#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 2.16 0.57 1.12 -4.23 -1.26 -5.10 115.64 108.89 4pbg s THR 2 Ca 0.00 -0.73 -0.08 0.00 -1.18 0.00 0.00 61.69 59.69 4pbg s THR 2 Cb 0.00 -2.43 -0.03 0.00 1.34 0.00 0.00 72.50 71.38 4pbg s THR 2 CO 0.00 0.00 0.93 -0.54 -0.54 0.00 0.00 174.62 174.47 4pbg s LYS 3 N -4.97 3.49 0.11 3.99 3.01 -1.26 -4.94 119.74 119.17 4pbg s LYS 3 Ca 0.65 0.46 0.03 0.00 -1.01 0.00 0.00 55.97 56.10 4pbg s LYS 3 Cb -0.06 -2.21 -0.04 0.00 -1.01 0.00 0.00 37.83 34.52 4pbg s LYS 3 CO 0.42 -0.45 -0.09 0.95 0.51 0.00 0.00 175.35 176.69 4pbg s THR 4 N -3.00 0.91 0.04 2.17 -4.23 -1.26 -1.28 115.64 108.99 4pbg s THR 4 Ca 0.52 -1.78 0.06 0.00 -1.18 0.00 0.00 61.69 59.31 4pbg s THR 4 Cb -0.11 -1.52 -0.03 0.00 1.34 0.00 0.00 72.50 72.18 4pbg s THR 4 CO 0.50 -0.67 -0.15 -0.76 -0.54 0.00 0.00 174.62 173.00 4pbg s LEU 5 N -2.72 2.79 0.30 4.79 1.43 0.38 -4.85 118.68 120.80 4pbg s LEU 5 Ca 0.09 -0.36 -0.27 0.00 -1.03 0.00 0.00 54.13 52.56 4pbg s LEU 5 Cb 0.00 -1.62 -0.14 0.00 0.03 0.00 0.00 46.19 44.46 4pbg s LEU 5 CO -0.01 0.25 0.82 -0.81 0.23 0.00 0.00 176.35 176.83 4pbg n PRO 6 N 1.44 0.91 0.29 1.29 -0.04 -1.26 -4.81 135.00 132.83 4pbg n PRO 6 Ca -0.16 0.32 0.18 0.00 -0.04 0.00 0.00 63.50 63.81 4pbg n PRO 6 Cb 0.52 -1.61 0.98 0.00 -0.04 0.00 0.00 33.50 33.36 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 1.53 0.00 -0.60 0.54 3.64 -1.98 -2.45 116.57 117.25 4pbg h LYS 7 Ca -0.37 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 58.65 4pbg h LYS 7 Cb 1.37 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.98 4pbg h LYS 7 CO 0.58 0.00 0.05 -0.40 -2.27 0.00 0.00 179.45 177.41 4pbg n ASP 8 N -2.82 3.75 -4.82 4.20 5.68 -1.26 -5.02 116.55 116.25 4pbg n ASP 8 Ca -0.02 -3.77 -0.34 0.00 -0.50 0.00 0.00 54.79 50.16 4pbg n ASP 8 Cb 0.13 -0.67 -0.07 0.00 -1.14 0.00 0.00 41.12 39.37 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 -3.40 3.43 -0.26 2.11 5.36 -0.92 -4.93 117.98 119.36 4pbg s PHE 9 Ca 0.50 1.48 -0.14 0.00 -0.96 0.00 0.00 56.93 57.82 4pbg s PHE 9 Cb 0.43 -2.73 -0.04 0.00 -0.34 0.00 0.00 43.02 40.34 4pbg s PHE 9 CO 0.02 0.06 0.31 0.42 -1.46 0.00 0.00 175.22 174.56 4pbg s ILE 10 N -1.96 5.23 -0.80 3.12 1.01 -1.01 -4.98 121.20 121.81 4pbg s ILE 10 Ca 0.55 0.45 -0.06 0.00 0.00 0.00 0.00 60.65 61.59 4pbg s ILE 10 Cb -0.12 -3.64 0.21 0.00 0.01 0.00 0.00 42.46 38.92 4pbg s ILE 10 CO 0.17 0.22 0.69 -0.36 0.00 0.00 0.00 174.94 175.66 4pbg s PHE 11 N 1.75 3.72 0.04 3.97 0.08 -1.26 0.02 117.98 126.30 4pbg s PHE 11 Ca 0.13 -2.59 0.01 0.00 0.12 0.00 0.00 56.93 54.60 4pbg s PHE 11 Cb -0.15 -3.45 0.01 0.00 -0.57 0.00 0.00 43.02 38.85 4pbg s PHE 11 CO 0.09 -0.87 0.06 0.41 -0.10 0.00 0.00 175.22 174.81 4pbg n GLY 12 N 3.25 2.03 3.01 4.36 0.00 0.88 -2.61 105.19 116.10 4pbg n GLY 12 Ca 0.15 -2.14 -0.09 0.00 0.00 0.00 0.00 46.02 43.94 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 -2.15 0.24 0.18 -0.02 0.00 -1.05 -2.65 107.32 101.87 4pbg s GLY 13 Ca 0.04 -0.61 0.11 0.00 0.00 0.00 0.00 44.72 44.26 4pbg s GLY 13 CO 0.03 -0.69 -0.23 0.00 0.00 0.00 0.00 173.10 172.20 4pbg s ALA 14 N -1.77 2.44 0.31 3.20 0.00 -0.75 -2.15 121.76 123.04 4pbg s ALA 14 Ca -0.13 -1.60 -0.05 0.00 0.00 0.00 0.00 51.96 50.18 4pbg s ALA 14 Cb -0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.74 4pbg s ALA 14 CO -0.02 0.41 0.45 0.95 0.00 0.00 0.00 175.76 177.55 4pbg s THR 15 N -1.69 0.00 -0.09 0.00 -4.23 -1.01 -1.89 115.64 106.74 4pbg s THR 15 Ca 0.19 -1.59 -0.07 0.00 -1.18 0.00 0.00 61.69 59.04 4pbg s THR 15 Cb -0.08 -2.54 0.02 0.00 1.34 0.00 0.00 72.50 71.25 4pbg s THR 15 CO 0.09 0.00 0.22 0.00 -0.54 0.00 0.00 174.62 174.39 4pbg s ALA 16 N -3.35 -0.55 0.03 3.99 0.00 -1.26 -4.51 121.76 116.12 4pbg s ALA 16 Ca 0.29 0.67 -0.12 0.00 0.00 0.00 0.00 51.96 52.80 4pbg s ALA 16 Cb 0.00 -0.39 -0.06 0.00 0.00 0.00 0.00 23.12 22.67 4pbg s ALA 16 CO 0.17 -0.12 1.19 0.00 0.00 0.00 0.00 175.76 177.01 4pbg h ALA 17 N 5.97 -0.81 -0.50 0.00 0.00 -1.91 0.10 119.26 122.10 4pbg h ALA 17 Ca -0.27 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 54.68 4pbg h ALA 17 Cb 1.19 0.50 -0.09 0.00 0.00 0.00 0.00 17.79 19.39 4pbg h ALA 17 CO 0.37 -0.84 -0.08 -0.92 0.00 0.00 0.00 179.25 177.78 4pbg h TYR 18 N -0.31 -0.18 -0.84 0.00 3.20 -1.94 0.20 116.97 117.09 4pbg h TYR 18 Ca -0.01 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 4pbg h TYR 18 Cb 0.29 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 4pbg h TYR 18 CO -0.22 -0.18 0.43 1.96 -1.64 0.00 0.00 178.16 178.51 4pbg h GLN 19 N 0.04 1.18 0.00 1.82 4.20 -1.88 -3.38 115.11 117.10 4pbg h GLN 19 Ca 0.25 -0.15 -0.21 0.00 0.06 0.00 0.00 58.65 58.59 4pbg h GLN 19 Cb 0.38 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.90 4pbg h GLN 19 CO -0.48 0.89 -1.31 0.00 -0.67 0.00 0.00 178.83 177.26 4pbg n ALA 20 N -2.40 0.79 -0.10 3.87 0.00 0.01 -3.98 120.51 118.70 4pbg n ALA 20 Ca 0.08 -0.59 -0.09 0.00 0.00 0.00 0.00 53.44 52.85 4pbg n ALA 20 Cb 0.11 -0.32 -0.03 0.00 0.00 0.00 0.00 19.45 19.22 4pbg n ALA 20 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 4pbg h GLU 21 N -1.00 -0.30 0.00 0.00 5.08 -0.78 -1.12 114.58 116.46 4pbg h GLU 21 Ca -0.32 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 4pbg h GLU 21 Cb 1.19 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.50 4pbg h GLU 21 CO -0.20 -0.20 0.00 0.41 -1.00 0.00 0.00 179.01 178.02 4pbg n GLY 22 N -1.42 -0.54 3.98 -3.84 0.00 -1.26 -2.65 105.19 99.46 4pbg n GLY 22 Ca -0.00 -1.11 -0.30 0.00 0.00 0.00 0.00 46.02 44.61 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 3.82 -2.18 0.28 4.61 0.00 -1.26 -4.84 120.51 120.93 4pbg n ALA 23 Ca 0.00 -0.33 0.17 0.00 0.00 0.00 0.00 53.44 53.28 4pbg n ALA 23 Cb 0.00 -1.98 0.70 0.00 0.00 0.00 0.00 19.45 18.16 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 -1.93 0.05 -0.51 0.00 1.35 -1.91 -3.08 112.91 106.87 4pbg h THR 24 Ca -0.65 -0.53 -0.33 0.00 -0.55 0.00 0.00 66.41 64.35 4pbg h THR 24 Cb 1.38 1.50 -0.40 0.00 -1.73 0.00 0.00 68.15 68.90 4pbg h THR 24 CO 0.60 0.02 -1.02 1.41 -0.25 0.00 0.00 175.52 176.28 4pbg n HIS 25 N -3.12 1.67 -4.93 4.73 8.25 -1.26 -4.71 115.22 115.85 4pbg n HIS 25 Ca 0.00 -2.12 -0.33 0.00 -0.26 0.00 0.00 57.72 55.02 4pbg n HIS 25 Cb 0.30 -0.26 -0.14 0.00 1.12 0.00 0.00 29.99 31.02 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 -3.95 2.95 -1.57 1.59 2.01 -1.17 -4.71 115.64 110.79 4pbg s THR 26 Ca 0.35 -0.76 -0.11 0.00 0.31 0.00 0.00 61.69 61.48 4pbg s THR 26 Cb 0.35 -2.15 0.09 0.00 0.01 0.00 0.00 72.50 70.80 4pbg s THR 26 CO -0.02 0.59 0.68 0.47 -0.69 0.00 0.00 174.62 175.65 4pbg n ASP 27 N 2.42 -2.42 0.00 3.53 8.00 -1.26 -1.78 116.55 125.04 4pbg n ASP 27 Ca -0.17 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.36 4pbg n ASP 27 Cb 0.52 -3.06 0.00 0.00 -0.02 0.00 0.00 41.12 38.56 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 -1.66 0.62 3.72 0.44 0.00 -1.26 -4.41 105.19 102.64 4pbg n GLY 28 Ca -0.08 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.60 4.25 0.49 1.61 2.20 -0.73 -4.70 119.74 122.25 4pbg s LYS 29 Ca 0.00 2.28 -0.09 0.00 -0.36 0.00 0.00 55.97 57.79 4pbg s LYS 29 Cb 0.00 -3.18 -0.05 0.00 -1.51 0.00 0.00 37.83 33.09 4pbg s LYS 29 CO 0.00 -0.55 0.86 0.20 -0.36 0.00 0.00 175.35 175.50 4pbg s GLY 30 N 1.08 1.73 0.64 5.54 0.00 0.07 -4.72 107.32 111.65 4pbg s GLY 30 Ca 0.68 -0.24 -0.16 0.00 0.00 0.00 0.00 44.72 45.00 4pbg s GLY 30 CO 0.32 -0.03 1.13 2.56 0.00 0.00 0.00 173.10 177.08 4pbg s PRO 31 N -4.50 2.84 0.22 2.90 0.04 -1.26 -4.82 135.00 130.42 4pbg s PRO 31 Ca 0.52 1.51 0.06 0.00 0.04 0.00 0.00 61.00 63.13 4pbg s PRO 31 Cb -0.10 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.44 4pbg s PRO 31 CO 0.41 -1.24 -0.10 0.54 0.04 0.00 0.00 177.00 176.66 4pbg s VAL 32 N -2.13 1.53 0.29 -0.36 0.11 -1.26 -0.50 120.40 118.08 4pbg s VAL 32 Ca 0.70 -2.14 0.03 0.00 -2.93 0.00 0.00 61.98 57.63 4pbg s VAL 32 Cb -0.23 -2.16 0.28 0.00 -1.53 0.00 0.00 36.38 32.74 4pbg s VAL 32 CO 0.38 -0.51 1.77 0.00 -3.33 0.00 0.00 175.10 173.42 4pbg h ALA 33 N 2.51 1.51 0.00 1.54 0.00 -1.88 -1.53 119.26 121.41 4pbg h ALA 33 Ca -0.38 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.61 4pbg h ALA 33 Cb 1.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.95 4pbg h ALA 33 CO 0.64 -0.06 0.00 -1.49 0.00 0.00 0.00 179.25 178.34 4pbg h TRP 34 N 0.71 0.00 0.00 0.00 4.06 -1.94 -2.45 115.95 116.33 4pbg h TRP 34 Ca 0.53 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.48 4pbg h TRP 34 Cb 0.80 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.96 4pbg h TRP 34 CO -0.04 0.00 -0.00 -0.44 -3.56 0.00 0.00 178.44 174.40 4pbg h ASP 35 N 0.00 -0.00 0.13 -3.49 3.32 -1.69 -2.80 116.42 111.89 4pbg h ASP 35 Ca 0.00 -0.24 -0.20 0.00 0.02 0.00 0.00 57.03 56.60 4pbg h ASP 35 Cb 0.08 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.64 4pbg h ASP 35 CO 0.00 0.24 -0.96 0.50 -1.72 0.00 0.00 179.24 177.31 4pbg h LYS 36 N -0.24 0.27 0.11 3.56 1.63 -1.69 -3.36 116.57 116.85 4pbg h LYS 36 Ca -0.00 -0.46 0.02 0.00 -0.85 0.00 0.00 60.65 59.36 4pbg h LYS 36 Cb 0.24 0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 32.00 4pbg h LYS 36 CO 0.00 1.22 -0.38 -0.92 -3.45 0.00 0.00 179.45 175.92 4pbg h TYR 37 N -0.39 -1.06 -0.74 1.91 3.20 -1.54 -1.87 116.97 116.48 4pbg h TYR 37 Ca -0.19 0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.81 4pbg h TYR 37 Cb 1.65 0.45 -0.05 0.00 1.54 0.00 0.00 36.73 40.32 4pbg h TYR 37 CO 0.18 -0.48 0.49 -0.07 -1.64 0.00 0.00 178.16 176.63 4pbg h LEU 38 N -0.61 0.56 -0.53 2.82 3.38 -1.70 0.30 115.31 119.53 4pbg h LEU 38 Ca 0.03 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 4pbg h LEU 38 Cb 0.64 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 4pbg h LEU 38 CO -0.23 0.33 0.10 -0.08 0.09 0.00 0.00 178.44 178.65 4pbg h GLU 39 N 0.61 0.87 0.00 1.13 4.81 -1.58 -0.34 114.58 120.08 4pbg h GLU 39 Ca 0.34 -0.22 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 4pbg h GLU 39 Cb 0.51 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 4pbg h GLU 39 CO -0.12 0.84 -1.15 -0.44 -0.73 0.00 0.00 179.01 177.40 4pbg h ASP 40 N 0.76 0.00 0.00 1.04 3.32 -0.45 -3.40 116.42 117.69 4pbg h ASP 40 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 4pbg h ASP 40 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 4pbg h ASP 40 CO 0.01 0.60 -0.41 0.59 -1.72 0.00 0.00 179.24 178.31 4pbg n ASN 41 N -3.02 0.73 -3.44 6.45 3.02 0.93 -5.05 115.26 114.88 4pbg n ASN 41 Ca -0.06 -0.55 -0.20 0.00 -0.03 0.00 0.00 54.58 53.74 4pbg n ASN 41 Cb 0.83 1.04 -0.05 0.00 -0.61 0.00 0.00 39.78 40.98 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 -1.22 0.35 -1.47 3.10 4.02 -0.14 -5.02 117.16 116.78 4pbg n TYR 42 Ca 0.01 -1.85 -0.10 0.00 -0.01 0.00 0.00 57.90 55.95 4pbg n TYR 42 Cb 0.10 -0.09 0.18 0.00 -0.02 0.00 0.00 39.34 39.51 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 -0.74 1.54 -3.67 -0.72 2.14 -1.26 -4.67 117.44 110.05 4pbg n TRP 43 Ca -0.08 -1.77 -0.06 0.00 2.07 0.00 0.00 57.50 57.66 4pbg n TRP 43 Cb 0.45 -0.59 -0.02 0.00 -0.81 0.00 0.00 31.31 30.34 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 -3.32 -0.24 0.40 -2.67 1.13 -1.26 -5.05 117.35 106.35 4pbg s TYR 44 Ca 0.48 -0.04 0.03 0.00 -1.41 0.00 0.00 57.07 56.13 4pbg s TYR 44 Cb 0.42 0.62 -0.03 0.00 -1.10 0.00 0.00 41.96 41.86 4pbg s TYR 44 CO 0.01 -0.82 0.09 0.95 -2.51 0.00 0.00 175.55 173.28 4pbg s THR 45 N -3.38 0.84 -1.42 -3.49 -4.23 -1.26 -4.37 115.64 98.33 4pbg s THR 45 Ca 0.09 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.62 4pbg s THR 45 Cb -0.02 -2.44 0.07 0.00 1.34 0.00 0.00 72.50 71.45 4pbg s THR 45 CO -0.02 0.00 0.81 0.00 -0.54 0.00 0.00 174.62 174.87 4pbg n ALA 46 N -0.91 2.56 -2.86 3.99 0.00 -1.26 -4.67 120.51 117.36 4pbg n ALA 46 Ca -0.07 -0.14 -0.31 0.00 0.00 0.00 0.00 53.44 52.91 4pbg n ALA 46 Cb 0.66 -1.00 -0.17 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.50 2.58 0.00 0.00 0.41 -1.26 -3.59 118.70 115.34 4pbg s GLU 47 Ca 0.05 -0.87 0.27 0.00 -0.41 0.00 0.00 54.97 54.01 4pbg s GLU 47 Cb 0.03 -2.13 0.96 0.00 -1.78 0.00 0.00 34.13 31.21 4pbg s GLU 47 CO 0.02 0.32 1.71 -0.35 -0.49 0.00 0.00 175.26 176.48 4pbg n PRO 48 N 3.09 0.34 0.00 0.39 -0.04 -1.26 -5.10 135.00 132.42 4pbg n PRO 48 Ca -0.18 -0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.14 4pbg n PRO 48 Cb 0.52 -1.50 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 -1.21 0.00 -0.67 0.55 0.00 -1.24 -2.64 120.51 115.31 4pbg n ALA 49 Ca 0.10 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.63 4pbg n ALA 49 Cb 0.32 0.00 0.36 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 -2.54 4.84 -4.27 0.00 7.64 -1.03 -4.95 113.62 113.31 4pbg n SER 50 Ca 0.00 -2.53 -0.36 0.00 1.01 0.00 0.00 58.87 56.99 4pbg n SER 50 Cb 0.00 -0.59 -0.04 0.00 -1.01 0.00 0.00 64.21 62.57 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 0.98 -2.27 -0.02 6.43 2.03 -0.90 -4.83 116.55 117.97 4pbg n ASP 51 Ca 0.26 -1.09 0.15 0.00 0.52 0.00 0.00 54.79 54.63 4pbg n ASP 51 Cb 0.93 -2.44 0.58 0.00 -0.72 0.00 0.00 41.12 39.47 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 -1.43 0.23 -0.60 -0.67 3.57 -0.98 -2.36 116.94 114.71 4pbg h PHE 52 Ca -0.60 0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.08 4pbg h PHE 52 Cb 1.39 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 4pbg h PHE 52 CO 0.63 0.11 0.52 -0.92 -2.23 0.00 0.00 178.31 176.42 4pbg h TYR 53 N 0.22 0.00 0.00 0.41 3.20 -1.76 -1.28 116.97 117.76 4pbg h TYR 53 Ca 0.24 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.11 4pbg h TYR 53 Cb 0.66 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.93 4pbg h TYR 53 CO -0.00 0.00 0.00 0.72 -1.64 0.00 0.00 178.16 177.24 4pbg n HIS 54 N -3.95 0.00 0.54 -3.82 8.25 -0.93 -4.73 115.22 110.58 4pbg n HIS 54 Ca 0.12 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.66 4pbg n HIS 54 Cb 0.75 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.97 4pbg n HIS 54 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 4pbg n LYS 55 N -0.91 1.65 0.16 -0.41 4.76 -0.60 -4.54 118.16 118.27 4pbg n LYS 55 Ca 0.00 -1.68 0.17 0.00 -2.87 0.00 0.00 58.31 53.93 4pbg n LYS 55 Cb 0.00 -1.35 0.78 0.00 -1.84 0.00 0.00 35.03 32.62 4pbg n LYS 55 CO 0.00 0.00 0.00 0.10 -1.37 0.00 0.00 177.40 176.13 4pbg h TYR 56 N 3.35 0.00 0.00 2.13 -0.00 -1.56 -0.36 116.97 120.53 4pbg h TYR 56 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.64 4pbg h TYR 56 Cb 0.75 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.46 4pbg h TYR 56 CO 0.06 0.00 -0.43 -1.00 -0.00 0.00 0.00 178.16 176.80 4pbg h PRO 57 N 0.00 0.00 0.03 0.10 0.13 -1.88 -1.03 132.00 129.34 4pbg h PRO 57 Ca 0.12 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.25 4pbg h PRO 57 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 4pbg h PRO 57 CO -0.00 0.43 -0.01 0.28 -0.23 0.00 0.00 178.00 178.46 4pbg h VAL 58 N 0.00 0.84 -0.99 1.56 2.07 -1.46 -2.59 116.25 115.69 4pbg h VAL 58 Ca -0.00 -1.55 0.12 0.00 0.82 0.00 0.00 66.70 66.08 4pbg h VAL 58 Cb 0.85 1.57 -0.08 0.00 -1.52 0.00 0.00 31.29 32.10 4pbg h VAL 58 CO 0.06 0.28 0.63 0.44 0.02 0.00 0.00 177.57 178.99 4pbg h ASP 59 N -0.98 0.91 -0.20 0.57 3.32 -1.19 -1.50 116.42 117.34 4pbg h ASP 59 Ca -0.00 0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 4pbg h ASP 59 Cb 0.48 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 4pbg h ASP 59 CO 0.01 0.49 -0.23 -0.07 -1.72 0.00 0.00 179.24 177.72 4pbg h LEU 60 N 0.98 0.54 -0.36 1.55 3.38 -1.29 0.09 115.31 120.21 4pbg h LEU 60 Ca 0.48 -0.49 0.03 0.00 0.09 0.00 0.00 57.88 57.99 4pbg h LEU 60 Cb 0.48 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 4pbg h LEU 60 CO -0.25 0.93 0.18 -0.08 0.09 0.00 0.00 178.44 179.30 4pbg h GLU 61 N 0.17 0.35 0.47 1.13 4.81 -1.02 -0.33 114.58 120.17 4pbg h GLU 61 Ca 0.03 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 4pbg h GLU 61 Cb 0.78 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.09 4pbg h GLU 61 CO 0.05 0.23 -0.23 -0.07 -0.73 0.00 0.00 179.01 178.27 4pbg h LEU 62 N 0.36 -0.54 -1.35 1.64 3.38 -1.28 0.21 115.31 117.73 4pbg h LEU 62 Ca 0.15 -0.01 0.28 0.00 0.09 0.00 0.00 57.88 58.40 4pbg h LEU 62 Cb 0.07 0.14 -0.10 0.00 0.09 0.00 0.00 40.66 40.86 4pbg h LEU 62 CO -0.11 -0.35 0.68 0.00 0.09 0.00 0.00 178.44 178.75 4pbg h ALA 63 N -0.18 2.26 0.04 1.53 0.00 -0.65 0.50 119.26 122.75 4pbg h ALA 63 Ca -0.07 0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 4pbg h ALA 63 Cb 0.51 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.36 4pbg h ALA 63 CO 0.11 -0.69 -1.06 1.49 0.00 0.00 0.00 179.25 179.09 4pbg h GLU 64 N 0.37 0.52 -0.29 0.00 4.81 -0.41 0.54 114.58 120.12 4pbg h GLU 64 Ca 0.62 -0.61 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 4pbg h GLU 64 Cb 1.60 0.19 -0.02 0.00 0.63 0.00 0.00 28.75 31.15 4pbg h GLU 64 CO -0.32 1.23 0.11 1.49 -0.73 0.00 0.00 179.01 180.79 4pbg h GLU 65 N 0.27 0.41 -0.97 1.92 4.81 0.31 -2.87 114.58 118.46 4pbg h GLU 65 Ca -0.12 -0.05 -0.62 0.00 -0.13 0.00 0.00 59.36 58.44 4pbg h GLU 65 Cb 1.72 -0.08 -0.30 0.00 0.63 0.00 0.00 28.75 30.72 4pbg h GLU 65 CO 0.19 0.35 0.70 0.66 -0.73 0.00 0.00 179.01 180.19 4pbg n TYR 66 N -4.41 3.11 -2.51 0.92 4.02 0.08 -4.95 117.16 113.42 4pbg n TYR 66 Ca 0.01 -2.70 -0.11 0.00 -0.01 0.00 0.00 57.90 55.10 4pbg n TYR 66 Cb 0.14 -1.26 -0.00 0.00 -0.02 0.00 0.00 39.34 38.20 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 -0.96 -0.50 3.55 2.72 0.00 -1.08 -4.16 105.19 104.76 4pbg n GLY 67 Ca 0.60 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.53 4.82 -2.08 1.61 1.01 0.17 -4.79 120.40 118.61 4pbg s VAL 68 Ca 0.03 0.48 0.22 0.00 0.00 0.00 0.00 61.98 62.71 4pbg s VAL 68 Cb -0.01 -4.16 0.53 0.00 0.00 0.00 0.00 36.38 32.74 4pbg s VAL 68 CO 0.03 -0.46 1.46 -0.46 0.00 0.00 0.00 175.10 175.67 4pbg n ASN 69 N 6.24 3.68 -3.80 3.32 6.94 -1.07 -4.42 115.26 126.14 4pbg n ASN 69 Ca -0.00 -1.99 -0.12 0.00 -0.02 0.00 0.00 54.58 52.45 4pbg n ASN 69 Cb 0.48 -0.37 -0.09 0.00 -2.36 0.00 0.00 39.78 37.44 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 -1.18 -0.08 -0.21 4.83 0.00 -1.26 -1.76 107.32 107.66 4pbg s GLY 70 Ca 0.43 0.11 -0.09 0.00 0.00 0.00 0.00 44.72 45.16 4pbg s GLY 70 CO 0.31 -0.08 0.48 -1.50 0.00 0.00 0.00 173.10 172.31 4pbg s ILE 71 N -1.62 -0.36 0.01 0.90 2.07 -0.23 -2.53 121.20 119.44 4pbg s ILE 71 Ca -0.12 0.10 -0.24 0.00 -1.41 0.00 0.00 60.65 58.98 4pbg s ILE 71 Cb -0.05 -0.73 -0.05 0.00 0.13 0.00 0.00 42.46 41.76 4pbg s ILE 71 CO 0.02 0.04 0.71 -0.13 -1.91 0.00 0.00 174.94 173.67 4pbg s ARG 72 N 2.06 4.44 0.04 3.50 0.52 -0.91 -0.26 118.95 128.33 4pbg s ARG 72 Ca -0.06 0.95 -0.02 0.00 -0.52 0.00 0.00 55.73 56.08 4pbg s ARG 72 Cb -0.10 -3.37 -0.02 0.00 0.52 0.00 0.00 34.95 31.98 4pbg s ARG 72 CO -0.14 0.27 0.02 0.42 0.02 0.00 0.00 175.30 175.88 4pbg s ILE 73 N 0.05 0.15 0.20 1.52 1.01 0.10 -2.41 121.20 121.83 4pbg s ILE 73 Ca 0.37 -1.24 0.10 0.00 0.00 0.00 0.00 60.65 59.87 4pbg s ILE 73 Cb -0.19 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.36 4pbg s ILE 73 CO 0.21 -0.68 -0.19 -0.94 0.00 0.00 0.00 174.94 173.33 4pbg s SER 74 N -2.14 2.99 -0.28 3.58 1.04 -1.26 -1.07 113.70 116.56 4pbg s SER 74 Ca -0.05 -0.93 -0.09 0.00 0.48 0.00 0.00 55.95 55.37 4pbg s SER 74 Cb -0.01 -0.20 -0.02 0.00 0.10 0.00 0.00 66.02 65.88 4pbg s SER 74 CO -0.05 -0.01 0.12 -0.63 0.98 0.00 0.00 173.24 173.64 4pbg s ILE 75 N -2.24 4.54 -0.59 -1.02 1.01 -0.30 -4.42 121.20 118.20 4pbg s ILE 75 Ca 0.21 -0.23 -0.26 0.00 0.00 0.00 0.00 60.65 60.37 4pbg s ILE 75 Cb -0.05 -3.21 -0.06 0.00 0.01 0.00 0.00 42.46 39.15 4pbg s ILE 75 CO 0.09 0.22 2.22 0.00 0.00 0.00 0.00 174.94 177.47 4pbg s ALA 76 N 1.63 1.69 0.37 9.38 0.00 -1.26 -4.61 121.76 128.95 4pbg s ALA 76 Ca 0.06 -0.36 0.18 0.00 0.00 0.00 0.00 51.96 51.83 4pbg s ALA 76 Cb -0.16 -4.37 1.14 0.00 0.00 0.00 0.00 23.12 19.73 4pbg s ALA 76 CO 0.06 -4.48 1.68 2.35 0.00 0.00 0.00 175.76 175.36 4pbg h TRP 77 N 16.98 0.83 0.00 0.00 2.91 -1.81 0.28 115.95 135.14 4pbg h TRP 77 Ca -0.20 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.85 4pbg h TRP 77 Cb 1.19 -0.22 0.00 0.00 -0.51 0.00 0.00 29.16 29.62 4pbg h TRP 77 CO 1.02 -0.13 0.00 -1.13 -1.03 0.00 0.00 178.44 177.17 4pbg n SER 78 N -4.92 0.00 -0.03 2.65 3.41 -1.26 -1.64 113.62 111.83 4pbg n SER 78 Ca 0.31 -1.34 0.04 0.00 -0.26 0.00 0.00 58.87 57.63 4pbg n SER 78 Cb 1.03 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.83 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 -0.80 0.71 -0.10 4.33 0.63 0.99 -0.75 116.66 121.66 4pbg n ARG 79 Ca 0.14 -0.13 -0.17 0.00 -0.92 0.00 0.00 57.85 56.77 4pbg n ARG 79 Cb 0.06 -1.49 -0.07 0.00 0.45 0.00 0.00 32.46 31.41 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 -2.36 1.50 -3.88 5.15 2.08 -1.13 -4.03 119.36 116.69 4pbg n ILE 80 Ca -0.12 0.01 -0.31 0.00 0.56 0.00 0.00 62.75 62.89 4pbg n ILE 80 Cb 0.71 -2.15 -0.12 0.00 -0.75 0.00 0.00 39.64 37.33 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 -2.40 3.39 -0.92 1.39 0.08 -0.65 0.26 117.98 119.12 4pbg s PHE 81 Ca -0.26 -3.15 0.00 0.00 0.12 0.00 0.00 56.93 53.64 4pbg s PHE 81 Cb 0.06 -2.88 0.00 0.00 -0.57 0.00 0.00 43.02 39.63 4pbg s PHE 81 CO 0.45 -0.70 0.51 -2.30 -0.10 0.00 0.00 175.22 173.09 4pbg n PRO 82 N 2.75 0.00 0.00 0.24 -0.02 -1.24 -0.26 135.00 136.48 4pbg n PRO 82 Ca 0.11 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 4pbg n PRO 82 Cb 0.34 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 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 -1.01 0.07 0.00 3.45 -2.24 -1.26 -4.40 114.28 108.88 4pbg n THR 83 Ca 0.00 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 4pbg n THR 83 Cb 0.09 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 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 -0.04 2.91 3.55 3.38 0.00 0.65 -4.70 105.19 110.94 4pbg n GLY 84 Ca 0.00 -0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.45 -0.38 0.00 1.61 -0.85 -1.26 -4.85 117.35 109.17 4pbg s TYR 85 Ca 0.00 0.14 0.00 0.00 -0.52 0.00 0.00 57.07 56.69 4pbg s TYR 85 Cb 0.00 0.59 0.00 0.00 0.38 0.00 0.00 41.96 42.93 4pbg s TYR 85 CO 0.00 -0.84 0.00 0.41 -1.52 0.00 0.00 175.55 173.60 4pbg n GLY 86 N -0.37 0.96 3.71 5.49 0.00 -1.26 -4.93 105.19 108.79 4pbg n GLY 86 Ca -0.11 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 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 2.40 2.25 -3.89 1.61 -0.58 -1.26 -5.00 120.64 116.18 4pbg n GLU 87 Ca 0.00 0.79 -0.33 0.00 -0.42 0.00 0.00 57.16 57.20 4pbg n GLU 87 Cb 0.00 -2.42 -0.05 0.00 -0.57 0.00 0.00 31.44 28.40 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 -0.93 5.41 -0.49 2.62 1.01 -1.26 -4.44 120.40 122.32 4pbg s VAL 88 Ca 0.57 -0.15 -0.15 0.00 0.00 0.00 0.00 61.98 62.25 4pbg s VAL 88 Cb -0.56 -3.56 0.09 0.00 0.00 0.00 0.00 36.38 32.36 4pbg s VAL 88 CO 0.60 0.30 0.42 0.21 0.00 0.00 0.00 175.10 176.63 4pbg s ASN 89 N -1.99 6.10 0.15 3.32 2.47 0.14 -4.97 114.94 120.16 4pbg s ASN 89 Ca 0.29 -1.51 -0.25 0.00 0.42 0.00 0.00 52.86 51.81 4pbg s ASN 89 Cb -0.13 -2.17 0.01 0.00 -1.45 0.00 0.00 41.25 37.51 4pbg s ASN 89 CO 0.20 -0.71 1.59 -0.33 -3.72 0.00 0.00 177.10 174.14 4pbg h GLU 90 N 8.76 -0.33 -0.51 0.43 3.07 -1.89 -1.73 114.58 122.38 4pbg h GLU 90 Ca -0.28 0.02 0.12 0.00 -0.50 0.00 0.00 59.36 58.72 4pbg h GLU 90 Cb 1.10 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 29.06 4pbg h GLU 90 CO 0.92 -0.22 0.35 0.87 -1.40 0.00 0.00 179.01 179.53 4pbg h LYS 91 N -0.34 0.17 0.67 2.33 1.57 -1.91 0.15 116.57 119.21 4pbg h LYS 91 Ca 0.13 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 4pbg h LYS 91 Cb 0.56 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.84 4pbg h LYS 91 CO -0.47 0.11 -0.32 0.78 -0.57 0.00 0.00 179.45 178.98 4pbg h GLY 92 N 0.17 -0.94 0.27 3.86 0.00 -1.47 -1.93 103.07 103.04 4pbg h GLY 92 Ca 0.24 0.35 0.19 0.00 0.00 0.00 0.00 47.33 48.10 4pbg h GLY 92 CO -0.04 -0.34 0.61 -2.08 0.00 0.00 0.00 176.54 174.69 4pbg h VAL 93 N -1.18 0.72 -0.66 4.60 2.07 -0.83 -0.59 116.25 120.38 4pbg h VAL 93 Ca -0.09 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 4pbg h VAL 93 Cb 0.71 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 4pbg h VAL 93 CO 0.15 0.11 0.33 -0.08 0.02 0.00 0.00 177.57 178.10 4pbg h GLU 94 N 0.60 0.94 0.12 1.57 4.81 -0.58 -2.90 114.58 119.14 4pbg h GLU 94 Ca 0.51 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 4pbg h GLU 94 Cb 0.99 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.20 4pbg h GLU 94 CO -0.26 0.74 -0.06 0.35 -0.73 0.00 0.00 179.01 179.05 4pbg h PHE 95 N 0.91 -0.15 -0.59 0.92 3.57 -0.29 -2.40 116.94 118.90 4pbg h PHE 95 Ca 0.23 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.76 4pbg h PHE 95 Cb 0.10 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 4pbg h PHE 95 CO 0.00 -0.07 0.39 1.88 -2.23 0.00 0.00 178.31 178.28 4pbg h TYR 96 N -0.19 0.65 -0.45 0.41 0.05 -1.33 -0.40 116.97 115.70 4pbg h TYR 96 Ca -0.02 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.70 4pbg h TYR 96 Cb 0.15 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 4pbg h TYR 96 CO -0.06 0.37 -0.01 0.45 -1.05 0.00 0.00 178.16 177.86 4pbg h HIS 97 N 0.67 0.88 -0.50 4.88 3.86 -1.36 0.29 115.15 123.87 4pbg h HIS 97 Ca 0.24 -0.16 -0.03 0.00 -1.16 0.00 0.00 60.37 59.26 4pbg h HIS 97 Cb 0.12 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 4pbg h HIS 97 CO -0.00 0.86 0.18 0.87 0.86 0.00 0.00 177.93 180.70 4pbg h LYS 98 N 0.65 0.76 0.88 2.45 1.57 -0.78 -0.74 116.57 121.35 4pbg h LYS 98 Ca 0.13 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 4pbg h LYS 98 Cb 0.51 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.72 4pbg h LYS 98 CO 0.03 0.69 -0.42 1.25 -0.57 0.00 0.00 179.45 180.42 4pbg h LEU 99 N 0.66 -1.01 -1.00 2.94 5.85 -0.78 -1.37 115.31 120.61 4pbg h LEU 99 Ca 0.16 0.04 0.16 0.00 0.84 0.00 0.00 57.88 59.08 4pbg h LEU 99 Cb 0.23 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 41.43 4pbg h LEU 99 CO -0.01 -0.72 0.61 -0.26 -0.34 0.00 0.00 178.44 177.73 4pbg h PHE 100 N -1.18 1.09 -0.79 1.25 0.04 -0.37 0.11 116.94 117.08 4pbg h PHE 100 Ca -0.12 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.66 4pbg h PHE 100 Cb 0.91 -0.33 -0.04 0.00 2.20 0.00 0.00 35.95 38.69 4pbg h PHE 100 CO -0.01 0.31 0.39 0.00 -0.60 0.00 0.00 178.31 178.39 4pbg h ALA 101 N 1.61 1.02 -0.31 2.45 0.00 -0.90 -2.04 119.26 121.09 4pbg h ALA 101 Ca 0.55 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.22 4pbg h ALA 101 Cb 0.75 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 4pbg h ALA 101 CO -0.34 0.58 -0.15 0.93 0.00 0.00 0.00 179.25 180.26 4pbg h GLU 102 N 1.12 0.54 0.53 0.00 4.39 0.31 0.10 114.58 121.57 4pbg h GLU 102 Ca 0.27 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.77 4pbg h GLU 102 Cb 0.11 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.72 4pbg h GLU 102 CO -0.04 0.68 -0.26 0.00 -1.16 0.00 0.00 179.01 178.24 4pbg h HIS 104 N -0.75 0.63 -0.38 0.00 3.86 -1.20 0.18 115.15 117.49 4pbg h HIS 104 Ca -0.07 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.08 4pbg h HIS 104 Cb 0.57 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 4pbg h HIS 104 CO -0.03 0.47 0.09 -0.22 0.86 0.00 0.00 177.93 179.10 4pbg h LYS 105 N 0.65 0.62 -0.03 2.45 3.64 -0.74 -2.52 116.57 120.64 4pbg h LYS 105 Ca 0.16 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 4pbg h LYS 105 Cb 0.08 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 4pbg h LYS 105 CO -0.02 0.65 0.00 0.54 -2.27 0.00 0.00 179.45 178.35 4pbg n ARG 106 N -4.57 1.21 -1.05 1.90 5.12 0.42 -4.91 116.66 114.78 4pbg n ARG 106 Ca -0.01 -0.31 -0.02 0.00 -1.93 0.00 0.00 57.85 55.58 4pbg n ARG 106 Cb 0.21 -1.40 -0.01 0.00 -1.16 0.00 0.00 32.46 30.10 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 -0.54 0.00 -3.10 -1.55 8.25 0.50 -4.75 115.22 114.03 4pbg n HIS 107 Ca 0.18 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.22 4pbg n HIS 107 Cb 0.16 -1.08 -0.07 0.00 1.12 0.00 0.00 29.99 30.13 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 -1.67 4.86 -0.18 1.59 1.01 -0.48 -4.75 120.40 120.78 4pbg s VAL 108 Ca 0.00 0.48 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 4pbg s VAL 108 Cb 0.00 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.24 4pbg s VAL 108 CO 0.00 -0.40 1.44 -0.70 0.00 0.00 0.00 175.10 175.44 4pbg s GLU 109 N 2.78 4.05 -0.02 2.72 2.56 -0.72 -4.17 118.70 125.90 4pbg s GLU 109 Ca 0.24 1.69 -0.30 0.00 0.00 0.00 0.00 54.97 56.61 4pbg s GLU 109 Cb -0.14 -3.90 -0.04 0.00 2.00 0.00 0.00 34.13 32.05 4pbg s GLU 109 CO 0.16 -0.96 1.15 -1.25 -0.56 0.00 0.00 175.26 173.80 4pbg s PRO 110 N 4.04 4.41 -0.30 4.30 0.04 -1.26 -1.07 135.00 145.16 4pbg s PRO 110 Ca 0.63 1.63 -0.04 0.00 0.04 0.00 0.00 61.00 63.26 4pbg s PRO 110 Cb -0.24 -3.49 0.03 0.00 0.04 0.00 0.00 34.50 30.84 4pbg s PRO 110 CO 0.23 -0.33 0.04 -0.06 0.04 0.00 0.00 177.00 176.92 4pbg s PHE 111 N 1.74 3.18 -0.13 0.56 0.40 0.64 -4.16 117.98 120.21 4pbg s PHE 111 Ca 0.55 -1.43 -0.04 0.00 -0.60 0.00 0.00 56.93 55.41 4pbg s PHE 111 Cb -0.25 -2.18 -0.03 0.00 0.51 0.00 0.00 43.02 41.07 4pbg s PHE 111 CO 0.24 -0.70 0.02 0.08 0.70 0.00 0.00 175.22 175.56 4pbg s VAL 112 N 1.38 4.42 -0.13 -0.44 1.01 -0.81 -0.72 120.40 125.11 4pbg s VAL 112 Ca -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 4pbg s VAL 112 Cb -0.18 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 4pbg s VAL 112 CO 0.00 0.54 -0.06 -0.89 0.00 0.00 0.00 175.10 174.69 4pbg s THR 113 N -0.30 3.69 0.06 3.92 2.01 -0.23 -0.20 115.64 124.60 4pbg s THR 113 Ca 0.07 -0.44 0.11 0.00 0.31 0.00 0.00 61.69 61.74 4pbg s THR 113 Cb -0.12 -2.58 -0.06 0.00 0.01 0.00 0.00 72.50 69.75 4pbg s THR 113 CO 0.02 0.53 1.43 -0.07 -0.69 0.00 0.00 174.62 175.84 4pbg h LEU 114 N 6.28 0.00 -7.36 4.42 3.38 -0.30 -0.77 115.31 120.95 4pbg h LEU 114 Ca -0.35 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.30 4pbg h LEU 114 Cb 1.19 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 41.58 4pbg h LEU 114 CO 0.59 0.73 -0.69 -2.28 0.09 0.00 0.00 178.44 176.87 4pbg s HIS 115 N -3.01 -0.04 -0.44 1.13 5.04 -0.41 -4.48 115.29 113.08 4pbg s HIS 115 Ca 0.01 0.35 0.03 0.00 -1.54 0.00 0.00 55.06 53.91 4pbg s HIS 115 Cb 0.10 -0.31 0.16 0.00 0.04 0.00 0.00 32.58 32.57 4pbg s HIS 115 CO 0.77 -0.18 0.32 -1.58 -2.34 0.00 0.00 174.74 171.73 4pbg s HIS 116 N 1.80 1.43 -1.62 3.88 2.46 -1.26 -1.33 115.29 120.64 4pbg s HIS 116 Ca -0.01 -2.31 0.00 0.00 0.47 0.00 0.00 55.06 53.21 4pbg s HIS 116 Cb -0.12 -1.26 0.00 0.00 -0.13 0.00 0.00 32.58 31.07 4pbg s HIS 116 CO -0.04 -0.79 0.00 1.19 -2.47 0.00 0.00 174.74 172.63 4pbg n PHE 117 N 3.09 -0.44 -3.20 3.88 3.72 -1.26 -4.87 117.46 118.38 4pbg n PHE 117 Ca 0.22 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.39 4pbg n PHE 117 Cb 0.42 -2.97 -0.06 0.00 -0.94 0.00 0.00 39.48 35.94 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 -1.02 0.65 -4.77 4.37 5.75 -1.26 -4.99 116.55 115.28 4pbg n ASP 118 Ca -0.16 -2.85 -0.39 0.00 -0.01 0.00 0.00 54.79 51.38 4pbg n ASP 118 Cb 0.55 -0.63 -0.02 0.00 -1.03 0.00 0.00 41.12 39.99 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 -1.69 2.89 0.29 2.12 2.01 -1.26 -4.60 115.64 115.41 4pbg s THR 119 Ca 0.37 0.80 -0.28 0.00 0.31 0.00 0.00 61.69 62.89 4pbg s THR 119 Cb 0.22 -3.47 -0.14 0.00 0.01 0.00 0.00 72.50 69.12 4pbg s THR 119 CO -0.10 0.12 1.11 -2.65 -0.69 0.00 0.00 174.62 172.42 4pbg n PRO 120 N 0.29 1.59 -0.06 4.92 -0.02 -1.26 -4.32 135.00 136.14 4pbg n PRO 120 Ca 0.03 0.56 -0.09 0.00 -2.02 0.00 0.00 63.50 61.98 4pbg n PRO 120 Cb 