 -0.20 0.36 6.14 0.24 -1.36 117.35 125.28 4pbg s TYR 441 Ca 0.08 0.91 -0.13 0.00 0.64 0.00 0.00 57.07 58.57 4pbg s TYR 441 Cb -0.10 -2.88 -0.05 0.00 0.42 0.00 0.00 41.96 39.35 4pbg s TYR 441 CO -0.00 -0.32 0.27 0.08 0.64 0.00 0.00 175.55 176.22 4pbg s VAL 442 N 2.47 5.30 -0.95 3.14 1.01 -1.26 -1.31 120.40 128.81 4pbg s VAL 442 Ca 0.29 0.44 -0.18 0.00 0.00 0.00 0.00 61.98 62.53 4pbg s VAL 442 Cb -0.16 -3.60 0.14 0.00 0.00 0.00 0.00 36.38 32.76 4pbg s VAL 442 CO 0.09 0.34 1.13 -0.62 0.00 0.00 0.00 175.10 176.04 4pbg s ASP 443 N 0.80 6.67 0.44 3.32 -1.08 -0.63 -4.90 116.67 121.29 4pbg s ASP 443 Ca 0.14 -2.15 0.06 0.00 -0.52 0.00 0.00 52.55 50.07 4pbg s ASP 443 Cb -0.13 -2.39 0.31 0.00 -1.46 0.00 0.00 42.92 39.25 4pbg s ASP 443 CO 0.04 -1.01 1.04 -0.26 0.52 0.00 0.00 175.17 175.51 4pbg h PHE 444 N 8.65 0.00 0.00 -5.34 0.04 -1.92 0.62 116.94 118.99 4pbg h PHE 444 Ca 0.17 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.91 4pbg h PHE 444 Cb 1.01 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.16 4pbg h PHE 444 CO 1.15 0.00 -1.19 -0.25 -0.60 0.00 0.00 178.31 177.43 4pbg n ASP 445 N -2.11 0.75 -0.01 2.17 8.00 -1.26 -4.39 116.55 119.71 4pbg n ASP 445 Ca -0.00 0.30 -0.00 0.00 0.71 0.00 0.00 54.79 55.79 4pbg n ASP 445 Cb 0.68 0.58 -0.02 0.00 -0.02 0.00 0.00 41.12 42.35 4pbg n ASP 445 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 4pbg n THR 446 N -2.67 0.07 -1.02 -3.53 -2.24 0.14 -5.01 114.28 100.03 4pbg n THR 446 Ca -0.02 -0.06 -0.01 0.00 -2.27 0.00 0.00 64.05 61.69 4pbg n THR 446 Cb 0.60 -0.29 -0.00 0.00 -2.10 0.00 0.00 70.33 68.54 4pbg n THR 446 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 4pbg n GLN 447 N -1.83 -0.13 -2.45 -0.78 1.13 0.17 -5.02 117.38 108.47 4pbg n GLN 447 Ca -0.02 0.29 -0.41 0.00 -1.94 0.00 0.00 57.00 54.92 4pbg n GLN 447 Cb 0.32 -3.62 -0.03 0.00 0.11 0.00 0.00 30.24 27.02 4pbg n GLN 447 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 4pbg s GLU 448 N -1.12 4.51 -0.03 -1.09 2.02 -1.25 -4.69 118.70 117.05 4pbg s GLU 448 Ca 0.00 1.77 -0.09 0.00 0.02 0.00 0.00 54.97 56.67 4pbg s GLU 448 Cb 0.00 -3.30 -0.05 0.00 0.10 0.00 0.00 34.13 30.88 4pbg s GLU 448 CO 0.00 -0.09 0.26 1.03 0.02 0.00 0.00 175.26 176.49 4pbg s ARG 449 N 0.21 3.62 -0.04 1.61 3.00 -1.26 -1.61 118.95 124.49 4pbg s ARG 449 Ca 0.54 0.03 -0.00 0.00 0.00 0.00 0.00 55.73 56.29 4pbg s ARG 449 Cb -0.30 -3.14 0.03 0.00 0.00 0.00 0.00 34.95 31.53 4pbg s ARG 449 CO 0.33 0.70 0.01 0.71 0.00 0.00 0.00 175.30 177.05 4pbg s TYR 450 N -1.17 0.32 0.25 -0.53 1.51 -0.43 -4.96 117.35 112.35 