#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fbg s LYS 2 N 0.00 3.56 0.02 1.47 2.20 -1.26 -0.43 119.74 125.30 3fbg s LYS 2 Ca 0.00 -0.23 -0.15 0.00 -0.36 0.00 0.00 55.97 55.24 3fbg s LYS 2 Cb 0.00 -2.80 0.02 0.00 -1.51 0.00 0.00 37.83 33.54 3fbg s LYS 2 CO 0.00 0.37 0.32 0.00 -0.36 0.00 0.00 175.35 175.68 3fbg s ALA 3 N -1.88 -0.75 -0.15 3.13 0.00 0.20 -0.94 121.76 121.36 3fbg s ALA 3 Ca 0.40 0.17 -0.03 0.00 0.00 0.00 0.00 51.96 52.50 3fbg s ALA 3 Cb -0.11 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 3fbg s ALA 3 CO 0.28 -0.35 -0.04 0.42 0.00 0.00 0.00 175.76 176.08 3fbg s ILE 4 N -2.00 3.88 0.00 0.00 -1.09 -0.45 -0.32 121.20 121.22 3fbg s ILE 4 Ca -0.09 -0.36 0.00 0.00 -2.23 0.00 0.00 60.65 57.97 3fbg s ILE 4 Cb -0.03 -2.70 0.00 0.00 -1.58 0.00 0.00 42.46 38.16 3fbg s ILE 4 CO 0.00 0.50 0.00 0.61 -1.23 0.00 0.00 174.94 174.82 3fbg n GLY 5 N 3.48 2.61 3.29 6.18 0.00 -0.57 -4.29 105.19 115.88 3fbg n GLY 5 Ca -0.17 -1.18 -0.10 0.00 0.00 0.00 0.00 46.02 44.56 3fbg n GLY 5 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3fbg s PHE 6 N -6.84 -0.12 -0.18 1.61 -0.12 -0.24 -0.87 117.98 111.23 3fbg s PHE 6 Ca 0.00 -0.19 0.18 0.00 -0.05 0.00 0.00 56.93 56.87 3fbg s PHE 6 Cb 0.00 0.17 -0.25 0.00 -0.63 0.00 0.00 43.02 42.31 3fbg s PHE 6 CO 0.00 -0.64 0.11 0.39 -0.05 0.00 0.00 175.22 175.03 3fbg n GLU 7 N -0.09 0.74 -3.93 1.99 1.02 -1.26 -0.26 120.64 118.84 3fbg n GLU 7 Ca -0.16 -0.03 -0.10 0.00 -0.02 0.00 0.00 57.16 56.85 3fbg n GLU 7 Cb 0.63 -1.51 -0.11 0.00 -0.02 0.00 0.00 31.44 30.43 3fbg n GLU 7 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3fbg s GLN 8 N -2.59 0.37 0.62 3.49 -0.21 -1.26 -4.45 119.66 115.63 3fbg s GLN 8 Ca -0.10 -0.51 -0.18 0.00 0.02 0.00 0.00 55.36 54.59 3fbg s GLN 8 Cb 0.07 0.14 -0.02 0.00 1.00 0.00 0.00 33.01 34.20 3fbg s GLN 8 CO 0.82 -0.07 1.22 -1.25 -2.12 0.00 0.00 175.29 173.89 3fbg s PRO 9 N -1.40 2.82 -0.03 2.91 0.04 -1.25 -5.01 135.00 133.08 3fbg s PRO 9 Ca -0.15 1.86 -0.30 0.00 0.04 0.00 0.00 61.00 62.45 3fbg s PRO 9 Cb -0.09 -1.91 0.08 0.00 0.04 0.00 0.00 34.50 32.62 3fbg s PRO 9 CO 0.00 -1.33 0.71 -0.59 0.04 0.00 0.00 177.00 175.83 3fbg s PHE 10 N -1.60 -0.60 0.29 0.56 -0.12 -1.17 -5.00 117.98 110.34 3fbg s PHE 10 Ca 0.78 0.93 -0.04 0.00 -0.05 0.00 0.00 56.93 58.54 3fbg s PHE 10 Cb -0.31 0.44 -0.05 0.00 -0.63 0.00 0.00 43.02 42.47 3fbg s PHE 10 CO 0.35 -0.62 0.54 0.15 -0.05 0.00 0.00 175.22 175.60 3fbg s LYS 11 N -1.63 3.62 0.39 1.99 1.02 -1.26 -4.72 119.74 119.14 3fbg s LYS 11 Ca -0.08 -0.03 0.11 0.00 0.02 0.00 0.00 55.97 55.99 3fbg s LYS 11 Cb -0.00 -2.66 0.78 0.00 -0.52 0.00 0.00 37.83 35.42 3fbg s LYS 11 CO 0.05 0.22 1.89 -0.07 -0.92 0.00 0.00 175.35 176.52 3fbg h LEU 12 N 1.67 0.15 -0.91 3.17 3.38 -2.00 -1.25 115.31 119.51 3fbg h LEU 12 Ca -0.48 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.46 3fbg h LEU 12 Cb 1.19 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3fbg h LEU 12 CO 0.66 0.37 0.00 0.77 0.09 0.00 0.00 178.44 180.33 3fbg h SER 13 N 0.14 0.00 -0.47 -0.43 4.64 -2.05 -1.17 113.55 114.22 3fbg h SER 13 Ca 0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 3fbg h SER 13 Cb 0.46 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 3fbg h SER 13 CO 0.03 0.00 0.26 0.44 -0.87 0.00 0.00 176.83 176.69 3fbg h ASP 14 N 0.00 0.60 -4.39 4.97 3.32 -1.61 -3.49 116.42 115.82 3fbg h ASP 14 Ca 0.00 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.01 3fbg h ASP 14 Cb 0.35 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3fbg h ASP 14 CO 0.00 0.50 0.00 0.61 -1.72 0.00 0.00 179.24 178.63 3fbg n GLY 15 N -1.28 2.15 3.54 2.75 0.00 -0.44 -4.99 105.19 106.92 3fbg n GLY 15 Ca 0.04 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 3fbg n GLY 15 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3fbg s ASN 16 N 0.00 6.19 -0.22 1.61 3.84 -1.26 -4.77 114.94 120.34 3fbg s ASN 16 Ca 0.00 -0.58 0.15 0.00 0.21 0.00 0.00 52.86 52.64 3fbg s ASN 16 Cb 0.00 -2.55 0.73 0.00 -0.55 0.00 0.00 41.25 38.88 3fbg s ASN 16 CO 0.00 -1.78 1.64 0.18 -2.79 0.00 0.00 177.10 174.36 3fbg n LEU 17 N 9.18 5.13 -4.77 3.21 4.32 -1.26 -4.95 117.00 127.87 3fbg n LEU 17 Ca 0.05 -2.95 -0.38 0.00 -0.02 0.00 0.00 56.01 52.70 3fbg n LEU 17 Cb 0.49 -0.64 -0.05 0.00 -1.62 0.00 0.00 43.42 41.60 3fbg n LEU 17 CO 0.70 0.65 0.74 -0.36 -1.22 0.00 0.00 177.39 177.89 3fbg s PHE 18 N -2.77 3.51 0.12 -1.77 0.08 -1.26 -4.64 117.98 111.25 3fbg s PHE 18 Ca 0.51 1.71 0.05 0.00 0.12 0.00 0.00 56.93 59.31 3fbg s PHE 18 Cb 0.39 -3.14 -0.04 0.00 -0.57 0.00 0.00 43.02 39.66 3fbg s PHE 18 CO 0.14 -0.37 -0.11 0.15 -0.10 0.00 0.00 175.22 174.92 3fbg s LYS 19 N -1.92 0.98 0.35 0.44 1.02 -0.05 -4.93 