0.44 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.89 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 2.33 -0.31 -1.17 -0.52 4.22 -1.08 -1.07 114.58 116.98 4pbg h GLU 121 Ca -0.42 0.02 0.34 0.00 0.08 0.00 0.00 59.36 59.39 4pbg h GLU 121 Cb 1.32 0.07 -0.11 0.00 0.50 0.00 0.00 28.75 30.53 4pbg h GLU 121 CO 0.62 -0.21 0.76 0.00 -2.18 0.00 0.00 179.01 178.01 4pbg h ALA 122 N 0.60 2.50 0.19 2.92 0.00 -1.89 0.83 119.26 124.40 4pbg h ALA 122 Ca 0.13 0.08 -0.35 0.00 0.00 0.00 0.00 54.91 54.78 4pbg h ALA 122 Cb 0.54 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.45 4pbg h ALA 122 CO -0.44 -1.00 -1.70 -0.07 0.00 0.00 0.00 179.25 176.04 4pbg h LEU 123 N 0.24 0.62 -0.10 0.00 3.38 -1.71 -3.34 115.31 114.40 4pbg h LEU 123 Ca 0.69 -0.89 0.01 0.00 0.09 0.00 0.00 57.88 57.79 4pbg h LEU 123 Cb 2.02 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.55 4pbg h LEU 123 CO -0.34 1.74 0.01 -0.74 0.09 0.00 0.00 178.44 179.20 4pbg h HIS 124 N 0.11 0.01 0.00 1.13 2.76 0.37 -1.85 115.15 117.67 4pbg h HIS 124 Ca -0.32 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.85 4pbg h HIS 124 Cb 2.10 0.01 0.00 0.00 1.55 0.00 0.00 27.41 31.07 4pbg h HIS 124 CO 0.10 -0.00 0.00 0.43 -1.30 0.00 0.00 177.93 177.16 4pbg n SER 125 N -5.10 0.00 -1.87 3.26 7.64 -0.13 -1.24 113.62 116.17 4pbg n SER 125 Ca -0.05 0.23 -0.21 0.00 1.01 0.00 0.00 58.87 59.86 4pbg n SER 125 Cb 0.06 -0.32 0.12 0.00 -1.01 0.00 0.00 64.21 63.06 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 -1.32 4.74 0.00 6.43 5.15 -0.72 -4.87 115.26 124.66 4pbg n ASN 126 Ca 0.03 -3.76 0.00 0.00 -0.60 0.00 0.00 54.58 50.26 4pbg n ASN 126 Cb 0.06 -0.71 0.00 0.00 -0.53 0.00 0.00 39.78 38.61 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 -0.98 0.29 7.00 8.20 0.00 -0.91 -4.64 105.19 114.15 4pbg n GLY 127 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.25 1.61 2.03 -0.37 -0.81 116.55 118.75 4pbg n ASP 128 Ca 0.00 0.00 0.08 0.00 0.52 0.00 0.00 54.79 55.39 4pbg n ASP 128 Cb 0.00 0.00 0.39 0.00 -0.72 0.00 0.00 41.12 40.79 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 0.12 0.08 -0.67 3.01 -1.26 -3.09 117.46 129.65 4pbg n PHE 129 Ca 0.00 -0.06 -0.04 0.00 1.01 0.00 0.00 57.45 58.36 4pbg n PHE 129 Cb 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.39 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 0.97 0.00 -8.89 4.37 3.38 -1.35 -3.42 115.31 110.37 4pbg h LEU 130 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 4pbg h LEU 130 Cb 0.21 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.87 4pbg h LEU 130 CO 0.00 0.86 0.50 0.21 0.09 0.00 0.00 178.44 180.10 4pbg s ASN 131 N -6.64 6.70 0.25 -0.43 3.84 -1.18 -4.94 114.94 112.54 4pbg s ASN 131 Ca 0.02 0.67 0.20 0.00 0.21 0.00 0.00 52.86 53.96 4pbg s ASN 131 Cb 0.09 -2.44 0.98 0.00 -0.55 0.00 0.00 41.25 39.33 4pbg s ASN 131 CO 0.80 -0.72 1.62 0.54 -2.79 0.00 0.00 177.10 176.55 4pbg n ARG 132 N 6.44 0.14 -0.15 0.43 1.74 -1.26 -1.98 116.66 122.02 4pbg n ARG 132 Ca 0.06 0.52 -0.10 0.00 -0.77 0.00 0.00 57.85 57.55 4pbg n ARG 132 Cb 0.48 -1.87 -0.01 0.00 -1.02 0.00 0.00 32.46 30.05 4pbg n ARG 132 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 4pbg h GLU 133 N 0.00 0.79 0.00 5.56 5.08 -1.92 -2.86 114.58 121.22 4pbg h GLU 133 Ca 0.00 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 4pbg h GLU 133 Cb 0.16 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 4pbg h GLU 133 CO 0.00 0.86 -0.03 -0.91 -1.00 0.00 0.00 179.01 177.93 4pbg h ASN 134 N 0.63 0.00 -0.41 1.42 4.21 -1.66 -0.51 115.58 119.25 4pbg h ASN 134 Ca 0.12 0.00 0.04 0.00 1.21 0.00 0.00 56.30 57.67 4pbg h ASN 134 Cb 0.51 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.68 4pbg h ASN 134 CO 0.03 0.03 0.19 0.40 -1.29 0.00 0.00 177.43 176.78 4pbg h ILE 135 N 0.00 0.94 0.14 2.81 2.04 -1.61 -0.28 117.51 121.55 4pbg h ILE 135 Ca -0.00 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.74 4pbg h ILE 135 Cb 0.06 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 4pbg h ILE 135 CO 0.00 0.07 -0.25 -0.33 0.00 0.00 0.00 178.15 177.65 4pbg h GLU 136 N 0.38 -0.44 -0.92 2.37 4.39 -1.16 -0.71 114.58 118.48 4pbg h GLU 136 Ca 0.18 0.03 0.22 0.00 0.34 0.00 0.00 59.36 60.13 4pbg h GLU 136 Cb 0.12 0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.80 4pbg h GLU 136 CO -0.15 -0.30 0.61 0.45 -1.16 0.00 0.00 179.01 178.47 4pbg h HIS 137 N -0.46 0.50 0.07 4.33 3.86 -1.16 -1.01 115.15 121.27 4pbg h HIS 137 Ca 0.02 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 4pbg h HIS 137 Cb 0.47 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.79 4pbg h HIS 137 CO -0.22 0.12 -0.03 0.35 0.86 0.00 0.00 177.93 179.01 4pbg h PHE 138 N 0.37 -0.09 -0.98 2.45 3.57 0.43 -1.22 116.94 121.48 4pbg h PHE 138 Ca 0.48 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 62.03 4pbg h PHE 138 Cb 1.27 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.97 4pbg h PHE 138 CO -0.00 0.27 0.64 0.82 -2.23 0.00 0.00 178.31 177.81 4pbg h ILE 139 N -0.45 1.13 -0.61 1.41 5.03 -0.58 0.37 117.51 123.81 4pbg h ILE 139 Ca -0.01 -0.41 -0.10 0.00 -0.12 0.00 0.00 64.86 64.22 4pbg h ILE 139 Cb 0.40 -0.17 -0.02 0.00 -3.03 0.00 0.00 36.82 33.99 4pbg h ILE 139 CO 0.02 0.22 0.00 0.44 -0.68 0.00 0.00 178.15 178.15 4pbg h ASP 140 N 1.20 1.06 0.29 1.72 3.32 -1.29 0.39 116.42 123.11 4pbg h ASP 140 Ca 0.40 -0.31 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 4pbg h ASP 140 Cb 0.07 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 4pbg h ASP 140 CO -0.14 1.10 -0.39 0.22 -1.72 0.00 0.00 179.24 178.31 4pbg h TYR 141 N 0.98 0.16 -0.10 4.55 3.20 -0.07 -1.77 116.97 123.91 4pbg h TYR 141 Ca 0.17 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.92 4pbg h TYR 141 Cb 0.56 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.80 4pbg h TYR 141 CO 0.04 0.51 -0.27 0.00 -1.64 0.00 0.00 178.16 176.80 4pbg h ALA 142 N 1.49 0.17 -0.75 1.82 0.00 0.15 -2.72 119.26 119.42 4pbg h ALA 142 Ca 0.01 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.52 4pbg h ALA 142 Cb 0.74 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 4pbg h ALA 142 CO 0.06 0.18 0.50 0.00 0.00 0.00 0.00 179.25 179.98 4pbg h ALA 143 N 0.49 1.47 0.15 0.00 0.00 -0.80 -0.14 119.26 120.43 4pbg h ALA 143 Ca -0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 4pbg h ALA 143 Cb 0.89 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.37 4pbg h ALA 143 CO 0.06 0.49 -0.07 0.35 0.00 0.00 0.00 179.25 180.08 4pbg h PHE 144 N 1.01 -0.18 0.00 0.00 3.57 -1.32 -2.45 116.94 117.57 4pbg h PHE 144 Ca 0.28 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 4pbg h PHE 144 Cb -0.11 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 4pbg h PHE 144 CO -0.00 0.03 -0.24 0.00 -2.23 0.00 0.00 178.31 175.87 4pbg h PHE 146 N 0.00 0.40 -0.18 0.00 0.04 -0.85 -2.25 116.94 114.09 4pbg h PHE 146 Ca -0.00 -0.11 -0.04 0.00 2.80 0.00 0.00 57.97 60.62 4pbg h PHE 146 Cb 0.49 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.54 4pbg h PHE 146 CO 0.00 0.70 -0.03 1.49 -0.60 0.00 0.00 178.31 179.87 4pbg h GLU 147 N -0.01 0.34 0.00 1.51 4.57 -1.14 -3.30 114.58 116.54 4pbg h GLU 147 Ca 0.03 -0.12 -0.06 0.00 -1.18 0.00 0.00 59.36 58.02 4pbg h GLU 147 Cb 0.61 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 4pbg h GLU 147 CO 0.03 0.59 -0.30 1.49 -1.18 0.00 0.00 179.01 179.63 4pbg h GLU 148 N 0.07 0.00 -2.29 1.92 4.57 -0.83 -3.37 114.58 114.65 4pbg h GLU 148 Ca 0.05 0.00 -0.60 0.00 -1.18 0.00 0.00 59.36 57.63 4pbg h GLU 148 Cb 0.45 0.00 -0.42 0.00 -0.16 0.00 0.00 28.75 28.62 4pbg h GLU 148 CO 0.01 0.30 -0.62 1.19 -1.18 0.00 0.00 179.01 178.72 4pbg n PHE 149 N -3.43 3.39 0.60 0.92 3.72 -0.85 -4.83 117.46 116.98 4pbg n PHE 149 Ca 0.00 -4.14 0.07 0.00 -0.05 0.00 0.00 57.45 53.33 4pbg n PHE 149 Cb 0.48 -0.55 0.34 0.00 -0.94 0.00 0.00 39.48 38.81 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 1.01 0.12 0.00 -1.08 -0.04 -1.26 -2.22 135.00 131.54 4pbg n PRO 150 Ca 0.28 0.19 0.11 0.00 -0.04 0.00 0.00 63.50 64.04 4pbg n PRO 150 Cb 0.41 -1.50 0.57 0.00 -0.04 0.00 0.00 33.50 32.93 4pbg n PRO 150 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 4pbg n GLU 151 N -1.37 0.41 -3.70 0.54 4.71 -1.26 -4.73 120.64 115.24 4pbg n GLU 151 Ca 0.05 0.06 -0.37 0.00 -0.01 0.00 0.00 57.16 56.90 4pbg n GLU 151 Cb 0.14 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 28.95 4pbg n GLU 151 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 4pbg s VAL 152 N -2.40 4.81 -1.30 2.62 1.01 -0.94 -4.97 120.40 119.23 4pbg s VAL 152 Ca 0.24 -0.00 0.24 0.00 0.00 0.00 0.00 61.98 62.46 4pbg s VAL 152 Cb 0.14 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 33.27 4pbg s VAL 152 CO 0.30 0.31 1.30 0.59 0.00 0.00 0.00 175.10 177.60 4pbg n ASN 153 N 4.86 0.91 -3.71 3.32 3.02 -1.26 -4.63 115.26 117.77 4pbg n ASN 153 Ca -0.15 -0.72 -0.16 0.00 -0.03 0.00 0.00 54.58 53.52 4pbg n ASN 153 Cb 0.52 0.42 -0.16 0.00 -0.61 0.00 0.00 39.78 39.95 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 -2.82 -0.08 0.10 3.10 2.02 -1.26 -1.12 117.35 117.28 4pbg s TYR 154 Ca 0.14 0.41 0.08 0.00 -0.37 0.00 0.00 57.07 57.33 4pbg s TYR 154 Cb 0.18 -0.25 -0.03 0.00 -0.40 0.00 0.00 41.96 41.45 4pbg s TYR 154 CO 0.68 -0.19 -0.21 -1.58 -1.57 0.00 0.00 175.55 172.69 4pbg s TRP 155 N 1.70 1.80 0.00 2.71 0.52 0.10 -1.92 118.94 123.85 4pbg s TRP 155 Ca -0.03 -0.41 0.01 0.00 0.02 0.00 0.00 56.10 55.70 4pbg s TRP 155 Cb -0.12 -1.00 -0.01 0.00 -1.15 0.00 0.00 33.47 31.20 4pbg s TRP 155 CO -0.05 0.19 -0.05 0.95 0.02 0.00 0.00 176.95 178.02 4pbg s THR 156 N -1.12 0.35 0.00 2.01 -4.23 0.72 -1.25 115.64 112.12 4pbg s THR 156 Ca 0.07 -0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.26 4pbg s THR 156 Cb -0.10 -0.32 0.00 0.00 1.34 0.00 0.00 72.50 73.42 4pbg s THR 156 CO 0.04 0.02 0.03 0.35 -0.54 0.00 0.00 174.62 174.52 4pbg n THR 157 N 2.74 0.00 -4.10 3.99 -2.24 -1.08 -1.41 114.28 112.19 4pbg n THR 157 Ca -0.14 0.15 -0.28 0.00 -2.27 0.00 0.00 64.05 61.51 4pbg n THR 157 Cb 0.58 -0.39 -0.06 0.00 -2.10 0.00 0.00 70.33 68.36 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 -0.26 3.10 -0.24 4.78 0.08 -1.26 -1.28 117.98 122.90 4pbg s PHE 158 Ca 0.00 -0.02 -0.05 0.00 0.12 0.00 0.00 56.93 56.99 4pbg s PHE 158 Cb 0.00 -1.52 -0.01 0.00 -0.57 0.00 0.00 43.02 40.93 4pbg s PHE 158 CO 0.00 0.52 -0.01 1.21 -0.10 0.00 0.00 175.22 176.84 4pbg s ASN 159 N -2.85 4.55 -0.60 1.36 2.47 -0.44 -3.10 114.94 116.33 4pbg s ASN 159 Ca 0.30 -0.46 -0.12 0.00 0.42 0.00 0.00 52.86 53.00 4pbg s ASN 159 Cb -0.11 -1.78 0.02 0.00 -1.45 0.00 0.00 41.25 37.93 4pbg s ASN 159 CO 0.22 -0.06 0.64 -0.62 -3.72 0.00 0.00 177.10 173.56 4pbg n GLU 160 N 4.82 -1.81 -0.16 0.43 1.02 0.78 -4.60 120.64 121.11 4pbg n GLU 160 Ca -0.17 1.56 -0.10 0.00 -0.02 0.00 0.00 57.16 58.43 4pbg n GLU 160 Cb 0.50 -4.48 -0.00 0.00 -0.02 0.00 0.00 31.44 27.44 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 1.11 1.26 -0.01 -3.67 2.04 -1.88 -2.81 117.51 113.54 4pbg h ILE 161 Ca -0.21 -0.99 0.02 0.00 1.00 0.00 0.00 64.86 64.68 4pbg h ILE 161 Cb 1.14 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 38.15 4pbg h ILE 161 CO 0.27 0.35 -0.50 1.23 0.00 0.00 0.00 178.15 179.49 4pbg h GLY 162 N 0.66 -1.15 1.77 5.37 0.00 -1.91 -0.98 103.07 106.83 4pbg h GLY 162 Ca 0.14 0.66 0.00 0.00 0.00 0.00 0.00 47.33 48.13 4pbg h GLY 162 CO 0.02 -0.25 0.08 -1.05 0.00 0.00 0.00 176.54 175.34 4pbg n PRO 163 N -5.26 0.12 -0.07 4.80 -0.02 -1.19 -0.96 135.00 132.42 4pbg n PRO 163 Ca -0.07 0.61 -0.18 0.00 -2.02 0.00 0.00 63.50 61.84 4pbg n PRO 163 Cb 0.37 -1.96 -0.13 0.00 -0.02 0.00 0.00 33.50 31.76 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 1.38 -0.40 4.25 1.08 -0.94 -2.56 117.51 120.32 4pbg h ILE 164 Ca 0.00 -2.30 -0.09 0.00 -0.39 0.00 0.00 64.86 62.08 4pbg h ILE 164 Cb 0.17 2.88 -0.02 0.00 -3.07 0.00 0.00 36.82 36.78 4pbg h ILE 164 CO 0.00 0.51 -0.14 1.23 -0.69 0.00 0.00 178.15 179.07 4pbg h GLY 165 N -0.87 0.79 0.76 5.37 0.00 -0.69 -0.94 103.07 107.48 4pbg h GLY 165 Ca -0.17 -0.60 -0.04 0.00 0.00 0.00 0.00 47.33 46.52 4pbg h GLY 165 CO -0.07 0.55 -0.37 -1.80 0.00 0.00 0.00 176.54 174.86 4pbg h ASP 166 N 0.66 -0.87 0.82 0.19 3.58 -1.17 0.22 116.42 119.84 4pbg h ASP 166 Ca 0.11 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.59 4pbg h ASP 166 Cb 0.60 0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.88 4pbg h ASP 166 CO 0.04 -0.60 0.00 0.61 -2.88 0.00 0.00 179.24 176.41 4pbg n GLY 167 N -1.35 -1.32 0.13 -0.78 0.00 -0.97 -0.46 105.19 100.45 4pbg n GLY 167 Ca -0.13 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 4pbg n GLY 167 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 4pbg n GLN 168 N -2.19 0.65 -0.01 1.61 7.27 -0.36 0.77 117.38 125.11 4pbg n GLN 168 Ca 0.03 0.33 0.03 0.00 0.07 0.00 0.00 57.00 57.46 4pbg n GLN 168 Cb 0.25 -1.64 -0.06 0.00 2.41 0.00 0.00 30.24 31.21 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 -3.87 0.00 -0.09 3.69 4.01 0.05 -2.00 117.16 118.94 4pbg n TYR 169 Ca -0.40 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.24 4pbg n TYR 169 Cb 0.90 -0.18 -0.04 0.00 -0.31 0.00 0.00 39.34 39.71 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 -1.80 1.93 0.03 7.72 7.94 -0.44 -0.68 117.00 131.70 4pbg n LEU 170 Ca -0.02 0.35 -0.05 0.00 -1.11 0.00 0.00 56.01 55.18 4pbg n LEU 170 Cb 0.24 -0.76 -0.10 0.00 0.53 0.00 0.00 43.42 43.33 4pbg n LEU 170 CO 0.15 -0.20 -0.14 0.58 -1.11 0.00 0.00 177.39 176.66 4pbg h VAL 171 N -1.00 1.06 -0.84 1.96 2.07 -0.95 -0.64 116.25 117.92 4pbg h VAL 171 Ca -0.07 -2.75 -0.19 0.00 0.82 0.00 0.00 66.70 64.51 4pbg h VAL 171 Cb 1.03 2.49 -0.05 0.00 -1.52 0.00 0.00 31.29 33.24 4pbg h VAL 171 CO -0.04 0.61 -0.21 0.61 0.02 0.00 0.00 177.57 178.56 4pbg n GLY 172 N 1.42 0.63 0.09 2.17 0.00 -1.14 -4.78 105.19 103.58 4pbg n GLY 172 Ca -0.08 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.38 0.59 -3.98 1.61 2.85 -0.24 -4.40 118.16 112.22 4pbg n LYS 173 Ca -0.10 0.06 -0.30 0.00 -1.05 0.00 0.00 58.31 56.92 4pbg n LYS 173 Cb 0.43 -1.76 -0.05 0.00 -0.65 0.00 0.00 35.03 33.00 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 -3.38 3.38 0.58 5.58 0.08 0.23 -4.91 117.98 119.54 4pbg s PHE 174 Ca -0.02 0.16 -0.21 0.00 0.12 0.00 0.00 56.93 56.98 4pbg s PHE 174 Cb 0.11 -1.68 -0.04 0.00 -0.57 0.00 0.00 43.02 40.84 4pbg s PHE 174 CO 0.81 0.55 1.35 -2.14 -0.10 0.00 0.00 175.22 175.69 4pbg s PRO 175 N -2.61 2.94 0.00 0.24 0.02 -1.26 -0.72 135.00 133.60 4pbg s PRO 175 Ca 0.33 2.20 0.24 0.00 0.02 0.00 0.00 61.00 63.79 4pbg s PRO 175 Cb -0.12 -2.12 1.19 0.00 0.02 0.00 0.00 34.50 33.46 4pbg s PRO 175 CO 0.26 -1.34 1.80 -0.35 -0.33 0.00 0.00 177.00 177.04 4pbg n PRO 176 N -1.32 0.29 -1.89 5.54 -0.04 -1.26 -4.74 135.00 131.58 4pbg n PRO 176 Ca 0.12 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 4pbg n PRO 176 Cb 0.46 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 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 0.80 0.91 3.74 0.55 0.00 0.10 -5.05 105.19 106.24 4pbg n GLY 177 Ca 0.11 -0.58 -0.40 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 -2.61 4.86 0.04 -0.61 1.01 -0.85 -4.71 121.20 118.33 4pbg s ILE 178 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 60.65 62.19 4pbg s ILE 178 Cb 0.00 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 4pbg s ILE 178 CO 0.00 0.33 0.14 -0.54 0.00 0.00 0.00 174.94 174.87 4pbg s LYS 179 N 0.22 3.19 -1.58 2.79 1.02 -1.25 -2.87 119.74 121.25 4pbg s LYS 179 Ca 0.38 -0.51 -0.18 0.00 0.02 0.00 0.00 55.97 55.68 4pbg s LYS 179 Cb -0.19 -2.91 0.17 0.00 -0.52 0.00 0.00 37.83 34.37 4pbg s LYS 179 CO 0.21 0.61 0.61 0.66 -0.92 0.00 0.00 175.35 176.52 4pbg n TYR 180 N 0.63 -1.53 -3.32 3.18 4.01 -0.25 -4.83 117.16 115.05 4pbg n TYR 180 Ca -0.09 0.65 -0.46 0.00 -0.16 