4pbg s TYR 450 Ca 0.23 0.02 -0.30 0.00 -1.01 0.00 0.00 57.07 56.01 4pbg s TYR 450 Cb -0.14 -0.48 -0.10 0.00 -0.11 0.00 0.00 41.96 41.14 4pbg s TYR 450 CO 0.12 -0.17 1.42 -1.25 -1.11 0.00 0.00 175.55 174.55 4pbg s PRO 451 N 1.37 4.28 0.51 -1.71 0.04 -1.26 -0.59 135.00 137.64 4pbg s PRO 451 Ca -0.05 2.27 0.02 0.00 0.04 0.00 0.00 61.00 63.28 4pbg s PRO 451 Cb -0.13 -3.11 0.02 0.00 0.04 0.00 0.00 34.50 31.31 4pbg s PRO 451 CO -0.03 -0.39 0.72 0.15 0.04 0.00 0.00 177.00 177.50 4pbg s LYS 452 N -0.47 2.73 0.56 4.56 1.02 -0.82 -4.54 119.74 122.79 4pbg s LYS 452 Ca 0.58 -0.73 0.26 0.00 0.02 0.00 0.00 55.97 56.11 4pbg s LYS 452 Cb -0.41 -2.53 1.48 0.00 -0.52 0.00 0.00 37.83 35.84 4pbg s LYS 452 CO 0.44 -0.53 2.02 -0.22 -0.92 0.00 0.00 175.35 176.13 4pbg h LYS 453 N 0.23 0.00 -0.07 1.68 3.64 -1.68 0.35 116.57 120.72 4pbg h LYS 453 Ca -0.43 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 58.82 4pbg h LYS 453 Cb 1.28 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 4pbg h LYS 453 CO 0.53 0.00 -0.53 0.66 -2.27 0.00 0.00 179.45 177.84 4pbg h SER 454 N 0.00 0.21 -0.48 4.20 4.64 -1.83 -1.97 113.55 118.32 4pbg h SER 454 Ca 0.19 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 4pbg h SER 454 Cb 0.84 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.85 4pbg h SER 454 CO -0.00 0.70 0.24 0.00 -0.87 0.00 0.00 176.83 176.91 4pbg h ALA 455 N 1.30 0.62 -0.32 5.18 0.00 -0.40 0.22 119.26 125.85 4pbg h ALA 455 Ca 0.00 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 4pbg h ALA 455 Cb 0.99 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 4pbg h ALA 455 CO 0.08 0.17 -0.15 0.45 0.00 0.00 0.00 179.25 179.80 4pbg h HIS 456 N 0.64 0.62 -0.11 0.00 -0.00 -1.42 -2.31 115.15 112.58 4pbg h HIS 456 Ca 0.17 -0.11 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 4pbg h HIS 456 Cb 0.09 -0.16 -0.00 0.00 -0.00 0.00 0.00 27.41 27.34 4pbg h HIS 456 CO -0.01 0.69 -0.10 2.35 -0.00 0.00 0.00 177.93 180.86 4pbg h TRP 457 N 0.52 0.31 -0.73 2.45 7.01 -0.78 -3.15 115.95 121.58 4pbg h TRP 457 Ca 0.09 -0.09 0.08 0.00 2.11 0.00 0.00 58.89 61.08 4pbg h TRP 457 Cb 0.56 -0.06 -0.05 0.00 -2.10 0.00 0.00 29.16 27.51 4pbg h TRP 457 CO 0.02 0.67 0.48 -0.92 -2.79 0.00 0.00 178.44 175.90 4pbg h TYR 458 N -0.15 0.71 0.27 2.65 3.20 -0.49 -1.71 116.97 121.46 4pbg h TYR 458 Ca 0.02 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 4pbg h TYR 458 Cb 0.62 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 4pbg h TYR 458 CO 0.09 0.35 -0.23 -0.22 -1.64 0.00 0.00 178.16 176.50 4pbg h LYS 459 N 0.68 -0.50 -0.96 1.82 