119.74 115.64 3fbg s LYS 19 Ca 0.50 -1.30 -0.14 0.00 0.02 0.00 0.00 55.97 55.05 3fbg s LYS 19 Cb -0.26 -0.66 -0.08 0.00 -0.52 0.00 0.00 37.83 36.31 3fbg s LYS 19 CO 0.32 0.10 0.76 0.99 -0.92 0.00 0.00 175.35 176.60 3fbg s THR 20 N -2.74 4.69 0.01 2.17 2.01 -1.26 -1.52 115.64 119.01 3fbg s THR 20 Ca 0.11 0.90 0.01 0.00 0.31 0.00 0.00 61.69 63.02 3fbg s THR 20 Cb -0.01 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.85 3fbg s THR 20 CO 0.01 -0.28 -0.03 -0.36 -0.69 0.00 0.00 174.62 173.27 3fbg s PHE 21 N -2.10 0.29 -0.34 4.92 0.08 0.57 -4.93 117.98 116.47 3fbg s PHE 21 Ca 0.54 -0.29 -0.06 0.00 0.12 0.00 0.00 56.93 57.24 3fbg s PHE 21 Cb -0.10 -0.19 0.05 0.00 -0.57 0.00 0.00 43.02 42.21 3fbg s PHE 21 CO 0.21 -0.08 0.10 -0.80 -0.10 0.00 0.00 175.22 174.54 3fbg s ASN 22 N -0.82 5.26 0.33 1.36 -0.87 -1.26 -0.63 114.94 118.30 3fbg s ASN 22 Ca -0.07 -1.21 0.09 0.00 -1.57 0.00 0.00 52.86 50.09 3fbg s ASN 22 Cb -0.06 -1.85 -0.05 0.00 -0.02 0.00 0.00 41.25 39.28 3fbg s ASN 22 CO -0.00 -0.33 0.03 -0.76 -2.57 0.00 0.00 177.10 173.46 3fbg s LEU 23 N 1.37 3.05 1.17 0.60 1.43 0.43 -4.89 118.68 121.84 3fbg s LEU 23 Ca -0.02 -0.91 -0.19 0.00 -1.03 0.00 0.00 54.13 51.99 3fbg s LEU 23 Cb -0.20 -1.47 0.27 0.00 0.03 0.00 0.00 46.19 44.83 3fbg s LEU 23 CO 0.02 -0.21 1.13 -1.81 0.23 0.00 0.00 176.35 175.70 3fbg s ASP 24 N -3.73 1.20 -0.30 2.29 1.11 -1.26 0.15 116.67 116.13 3fbg s ASP 24 Ca 0.35 0.63 -0.03 0.00 0.18 0.00 0.00 52.55 53.67 3fbg s ASP 24 Cb -0.02 -0.88 0.04 0.00 1.07 0.00 0.00 42.92 43.14 3fbg s ASP 24 CO 0.20 -3.95 0.03 -0.63 1.18 0.00 0.00 175.17 171.99 3fbg s ILE 25 N -3.08 3.26 1.02 0.77 -1.09 -1.26 -4.38 121.20 116.44 3fbg s ILE 25 Ca 0.71 -1.22 -0.16 0.00 -2.23 0.00 0.00 60.65 57.75 3fbg s ILE 25 Cb -0.10 -2.82 0.21 0.00 -1.58 0.00 0.00 42.46 38.17 3fbg s ILE 25 CO 0.56 -0.07 1.22 -2.16 -1.23 0.00 0.00 174.94 173.26 3fbg s PRO 26 N 1.32 0.18 0.32 2.79 0.04 -1.26 -5.05 135.00 133.34 3fbg s PRO 26 Ca -0.03 -0.18 -0.03 0.00 0.04 0.00 0.00 61.00 60.79 3fbg s PRO 26 Cb -0.19 -1.77 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 3fbg s PRO 26 CO -0.00 -2.76 0.57 -1.83 0.04 0.00 0.00 177.00 173.02 3fbg s GLU 27 N -5.64 3.57 -0.10 4.56 1.03 -1.26 -5.06 118.70 115.80 3fbg s GLU 27 Ca 0.71 -0.09 -0.30 0.00 0.03 0.00 0.00 54.97 55.32 3fbg s GLU 27 Cb -0.07 -2.63 -0.02 0.00 -0.80 0.00 0.00 34.13 30.60 3fbg s GLU 27 CO 0.54 0.16 1.11 -2.14 -1.33 0.00 0.00 175.26 173.60 3fbg s PRO 28 N -3.88 4.36 1.05 -4.83 0.02 -1.26 -5.03 135.00 125.43 3fbg s PRO 28 Ca 0.43 1.52 -0.20 0.00 0.02 0.00 0.00 61.00 62.77 3fbg s PRO 28 Cb -0.10 -3.57 -0.02 0.00 0.02 0.00 0.00 34.50 30.83 3fbg s PRO 28 CO 0.33 -0.43 -0.47 0.36 -0.33 0.00 0.00 177.00 176.46 3fbg n LYS 29 N 5.32 -0.79 -0.29 5.54 0.00 -1.26 -4.60 118.16 122.09 3fbg n LYS 29 Ca 0.10 -0.22 0.07 0.00 -0.00 0.00 0.00 58.31 58.26 3fbg n LYS 29 Cb 0.47 -1.45 0.29 0.00 -0.00 0.00 0.00 35.03 34.34 3fbg n LYS 29 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 3fbg h VAL 30 N -1.58 0.98 -0.52 0.58 2.07 -1.96 -0.59 116.25 115.25 3fbg h VAL 30 Ca -0.47 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 66.74 3fbg h VAL 30 Cb 1.35 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3fbg h VAL 30 CO 0.31 0.16 0.00 1.41 0.02 0.00 0.00 177.57 179.48 3fbg n HIS 31 N -4.52 0.68 -2.83 1.57 8.25 -1.26 -1.63 115.22 115.47 3fbg n HIS 31 Ca 0.15 -0.37 -0.28 0.00 -0.26 0.00 0.00 57.72 56.96 3fbg n HIS 31 Cb 0.29 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.38 3fbg n HIS 31 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3fbg s GLU 32 N -1.22 3.63 0.14 -0.41 2.02 -0.23 -2.14 118.70 120.49 3fbg s GLU 32 Ca 0.41 0.23 0.09 0.00 0.02 0.00 0.00 54.97 55.71 3fbg s GLU 32 Cb 0.22 -2.43 -0.04 0.00 0.10 0.00 0.00 34.13 31.98 3fbg s GLU 32 CO 0.30 -0.08 -0.20 0.96 0.02 0.00 0.00 175.26 176.27 3fbg s ILE 33 N -2.52 1.81 -0.12 -1.63 -4.36 -0.84 -1.53 121.20 112.02 3fbg s ILE 33 Ca 0.48 -1.77 -0.01 0.00 -0.26 0.00 0.00 60.65 59.09 3fbg s ILE 33 Cb -0.10 -1.75 -0.02 0.00 1.25 0.00 0.00 42.46 41.84 3fbg s ILE 33 CO 0.38 -0.20 -0.08 -0.22 0.24 0.00 0.00 174.94 175.06 3fbg s LEU 34 N -2.35 3.03 -0.10 0.37 2.96 0.20 -2.60 118.68 120.17 3fbg s LEU 34 Ca 0.12 -0.17 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 3fbg s LEU 34 Cb -0.08 -1.69 0.01 0.00 0.50 0.00 0.00 46.19 44.93 3fbg s LEU 34 CO 0.06 0.23 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.45 3fbg s VAL 35 N -0.00 1.60 -0.29 1.68 1.01 -0.65 -0.32 120.40 123.44 3fbg s VAL 35 Ca -0.01 -0.73 -0.24 0.00 0.00 0.00 0.00 61.98 61.00 3fbg s VAL 35 Cb -0.14 -1.44 -0.00 0.00 0.00 0.00 0.00 36.38 34.81 3fbg s VAL 35 CO 0.03 0.46 