0.00 0.00 57.90 57.84 4pbg n TYR 180 Cb 0.52 -2.34 -0.01 0.00 -0.31 0.00 0.00 39.34 37.20 4pbg n TYR 180 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 4pbg s ASP 181 N -3.09 6.99 0.00 7.72 -1.08 0.14 -4.87 116.67 122.49 4pbg s ASP 181 Ca 0.68 -3.05 0.19 0.00 -0.52 0.00 0.00 52.55 49.85 4pbg s ASP 181 Cb -0.38 -2.22 0.88 0.00 -1.46 0.00 0.00 42.92 39.74 4pbg s ASP 181 CO 0.84 -0.47 1.59 0.18 0.52 0.00 0.00 175.17 177.83 4pbg n LEU 182 N 3.54 0.00 -0.06 -1.34 4.32 -1.26 -2.06 117.00 120.14 4pbg n LEU 182 Ca 0.18 0.39 -0.18 0.00 -0.02 0.00 0.00 56.01 56.39 4pbg n LEU 182 Cb 0.44 -0.39 -0.13 0.00 -1.62 0.00 0.00 43.42 41.72 4pbg n LEU 182 CO 0.39 -0.14 -0.05 0.00 -1.22 0.00 0.00 177.39 176.37 4pbg h ALA 183 N 2.77 0.11 -0.44 -1.18 0.00 -1.89 -3.09 119.26 115.53 4pbg h ALA 183 Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 54.91 54.08 4pbg h ALA 183 Cb 0.25 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 4pbg h ALA 183 CO 0.00 0.38 0.29 0.87 0.00 0.00 0.00 179.25 180.79 4pbg h LYS 184 N -0.86 0.57 -0.01 0.00 1.57 -1.88 -0.45 116.57 115.51 4pbg h LYS 184 Ca -0.17 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.60 4pbg h LYS 184 Cb 1.25 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 33.38 4pbg h LYS 184 CO -0.05 0.38 -0.52 0.28 -0.57 0.00 0.00 179.45 178.96 4pbg h VAL 185 N 0.59 0.00 -0.22 0.50 2.07 -1.54 0.20 116.25 117.85 4pbg h VAL 185 Ca 0.17 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 4pbg h VAL 185 Cb -0.05 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.70 4pbg h VAL 185 CO -0.04 0.00 0.11 -0.26 0.02 0.00 0.00 177.57 177.39 4pbg h PHE 186 N -0.65 0.29 -0.07 1.57 0.04 -1.42 -1.82 116.94 114.88 4pbg h PHE 186 Ca 0.01 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.75 4pbg h PHE 186 Cb 0.70 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.75 4pbg h PHE 186 CO -0.52 0.22 -0.10 0.37 -0.60 0.00 0.00 178.31 177.68 4pbg h GLN 187 N 0.31 0.19 -0.78 1.51 5.75 -0.20 -2.71 115.11 119.19 4pbg h GLN 187 Ca 0.08 -0.11 0.05 0.00 -0.15 0.00 0.00 58.65 58.52 4pbg h GLN 187 Cb 0.04 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 28.55 4pbg h GLN 187 CO -0.01 0.67 0.51 1.03 -2.65 0.00 0.00 178.83 178.38 4pbg h SER 188 N -0.28 0.77 -0.56 -0.69 0.87 -0.34 0.27 113.55 113.59 4pbg h SER 188 Ca 0.01 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 4pbg h SER 188 Cb 0.65 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.42 4pbg h SER 188 CO 0.02 0.52 0.13 0.45 -0.53 0.00 0.00 176.83 177.42 4pbg h HIS 189 N 0.89 0.98 0.02 2.24 3.86 -1.28 -0.37 115.15 121.49 4pbg h HIS 189 Ca 0.32 -0.10 -0.04 0.00 -1.16 0.00 0.00 60.37 59.39 4pbg h HIS 189 Cb 0.15 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.34 4pbg h HIS 189 CO -0.00 0.82 -0.18 1.25 0.86 0.00 0.00 177.93 180.68 4pbg h HIS 190 N 0.90 0.15 0.32 2.45 6.17 -0.99 -2.69 115.15 121.46 4pbg h HIS 190 Ca 0.19 -0.09 -0.01 0.00 0.71 0.00 0.00 60.37 61.17 4pbg h HIS 190 Cb 0.34 -0.01 -0.00 0.00 2.52 0.00 0.00 27.41 30.25 4pbg h HIS 190 CO 0.02 0.97 -0.18 -0.91 0.71 0.00 0.00 177.93 178.54 4pbg h ASN 191 N -0.72 -0.44 -0.58 3.26 4.21 -0.47 0.82 115.58 121.67 4pbg h ASN 191 Ca -0.03 0.02 0.07 0.00 1.21 0.00 0.00 56.30 57.58 4pbg h ASN 191 Cb 1.03 0.12 -0.06 0.00 -1.12 0.00 0.00 38.32 38.30 4pbg h ASN 191 CO 0.03 -0.29 0.26 0.24 -1.29 0.00 0.00 177.43 176.38 4pbg h MET 192 N -0.47 0.47 0.00 0.81 2.86 -1.22 0.26 114.93 117.64 4pbg h MET 192 Ca -0.04 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 4pbg h MET 192 Cb 0.38 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 4pbg h MET 192 CO 0.05 0.31 -0.17 0.52 1.06 0.00 0.00 176.91 178.68 4pbg h MET 193 N 0.49 0.00 -0.23 1.72 2.86 -1.11 -0.71 114.93 117.95 4pbg h MET 193 Ca 0.27 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.81 4pbg h MET 193 Cb 0.25 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.91 4pbg h MET 193 CO -0.23 0.17 -0.28 0.28 1.06 0.00 0.00 176.91 177.91 4pbg h VAL 194 N 0.00 1.32 -0.88 -2.22 2.07 0.81 -1.66 116.25 115.69 4pbg h VAL 194 Ca -0.00 -1.46 0.09 0.00 0.82 0.00 0.00 66.70 66.15 4pbg h VAL 194 Cb 0.30 1.72 -0.06 0.00 -1.52 0.00 0.00 31.29 31.74 4pbg h VAL 194 CO 0.02 0.46 0.57 0.28 0.02 0.00 0.00 177.57 178.91 4pbg h SER 195 N 0.30 0.79 0.40 0.57 0.02 0.37 -1.99 113.55 114.01 4pbg h SER 195 Ca 0.03 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 4pbg h SER 195 Cb 0.85 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.25 4pbg h SER 195 CO 0.07 0.47 -0.19 -0.74 -1.14 0.00 0.00 176.83 175.30 4pbg h HIS 196 N 0.88 -0.50 -1.01 3.45 -0.00 -1.10 -2.67 115.15 114.19 4pbg h HIS 196 Ca 0.40 -0.01 0.28 0.00 -0.00 0.00 0.00 60.37 61.04 4pbg h HIS 196 Cb 0.39 0.16 -0.05 0.00 -0.00 0.00 0.00 27.41 27.91 4pbg h HIS 196 CO -0.00 -0.17 0.71 0.00 -0.00 0.00 0.00 177.93 178.47 4pbg h ALA 197 N -0.62 2.78 0.00 5.26 0.00 -0.83 -1.08 119.26 124.77 4pbg h ALA 197 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 4pbg h ALA 197 Cb 0.55 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.40 4pbg h ALA 197 CO 0.09 -1.09 -0.00 0.00 0.00 0.00 0.00 179.25 178.25 4pbg h ARG 198 N 0.10 -0.00 -0.51 0.00 3.08 -1.37 -2.68 114.38 113.00 4pbg h ARG 198 Ca 0.50 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.57 4pbg h ARG 198 Cb 1.81 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.83 4pbg h ARG 198 CO -0.07 0.74 0.34 0.00 -1.07 0.00 0.00 179.97 179.91 4pbg h ALA 199 N 0.22 1.70 -0.07 0.04 0.00 -0.88 -0.81 119.26 119.46 4pbg h ALA 199 Ca -0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 4pbg h ALA 199 Cb 0.75 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.37 4pbg h ALA 199 CO 0.00 0.25 -0.85 -0.24 0.00 0.00 0.00 179.25 178.41 4pbg h VAL 200 N 0.62 1.33 0.04 0.00 3.04 -1.34 -0.74 116.25 119.20 4pbg h VAL 200 Ca 0.20 -2.17 0.02 0.00 -1.01 0.00 0.00 66.70 63.73 4pbg h VAL 200 Cb 0.02 2.18 -0.02 0.00 -2.01 0.00 0.00 31.29 31.46 4pbg h VAL 200 CO -0.05 0.67 -0.14 0.50 -1.01 0.00 0.00 177.57 177.54 4pbg h LYS 201 N 0.38 -0.25 0.02 4.17 1.63 -1.03 -1.90 116.57 119.59 4pbg h LYS 201 Ca -0.07 0.02 0.03 0.00 -0.85 0.00 0.00 60.65 59.78 4pbg h LYS 201 Cb 1.47 0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 33.12 4pbg h LYS 201 CO 0.16 -0.16 -0.20 1.25 -3.45 0.00 0.00 179.45 177.05 4pbg h LEU 202 N -0.26 -0.57 -2.33 5.20 6.46 -1.07 0.10 115.31 122.85 4pbg h LEU 202 Ca 0.04 0.08 0.03 0.00 -0.12 0.00 0.00 57.88 57.90 4pbg h LEU 202 Cb 0.30 0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 40.46 4pbg h LEU 202 CO -0.11 -0.26 0.11 0.22 -0.62 0.00 0.00 178.44 177.77 4pbg h TYR 203 N -0.32 0.00 0.04 1.25 3.20 -1.02 -1.97 116.97 118.15 4pbg h TYR 203 Ca 0.05 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.81 4pbg h TYR 203 Cb 0.39 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 4pbg h TYR 203 CO -0.23 0.00 -0.54 0.87 -1.64 0.00 0.00 178.16 176.62 4pbg h LYS 204 N 0.00 0.09 -0.01 1.82 1.79 -0.23 -3.04 116.57 116.99 4pbg h LYS 204 Ca 0.05 -0.16 0.03 0.00 -2.18 0.00 0.00 60.65 58.39 4pbg h LYS 204 Cb 0.26 0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.93 4pbg h LYS 204 CO -0.00 1.08 -0.25 -0.44 -1.08 0.00 0.00 179.45 178.76 4pbg h ASP 205 N -0.78 -0.73 0.00 0.86 3.32 -0.38 0.13 116.42 118.83 4pbg h ASP 205 Ca -0.12 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.03 4pbg h ASP 205 Cb 1.28 0.30 0.00 0.00 0.22 0.00 0.00 39.33 41.13 4pbg h ASP 205 CO 0.01 -0.32 0.00 0.29 -1.72 0.00 0.00 179.24 177.50 4pbg n LYS 206 N -5.37 0.65 -3.93 3.56 5.02 -0.79 -4.90 118.16 112.40 4pbg n LYS 206 Ca -0.05 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.92 4pbg n LYS 206 Cb 0.28 -1.19 0.01 0.00 -0.02 0.00 0.00 35.03 34.12 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 0.16 -0.62 3.85 0.72 0.00 0.44 -4.93 105.19 104.81 4pbg n GLY 207 Ca 0.00 0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.82 3.50 0.19 1.61 1.51 -1.15 -5.01 117.35 114.18 4pbg s TYR 208 Ca 0.31 1.40 -0.09 0.00 -1.01 0.00 0.00 57.07 57.68 4pbg s TYR 208 Cb -0.18 -2.76 0.11 0.00 -0.11 0.00 0.00 41.96 39.03 4pbg s TYR 208 CO 0.69 -0.45 1.73 1.57 -1.11 0.00 0.00 175.55 177.97 4pbg h LYS 209 N 0.58 1.07 0.00 -0.62 5.09 -1.92 -3.47 116.57 117.30 4pbg h LYS 209 Ca -0.46 -0.23 0.00 0.00 0.09 0.00 0.00 60.65 60.05 4pbg h LYS 209 Cb 1.19 -0.16 0.00 0.00 0.10 0.00 0.00 32.23 33.36 4pbg h LYS 209 CO 0.62 0.92 0.00 0.41 -2.09 0.00 0.00 179.45 179.31 4pbg n GLY 210 N -0.74 -1.33 3.48 0.07 0.00 -1.26 -5.09 105.19 100.31 4pbg n GLY 210 Ca 0.05 -1.44 -0.30 0.00 0.00 0.00 0.00 46.02 44.33 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 1.97 -0.01 1.61 2.02 -0.28 -4.99 118.70 119.02 4pbg s GLU 211 Ca 0.00 -1.05 0.05 0.00 0.02 0.00 0.00 54.97 53.99 4pbg s GLU 211 Cb 0.00 -2.17 -0.01 0.00 0.10 0.00 0.00 34.13 32.05 4pbg s GLU 211 CO 0.00 0.52 -0.17 -1.50 0.02 0.00 0.00 175.26 174.13 4pbg s ILE 212 N -1.02 1.34 0.11 -1.63 1.10 -1.26 0.00 121.20 119.85 4pbg s ILE 212 Ca 0.16 -0.76 -0.04 0.00 -0.51 0.00 0.00 60.65 59.51 4pbg s ILE 212 Cb -0.11 -1.12 0.02 0.00 0.15 0.00 0.00 42.46 41.40 4pbg s ILE 212 CO 0.08 0.36 0.22 0.61 -2.11 0.00 0.00 174.94 174.09 4pbg n GLY 213 N 2.60 1.74 3.49 1.50 0.00 -0.38 -0.61 105.19 113.52 4pbg n GLY 213 Ca -0.15 -1.09 -0.28 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.74 2.76 -0.40 1.61 1.01 -1.23 -2.62 120.40 118.80 4pbg s VAL 214 Ca 0.05 -1.76 -0.00 0.00 0.00 0.00 0.00 61.98 60.27 4pbg s VAL 214 Cb -0.01 -2.32 0.11 0.00 0.00 0.00 0.00 36.38 34.16 4pbg s VAL 214 CO 0.03 -0.05 0.16 -0.69 0.00 0.00 0.00 175.10 174.56 4pbg s VAL 215 N -1.51 2.95 -0.12 2.92 1.01 -1.18 -0.40 120.40 124.05 4pbg s VAL 215 Ca 0.21 -2.23 -0.06 0.00 0.00 0.00 0.00 61.98 59.90 4pbg s VAL 215 Cb -0.09 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 4pbg s VAL 215 CO 0.11 -0.67 0.09 -1.00 0.00 0.00 0.00 175.10 173.63 4pbg s HIS 216 N 0.97 3.40 -0.15 5.22 3.76 0.17 -0.16 115.29 128.50 4pbg s HIS 216 Ca 0.10 0.35 -0.25 0.00 -0.15 0.00 0.00 55.06 55.10 4pbg s HIS 216 Cb -0.21 -1.93 -0.02 0.00 1.11 0.00 0.00 32.58 31.53 4pbg s HIS 216 CO -0.05 0.54 0.83 0.00 -0.85 0.00 0.00 174.74 175.21 4pbg s ALA 217 N -0.68 3.48 -0.52 -1.40 0.00 -1.26 -0.60 121.76 120.79 4pbg s ALA 217 Ca 0.12 0.07 0.07 0.00 0.00 0.00 0.00 51.96 52.23 4pbg s ALA 217 Cb -0.12 -3.22 0.25 0.00 0.00 0.00 0.00 23.12 20.04 4pbg s ALA 217 CO 0.02 -0.59 0.64 1.28 0.00 0.00 0.00 175.76 177.12 4pbg n LEU 218 N 5.05 2.02 -4.68 0.00 4.77 -0.94 -4.82 117.00 118.40 4pbg n LEU 218 Ca 0.04 -5.08 -0.42 0.00 -0.03 0.00 0.00 56.01 50.51 4pbg n LEU 218 Cb 0.49 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 4pbg n LEU 218 CO 0.48 2.07 1.14 -2.16 -1.33 0.00 0.00 177.39 177.59 4pbg s PRO 219 N -1.87 4.26 0.17 3.23 0.04 -1.26 -4.92 135.00 134.65 4pbg s PRO 219 Ca 0.38 1.90 -0.32 0.00 0.04 0.00 0.00 61.00 63.01 4pbg s PRO 219 Cb 0.16 -3.68 -0.11 0.00 0.04 0.00 0.00 34.50 30.91 4pbg s PRO 219 CO -0.06 -0.64 1.65 0.99 0.04 0.00 0.00 177.00 178.99 4pbg s THR 220 N 2.90 2.44 -0.21 1.26 2.01 -1.25 -4.83 115.64 117.95 4pbg s THR 220 Ca 0.63 0.26 -0.06 0.00 0.31 0.00 0.00 61.69 62.82 4pbg s THR 220 Cb -0.29 -3.17 -0.03 0.00 0.01 0.00 0.00 72.50 69.02 4pbg s THR 220 CO 0.24 0.02 0.04 -0.54 -0.69 0.00 0.00 174.62 173.69 4pbg s LYS 221 N 1.43 3.73 0.03 4.92 -0.14 -1.26 -0.13 119.74 128.32 4pbg s LYS 221 Ca 0.73 -0.46 0.07 0.00 -1.36 0.00 0.00 55.97 54.96 4pbg s LYS 221 Cb -0.46 -3.20 -0.02 0.00 -1.68 0.00 0.00 37.83 32.47 4pbg s LYS 221 CO 0.32 0.02 -0.21 0.71 -0.76 0.00 0.00 175.35 175.43 4pbg s TYR 222 N 1.04 1.85 0.29 3.18 2.02 0.90 -4.90 117.35 121.73 4pbg s TYR 222 Ca 0.03 -0.37 -0.29 0.00 -0.37 0.00 0.00 57.07 56.07 4pbg s TYR 222 Cb -0.14 -1.13 -0.10 0.00 -0.40 0.00 0.00 41.96 40.19 4pbg s TYR 222 CO 0.03 0.06 1.11 -1.25 -1.57 0.00 0.00 175.55 173.93 4pbg s PRO 223 N -0.97 4.57 0.19 -1.71 0.04 -1.26 -0.73 135.00 135.13 4pbg s PRO 223 Ca 0.08 1.82 -0.12 0.00 0.04 0.00 0.00 61.00 62.82 4pbg s PRO 223 Cb -0.09 -3.13 0.19 0.00 0.04 0.00 0.00 34.50 31.52 4pbg s PRO 223 CO 0.01 0.15 1.74 -0.92 0.04 0.00 0.00 177.00 178.02 4pbg h TYR 224 N 3.67 0.31 -3.38 0.56 3.20 -0.64 -3.35 116.97 117.34 4pbg h TYR 224 Ca -0.47 0.03 -0.62 0.00 3.14 0.00 0.00 58.73 60.81 4pbg h TYR 224 Cb 1.21 -0.06 -0.40 0.00 1.54 0.00 0.00 36.73 39.02 4pbg h TYR 224 CO 0.58 0.09 -0.74 0.34 -1.64 0.00 0.00 178.16 176.80 4pbg s ASP 225 N -5.38 4.33 0.55 -2.11 2.15 -1.26 -5.00 116.67 109.96 4pbg s ASP 225 Ca -0.13 -1.97 0.37 0.00 0.43 0.00 0.00 52.55 51.25 4pbg s ASP 225 Cb 0.15 -1.23 1.53 0.00 -0.30 0.00 0.00 42.92 43.08 4pbg s ASP 225 CO 0.73 -0.39 1.77 1.55 -0.17 0.00 0.00 175.17 178.66 4pbg h PRO 226 N 7.75 0.00 0.00 4.34 0.13 -1.98 0.20 132.00 142.44 4pbg h PRO 226 Ca -0.09 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.91 4pbg h PRO 226 Cb 1.01 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 4pbg h PRO 226 CO 0.50 0.00 -0.64 0.93 -0.23 0.00 0.00 178.00 178.56 4pbg h GLU 227 N 0.00 0.00 -6.11 0.86 5.08 -1.95 -3.42 114.58 109.04 4pbg h GLU 227 Ca 0.57 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 58.33 4pbg h GLU 227 Cb 2.35 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 31.49 4pbg h GLU 227 CO -0.01 0.64 0.57 1.21 -1.00 0.00 0.00 179.01 180.43 4pbg s ASN 228 N -6.81 6.54 0.54 1.42 3.84 0.70 -4.90 114.94 116.27 4pbg s ASN 228 Ca -0.01 0.22 0.22 0.00 0.21 0.00 0.00 52.86 53.50 4pbg s ASN 228 Cb 0.12 -2.45 1.42 0.00 -0.55 0.00 0.00 41.25 39.80 4pbg s ASN 228 CO 0.76 -0.99 2.12 -0.65 -2.79 0.00 0.00 177.10 175.55 4pbg h PRO 229 N 8.92 0.00 -0.23 0.43 0.11 -1.83 0.20 132.00 139.60 4pbg h PRO 229 Ca -0.24 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.80 4pbg h PRO 229 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 4pbg h PRO 229 CO 1.01 0.00 -0.15 0.00 -0.21 0.00 0.00 178.00 178.65 4pbg h ALA 230 N 1.90 1.32 -0.02 -0.75 0.00 -1.93 -0.89 119.26 118.89 4pbg h ALA 230 Ca 0.08 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 4pbg h ALA 230 Cb 0.33 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.01 4pbg h ALA 230 CO -0.00 0.46 -0.06 -0.44 0.00 0.00 0.00 179.25 179.20 4pbg h ASP 231 N 0.36 0.09 -0.15 0.00 3.32 -0.92 -2.80 116.42 116.32 4pbg h ASP 231 Ca 0.07 -0.62 0.05 0.00 0.02 0.00 0.00 57.03 56.55 4pbg h ASP 231 Cb 0.48 -0.03 -0.06 0.00 0.22 0.00 0.00 39.33 39.95 4pbg h ASP 231 CO 0.03 0.70 -0.24 0.58 -1.72 0.00 0.00 179.24 178.59 4pbg h VAL 232 N -0.51 0.42 -0.90 -1.35 2.07 -1.11 -0.86 116.25 114.02 4pbg h VAL 232 Ca -0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.64 4pbg h VAL 232 Cb 0.69 0.42 -0.09 0.00 -1.52 0.00 0.00 31.29 30.79 4pbg h VAL 232 CO 0.01 0.00 0.52 -0.09 0.02 0.00 0.00 177.57 178.03 4pbg h ARG 233 N -0.29 0.77 -0.34 1.57 1.12 -1.24 -0.43 114.38 115.54 4pbg h ARG 233 Ca 0.11 -0.05 -0.03 0.00 -1.11 0.00 0.00 59.98 58.90 4pbg h ARG 233 Cb 0.45 -0.17 -0.01 0.00 -0.01 0.00 0.00 29.97 30.22 4pbg h ARG 233 CO -0.32 0.51 0.10 0.00 -3.11 0.00 0.00 179.97 177.15 4pbg h ALA 234 N 1.53 0.44 -0.59 2.80 0.00 -1.05 -0.58 119.26 121.81 4pbg h ALA 234 Ca 0.46 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 4pbg h ALA 234 Cb 0.54 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 4pbg h ALA 234 CO -0.30 0.10 0.11 0.00 0.00 0.00 0.00 179.25 179.15 4pbg h ALA 235 N 0.93 0.79 -0.10 0.00 0.00 -0.43 -1.15 119.26 119.30 4pbg h ALA 235 Ca 0.11 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.80 4pbg h ALA 235 Cb 0.27 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 4pbg h ALA 235 CO -0.00 0.53 -0.07 1.49 0.00 0.00 0.00 179.25 181.20 4pbg h GLU 236 N 0.88 -0.07 -0.59 0.00 4.81 -0.88 0.25 114.58 118.98 4pbg h GLU 236 Ca 0.18 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.32 4pbg h GLU 236 Cb 0.40 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 4pbg h GLU 236 CO 0.01 -0.04 -0.00 -0.07 -0.73 0.00 0.00 179.01 178.17 4pbg h LEU 237 N -0.07 1.02 -1.12 1.64 3.38 -0.92 -0.96 115.31 118.28 4pbg h LEU 237 Ca 0.06 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 4pbg h LEU 237 Cb 0.16 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 4pbg h LEU 237 CO -0.15 1.08 0.51 -0.08 0.09 0.00 0.00 178.44 179.89 4pbg h GLU 238 N 0.93 1.11 -0.15 1.13 4.57 -0.82 -0.82 114.58 120.52 4pbg h GLU 238 Ca 0.17 -0.09 -0.14 0.00 -1.18 0.00 0.00 59.36 58.12 4pbg h GLU 238 Cb 0.56 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 4pbg h GLU 238 CO 0.03 0.77 -0.50 0.22 -1.18 0.00 0.00 179.01 178.35 4pbg h ASP 239 N 1.13 0.43 -0.53 1.04 3.58 -0.21 -2.53 116.42 119.33 4pbg h ASP 239 Ca 0.30 -0.21 -0.06 0.00 0.42 0.00 0.00 57.03 57.47 4pbg h ASP 239 Cb -0.07 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.84 4pbg h ASP 239 CO -0.06 0.86 0.10 0.40 -2.88 0.00 0.00 179.24 177.66 4pbg h ILE 240 N 0.32 1.24 -0.19 2.25 2.04 0.15 0.85 117.51 124.17 4pbg h ILE 240 Ca 0.01 -0.93 -0.04 0.00 1.00 0.00 0.00 64.86 64.91 4pbg h ILE 240 Cb 0.98 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 4pbg h ILE 240 CO 0.09 0.34 -0.04 0.40 0.00 0.00 0.00 178.15 178.94 4pbg h ILE 241 N 0.87 1.28 0.02 -0.67 2.04 -1.08 -2.97 117.51 117.00 4pbg h ILE 241 Ca 0.18 -0.99 -0.31 0.00 1.00 0.00 0.00 64.86 64.75 4pbg h ILE 241 Cb 0.37 1.