3.64 -1.38 0.33 116.57 120.19 4pbg h LYS 459 Ca 0.33 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.77 4pbg h LYS 459 Cb 0.40 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.28 4pbg h LYS 459 CO -0.12 -0.34 0.63 -0.22 -2.27 0.00 0.00 179.45 177.14 4pbg h LYS 460 N -0.52 1.21 0.25 1.90 3.11 -1.44 0.39 116.57 121.46 4pbg h LYS 460 Ca -0.01 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 57.74 4pbg h LYS 460 Cb 0.47 -0.27 0.00 0.00 -1.00 0.00 0.00 32.23 31.43 4pbg h LYS 460 CO -0.03 0.80 -0.12 1.25 -2.81 0.00 0.00 179.45 178.54 4pbg h LEU 461 N 1.24 -0.28 -0.47 5.20 5.85 -0.69 -1.97 115.31 124.19 4pbg h LEU 461 Ca 0.37 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 59.16 4pbg h LEU 461 Cb -0.04 0.07 -0.10 0.00 0.37 0.00 0.00 40.66 40.96 4pbg h LEU 461 CO -0.10 -0.16 -0.24 0.00 -0.34 0.00 0.00 178.44 177.60 4pbg h ALA 462 N 0.36 0.08 -0.48 1.25 0.00 0.55 0.51 119.26 121.53 4pbg h ALA 462 Ca -0.03 0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 4pbg h ALA 462 Cb 0.29 0.57 -0.08 0.00 0.00 0.00 0.00 17.79 18.58 4pbg h ALA 462 CO 0.06 -0.59 0.17 -0.85 0.00 0.00 0.00 179.25 178.04 4pbg n GLU 463 N -5.41 2.82 0.00 0.00 0.28 0.04 -4.21 120.64 114.17 4pbg n GLU 463 Ca 0.03 -1.98 0.00 0.00 -0.16 0.00 0.00 57.16 55.06 4pbg n GLU 463 Cb 0.32 -1.90 0.00 0.00 1.43 0.00 0.00 31.44 31.29 4pbg n GLU 463 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 4pbg n THR 464 N 0.02 0.00 -2.12 3.84 -1.04 -0.72 -5.01 114.28 109.25 4pbg n THR 464 Ca 0.26 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 62.07 4pbg n THR 464 Cb 1.02 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.49 4pbg n THR 464 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 4pbg n GLN 465 N -0.96 -1.62 -3.96 -2.82 0.00 0.17 -4.91 117.38 103.28 4pbg n GLN 465 Ca 0.00 1.07 -0.35 0.00 0.00 0.00 0.00 57.00 57.72 4pbg n GLN 465 Cb 0.00 -5.63 -0.14 0.00 0.00 0.00 0.00 30.24 24.46 4pbg n GLN 465 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 4pbg s VAL 466 N -2.92 2.96 -0.52 -0.39 1.01 -1.26 -0.16 120.40 119.12 4pbg s VAL 466 Ca 0.00 -0.83 -0.26 0.00 0.00 0.00 0.00 61.98 60.89 4pbg s VAL 466 Cb 0.00 -2.42 0.03 0.00 0.00 0.00 0.00 36.38 33.99 4pbg s VAL 466 CO 0.00 0.31 1.01 -0.63 0.00 0.00 0.00 175.10 175.79 4pbg s ILE 467 N 1.38 4.32 0.00 2.22 1.01 -0.42 -4.77 121.20 124.94 4pbg s ILE 467 Ca 0.03 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.33 4pbg s ILE 467 Cb -0.15 -4.55 0.00 0.00 0.01 0.00 0.00 42.46 37.77 4pbg s ILE 467 CO -0.05 -1.06 0.00 -1.84 0.00 0.00 0.00 174.94 171.99