0.81 -0.75 0.00 0.00 0.00 175.10 175.65 3fbg s LYS 36 N 0.73 4.03 0.01 2.72 2.20 0.26 -1.37 119.74 128.31 3fbg s LYS 36 Ca -0.12 0.70 -0.30 0.00 -0.36 0.00 0.00 55.97 55.89 3fbg s LYS 36 Cb -0.16 -3.70 -0.03 0.00 -1.51 0.00 0.00 37.83 32.42 3fbg s LYS 36 CO 0.02 -0.64 1.01 0.42 -0.36 0.00 0.00 175.35 175.81 3fbg s ILE 37 N 2.95 4.74 -0.25 5.43 -1.09 -0.68 -1.57 121.20 130.73 3fbg s ILE 37 Ca 0.33 1.97 -0.15 0.00 -2.23 0.00 0.00 60.65 60.57 3fbg s ILE 37 Cb -0.14 -4.26 -0.15 0.00 -1.58 0.00 0.00 42.46 36.33 3fbg s ILE 37 CO 0.11 0.15 -0.15 0.00 -1.23 0.00 0.00 174.94 173.83 3fbg n GLN 38 N 3.90 0.59 -3.96 2.79 6.02 -0.08 -4.85 117.38 121.79 3fbg n GLN 38 Ca 0.06 0.36 -0.08 0.00 -0.01 0.00 0.00 57.00 57.32 3fbg n GLN 38 Cb 0.50 -1.58 -0.09 0.00 1.02 0.00 0.00 30.24 30.09 3fbg n GLN 38 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3fbg s SER 39 N -7.23 0.26 0.28 1.08 0.01 -1.18 -2.27 113.70 104.65 3fbg s SER 39 Ca -0.35 -0.71 0.02 0.00 1.31 0.00 0.00 55.95 56.22 3fbg s SER 39 Cb 0.12 0.25 -0.04 0.00 0.21 0.00 0.00 66.02 66.55 3fbg s SER 39 CO 0.54 -0.60 0.13 0.27 0.41 0.00 0.00 173.24 173.98 3fbg s ILE 40 N -3.38 0.43 0.15 1.44 -4.36 -0.24 -2.25 121.20 112.99 3fbg s ILE 40 Ca 0.02 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.49 3fbg s ILE 40 Cb 0.03 -2.57 -0.04 0.00 1.25 0.00 0.00 42.46 41.14 3fbg s ILE 40 CO -0.08 0.00 -0.19 -0.55 0.24 0.00 0.00 174.94 174.36 3fbg s SER 41 N -3.34 2.62 -0.09 4.36 0.15 -1.17 -1.26 113.70 114.96 3fbg s SER 41 Ca 0.36 -0.82 -0.03 0.00 0.70 0.00 0.00 55.95 56.17 3fbg s SER 41 Cb 0.06 -0.15 -0.03 0.00 -1.71 0.00 0.00 66.02 64.19 3fbg s SER 41 CO 0.15 -0.02 0.03 -0.69 1.20 0.00 0.00 173.24 173.92 3fbg s VAL 42 N -1.83 4.60 0.13 4.45 1.01 -1.00 -4.32 120.40 123.44 3fbg s VAL 42 Ca 0.13 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.04 3fbg s VAL 42 Cb -0.07 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 3fbg s VAL 42 CO 0.06 0.61 -0.15 0.20 0.00 0.00 0.00 175.10 175.81 3fbg s ASN 43 N -0.91 2.18 0.33 3.32 0.01 -1.26 -4.59 114.94 114.02 3fbg s ASN 43 Ca 0.14 -0.82 0.15 0.00 -0.71 0.00 0.00 52.86 51.62 3fbg s ASN 43 Cb -0.11 -0.09 1.11 0.00 0.41 0.00 0.00 41.25 42.57 3fbg s ASN 43 CO 0.03 -0.11 1.46 -2.65 -1.51 0.00 0.00 177.10 174.31 3fbg n PRO 44 N 0.51 -0.06 -0.31 -0.60 -0.02 -1.26 -0.25 135.00 133.01 