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.96 4pbg h ILE 241 CO 0.01 0.30 -1.80 1.41 0.00 0.00 0.00 178.15 178.07 4pbg n HIS 242 N -4.66 0.98 0.00 1.37 8.25 -0.97 -4.84 115.22 115.36 4pbg n HIS 242 Ca -0.05 0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 4pbg n HIS 242 Cb 0.26 -1.17 0.00 0.00 1.12 0.00 0.00 29.99 30.20 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 -3.10 0.00 -0.34 0.41 3.02 0.29 -4.77 115.26 110.77 4pbg n ASN 243 Ca -0.20 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.47 4pbg n ASN 243 Cb 1.06 -0.00 0.25 0.00 -0.61 0.00 0.00 39.78 40.47 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 0.01 0.11 3.52 1.79 -1.54 -1.80 116.57 118.65 4pbg h LYS 244 Ca 0.00 -0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.49 4pbg h LYS 244 Cb 0.00 -0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.60 4pbg h LYS 244 CO 0.00 0.00 -0.48 0.35 -1.08 0.00 0.00 179.45 178.25 4pbg h PHE 245 N 0.01 -1.37 0.20 -1.35 3.57 -1.78 0.10 116.94 116.32 4pbg h PHE 245 Ca 0.56 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 62.09 4pbg h PHE 245 Cb 1.09 0.58 0.00 0.00 2.79 0.00 0.00 35.95 40.42 4pbg h PHE 245 CO -0.57 -0.56 -0.10 0.82 -2.23 0.00 0.00 178.31 175.67 4pbg h ILE 246 N -0.71 0.84 -0.55 1.41 2.04 -1.73 -2.67 117.51 116.14 4pbg h ILE 246 Ca 0.01 -0.18 0.11 0.00 1.00 0.00 0.00 64.86 65.80 4pbg h ILE 246 Cb 0.73 0.95 -0.10 0.00 -0.74 0.00 0.00 36.82 37.65 4pbg h ILE 246 CO -0.27 0.04 -0.15 -0.07 0.00 0.00 0.00 178.15 177.70 4pbg h LEU 247 N -0.36 -0.53 -0.61 1.44 3.38 -1.22 -1.19 115.31 116.21 4pbg h LEU 247 Ca -0.03 0.17 0.10 0.00 0.09 0.00 0.00 57.88 58.21 4pbg h LEU 247 Cb 0.28 0.35 -0.08 0.00 0.09 0.00 0.00 40.66 41.30 4pbg h LEU 247 CO 0.05 -0.19 0.20 0.44 0.09 0.00 0.00 178.44 179.03 4pbg h ASP 248 N -0.01 0.16 -0.63 -0.43 5.19 -0.60 -0.92 116.42 119.18 4pbg h ASP 248 Ca 0.26 0.09 -0.03 0.00 -0.62 0.00 0.00 57.03 56.73 4pbg h ASP 248 Cb 0.41 0.09 -0.03 0.00 0.18 0.00 0.00 39.33 39.98 4pbg h ASP 248 CO -0.57 0.09 0.28 0.00 -3.12 0.00 0.00 179.24 175.92 4pbg h ALA 249 N 1.44 0.82 0.00 3.45 0.00 -0.97 0.63 119.26 124.63 4pbg h ALA 249 Ca 0.32 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.07 4pbg h ALA 249 Cb 0.42 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.97 4pbg h ALA 249 CO -0.34 0.41 0.00 1.15 0.00 0.00 0.00 179.25 180.47 4pbg h THR 250 N 0.88 0.00 0.00 0.00 2.02 -0.04 -3.05 112.91 112.72 4pbg h THR 250 Ca 0.21 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.31 4pbg h THR 250 Cb 0.16 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 4pbg h THR 250 CO -0.02 0.00 -0.04 -1.22 0.37 0.00 0.00 175.52 174.60 4pbg n TYR 251 N -2.96 0.00 0.48 3.16 4.01 -0.93 -4.63 117.16 116.29 4pbg n TYR 251 Ca -0.02 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.84 4pbg n TYR 251 Cb 0.11 0.00 0.24 0.00 -0.31 0.00 0.00 39.34 39.37 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 0.09 -3.44 115.31 123.06 4pbg h LEU 252 Ca 0.00 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.90 4pbg h LEU 252 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 4pbg h LEU 252 CO 0.00 0.04 0.00 0.61 0.09 0.00 0.00 178.44 179.18 4pbg n GLY 253 N 1.27 1.87 3.70 0.83 0.00 -0.97 -4.91 105.19 106.98 4pbg n GLY 253 Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.14 0.03 -0.21 1.61 0.00 -1.25 -3.95 115.29 108.38 4pbg s HIS 254 Ca 0.00 -0.43 -0.19 0.00 -3.00 0.00 0.00 55.06 51.44 4pbg s HIS 254 Cb 0.00 0.47 -0.03 0.00 -4.00 0.00 0.00 32.58 29.02 4pbg s HIS 254 CO 0.00 -1.10 0.54 0.71 -1.00 0.00 0.00 174.74 173.90 4pbg s TYR 255 N -3.95 3.36 0.97 0.38 2.02 -1.26 -4.13 117.35 114.74 4pbg s TYR 255 Ca 0.15 0.79 -0.11 0.00 -0.37 0.00 0.00 57.07 57.53 4pbg s TYR 255 Cb -0.03 -2.71 0.18 0.00 -0.40 0.00 0.00 41.96 39.00 4pbg s TYR 255 CO 0.06 -0.14 1.12 -1.54 -1.57 0.00 0.00 175.55 173.48 4pbg s SER 256 N 1.21 2.41 0.16 2.29 1.04 -1.26 -4.63 113.70 114.92 4pbg s SER 256 Ca 0.25 2.07 -0.15 0.00 0.48 0.00 0.00 55.95 58.60 4pbg s SER 256 Cb -0.16 -2.53 0.07 0.00 0.10 0.00 0.00 66.02 63.51 4pbg s SER 256 CO 0.10 -3.40 1.78 0.44 0.98 0.00 0.00 173.24 173.13 4pbg h ASP 257 N -2.08 0.29 -0.90 7.02 3.32 -1.99 0.86 116.42 122.95 4pbg h ASP 257 Ca -0.47 0.02 0.01 0.00 0.02 0.00 0.00 57.03 56.61 4pbg h ASP 257 Cb 1.28 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.75 4pbg h ASP 257 CO 0.43 0.21 0.59 0.11 -1.72 0.00 0.00 179.24 178.87 4pbg h LYS 258 N 0.41 1.18 -0.12 3.56 1.57 -1.99 0.14 116.57 121.32 4pbg h LYS 258 Ca 0.17 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 4pbg h LYS 258 Cb 0.08 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 4pbg h LYS 258 CO -0.12 0.78 0.06 1.15 -0.57 0.00 0.00 179.45 180.75 4pbg h THR 259 N 1.21 1.11 -0.02 -0.16 2.02 -1.38 -0.30 112.91 115.39 4pbg h THR 259 Ca 0.33 -0.30 -0.12 0.00 0.77 0.00 0.00 66.41 67.09 4pbg h THR 259 Cb -0.14 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 4pbg h THR 259 CO -0.07 0.09 -0.54 0.24 0.37 0.00 0.00 175.52 175.61 4pbg h MET 260 N 0.08 0.06 -0.22 6.66 2.86 -0.43 -1.45 114.93 122.50 4pbg h MET 260 Ca 0.04 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 4pbg h MET 260 Cb 0.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 4pbg h MET 260 CO -0.01 0.59 0.05 1.49 1.06 0.00 0.00 176.91 180.09 4pbg h GLU 261 N 0.05 0.35 -0.76 1.72 4.22 -0.41 -0.56 114.58 119.19 4pbg h GLU 261 Ca -0.00 -0.09 -0.06 0.00 0.08 0.00 0.00 59.36 59.29 4pbg h GLU 261 Cb 0.97 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 4pbg h GLU 261 CO 0.07 0.48 0.24 0.78 -2.18 0.00 0.00 179.01 178.40 4pbg h GLY 262 N 0.16 1.26 1.57 1.92 0.00 -0.87 -1.66 103.07 105.44 4pbg h GLY 262 Ca 0.07 -0.74 -0.09 0.00 0.00 0.00 0.00 47.33 46.56 4pbg h GLY 262 CO 0.00 0.70 -0.23 -2.08 0.00 0.00 0.00 176.54 174.93 4pbg h VAL 263 N 1.12 1.26 -0.38 4.60 2.07 -1.12 -0.01 116.25 123.79 4pbg h VAL 263 Ca 0.24 -1.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.50 4pbg h VAL 263 Cb 0.31 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 4pbg h VAL 263 CO -0.01 0.39 0.12 0.78 0.02 0.00 0.00 177.57 178.88 4pbg h ASN 264 N 0.45 0.55 0.75 0.57 -0.26 -0.77 -0.35 115.58 116.52 4pbg h ASN 264 Ca 0.07 -0.20 -0.04 0.00 -0.56 0.00 0.00 56.30 55.57 4pbg h ASN 264 Cb 0.64 -0.14 0.01 0.00 -1.06 0.00 0.00 38.32 37.77 4pbg h ASN 264 CO 0.05 0.61 -0.36 -0.74 -1.06 0.00 0.00 177.43 175.92 4pbg h HIS 265 N 0.46 -0.94 -0.68 1.19 2.76 -1.00 -0.43 115.15 116.52 4pbg h HIS 265 Ca 0.12 -0.02 0.15 0.00 -2.20 0.00 0.00 60.37 58.42 4pbg h HIS 265 Cb 0.25 0.31 -0.11 0.00 1.55 0.00 0.00 27.41 29.41 4pbg h HIS 265 CO 0.01 -0.58 0.03 0.82 -1.30 0.00 0.00 177.93 176.91 4pbg h ILE 266 N -1.06 0.45 -0.49 6.26 2.04 -0.99 -0.07 117.51 123.65 4pbg h ILE 266 Ca -0.10 -0.05 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 4pbg h ILE 266 Cb 0.78 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 4pbg h ILE 266 CO 0.17 0.03 -0.14 -0.07 0.00 0.00 0.00 178.15 178.14 4pbg h LEU 267 N 0.14 0.95 -0.08 1.44 3.38 -1.01 -2.63 115.31 117.49 4pbg h LEU 267 Ca 0.37 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 58.04 4pbg h LEU 267 Cb 0.62 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 4pbg h LEU 267 CO -0.57 1.08 -0.03 0.00 0.09 0.00 0.00 178.44 179.01 4pbg h ALA 268 N 1.00 0.05 0.00 1.53 0.00 0.73 1.20 119.26 123.76 4pbg h ALA 268 Ca 0.13 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 4pbg h ALA 268 Cb 0.69 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 4pbg h ALA 268 CO 0.05 -0.50 -0.19 0.93 0.00 0.00 0.00 179.25 179.54 4pbg h GLU 269 N -0.01 0.00 -0.00 0.00 4.39 -1.32 -3.23 114.58 114.40 4pbg h GLU 269 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 4pbg h GLU 269 Cb 0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 4pbg h GLU 269 CO -0.09 0.19 -0.03 0.09 -1.16 0.00 0.00 179.01 178.01 4pbg n ASN 270 N -3.68 1.11 0.00 1.42 3.02 -1.00 -4.94 115.26 111.20 4pbg n ASN 270 Ca -0.01 -1.06 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 4pbg n ASN 270 Cb 0.31 0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 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 0.39 -1.94 0.00 7.41 0.00 0.41 -4.95 105.19 106.51 4pbg n GLY 271 Ca 0.02 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.70 3.54 3.15 -0.02 0.00 -1.25 -4.64 105.19 104.26 4pbg n GLY 272 Ca 0.00 -1.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.76 0.51 -0.09 1.61 0.41 -1.26 -4.88 118.70 112.24 4pbg s GLU 273 Ca 0.00 -0.21 0.04 0.00 -0.41 0.00 0.00 54.97 54.39 4pbg s GLU 273 Cb 0.00 0.22 -0.00 0.00 -1.78 0.00 0.00 34.13 32.57 4pbg s GLU 273 CO 0.00 -0.13 -0.23 -0.51 -0.49 0.00 0.00 175.26 173.90 4pbg s LEU 274 N -1.12 2.06 -0.73 1.80 1.43 -1.26 -4.88 118.68 115.97 4pbg s LEU 274 Ca -0.12 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 52.27 4pbg s LEU 274 Cb -0.06 -1.36 0.14 0.00 0.03 0.00 0.00 46.19 44.95 4pbg s LEU 274 CO 0.02 0.16 0.81 -0.62 0.23 0.00 0.00 176.35 176.95 4pbg s ASP 275 N 0.28 6.45 -0.37 2.29 2.15 -1.26 -5.00 116.67 121.21 4pbg s ASP 275 Ca -0.16 -1.95 -0.02 0.00 0.43 0.00 0.00 52.55 50.85 4pbg s ASP 275 Cb -0.17 -2.29 0.09 0.00 -0.30 0.00 0.00 42.92 40.25 4pbg s ASP 275 CO 0.08 -0.94 0.12 -0.76 -0.17 0.00 0.00 175.17 173.50 4pbg s LEU 276 N 1.91 4.78 0.40 -1.34 1.43 -1.26 -5.04 118.68 119.57 4pbg s LEU 276 Ca 0.18 -1.81 -0.23 0.00 -1.03 0.00 0.00 54.13 51.24 4pbg s LEU 276 Cb -0.16 -1.77 -0.11 0.00 0.03 0.00 0.00 46.19 44.18 4pbg s LEU 276 CO -0.02 -0.44 0.95 -0.13 0.23 0.00 0.00 176.35 176.95 4pbg s ARG 277 N 1.15 4.33 0.42 1.70 3.00 -1.26 -4.95 118.95 123.32 4pbg s ARG 277 Ca 0.05 1.19 0.15 0.00 0.00 0.00 0.00 55.73 57.12 4pbg s ARG 277 Cb -0.21 -2.37 0.91 0.00 0.00 0.00 0.00 34.95 33.28 4pbg s ARG 277 CO -0.04 0.05 1.92 0.22 0.00 0.00 0.00 175.30 177.45 4pbg h ASP 278 N 2.28 0.00 0.14 0.23 1.82 -2.01 -1.70 116.42 117.18 4pbg h ASP 278 Ca -0.48 0.00 -0.05 0.00 -0.39 0.00 0.00 57.03 56.11 4pbg h ASP 278 Cb 1.18 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.19 4pbg h ASP 278 CO 0.62 0.27 -0.19 1.05 -1.61 0.00 0.00 179.24 179.37 4pbg h GLU 279 N 0.00 0.12 -0.50 0.28 9.09 -2.00 -2.16 114.58 119.40 4pbg h GLU 279 Ca -0.00 -0.03 -0.02 0.00 0.05 0.00 0.00 59.36 59.36 4pbg h GLU 279 Cb 0.49 -0.01 -0.02 0.00 -1.65 0.00 0.00 28.75 27.55 4pbg h GLU 279 CO 0.03 0.31 0.22 -0.44 0.05 0.00 0.00 179.01 179.18 4pbg h ASP 280 N 0.11 0.63 1.62 3.06 3.32 -1.69 -1.05 116.42 122.42 4pbg h ASP 280 Ca 0.02 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.01 4pbg h ASP 280 Cb 0.41 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.80 4pbg h ASP 280 CO 0.03 0.56 -0.01 -0.26 -1.72 0.00 0.00 179.24 177.83 4pbg h PHE 281 N 0.70 0.00 -0.08 4.55 0.04 -1.43 -1.06 116.94 119.66 4pbg h PHE 281 Ca 0.17 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.79 4pbg h PHE 281 Cb 0.11 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.27 4pbg h PHE 281 CO 0.01 0.00 -0.56 1.96 -0.60 0.00 0.00 178.31 179.12 4pbg h GLN 282 N 0.00 0.51 0.26 1.51 4.20 -0.97 -0.51 115.11 120.10 4pbg h GLN 282 Ca 0.00 -0.45 -0.01 0.00 0.06 0.00 0.00 58.65 58.25 4pbg h GLN 282 Cb 0.82 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.70 4pbg h GLN 282 CO 0.00 1.08 -0.13 0.00 -0.67 0.00 0.00 178.83 179.12 4pbg h ALA 283 N 0.44 -0.35 -0.96 3.87 0.00 -1.25 -0.94 119.26 120.07 4pbg h ALA 283 Ca -0.05 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.77 4pbg h ALA 283 Cb 1.22 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.09 4pbg h ALA 283 CO 0.11 -0.63 0.63 -0.07 0.00 0.00 0.00 179.25 179.30 4pbg h LEU 284 N -0.49 1.05 -0.45 0.00 3.38 -1.23 -1.90 115.31 115.67 4pbg h LEU 284 Ca -0.04 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.76 4pbg h LEU 284 Cb 0.37 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 4pbg h LEU 284 CO 0.06 0.72 -0.46 -0.78 0.09 0.00 0.00 178.44 178.07 4pbg h ASP 285 N 1.22 0.84 -0.10 -0.43 3.58 -0.95 -2.02 116.42 118.55 4pbg h ASP 285 Ca 0.38 -0.41 0.02 0.00 0.42 0.00 0.00 57.03 57.44 4pbg h ASP 285 Cb -0.00 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.79 4pbg h ASP 285 CO -0.12 1.17 -0.01 0.00 -2.88 0.00 0.00 179.24 177.41 4pbg h ALA 286 N 0.86 0.08 -0.00 -0.78 0.00 -0.43 -2.94 119.26 116.05 4pbg h ALA 286 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 4pbg h ALA 286 Cb 1.03 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.88 4pbg h ALA 286 CO 0.10 -0.47 -0.14 0.00 0.00 0.00 0.00 179.25 178.75 4pbg n ALA 287 N -2.22 2.78 -0.29 0.00 0.00 -0.79 -4.42 120.51 115.56 4pbg n ALA 287 Ca -0.05 -0.25 0.11 0.00 0.00 0.00 0.00 53.44 53.26 4pbg n ALA 287 Cb 0.07 -1.33 0.27 0.00 0.00 0.00 0.00 19.45 18.46 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 0.39 0.37 -0.44 0.00 2.10 -1.17 -1.35 116.57 116.47 4pbg h LYS 288 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 4pbg h LYS 288 Cb 0.39 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 4pbg h LYS 288 CO 0.00 0.25 0.00 -0.25 -2.00 0.00 0.00 179.45 177.45 4pbg n ASP 289 N -5.06 3.53 0.09 7.07 9.92 -1.26 -4.50 116.55 126.33 4pbg n ASP 289 Ca 0.20 -1.99 -0.22 0.00 -0.53 0.00 0.00 54.79 52.25 4pbg n ASP 289 Cb 0.59 -0.29 -0.13 0.00 -0.64 0.00 0.00 41.12 40.66 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 4.35 0.88 -9.13 0.64 3.38 -1.50 -3.47 115.31 110.47 4pbg h LEU 290 Ca 0.00 -0.80 -0.75 0.00 0.09 0.00 0.00 57.88 56.43 4pbg h LEU 290 Cb 0.98 -0.28 0.04 0.00 0.09 0.00 0.00 40.66 41.49 4pbg h LEU 290 CO 0.00 1.60 0.44 0.59 0.09 0.00 0.00 178.44 181.16 4pbg n ASN 291 N -3.79 1.22 0.05 -0.43 3.02 -1.25 -4.91 115.26 109.17 4pbg n ASN 291 Ca -0.13 1.13 -0.04 0.00 -0.03 0.00 0.00 54.58 55.51 4pbg n ASN 291 Cb 0.98 -1.06 -0.09 0.00 -0.61 0.00 0.00 39.78 39.00 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 4.60 0.00 -5.08 6.41 3.32 -1.21 -3.47 116.42 120.99 4pbg h ASP 292 Ca -0.48 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.54 4pbg h ASP 292 Cb 1.37 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.80 4pbg h ASP 292 CO 0.79 0.81 0.01 0.72 -1.72 0.00 0.00 179.24 179.86 4pbg s PHE 293 N -2.78 -0.17 -0.12 4.55 -0.12 -1.26 -4.06 117.98 114.03 4pbg s PHE 293 Ca -0.00 -0.16 0.02 0.00 -0.05 0.00 0.00 56.93 56.74 4pbg s PHE 293 Cb 0.09 0.36 -0.00 0.00 -0.63 0.00 0.00 43.02 42.83 4pbg s PHE 293 CO 0.80 -0.84 -0.19 -1.17 -0.05 0.00 0.00 175.22 173.77 4pbg s LEU 294 N -2.84 2.33 -0.30 -1.99 0.20 0.10 -3.48 118.68 112.70 4pbg s LEU 294 Ca 0.07 -0.49 -0.11 0.00 0.69 0.00 0.00 54.13 54.29 4pbg s LEU 294 Cb -0.00 -1.50 -0.03 0.00 -0.43 0.00 0.00 46.19 44.23 4pbg s LEU 294 CO -0.06 0.14 0.18 -0.83 -0.29 0.00 0.00 176.35 175.49 4pbg s GLY 295 N 0.49 1.91 -0.35 7.98 0.00 0.46 -0.49 107.32 117.32 4pbg s GLY 295 Ca -0.13 -1.22 -0.09 0.00 0.00 0.00 0.00 44.72 43.28 4pbg s GLY 295 CO 0.05 0.68 0.16 -0.42 0.00 0.00 0.00 173.10 173.57 4pbg s ILE 296 N 1.71 4.29 -0.19 0.90 1.01 0.16 0.42 121.20 129.50 4pbg s ILE 296 Ca 0.06 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 59.64 4pbg s ILE 296 Cb -0.16 -3.37 -0.03 0.00 0.01 0.00 0.00 42.46 38.91 4pbg s ILE 296 CO 0.09 -0.16 0.57 0.20 0.00 0.00 0.00 174.94 175.65 4pbg s ASN 297 N 1.51 6.64 -0.02 3.58 -0.87 0.23 -3.27 114.94 122.74 4pbg s ASN 297 Ca 0.01 0.77 0.00 0.00 -1.57 0.00 0.00 52.86 52.08 4pbg s ASN 297 Cb -0.19 -2.32 0.02 0.00 -0.02 0.00 0.00 41.25 38.74 4pbg s ASN 297 CO 0.05 -0.21 -0.00 -0.47 -2.57 0.00 0.00 177.10 173.90 4pbg s TYR 298 N 1.68 0.24 0.00 2.20 6.14 -0.35 -2.22 117.35 125.05 4pbg s TYR 298 Ca 0.27 0.01 0.00 0.00 0.64 0.00 0.00 57.07 57.99 4pbg s TYR 298 Cb -0.16 -0.30 0.00 0.00 0.42 0.00 0.00 41.96 41.92 4pbg s TYR 298 CO 0.10 -0.09 0.00 0.66 0.64 0.00 0.00 175.55 176.87 4pbg n TYR 299 N 3.82 0.00 -3.94 4.97 4.01 -1.26 -4.35 117.16 120.41 4pbg n TYR 299 Ca -0.23 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.42 4pbg n TYR 299 Cb 0.53 0.03 -0.03 0.00 -0.31 0.00 0.00 39.34 39.55 4pbg n TYR 299 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 4pbg s MET 300 N -1.79 1.73 0.43 -0.72 0.23 -1.26 -4.73 119.30 113.18 4pbg s MET 300 Ca 0.00 -1.23 0.07 0.00 -1.03 0.00 0.00 55.69 53.50 4pbg s MET 300 Cb 0.00 0.53 -0.02 0.00 -1.53 0.00 0.00 34.83 33.81 4pbg s MET 300 CO 0.00 -0.75 0.33 -1.12 -2.03 0.00 0.00 175.02 171.45 4pbg s SER 301 N -3.01 4.84 0.01 -1.18 0.01 -1.26 -3.89 113.70 109.21 4pbg s SER 301 Ca 0.19 -0.89 0.01 0.00 1.31 0.00 0.00 55.95 56.57 4pbg s SER 301 Cb -0.03 -0.43 -0.01 0.00 0.21 0.00 0.00 66.02 65.76 4pbg s SER 301 CO 0.10 -0.68 -0.04 -1.81 0.41 0.00 0.00 173.24 171.21 4pbg s ASP 302 N -4.09 0.47 -0.07 2.44 1.01 0.82 -4.75 116.67 112.50 4pbg s ASP 302 Ca 0.45 -0.16 0.02 0.00 0.71 0.00 0.00 52.55 53.57 4pbg s ASP 302 Cb -0.01 -0.03 -0.02 0.00 1.01 0.00 0.00 42.92 43.87 4pbg s ASP 302 CO 0.26 -0.01 -0.12 0.26 0.21 0.00 0.00 175.17 175.76 4pbg s TRP 303 N -0.36 2.78 0.02 4.23 0.51 -1.26 -0.07 118.94 124.79 4pbg s TRP 303 Ca -0.01 -0.21 0.06 0.00 -2.12 0.00 0.00 56.10 53.81 4pbg s TRP 303 Cb -0.03 -1.69 -0.02 0.00 -0.81 0.00 0.00 33.47 30.92 4pbg s TRP 303 CO -0.00 0.14 -0.18 -1.64 -0.51 0.00 0.00 176.95 174.76 4pbg s MET 304 N -0.52 1.32 0.02 4.98 -1.94 0.09 -2.08 119.30 121.18 4pbg s MET 304 Ca 0.07 -0.76 0.03 0.00 -1.71 0.00 0.00 55.69 53.32 4pbg s MET 304 Cb -0.12 -1.34 -0.01 0.00 2.01 0.00 0.00 34.83 35.36 4pbg s MET 304 CO 0.02 0.35 -0.09 1.14 -0.01 0.00 0.00 175.02 176.43 4pbg s GLN 305 N -0.81 0.65 0.82 2.03 -2.07 -0.11 0.07 119.66 120.25 4pbg s GLN 305 Ca 0.06 -0.51 -0.15 0.00 -1.82 0.00 0.00 55.36 52.94 4pbg s GLN 305 Cb -0.08 -0.59 -0.01 0.00 -1.09 0.00 0.00 33.01 31.25 4pbg s GLN 305 CO 0.01 0.15 0.47 0.00 -1.32 0.00 0.00 175.29 174.60 4pbg n ALA 306 N 2.27 -1.98 -3.19 2.60 0.00 -1.26 -0.94 120.51 118.01 4pbg n ALA 306 Ca -0.17 -0.40 0.04 0.00 0.00 0.00 0.00 53.44 52.91 4pbg n ALA 306 Cb 0.56 -1.83 -0.02 0.00 0.00 0.00 0.00 19.45 18.16 4pbg n ALA 306 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 4pbg s PHE 307 N -2.11 -1.09 -2.04 0.00 2.19 -1.26 -4.55 117.98 109.11 4pbg s PHE 307 Ca 0.62 1.23 0.10 0.00 0.33 0.00 0.00 56.93 59.21 4pbg s PHE 307 Cb -0.29 0.41 0.44 0.00 -1.31 0.00 0.00 43.02 42.28 4pbg s PHE 307 CO 0.62 -0.59 1.31 -0.40 1.83 0.00 0.00 175.22 177.99 4pbg n ASP 308 N 5.42 0.78 -2.02 6.13 5.68 -1.26 -4.41 116.55 126.87 4pbg n ASP 308 Ca -0.05 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.42 4pbg n ASP 308 Cb 0.52 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.42 4pbg n ASP 308 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 4pbg n GLY 309 N 0.82 0.06 3.86 6.12 0.00 -1.26 -4.93 105.19 109.86 4pbg n GLY 309 Ca 0.09 -1.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.01 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 0.27 3.89 0.11 1.61 0.41 -1.26 -4.29 118.70 119.44 4pbg s GLU 310 Ca 0.00 0.41 -0.31 0.00 -0.41 0.00 0.00 54.97 54.66 4pbg s GLU 310 Cb 0.00 -2.67 -0.09 0.00 -1.78 0.00 0.00 34.13 29.59 4pbg s GLU 310 CO 0.00 0.32 1.56 -0.08 -0.49 0.00 0.00 175.26 176.57 4pbg s THR 311 N -1.77 2.95 -0.08 3.63 -1.32 -1.26 -4.73 115.64 113.07 4pbg s THR 311 Ca 0.47 0.58 -0.05 0.00 -1.21 0.00 0.00 61.69 61.48 4pbg s THR 311 Cb -0.12 -3.37 0.03 0.00 -1.51 0.00 0.00 72.50 67.53 4pbg s THR 311 CO 0.20 0.03 0.18 -0.70 -2.21 0.00 0.00 174.62 172.12 4pbg s GLU 312 N 1.74 0.16 -0.07 7.08 2.12 0.50 -4.97 118.70 125.26 4pbg s GLU 312 Ca 0.70 0.36 -0.03 0.00 0.36 0.00 0.00 54.97 56.37 4pbg s GLU 312 Cb -0.40 -0.06 0.04 0.00 0.26 0.00 0.00 34.13 33.96 4pbg s GLU 312 CO 0.31 -0.11 0.10 0.42 -0.54 0.00 0.00 175.26 175.43 4pbg s ILE 313 N 0.79 -0.16 -0.15 -3.70 1.01 -1.26 -0.51 121.20 117.23 4pbg s ILE 313 Ca -0.06 0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.94 4pbg s ILE 313 Cb -0.07 -0.25 -0.00 0.00 0.01 0.00 0.00 42.46 42.15 4pbg s ILE 313 CO -0.04 0.11 -0.17 -0.63 0.00 0.00 0.00 174.94 174.21 4pbg s ILE 314 N 2.21 2.54 -0.15 2.92 1.01 0.80 -4.96 121.20 125.57 4pbg s ILE 314 Ca 0.04 -0.82 -0.19 0.00 0.00 0.00 0.00 60.65 59.69 4pbg s ILE 314 Cb -0.13 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 4pbg s ILE 314 CO -0.05 0.52 0.52 -2.28 0.00 0.00 0.00 174.94 173.66 4pbg s HIS 315 N 0.77 3.46 -0.68 3.97 5.65 -1.26 -1.84 115.29 125.35 4pbg s HIS 315 Ca -0.06 0.88 -0.23 0.00 0.25 0.00 0.00 55.06 55.90 4pbg s HIS 315 Cb -0.15 -2.64 0.06 0.00 -1.18 0.00 0.00 32.58 28.67 4pbg s HIS 315 CO 0.00 0.04 1.03 1.21 -0.65 0.00 0.00 174.74 176.37 4pbg s ASN 316 N 0.87 6.18 -0.07 9.88 2.47 -1.26 -4.84 114.94 128.17 4pbg s ASN 316 Ca 0.27 -0.92 0.19 0.00 0.42 0.00 0.00 52.86 52.81 4pbg s ASN 316 Cb -0.15 -2.44 -0.28 0.00 -1.45 0.00 0.00 41.25 36.92 4pbg s ASN 316 CO 0.11 -1.51 0.32 0.61 -3.72 0.00 0.00 177.10 172.91 4pbg n GLY 317 N 5.35 -0.91 0.56 1.21 0.00 -1.26 -4.42 105.19 105.72 4pbg n GLY 317 Ca -0.02 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.34 1.74 -2.62 1.61 4.76 -1.26 -4.52 118.16 115.52 4pbg n LYS 318 Ca -0.12 -1.10 -0.08 0.00 -2.87 0.00 0.00 58.31 54.14 4pbg n LYS 318 Cb 0.70 -1.41 0.04 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 1.15 0.04 3.04 0.72 0.00 -1.26 -4.99 105.19 103.89 4pbg n GLY 319 Ca 0.17 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -4.50 2.47 0.02 1.61 2.02 -1.18 -4.72 118.70 114.42 4pbg s GLU 320 Ca 0.03 -2.71 -0.33 0.00 0.02 0.00 0.00 54.97 51.98 4pbg s GLU 320 Cb -0.00 -3.62 -0.17 0.00 0.10 0.00 0.00 34.13 30.44 4pbg s GLU 320 CO 0.34 -1.17 0.85 1.63 0.02 0.00 0.00 175.26 176.93 4pbg n LYS 321 N 3.12 0.00 0.00 1.61 4.01 -0.65 -0.95 118.16 125.31 4pbg n LYS 321 Ca 0.09 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.89 4pbg n LYS 321 Cb 0.36 -1.23 0.00 0.00 -0.51 0.00 0.00 35.03 33.65 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 1.33 1.43 0.00 0.72 0.00 -1.26 -4.91 105.19 102.50 4pbg n GLY 322 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 4pbg n GLY 322 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 4pbg n SER 323 N 0.00 0.00 -4.75 1.61 3.41 -0.12 -4.86 113.62 108.91 4pbg n SER 323 Ca 0.00 0.42 -0.41 0.00 -0.26 0.00 0.00 58.87 58.63 4pbg n SER 323 Cb 0.00 -0.47 -0.04 0.00 -0.26 0.00 0.00 64.21 63.44 4pbg n SER 323 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 4pbg s SER 324 N -2.95 7.25 -0.10 4.04 0.01 -1.26 -4.58 113.70 116.11 4pbg s SER 324 Ca 0.15 2.22 -0.05 0.00 1.31 0.00 0.00 55.95 59.58 4pbg s SER 324 Cb 0.18 -2.62 0.05 0.00 0.21 0.00 0.00 66.02 63.84 4pbg s SER 324 CO 0.49 -0.18 0.24 -0.75 0.41 0.00 0.00 173.24 173.45 4pbg s LYS 325 N -1.07 0.19 -0.30 12.44 2.20 -0.77 -4.95 119.74 127.49 4pbg s LYS 325 Ca 0.46 0.53 -0.03 0.00 -0.36 0.00 0.00 55.97 56.57 4pbg s LYS 325 Cb -0.31 -0.12 0.11 0.00 -1.51 0.00 0.00 37.83 35.99 4pbg s LYS 325 CO 0.39 -0.17 0.15 -0.47 -0.36 0.00 0.00 175.35 174.88 4pbg s TYR 326 N 1.34 0.33 -0.05 4.03 6.14 -1.26 -0.14 117.35 127.75 4pbg s TYR 326 Ca -0.08 -0.94 0.01 0.00 0.64 0.00 0.00 57.07 56.70 4pbg s TYR 326 Cb -0.11 -0.88 0.02 0.00 0.42 0.00 0.00 41.96 41.41 4pbg s TYR 326 CO -0.08 -0.83 -0.06 1.14 0.64 0.00 0.00 175.55 176.35 4pbg s GLN 327 N 1.99 1.07 -0.09 4.97 -2.07 0.33 -2.18 119.66 123.67 4pbg s GLN 327 Ca 0.10 -0.18 0.04 0.00 -1.82 0.00 0.00 55.36 53.50 4pbg s GLN 327 Cb -0.17 -1.00 -0.00 0.00 -1.09 0.00 0.00 33.01 30.75 4pbg s GLN 327 CO -0.32 -0.06 -0.23 0.42 -1.32 0.00 0.00 175.29 173.77 4pbg s ILE 328 N 0.89 2.15 0.38 3.63 1.01 -0.20 -0.37 121.20 128.68 4pbg s ILE 328 Ca -0.11 -1.00 -0.28 0.00 0.00 0.00 0.00 60.65 59.26 4pbg s ILE 328 Cb -0.15 -1.81 -0.11 0.00 0.01 0.00 0.00 42.46 40.40 4pbg s ILE 328 CO 0.01 0.56 1.47 -0.75 0.00 0.00 0.00 174.94 176.23 4pbg s LYS 329 N 0.22 4.12 0.00 2.79 2.20 -1.26 -1.11 119.74 126.70 4pbg s LYS 329 Ca -0.15 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.01 4pbg s LYS 329 Cb -0.17 -2.97 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 4pbg s LYS 329 CO 0.08 -0.52 0.00 0.41 -0.36 0.00 0.00 175.35 174.96 4pbg n GLY 330 N 0.48 2.03 0.36 5.54 0.00 -1.26 -4.72 105.19 107.61 4pbg n GLY 330 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.93 0.06 -3.15 1.61 0.31 -0.49 -4.90 118.33 109.84 4pbg n VAL 331 Ca 0.00 0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.65 4pbg n VAL 331 Cb 0.00 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 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 2.20 -0.81 3.14 2.92 0.00 -0.26 -4.49 105.19 107.88 4pbg n GLY 332 Ca -0.00 -1.37 -0.16 0.00 0.00 0.00 0.00 46.02 44.49 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 -2.00 0.72 -0.19 1.61 1.70 -0.12 -1.03 118.95 119.65 4pbg s ARG 333 Ca 0.00 -0.90 -0.17 0.00 -0.47 0.00 0.00 55.73 54.19 4pbg s ARG 333 Cb 0.00 -0.64 -0.04 0.00 -0.57 0.00 0.00 34.95 33.70 4pbg s ARG 333 CO 0.00 0.13 0.44 1.03 -1.08 0.00 0.00 175.30 175.83 4pbg s ARG 334 N -1.73 4.21 -0.20 3.89 0.52 -0.92 -0.93 118.95 123.78 4pbg s ARG 334 Ca -0.04 0.30 -0.00 0.00 -0.52 0.00 0.00 55.73 55.46 4pbg s ARG 334 Cb -0.10 -3.52 0.05 0.00 0.52 0.00 0.00 34.95 31.90 4pbg s ARG 334 CO 0.02 -0.03 -0.04 0.08 0.02 0.00 0.00 175.30 175.34 4pbg s VAL 335 N 1.26 1.23 0.30 3.52 1.01 -0.88 -4.72 120.40 122.13 4pbg s VAL 335 Ca 0.22 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 4pbg s VAL 335 Cb -0.15 -1.49 -0.11 0.00 0.00 0.00 0.00 36.38 34.63 4pbg s VAL 335 CO 0.09 -0.02 1.60 0.00 0.00 0.00 0.00 175.10 176.77 4pbg s ALA 336 N 1.55 3.74 1.17 5.51 0.00 -1.26 -4.51 121.76 127.96 4pbg s ALA 336 Ca -0.02 1.59 -0.13 0.00 0.00 0.00 0.00 51.96 53.40 4pbg s ALA 336 Cb -0.17 -3.65 0.29 0.00 0.00 0.00 0.00 23.12 19.59 4pbg s ALA 336 CO -0.07 -1.01 1.03 -2.14 0.00 0.00 0.00 175.76 173.56 4pbg s PRO 337 N -0.67 -0.99 0.06 0.00 0.02 -1.26 -4.96 135.00 127.20 4pbg s PRO 337 Ca 0.63 0.85 -0.24 0.00 0.02 0.00 0.00 61.00 62.26 4pbg s PRO 337 Cb -0.48 -1.54 -0.16 0.00 0.02 0.00 0.00 34.50 32.33 4pbg s PRO 337 CO 0.50 -3.78 1.59 -0.44 -0.33 0.00 0.00 177.00 174.54 4pbg h ASP 338 N -2.66 0.03 0.00 2.53 3.32 -2.02 -3.36 116.42 114.26 4pbg h ASP 338 Ca -0.62 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.27 4pbg h ASP 338 Cb 1.33 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.88 4pbg h ASP 338 CO 0.50 0.18 -0.20 -1.22 -1.72 0.00 0.00 179.24 176.78 4pbg n TYR 339 N -4.99 0.00 -2.54 4.55 4.01 -1.26 -5.02 117.16 111.90 4pbg n TYR 339 Ca -0.07 -1.18 -0.38 0.00 -0.16 0.00 0.00 57.90 56.11 4pbg n TYR 339 Cb 0.11 -0.19 -0.04 0.00 -0.31 0.00 0.00 39.34 38.91 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 -2.98 3.69 0.78 -0.72 -7.23 -1.26 -4.98 120.40 107.70 4pbg s VAL 340 Ca 0.34 1.41 -0.12 0.00 -1.81 0.00 0.00 61.98 61.80 4pbg s VAL 340 Cb 0.31 -3.78 0.07 0.00 0.56 0.00 0.00 36.38 33.54 4pbg s VAL 340 CO -0.01 0.12 1.14 -2.84 -0.31 0.00 0.00 175.10 173.20 4pbg s PRO 341 N -2.17 1.97 0.14 4.82 0.02 -1.26 -4.88 135.00 133.64 4pbg s PRO 341 Ca 0.54 1.46 -0.22 0.00 0.02 0.00 0.00 61.00 62.80 4pbg s PRO 341 Cb -0.24 -1.84 0.06 0.00 0.02 0.00 0.00 34.50 32.50 4pbg s PRO 341 CO 0.31 -1.90 0.56 -0.98 -0.33 0.00 0.00 177.00 174.66 4pbg s ARG 342 N -4.44 1.22 0.40 5.54 1.70 -1.26 -1.27 118.95 120.84 4pbg s ARG 342 Ca 0.67 -0.48 0.05 0.00 -0.47 0.00 0.00 55.73 55.51 4pbg s ARG 342 Cb -0.22 0.56 0.05 0.00 -0.57 0.00 0.00 34.95 34.77 4pbg s ARG 342 CO 0.51 -0.51 0.42 0.25 -1.08 0.00 0.00 175.30 174.89 4pbg n THR 343 N -0.26 0.00 0.08 4.99 -2.24 -0.95 -4.93 114.28 110.97 4pbg n THR 343 Ca -0.17 -1.47 0.17 0.00 -2.27 0.00 0.00 64.05 60.31 4pbg n THR 343 Cb 0.64 -0.40 0.68 0.00 -2.10 0.00 0.00 70.33 69.16 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 0.28 0.00 -0.10 3.42 3.32 -1.92 0.06 116.42 121.48 4pbg h ASP 344 Ca -0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.83 4pbg h ASP 344 Cb 0.89 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.44 4pbg h ASP 344 CO 0.33 0.00 0.00 0.79 -1.72 0.00 0.00 179.24 178.64 4pbg n TRP 345 N -4.39 0.13 -1.16 4.55 8.01 -1.26 -1.63 117.44 121.68 4pbg n TRP 345 Ca 0.06 -0.06 -0.06 0.00 -1.31 0.00 0.00 57.50 56.13 4pbg n TRP 345 Cb 0.45 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 29.73 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 -0.13 -3.85 -4.67 -0.99 8.00 0.01 -4.83 116.55 110.08 4pbg n ASP 346 Ca 0.15 0.14 -0.42 0.00 0.71 0.00 0.00 54.79 55.37 4pbg n ASP 346 Cb 0.22 -1.84 -0.03 0.00 -0.02 0.00 0.00 41.12 39.44 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 -2.15 3.43 0.13 1.24 0.52 -1.26 -4.77 118.94 116.08 4pbg s TRP 347 Ca 0.00 1.38 -0.30 0.00 0.02 0.00 0.00 56.10 57.20 4pbg s TRP 347 Cb 0.00 -3.10 -0.06 0.00 -1.15 0.00 0.00 33.47 29.16 4pbg s TRP 347 CO 0.00 -0.28 1.01 0.42 0.02 0.00 0.00 176.95 178.12 4pbg s ILE 348 N 2.29 4.30 -0.57 2.03 1.01 -1.26 -2.23 121.20 126.76 4pbg s ILE 348 Ca 0.42 1.93 -0.19 0.00 0.00 0.00 0.00 60.65 62.80 4pbg s ILE 348 Cb -0.17 -4.23 0.08 0.00 0.01 0.00 0.00 42.46 38.16 4pbg s ILE 348 CO 0.13 0.31 0.70 -0.63 0.00 0.00 0.00 174.94 175.44 4pbg s ILE 349 N -0.08 4.79 -0.35 2.92 1.01 -0.39 -4.35 121.20 124.75 4pbg s ILE 349 Ca 0.48 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 60.38 4pbg s ILE 349 Cb -0.25 -4.44 0.14 0.00 0.01 0.00 0.00 42.46 37.92 4pbg s ILE 349 CO 0.31 -1.04 0.25 -0.47 0.00 0.00 0.00 174.94 174.00 4pbg s TYR 350 N 2.79 0.43 0.23 3.97 5.04 -1.26 -4.34 117.35 124.20 4pbg s TYR 350 Ca 0.14 -1.39 -0.08 0.00 -2.44 0.00 0.00 57.07 53.30 4pbg s TYR 350 Cb -0.22 -0.77 0.23 0.00 0.35 0.00 0.00 41.96 41.56 4pbg s TYR 350 CO 0.09 -0.87 1.88 -1.35 -1.34 0.00 0.00 175.55 173.96 4pbg h PRO 351 N 7.05 1.05 -0.06 4.97 0.11 -1.93 -2.75 132.00 140.45 4pbg h PRO 351 Ca 0.05 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.12 4pbg h PRO 351 Cb 0.99 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.86 4pbg h PRO 351 CO 0.25 0.69 0.44 1.49 -0.21 0.00 0.00 178.00 180.66 4pbg h GLU 352 N 1.08 0.00 -0.16 1.05 4.57 -1.95 0.76 114.58 119.92 4pbg h GLU 352 Ca 0.33 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.39 4pbg h GLU 352 Cb -0.04 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 4pbg