3fbg n PRO 44 Ca -0.15 1.30 0.01 0.00 -2.02 0.00 0.00 63.50 62.64 3fbg n PRO 44 Cb 0.57 -2.27 0.14 0.00 -0.02 0.00 0.00 33.50 31.92 3fbg n PRO 44 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3fbg h VAL 45 N 0.00 1.03 -1.00 -1.45 3.04 -1.99 -0.50 116.25 115.38 3fbg h VAL 45 Ca 0.73 -0.32 0.16 0.00 -1.01 0.00 0.00 66.70 66.26 3fbg h VAL 45 Cb 1.85 0.00 -0.10 0.00 -2.01 0.00 0.00 31.29 31.03 3fbg h VAL 45 CO -0.75 0.17 0.62 0.44 -1.01 0.00 0.00 177.57 177.04 3fbg h ASP 46 N 0.94 0.83 0.01 3.17 3.32 -1.02 1.10 116.42 124.77 3fbg h ASP 46 Ca 0.37 0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.40 3fbg h ASP 46 Cb 0.19 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3fbg h ASP 46 CO -0.18 0.35 -0.31 0.71 -1.72 0.00 0.00 179.24 178.09 3fbg h THR 47 N 0.85 1.28 -0.06 0.35 1.35 -1.17 -1.06 112.91 114.45 3fbg h THR 47 Ca 0.55 -1.37 -0.14 0.00 -0.55 0.00 0.00 66.41 64.89 3fbg h THR 47 Cb 0.74 1.45 0.01 0.00 -1.73 0.00 0.00 68.15 68.63 3fbg h THR 47 CO -0.34 0.43 -0.53 0.11 -0.25 0.00 0.00 175.52 174.94 3fbg h LYS 48 N 0.39 0.46 0.00 4.72 1.79 -0.38 -3.21 116.57 120.34 3fbg h LYS 48 Ca 0.05 -0.42 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 3fbg h LYS 48 Cb 0.74 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.49 3fbg h LYS 48 CO 0.06 1.06 0.00 1.96 -1.08 0.00 0.00 179.45 181.45 3fbg h GLN 49 N 0.01 0.00 0.00 3.15 1.08 0.12 -2.34 115.11 117.13 3fbg h GLN 49 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 3fbg h GLN 49 Cb 1.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.63 3fbg h GLN 49 CO 0.11 0.00 0.00 -0.09 -0.95 0.00 0.00 178.83 177.90 3fbg h ARG 50 N 0.00 0.00 -0.00 1.46 2.43 -1.19 -3.12 114.38 113.96 3fbg h ARG 50 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3fbg h ARG 50 Cb 0.44 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 3fbg h ARG 50 CO 0.00 0.00 -0.57 1.28 -1.51 0.00 0.00 179.97 179.17 3fbg n LEU 51 N -2.53 0.77 -4.89 3.80 4.77 -0.88 -3.02 117.00 115.03 3fbg n LEU 51 Ca 0.02 -0.19 -0.29 0.00 -0.03 0.00 0.00 56.01 55.51 3fbg n LEU 51 Cb 0.26 -0.16 0.03 0.00 -2.33 0.00 0.00 43.42 41.22 3fbg n LEU 51 CO 0.23 0.18 0.65 -0.04 -1.33 0.00 0.00 177.39 177.08 3fbg s MET 52 N -2.89 3.15 0.88 3.23 -1.94 -1.18 -4.77 119.30 115.77 3fbg s MET 52 Ca 0.13 0.40 -0.10 0.00 -1.71 0.00 0.00 55.69 54.40 3fbg s MET 