h GLU 352 CO -0.10 0.00 -0.40 0.78 -1.18 0.00 0.00 179.01 178.11 4pbg h GLY 353 N 0.00 0.39 0.89 1.92 0.00 -1.91 -2.75 103.07 101.61 4pbg h GLY 353 Ca 0.03 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 4pbg h GLY 353 CO -0.00 0.34 -0.00 -2.00 0.00 0.00 0.00 176.54 174.87 4pbg h LEU 354 N 0.30 -0.01 -0.44 3.11 5.85 -1.04 -0.82 115.31 122.26 4pbg h LEU 354 Ca 0.03 -0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.72 4pbg h LEU 354 Cb 0.84 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.81 4pbg h LEU 354 CO 0.07 0.10 0.02 0.22 -0.34 0.00 0.00 178.44 178.52 4pbg h TYR 355 N -0.13 0.02 -0.23 1.25 5.03 -1.63 -0.56 116.97 120.73 4pbg h TYR 355 Ca -0.00 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.32 4pbg h TYR 355 Cb 0.12 0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.45 4pbg h TYR 355 CO -0.04 -0.07 0.05 -0.44 -1.32 0.00 0.00 178.16 176.34 4pbg h ASP 356 N 0.14 0.30 -0.21 -2.11 5.19 -1.17 -1.37 116.42 117.18 4pbg h ASP 356 Ca 0.22 -0.03 -0.16 0.00 -0.62 0.00 0.00 57.03 56.44 4pbg h ASP 356 Cb 0.31 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.74 4pbg h ASP 356 CO -0.34 0.32 -0.50 1.56 -3.12 0.00 0.00 179.24 177.15 4pbg h GLN 357 N 0.33 0.71 -0.48 3.56 1.08 0.08 -2.59 115.11 117.78 4pbg h GLN 357 Ca 0.08 -0.48 -0.01 0.00 -1.45 0.00 0.00 58.65 56.79 4pbg h GLN 357 Cb 0.15 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 4pbg h GLN 357 CO -0.00 1.10 0.26 0.82 -0.95 0.00 0.00 178.83 180.06 4pbg h ILE 358 N 0.42 1.17 0.00 2.54 2.04 -0.86 -1.42 117.51 121.40 4pbg h ILE 358 Ca -0.00 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.42 4pbg h ILE 358 Cb 1.12 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 4pbg h ILE 358 CO 0.11 0.18 0.00 0.23 0.00 0.00 0.00 178.15 178.67 4pbg n MET 359 N -4.67 0.16 -0.04 2.37 2.81 -0.54 -1.99 117.12 115.22 4pbg n MET 359 Ca 0.02 0.26 -0.20 0.00 -1.81 0.00 0.00 57.70 55.97 4pbg n MET 359 Cb 0.08 -1.74 -0.13 0.00 -0.71 0.00 0.00 33.22 30.72 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 0.13 -0.12 0.03 1.12 -1.01 -2.94 114.38 111.58 4pbg h ARG 360 Ca 0.00 -0.22 0.02 0.00 -1.11 0.00 0.00 59.98 58.67 4pbg h ARG 360 Cb 0.50 0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 30.52 4pbg h ARG 360 CO 0.00 1.11 -0.01 0.28 -3.11 0.00 0.00 179.97 178.23 4pbg h VAL 361 N -0.62 0.90 -0.86 0.20 2.07 -1.29 0.22 116.25 116.87 4pbg h VAL 361 Ca -0.27 -0.01 0.15 0.00 0.82 0.00 0.00 66.70 67.39 4pbg h VAL 361 Cb 1.51 0.87 -0.07 0.00 -1.52 0.00 0.00 31.29 32.08 4pbg h VAL 361 CO -0.03 0.00 0.56 0.50 0.02 0.00 0.00 177.57 178.62 4pbg h LYS 362 N 0.02 0.59 0.14 1.57 3.64 -1.54 0.46 116.57 121.45 4pbg h LYS 362 Ca 0.06 -0.04 -0.36 0.00 -1.27 0.00 0.00 60.65 59.05 4pbg h LYS 362 Cb 0.08 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 4pbg h LYS 362 CO -0.11 0.39 -1.90 -0.91 -2.27 0.00 0.00 179.45 174.65 4pbg h ASN 363 N 0.61 0.45 1.57 4.20 2.35 -1.25 -3.25 115.58 120.26 4pbg h ASN 363 Ca 0.43 -0.94 -0.09 0.00 -0.55 0.00 0.00 56.30 55.16 4pbg h ASN 363 Cb 0.79 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 4pbg h ASN 363 CO -0.19 1.83 -0.43 0.44 -1.65 0.00 0.00 177.43 177.43 4pbg h ASP 364 N 0.03 0.00 -2.20 5.81 5.19 -0.30 -3.38 116.42 121.56 4pbg h ASP 364 Ca -0.40 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 55.47 4pbg h ASP 364 Cb 2.02 0.00 -0.36 0.00 0.18 0.00 0.00 39.33 41.17 4pbg h ASP 364 CO 0.10 0.41 -0.93 -1.22 -3.12 0.00 0.00 179.24 174.47 4pbg n TYR 365 N -3.19 -1.24 0.30 4.55 4.01 0.16 -4.97 117.16 116.78 4pbg n TYR 365 Ca 0.02 -3.10 0.17 0.00 -0.16 0.00 0.00 57.90 54.83 4pbg n TYR 365 Cb 0.70 0.38 0.96 0.00 -0.31 0.00 0.00 39.34 41.07 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 5.51 0.00 -0.93 -0.72 0.11 -1.70 -2.71 132.00 131.57 4pbg h PRO 366 Ca 0.24 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.35 4pbg h PRO 366 Cb 0.93 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 4pbg h PRO 366 CO 0.34 0.02 0.00 0.27 -0.21 0.00 0.00 178.00 178.42 4pbg n ASN 367 N -3.54 1.83 0.27 -2.05 6.94 -1.26 -4.07 115.26 113.38 4pbg n ASN 367 Ca -0.03 -2.16 0.16 0.00 -0.02 0.00 0.00 54.58 52.53 4pbg n ASN 367 Cb 0.12 -0.53 0.72 0.00 -2.36 0.00 0.00 39.78 37.72 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 0.69 0.00 0.00 -2.53 -0.00 -1.82 -3.46 116.97 109.84 4pbg h TYR 368 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 4pbg h TYR 368 Cb 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.49 4pbg h TYR 368 CO 0.19 0.07 0.00 1.63 -0.00 0.00 0.00 178.16 180.05 4pbg n LYS 369 N -3.26 0.00 -3.79 0.10 5.02 -1.26 -4.30 118.16 110.67 4pbg n LYS 369 Ca -0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 4pbg n LYS 369 Cb 0.29 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.19 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 0.36 -0.04 1.97 2.20 -1.26 -4.82 119.74 118.15 4pbg s LYS 370 Ca 0.00 0.21 0.05 0.00 -0.36 0.00 0.00 55.97 55.88 4pbg s LYS 370 Cb 0.00 0.17 -0.01 0.00 -1.51 0.00 0.00 37.83 36.48 4pbg s LYS 370 CO 0.00 -0.06 -0.21 0.42 -0.36 0.00 0.00 175.35 175.14 4pbg s ILE 371 N -0.19 1.69 -0.02 5.43 1.01 0.45 0.02 121.20 129.58 4pbg s ILE 371 Ca -0.03 -0.88 0.07 0.00 0.00 0.00 0.00 60.65 59.81 4pbg s ILE 371 Cb -0.03 -1.43 -0.02 0.00 0.01 0.00 0.00 42.46 40.99 4pbg s ILE 371 CO 0.01 0.48 -0.22 -0.31 0.00 0.00 0.00 174.94 174.90 4pbg s TYR 372 N -0.16 1.99 -1.01 3.97 2.02 0.35 -0.50 117.35 124.02 4pbg s TYR 372 Ca -0.01 -0.41 -0.15 0.00 -0.37 0.00 0.00 57.07 56.13 4pbg s TYR 372 Cb -0.11 -1.29 0.18 0.00 -0.40 0.00 0.00 41.96 40.34 4pbg s TYR 372 CO 0.02 -0.06 1.14 0.42 -1.57 0.00 0.00 175.55 175.50 4pbg s ILE 373 N -0.45 5.14 -1.30 2.71 -1.09 -0.41 -0.67 121.20 125.13 4pbg s ILE 373 Ca 0.07 -2.27 0.05 0.00 -2.23 0.00 0.00 60.65 56.27 4pbg s ILE 373 Cb -0.09 -4.73 0.07 0.00 -1.58 0.00 0.00 42.46 36.13 4pbg s ILE 373 CO -0.00 -1.41 1.04 0.35 -1.23 0.00 0.00 174.94 173.69 4pbg n THR 374 N 4.61 1.17 -3.52 2.92 -2.24 -1.20 0.22 114.28 116.25 4pbg n THR 374 Ca 0.25 0.29 0.00 0.00 -2.27 0.00 0.00 64.05 62.33 4pbg n THR 374 Cb 0.46 -1.21 -0.05 0.00 -2.10 0.00 0.00 70.33 67.42 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 1.79 -0.70 0.00 0.00 3.84 -1.04 -1.21 114.94 117.62 4pbg s ASN 376 Ca -0.06 1.24 0.00 0.00 0.21 0.00 0.00 52.86 54.26 4pbg s ASN 376 Cb -0.04 1.27 0.00 0.00 -0.55 0.00 0.00 41.25 41.93 4pbg s ASN 376 CO -0.15 -0.21 0.00 0.61 -2.79 0.00 0.00 177.10 174.56 4pbg n GLY 377 N 3.17 -0.02 3.12 1.21 0.00 -1.26 -0.92 105.19 110.50 4pbg n GLY 377 Ca -0.16 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.65 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 3.25 -0.12 0.99 2.96 -1.26 -4.96 118.68 119.54 4pbg s LEU 378 Ca 0.00 -1.15 -0.20 0.00 -0.22 0.00 0.00 54.13 52.56 4pbg s LEU 378 Cb 0.00 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 4pbg s LEU 378 CO 0.00 -0.16 0.55 -0.83 -1.32 0.00 0.00 176.35 174.59 4pbg s GLY 379 N 1.20 2.40 -0.19 7.98 0.00 -1.26 -4.54 107.32 112.90 4pbg s GLY 379 Ca -0.04 -0.13 -0.33 0.00 0.00 0.00 0.00 44.72 44.21 4pbg s GLY 379 CO -0.06 0.95 1.19 -2.52 0.00 0.00 0.00 173.10 172.66 4pbg s TYR 380 N 0.86 -0.16 -0.90 1.90 -0.85 -0.15 -4.85 117.35 113.21 4pbg s TYR 380 Ca 0.29 0.15 -0.25 0.00 -0.52 0.00 0.00 57.07 56.74 4pbg s TYR 380 Cb -0.16 0.51 -0.08 0.00 0.38 0.00 0.00 41.96 42.61 4pbg s TYR 380 CO 0.12 -0.21 2.07 0.21 -1.52 0.00 0.00 175.55 176.21 4pbg s LYS 381 N -2.09 2.27 0.97 -3.49 2.47 -1.26 -3.69 119.74 114.93 4pbg s LYS 381 Ca 0.08 -0.16 -0.12 0.00 -1.56 0.00 0.00 55.97 54.21 4pbg s LYS 381 Cb -0.01 -5.00 0.17 0.00 -1.46 0.00 0.00 37.83 31.53 4pbg s LYS 381 CO -0.05 -3.75 1.08 -0.51 0.16 0.00 0.00 175.35 172.29 4pbg s ASP 382 N 8.66 2.76 -0.21 1.43 1.01 -1.26 -5.00 116.67 124.05 4pbg s ASP 382 Ca 0.76 1.47 -0.01 0.00 0.71 0.00 0.00 52.55 55.48 4pbg s ASP 382 Cb -0.08 -2.14 0.01 0.00 1.01 0.00 0.00 42.92 41.72 4pbg s ASP 382 CO 0.03 -3.09 -0.11 -0.70 0.21 0.00 0.00 175.17 171.51 4pbg s GLU 383 N -4.84 3.05 -0.33 8.23 2.12 -1.26 -5.06 118.70 120.62 4pbg s GLU 383 Ca 0.65 -0.82 -0.29 0.00 0.36 0.00 0.00 54.97 54.87 4pbg s GLU 383 Cb -0.20 -2.84 0.01 0.00 0.26 0.00 0.00 34.13 31.36 4pbg s GLU 383 CO 0.59 -0.27 1.23 0.12 -0.54 0.00 0.00 175.26 176.39 4pbg s PHE 384 N 1.36 2.81 -0.04 5.30 5.36 -1.26 -4.47 117.98 127.03 4pbg s PHE 384 Ca 0.04 0.93 -0.02 0.00 -0.96 0.00 0.00 56.93 56.92 4pbg s PHE 384 Cb -0.15 -3.92 0.03 0.00 -0.34 0.00 0.00 43.02 38.64 4pbg s PHE 384 CO -0.07 -1.43 0.08 0.14 -1.46 0.00 0.00 175.22 172.48 4pbg s VAL 385 N 4.24 -0.04 -1.35 3.12 -7.23 0.16 -4.89 120.40 114.41 4pbg s VAL 385 Ca 0.53 0.16 -0.08 0.00 -1.81 0.00 0.00 61.98 60.79 4pbg s VAL 385 Cb -0.14 -0.15 0.01 0.00 0.56 0.00 0.00 36.38 36.66 4pbg s VAL 385 CO 0.22 0.07 1.01 0.47 -0.31 0.00 0.00 175.10 176.56 4pbg n ASP 386 N 3.99 -6.16 -2.76 4.85 8.00 -1.26 -2.29 116.55 120.91 4pbg n ASP 386 Ca -0.25 -0.46 -0.22 0.00 0.71 0.00 0.00 54.79 54.58 4pbg n ASP 386 Cb 0.52 -4.83 0.02 0.00 -0.02 0.00 0.00 41.12 36.81 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 -2.71 -6.07 -0.82 -2.24 3.02 -1.26 -4.91 115.26 100.26 4pbg n ASN 387 Ca -0.02 -0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 4pbg n ASN 387 Cb 0.57 -4.96 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 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 -4.33 0.00 -3.74 3.41 -1.04 -0.97 -4.67 114.28 102.95 4pbg n THR 388 Ca -0.17 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.71 4pbg n THR 388 Cb 0.65 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 69.06 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 -2.81 0.00 -1.01 12.58 1.01 -1.26 -0.66 120.40 128.25 4pbg s VAL 389 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.95 4pbg s VAL 389 Cb 0.00 -0.57 0.29 0.00 0.00 0.00 0.00 36.38 36.11 4pbg s VAL 389 CO 0.00 -0.00 1.30 -1.22 0.00 0.00 0.00 175.10 175.18 4pbg n TYR 390 N 2.86 2.92 -1.03 5.22 4.02 -1.26 -0.90 117.16 128.98 4pbg n TYR 390 Ca -0.13 -3.05 -0.22 0.00 -0.01 0.00 0.00 57.90 54.49 4pbg n TYR 390 Cb 0.57 -1.20 -0.09 0.00 -0.02 0.00 0.00 39.34 38.59 4pbg n TYR 390 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 4pbg n ASP 391 N 1.46 6.22 -0.13 7.72 5.68 -1.26 -4.56 116.55 131.69 4pbg n ASP 391 Ca 0.26 -2.45 0.18 0.00 -0.50 0.00 0.00 54.79 52.28 4pbg n ASP 391 Cb 0.35 -1.36 0.57 0.00 -1.14 0.00 0.00 41.12 39.54 4pbg n ASP 391 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 4pbg h ASP 392 N 4.23 0.26 -0.44 -1.12 3.32 -1.97 0.41 116.42 121.11 4pbg h ASP 392 Ca 0.46 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.53 4pbg h ASP 392 Cb 0.85 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 4pbg h ASP 392 CO 0.94 0.13 0.29 1.23 -1.72 0.00 0.00 179.24 180.10 4pbg h GLY 393 N 0.28 0.63 0.90 2.75 0.00 -1.99 0.26 103.07 105.90 4pbg h GLY 393 Ca 0.35 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.39 4pbg h GLY 393 CO -0.08 0.24 0.01 -0.09 0.00 0.00 0.00 176.54 176.61 4pbg h ARG 394 N 0.60 0.57 -0.87 4.80 2.43 -0.66 -0.48 114.38 120.76 4pbg h ARG 394 Ca 0.16 -0.18 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 4pbg h ARG 394 Cb -0.05 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.40 4pbg h ARG 394 CO -0.03 0.69 0.58 0.82 -1.51 0.00 0.00 179.97 180.52 4pbg h ILE 395 N 0.38 1.19 -0.36 1.20 2.04 -0.64 -0.36 117.51 120.96 4pbg h ILE 395 Ca 0.09 -0.39 -0.12 0.00 1.00 0.00 0.00 64.86 65.44 4pbg h ILE 395 Cb 0.43 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 4pbg h ILE 395 CO 0.02 0.21 -0.27 -0.78 0.00 0.00 0.00 178.15 177.32 4pbg h ASP 396 N 1.15 0.77 0.45 1.72 3.58 -0.07 -0.74 116.42 123.27 4pbg h ASP 396 Ca 0.33 -0.30 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 4pbg h ASP 396 Cb -0.08 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 40.77 4pbg h ASP 396 CO -0.08 1.00 -0.21 0.22 -2.88 0.00 0.00 179.24 177.29 4pbg h TYR 397 N 0.64 -0.56 0.24 0.28 5.03 -0.19 -2.72 116.97 119.70 4pbg h TYR 397 Ca 0.08 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.38 4pbg h TYR 397 Cb 0.79 0.18 -0.01 0.00 1.55 0.00 0.00 36.73 39.24 4pbg h TYR 397 CO 0.04 -0.23 -0.20 0.28 -1.32 0.00 0.00 178.16 176.73 4pbg h VAL 398 N -0.92 0.58 -0.95 1.81 2.07 -1.11 -1.93 116.25 115.79 4pbg h VAL 398 Ca -0.06 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.72 4pbg h VAL 398 Cb 0.57 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 4pbg h VAL 398 CO 0.10 0.00 0.67 0.50 0.02 0.00 0.00 177.57 178.86 4pbg h LYS 399 N -0.45 0.12 0.02 1.57 3.64 -1.24 0.68 116.57 120.91 4pbg h LYS 399 Ca -0.01 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 59.13 4pbg h LYS 399 Cb 0.40 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 4pbg h LYS 399 CO -0.02 0.08 -0.99 1.96 -2.27 0.00 0.00 179.45 178.21 4pbg h GLN 400 N 0.13 0.41 -0.01 1.90 4.20 -1.02 -2.93 115.11 117.78 4pbg h GLN 400 Ca 0.47 -0.47 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 4pbg h GLN 400 Cb 1.66 0.14 0.01 0.00 0.30 0.00 0.00 27.48 29.59 4pbg h GLN 400 CO -0.07 1.14 -0.42 0.45 -0.67 0.00 0.00 178.83 179.25 4pbg h HIS 401 N 0.22 0.45 -1.00 2.96 3.86 -0.69 -3.11 115.15 117.84 4pbg h HIS 401 Ca -0.09 -0.24 0.19 0.00 -1.16 0.00 0.00 60.37 59.07 4pbg h HIS 401 Cb 1.64 -0.05 -0.10 0.00 1.06 0.00 0.00 27.41 29.95 4pbg h HIS 401 CO 0.06 1.04 0.61 -0.07 0.86 0.00 0.00 177.93 180.44 4pbg h LEU 402 N -0.27 0.75 -0.90 2.43 3.38 -1.02 0.41 115.31 120.09 4pbg h LEU 402 Ca -0.05 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 4pbg h LEU 402 Cb 1.15 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 4pbg h LEU 402 CO 0.08 0.27 0.19 -0.33 0.09 0.00 0.00 178.44 178.75 4pbg h GLU 403 N 0.73 1.00 -0.17 1.13 5.08 -1.58 0.08 114.58 120.85 4pbg h GLU 403 Ca 0.57 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.60 4pbg h GLU 403 Cb 0.93 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 4pbg h GLU 403 CO -0.35 0.87 -0.42 0.28 -1.00 0.00 0.00 179.01 178.38 4pbg h VAL 404 N 0.96 1.31 -0.10 3.13 2.07 -0.21 -2.43 116.25 120.98 4pbg h VAL 404 Ca 0.21 -1.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.14 4pbg h VAL 404 Cb 0.29 1.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 4pbg h VAL 404 CO -0.01 0.48 0.01 -0.07 0.02 0.00 0.00 177.57 178.00 4pbg h LEU 405 N 0.33 0.18 -1.87 2.57 3.38 -0.46 -0.22 115.31 119.21 4pbg h LEU 405 Ca 0.03 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.75 4pbg h LEU 405 Cb 0.88 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 4pbg h LEU 405 CO 0.07 0.43 0.42 -1.28 0.09 0.00 0.00 178.44 178.17 4pbg h SER 406 N -0.08 0.00 0.00 -0.43 0.87 -0.80 0.32 113.55 113.43 4pbg h SER 406 Ca 0.03 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.50 4pbg h SER 406 Cb 0.33 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.28 4pbg h SER 406 CO 0.00 0.00 -0.81 0.44 -0.53 0.00 0.00 176.83 175.94 4pbg h ASP 407 N 0.00 0.00 -0.73 6.23 3.32 -0.91 -3.24 116.42 121.08 4pbg h ASP 407 Ca 0.07 -0.20 0.21 0.00 0.02 0.00 0.00 57.03 57.13 4pbg h ASP 407 Cb 0.90 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.43 4pbg h ASP 407 CO -0.00 1.05 0.57 0.00 -1.72 0.00 0.00 179.24 179.14 4pbg h ALA 408 N -0.80 2.64 0.34 3.45 0.00 0.01 0.17 119.26 125.07 4pbg h ALA 408 Ca -0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 4pbg h ALA 408 Cb 0.82 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.67 4pbg h ALA 408 CO -0.09 -0.95 -0.16 0.82 0.00 0.00 0.00 179.25 178.87 4pbg h ILE 409 N 0.00 0.54 -0.88 0.00 2.04 -0.57 -0.29 117.51 118.34 4pbg h ILE 409 Ca 0.35 -0.69 0.21 0.00 1.00 0.00 0.00 64.86 65.73 4pbg h ILE 409 Cb 1.49 0.82 -0.06 0.00 -0.74 0.00 0.00 36.82 38.33 4pbg h ILE 409 CO -0.00 0.11 0.59 0.00 0.00 0.00 0.00 178.15 178.85 4pbg h ALA 410 N -0.51 2.34 -0.14 1.87 0.00 -0.80 0.63 119.26 122.65 4pbg h ALA 410 Ca -0.05 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 4pbg h ALA 410 Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 4pbg h ALA 410 CO 0.08 -0.61 0.00 -0.25 0.00 0.00 0.00 179.25 178.46 4pbg n ASP 411 N -4.46 1.89 0.00 0.00 9.92 -0.01 -4.86 116.55 119.02 4pbg n ASP 411 Ca 0.19 -2.18 0.00 0.00 -0.53 0.00 0.00 54.79 52.27 4pbg n ASP 411 Cb 0.74 -0.46 0.00 0.00 -0.64 0.00 0.00 41.12 40.76 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 0.27 0.82 3.74 0.44 0.00 0.20 -5.03 105.19 105.63 4pbg n GLY 412 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.02 3.51 -1.18 4.61 0.00 -0.13 -5.01 121.76 121.54 4pbg s ALA 413 Ca 0.00 -0.21 -0.19 0.00 0.00 0.00 0.00 51.96 51.57 4pbg s ALA 413 Cb 0.00 -2.60 0.08 0.00 0.00 0.00 0.00 23.12 20.60 4pbg s ALA 413 CO 0.00 0.06 1.57 1.21 0.00 0.00 0.00 175.76 178.60 4pbg s ASN 414 N 0.40 6.77 -0.19 0.00 2.47 -1.26 -4.20 114.94 118.92 4pbg s ASN 414 Ca 0.25 -2.23 -0.08 0.00 0.42 0.00 0.00 52.86 51.22 4pbg s ASN 414 Cb -0.15 -2.54 -0.04 0.00 -1.45 0.00 0.00 41.25 37.07 4pbg s ASN 414 CO 0.10 -1.19 0.07 -0.69 -3.72 0.00 0.00 177.10 171.67 4pbg s VAL 415 N 3.91 4.77 -0.50 -5.21 1.01 -1.26 -0.41 120.40 122.70 4pbg s VAL 415 Ca 0.48 -0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.50 4pbg s VAL 415 Cb 0.01 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 4pbg s VAL 415 CO 0.01 0.44 0.42 0.29 0.00 0.00 0.00 175.10 176.26 4pbg n LYS 416 N 3.73 3.36 -3.63 2.72 4.76 0.34 -4.95 118.16 124.50 4pbg n LYS 416 Ca -0.16 -0.29 -0.01 0.00 -2.87 0.00 0.00 58.31 54.98 4pbg n LYS 416 Cb 0.52 -0.91 -0.01 0.00 -1.84 0.00 0.00 35.03 32.79 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 -1.32 -0.36 -0.03 0.72 0.00 -1.26 -2.41 107.32 102.66 4pbg s GLY 417 Ca 0.04 0.83 0.01 0.00 0.00 0.00 0.00 44.72 45.60 4pbg s GLY 417 CO 0.22 0.21 -0.03 -0.47 0.00 0.00 0.00 173.10 173.03 4pbg s TYR 418 N -2.60 0.53 -0.21 1.90 5.04 0.10 -1.29 117.35 120.83 4pbg s TYR 418 Ca 0.12 -0.11 0.00 0.00 -2.44 0.00 0.00 57.07 54.65 4pbg s TYR 418 Cb 0.02 -0.49 0.02 0.00 0.35 0.00 0.00 41.96 41.86 4pbg s TYR 418 CO -0.03 -0.13 -0.15 -0.06 -1.34 0.00 0.00 175.55 173.84 4pbg s PHE 419 N 0.73 2.91 -0.21 4.97 0.40 0.13 -0.08 117.98 126.84 4pbg s PHE 419 Ca -0.09 -1.66 -0.22 0.00 -0.60 0.00 0.00 56.93 54.36 4pbg s PHE 419 Cb -0.12 -1.96 -0.02 0.00 0.51 0.00 0.00 43.02 41.43 4pbg s PHE 419 CO -0.00 -0.78 0.71 -1.50 0.70 0.00 0.00 175.22 174.35 4pbg s ILE 420 N 1.29 4.95 -0.31 0.64 2.07 -1.08 -2.50 121.20 126.24 4pbg s ILE 420 Ca 0.02 1.36 -0.24 0.00 -1.41 0.00 0.00 60.65 60.38 4pbg s ILE 420 Cb -0.15 -4.02 0.00 0.00 0.13 0.00 0.00 42.46 38.43 4pbg s ILE 420 CO -0.10 0.04 0.82 0.86 -1.91 0.00 0.00 174.94 174.66 4pbg s TRP 421 N 2.22 3.19 0.18 3.50 -0.11 -0.09 -1.81 118.94 126.02 4pbg s TRP 421 Ca 0.32 0.83 0.03 0.00 1.22 0.00 0.00 56.10 58.50 4pbg s TRP 421 Cb -0.16 -3.29 -0.05 0.00 -1.50 0.00 0.00 33.47 28.48 4pbg s TRP 421 CO 0.10 -0.60 -0.03 -1.54 -4.62 0.00 0.00 176.95 170.25 4pbg s SER 422 N 1.64 1.56 0.16 5.86 1.04 -1.24 -4.09 113.70 118.63 4pbg s SER 422 Ca 0.34 -1.13 -0.17 0.00 0.48 0.00 0.00 55.95 55.47 4pbg s SER 422 Cb -0.14 0.05 0.07 0.00 0.10 0.00 0.00 66.02 66.10 4pbg s SER 422 CO 0.13 -0.48 1.72 0.25 0.98 0.00 0.00 173.24 175.84 4pbg h LEU 423 N 2.67 -0.06 -8.54 2.42 5.85 -1.43 -2.52 115.31 113.70 4pbg h LEU 423 Ca -0.37 0.07 -0.25 0.00 0.84 0.00 0.00 57.88 58.16 4pbg h LEU 423 Cb 1.20 0.11 -0.15 0.00 0.37 0.00 0.00 40.66 42.19 4pbg h LEU 423 CO 0.64 0.01 -0.68 0.00 -0.34 0.00 0.00 178.44 178.06 4pbg s MET 424 N -6.17 0.97 0.06 1.25 0.23 -1.26 -2.22 119.30 112.16 4pbg s MET 424 Ca -0.13 -1.43 -0.31 0.00 -1.03 0.00 0.00 55.69 52.79 4pbg s MET 424 Cb 0.13 -0.22 -0.08 0.00 -1.53 0.00 0.00 34.83 33.13 4pbg s MET 424 CO 0.71 -0.08 1.67 -0.51 -2.03 0.00 0.00 175.02 174.78 4pbg s ASP 425 N -3.11 6.59 0.09 -1.18 1.01 -0.59 -4.37 116.67 115.12 4pbg s ASP 425 Ca 0.18 2.49 0.04 0.00 0.71 0.00 0.00 52.55 55.97 4pbg s ASP 425 Cb 0.06 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.39 4pbg s ASP 425 CO -0.00 -0.90 -0.12 0.68 0.21 0.00 0.00 175.17 175.04 4pbg s VAL 426 N 2.79 1.01 0.81 -1.27 -7.23 -1.26 -4.70 120.40 110.55 4pbg s VAL 426 Ca 0.75 -1.51 -0.11 0.00 -1.81 0.00 0.00 61.98 59.30 4pbg s VAL 426 Cb -0.40 -1.24 0.08 0.00 0.56 0.00 0.00 36.38 35.39 4pbg s VAL 426 CO 0.33 -0.43 1.12 0.72 -0.31 0.00 0.00 175.10 176.52 4pbg s PHE 427 N -1.98 2.23 0.04 2.82 -0.71 -1.26 -4.77 117.98 114.34 4pbg s PHE 427 Ca 0.03 1.64 -0.02 0.00 -1.04 0.00 0.00 56.93 57.53 4pbg s PHE 427 Cb -0.06 -3.18 -0.04 0.00 -1.21 0.00 0.00 43.02 38.53 4pbg s PHE 427 CO 0.01 -2.18 0.23 0.45 -1.34 0.00 0.00 175.22 172.39 4pbg s SER 428 N -3.01 6.40 0.14 1.98 0.15 0.14 -4.88 113.70 114.61 4pbg s SER 428 Ca 0.64 0.37 -0.18 0.00 0.70 0.00 0.00 55.95 57.48 4pbg s SER 428 Cb -0.20 -2.01 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 4pbg s SER 428 CO 0.55 0.20 1.74 -0.50 1.20 0.00 0.00 173.24 176.43 4pbg h TRP 429 N 3.40 0.13 -0.12 3.44 4.06 -1.95 -3.09 115.95 121.81 4pbg h TRP 429 Ca -0.47 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.50 4pbg h TRP 429 Cb 1.17 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 29.32 4pbg h TRP 429 CO 0.64 0.05 0.00 -1.13 -3.56 0.00 0.00 178.44 174.44 4pbg n SER 430 N -5.06 2.31 -0.17 -3.49 3.41 -1.26 -4.66 113.62 104.70 4pbg n SER 430 Ca -0.01 -1.99 0.04 0.00 -0.26 0.00 0.00 58.87 56.65 4pbg n SER 430 Cb 0.11 -0.08 0.06 0.00 -0.26 0.00 0.00 64.21 64.03 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 -0.15 1.34 -0.51 4.04 4.13 -1.23 -4.65 115.26 118.22 4pbg n ASN 431 Ca 0.04 -2.32 0.00 0.00 1.68 0.00 0.00 54.58 53.97 4pbg n ASN 431 Cb 0.31 -0.23 0.00 0.00 -1.54 0.00 0.00 39.78 38.32 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 -0.69 -0.50 0.08 7.41 0.00 -1.17 -3.86 105.19 106.47 4pbg n GLY 432 Ca 0.07 -1.01 0.15 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.03 0.00 0.03 1.61 4.02 -1.26 -0.68 117.16 119.86 4pbg n TYR 433 Ca 0.00 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.71 4pbg n TYR 433 Cb 0.00 -0.17 -0.09 0.00 -0.02 0.00 0.00 39.34 39.07 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 0.41 0.67 -5.85 -0.72 4.39 -1.94 -3.40 114.58 108.14 4pbg h GLU 434 Ca 0.00 -0.68 -0.59 0.00 0.34 0.00 0.00 59.36 58.43 4pbg h GLU 434 Cb 0.28 0.18 -0.08 0.00 -0.10 0.00 0.00 28.75 29.04 4pbg h GLU 434 CO 0.00 1.27 1.79 0.21 -1.16 0.00 0.00 179.01 181.12 4pbg s LYS 435 N -3.40 3.59 0.18 2.33 2.20 -1.25 -4.02 119.74 119.36 4pbg s LYS 435 Ca -0.09 -1.57 -0.26 0.00 -0.36 0.00 0.00 55.97 53.69 4pbg s LYS 435 Cb 0.08 -5.43 -0.08 0.00 -1.51 0.00 0.00 37.83 30.89 4pbg s LYS 435 CO 0.91 -2.58 0.80 1.03 -0.36 0.00 0.00 175.35 175.15 4pbg s ARG 436 N 4.91 4.60 0.00 4.03 0.52 -1.24 -4.64 118.95 127.13 4pbg s ARG 436 Ca 0.55 1.20 0.00 0.00 -0.52 0.00 0.00 55.73 56.96 4pbg s ARG 436 Cb 0.02 -3.26 0.00 0.00 0.52 0.00 0.00 34.95 32.22 4pbg s ARG 436 CO 0.04 0.57 0.00 0.66 0.02 0.00 0.00 175.30 176.59 4pbg n TYR 437 N 1.58 0.00 -1.59 -0.53 4.02 -1.26 -0.98 117.16 118.40 4pbg n TYR 437 Ca -0.05 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.47 4pbg n TYR 437 Cb 0.48 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.86 4pbg n TYR 437 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 4pbg n GLY 438 N 1.05 -0.33 0.17 2.72 0.00 -1.25 -3.65 105.19 103.91 4pbg n GLY 438 Ca 0.00 -0.18 0.06 0.00 0.00 0.00 0.00 46.02 45.90 4pbg n GLY 438 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 4pbg h LEU 439 N 0.33 0.00 -8.27 0.99 3.38 -0.98 -3.44 115.31 107.32 4pbg h LEU 439 Ca -0.49 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 56.91 4pbg h LEU 439 Cb 1.36 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.80 4pbg h LEU 439 CO 0.50 0.31 -0.84 -0.36 0.09 0.00 0.00 178.44 178.14 4pbg s PHE 440 N -3.09 1.78 -0.30 1.13 0.40 -0.97 -2.32 117.98 114.60 4pbg s PHE 440 Ca 0.05 -0.49 -0.25 0.00 -0.60 0.00 0.00 56.93 55.64 4pbg s PHE 440 Cb 0.07 -1.19 0.00 0.00 0.51 0.00 0.00 43.02 42.41 4pbg s PHE 440 CO 0.71 -0.15 0.86 -0.47 0.70 0.00 0.00 175.22 176.87 4pbg s TYR 441 N -0.04 3.20 -0.25 0.36 5.04 0.10 -1.54 117.35 124.23 4pbg s TYR 441 Ca -0.03 0.93 -0.14 0.00 -2.44 0.00 0.00 57.07 55.39 4pbg s TYR 441 Cb -0.11 -3.32 -0.04 0.00 0.35 0.00 0.00 41.96 38.84 4pbg s TYR 441 CO 0.02 -0.60 0.31 0.08 -1.34 0.00 0.00 175.55 174.01 4pbg s VAL 442 N 3.11 5.24 -0.74 3.14 1.01 -1.26 -0.64 120.40 130.26 4pbg s VAL 442 Ca 0.36 0.46 -0.22 0.00 0.00 0.00 0.00 61.98 62.58 4pbg s VAL 442 Cb -0.14 -3.64 0.08 0.00 0.00 0.00 0.00 36.38 32.69 4pbg s VAL 442 CO 0.13 0.24 1.03 -0.62 0.00 0.00 0.00 175.10 175.88 4pbg s ASP 443 N 1.37 6.30 0.00 3.32 2.15 -0.64 -4.90 116.67 124.27 4pbg s ASP 443 Ca 0.13 -1.26 0.00 0.00 0.43 0.00 0.00 52.55 51.86 4pbg s ASP 443 Cb -0.15 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 4pbg s ASP 443 CO 0.08 -1.36 0.38 0.49 -0.17 0.00 0.00 175.17 174.59 4pbg n PHE 444 N 7.53 0.00 -0.10 -5.34 3.72 -1.26 0.70 117.46 122.71 4pbg n PHE 444 Ca 0.05 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.30 4pbg n PHE 444 Cb 0.47 -0.06 -0.06 0.00 -0.94 0.00 0.00 39.48 38.89 4pbg n PHE 444 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 4pbg n ASP 445 N -0.88 1.88 0.04 4.37 8.00 -1.26 -4.50 116.55 124.21 4pbg n ASP 445 Ca 0.00 0.45 0.12 0.00 0.71 0.00 0.00 54.79 56.07 4pbg n ASP 445 Cb 0.04 -0.85 0.11 0.00 -0.02 0.00 0.00 41.12 40.41 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 -4.46 0.26 -1.20 -3.53 -2.24 -0.93 -4.93 114.28 97.24 4pbg n THR 446 Ca -0.24 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.22 4pbg n THR 446 Cb 0.55 0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.79 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 -2.01 -1.00 -2.64 -0.78 1.13 0.22 -4.98 117.38 107.31 4pbg n GLN 447 Ca 0.03 0.65 -0.41 0.00 -1.94 0.00 0.00 57.00 55.33 4pbg n GLN 447 Cb 0.43 -4.62 -0.04 0.00 0.11 0.00 0.00 30.24 26.12 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 -2.23 4.67 0.15 -1.09 2.02 -1.24 -4.72 118.70 116.26 4pbg s GLU 448 Ca 0.00 1.56 -0.05 0.00 0.02 0.00 0.00 54.97 56.50 4pbg s GLU 448 Cb 0.00 -3.33 -0.06 0.00 0.10 0.00 0.00 34.13 30.84 4pbg s GLU 448 CO 0.00 0.18 0.39 1.03 0.02 0.00 0.00 175.26 176.88 4pbg s ARG 449 N -0.23 3.62 -0.02 1.61 3.00 -1.26 -1.62 118.95 124.06 4pbg s ARG 449 Ca 0.47 -0.08 0.00 0.00 0.00 0.00 0.00 55.73 56.13 4pbg s ARG 449 Cb -0.26 -2.83 0.02 0.00 0.00 0.00 0.00 34.95 31.88 4pbg s ARG 449 CO 0.32 0.45 -0.00 0.71 0.00 0.00 0.00 175.30 176.78 4pbg s TYR 450 N -1.68 0.23 0.18 -0.53 1.51 0.19 -4.93 117.35 112.32 4pbg s TYR 450 Ca 0.41 0.01 -0.30 0.00 -1.01 0.00 0.00 57.07 56.18 4pbg s TYR 450 Cb -0.12 -0.30 -0.08 0.00 -0.11 0.00 0.00 41.96 41.35 4pbg s TYR 450 CO 0.25 -0.09 1.23 -1.25 -1.11 0.00 0.00 175.55 174.58 4pbg s PRO 451 N 0.71 4.46 0.60 -1.71 0.04 -1.26 0.02 135.00 137.86 4pbg s PRO 451 Ca -0.07 1.92 -0.01 0.00 0.04 0.00 0.00 61.00 62.89 4pbg s PRO 451 Cb -0.10 -3.23 0.05 0.00 0.04 0.00 0.00 34.50 31.26 4pbg s PRO 451 CO -0.01 -0.15 0.85 0.15 0.04 0.00 0.00 177.00 177.88 4pbg s LYS 452 N -0.14 2.37 0.54 4.56 1.02 -0.98 -4.55 119.74 122.56 4pbg s LYS 452 Ca 0.54 -0.70 0.22 0.00 0.02 0.00 0.00 55.97 56.05 4pbg s LYS 452 Cb -0.34 -2.40 1.45 0.00 -0.52 0.00 0.00 37.83 36.02 4pbg s LYS 452 CO 0.37 -0.91 2.14 -0.22 -0.92 0.00 0.00 175.35 175.80 4pbg h LYS 453 N -0.15 0.00 -0.02 1.68 3.64 -1.34 0.17 116.57 120.56 4pbg h LYS 453 Ca -0.42 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 58.80 4pbg h LYS 453 Cb 1.30 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 4pbg h LYS 453 CO 0.53 0.00 -0.71 0.66 -2.27 0.00 0.00 179.45 177.66 4pbg h SER 454 N 0.00 0.16 -0.18 4.20 4.64 -1.86 -2.07 113.55 118.43 4pbg h SER 454 Ca 0.06 -0.10 0.03 0.00 -0.47 0.00 0.00 61.79 61.30 4pbg h SER 454 Cb 0.25 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 4pbg h SER 454 CO -0.00 0.81 -0.02 0.00 -0.87 0.00 0.00 176.83 176.76 4pbg h ALA 455 N 1.18 0.15 -0.53 5.18 0.00 -0.75 0.20 119.26 124.68 4pbg h ALA 455 Ca -0.02 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 4pbg h ALA 455 Cb 1.26 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 4pbg h ALA 455 CO 0.10 -0.45 0.10 0.45 0.00 0.00 0.00 179.25 179.46 4pbg h HIS 456 N 0.04 0.86 -0.34 0.00 -0.00 -1.44 -2.08 115.15 112.18 4pbg h HIS 456 Ca 0.09 -0.09 -0.08 0.00 -0.00 0.00 0.00 60.37 60.29 4pbg h HIS 456 Cb 0.12 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.27 4pbg h HIS 456 CO -0.18 0.74 -0.10 2.35 -0.00 0.00 0.00 177.93 180.74 4pbg h TRP 457 N 0.79 0.75 -0.86 2.45 7.01 -0.75 -3.00 115.95 122.35 4pbg h TRP 457 Ca 0.17 -0.17 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 4pbg h TRP 457 Cb 0.33 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 27.16 4pbg h TRP 457 CO 0.02 0.84 0.48 -0.92 -2.79 0.00 0.00 178.44 176.07 4pbg h TYR 458 N 0.45 1.16 -0.14 2.65 3.20 -0.32 -2.34 116.97 121.64 4pbg h TYR 458 Ca 0.08 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.97 4pbg h TYR 458 Cb 0.61 -0.37 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 4pbg h TYR 458 CO 0.05 0.79 -0.10 -0.22 -1.64 0.00 0.00 178.16 177.05 4pbg h LYS 459 N 1.19 -0.10 -0.91 1.82 3.64 -1.30 0.34 116.57 121.26 4pbg h LYS 459 Ca 0.30 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.78 4pbg h LYS 459 Cb 0.01 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 31.78 4pbg h LYS 459 CO -0.05 -0.07 0.55 -0.22 -2.27 0.00 0.00 179.45 177.39 4pbg h LYS 460 N -0.11 0.91 -0.07 1.90 3.11 -1.31 -0.88 116.57 120.13 4pbg h LYS 460 Ca 0.09 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.86 4pbg h LYS 460 Cb 0.24 -0.20 -0.00 0.00 -1.00 0.00 0.00 32.23 31.26 4pbg h LYS 460 CO -0.21 0.60 -0.02 1.25 -2.81 0.00 0.00 179.45 178.27 4pbg h LEU 461 N 0.94 0.13 -0.27 5.20 5.85 -0.93 -2.77 115.31 123.46 4pbg h LEU 461 Ca 0.43 -0.37 0.06 0.00 0.84 0.00 0.00 57.88 58.84 4pbg h LEU 461 Cb 0.34 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.25 4pbg h LEU 461 CO -0.23 0.47 -0.37 0.00 -0.34 0.00 0.00 178.44 177.97 4pbg h ALA 462 N 0.67 -0.38 -0.43 1.25 0.00 0.49 0.42 119.26 121.27 4pbg h ALA 462 Ca 0.02 0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 4pbg h ALA 462 Cb 0.41 0.74 -0.11 0.00 0.00 0.00 0.00 17.79 18.83 4pbg h ALA 462 CO 0.01 -0.82 0.22 -0.85 0.00 0.00 0.00 179.25 177.81 4pbg n GLU 463 N -5.42 2.06 0.00 0.00 0.28 -0.41 -4.13 120.64 113.02 4pbg n GLU 463 Ca -0.02 -1.54 0.00 0.00 -0.16 0.00 0.00 57.16 55.45 4pbg n GLU 463 Cb 0.34 -1.69 0.00 0.00 1.43 0.00 0.00 31.44 31.52 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 -0.12 0.00 -2.71 3.84 -1.04 -0.84 -5.02 114.28 108.39 4pbg n THR 464 Ca 0.25 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 62.07 4pbg n THR 464 Cb 0.98 0.00 0.00 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 -0.66 -2.87 -4.07 -2.82 0.00 0.14 -4.92 117.38 102.18 4pbg n GLN 465 Ca 0.00 0.75 -0.33 0.00 0.00 0.00 0.00 57.00 57.42 4pbg n GLN 465 Cb 0.00 -5.44 -0.15 0.00 0.00 0.00 0.00 30.24 24.64 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 -2.90 2.28 -0.92 -0.39 1.01 -1.26 -0.47 120.40 117.75 4pbg s VAL 466 Ca 0.13 -1.09 -0.24 0.00 0.00 0.00 0.00 61.98 60.78 4pbg s VAL 466 Cb -0.06 -2.08 0.04 0.00 0.00 0.00 0.00 36.38 34.27 4pbg s VAL 466 CO 0.16 0.35 1.44 -0.63 0.00 0.00 0.00 175.10 176.43 4pbg s ILE 467 N 1.26 3.81 -0.45 2.22 1.01 -0.41 -4.75 121.20 123.90 4pbg s ILE 467 Ca 0.01 -0.35 0.04 0.00 0.00 0.00 0.00 60.65 60.34 4pbg s ILE 467 Cb -0.15 -4.92 0.03 0.00 0.01 0.00 0.00 42.46 37.43 4pbg s ILE 467 CO -0.09 -1.82 0.61 1.21 0.00 0.00 0.00 174.94 174.85