52 Cb 0.17 -2.14 0.12 0.00 2.01 0.00 0.00 34.83 35.00 3fbg s MET 52 CO 0.70 -0.73 1.14 -0.51 -0.01 0.00 0.00 175.02 175.60 3fbg s ASP 53 N -4.27 3.29 -0.37 3.03 1.01 -1.26 -3.96 116.67 114.14 3fbg s ASP 53 Ca 0.55 2.12 -0.09 0.00 0.71 0.00 0.00 52.55 55.84 3fbg s ASP 53 Cb -0.11 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.31 3fbg s ASP 53 CO 0.50 -2.86 0.18 -0.69 0.21 0.00 0.00 175.17 172.52 3fbg s VAL 54 N -2.68 4.21 0.35 -1.27 1.01 -1.26 -4.92 120.40 115.84 3fbg s VAL 54 Ca 0.66 -1.10 0.39 0.00 0.00 0.00 0.00 61.98 61.93 3fbg s VAL 54 Cb -0.22 -3.42 0.41 0.00 0.00 0.00 0.00 36.38 33.15 3fbg s VAL 54 CO 0.57 -0.29 2.16 -1.28 0.00 0.00 0.00 175.10 176.26 3fbg h SER 55 N 8.35 0.00 -3.39 3.32 0.87 -1.94 -3.49 113.55 117.27 3fbg h SER 55 Ca -0.24 0.00 -0.40 0.00 -1.23 0.00 0.00 61.79 59.92 3fbg h SER 55 Cb 1.09 0.00 0.20 0.00 -0.44 0.00 0.00 62.40 63.25 3fbg h SER 55 CO 0.67 0.00 0.09 -2.16 -0.53 0.00 0.00 176.83 174.90 3fbg s PRO 58 N -3.89 -1.68 -0.04 2.24 0.04 -1.26 -5.21 135.00 125.20 3fbg s PRO 58 Ca -0.02 -0.13 -0.22 0.00 0.04 0.00 0.00 61.00 60.68 3fbg s PRO 58 Cb 0.11 -1.55 -0.05 0.00 0.04 0.00 0.00 34.50 33.05 3fbg s PRO 58 CO 0.46 -4.00 0.63 0.50 0.04 0.00 0.00 177.00 174.63 3fbg s ARG 59 N -5.43 4.38 -0.25 4.56 6.06 0.64 -4.86 118.95 124.04 3fbg s ARG 59 Ca 0.71 0.78 0.02 0.00 -2.50 0.00 0.00 55.73 54.74 3fbg s ARG 59 Cb -0.09 -3.39 0.05 0.00 0.06 0.00 0.00 34.95 31.58 3fbg s ARG 59 CO 0.56 0.23 -0.11 0.08 -2.50 0.00 0.00 175.30 173.56 3fbg s VAL 60 N 0.28 2.30 0.00 7.11 1.01 -1.26 -1.07 120.40 128.77 3fbg s VAL 60 Ca 0.33 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.87 3fbg s VAL 60 Cb -0.18 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 33.93 3fbg s VAL 60 CO 0.17 0.08 0.00 0.18 0.00 0.00 0.00 175.10 175.53 3fbg n LEU 61 N 4.50 0.00 -0.15 3.92 4.77 -1.26 0.57 117.00 129.35 3fbg n LEU 61 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 3fbg n LEU 61 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3fbg n LEU 61 CO 0.23 -0.23 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 3fbg n GLY 62 N 5.00 0.07 2.44 -0.72 0.00 -1.26 -1.40 105.19 109.33 3fbg n GLY 62 Ca 0.00 -0.86 -0.12 0.00 0.00 0.00 0.00 46.02 45.05 3fbg n GLY 62 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3fbg n PHE 63 N 1.64 1.97 -3.70 1.61 3.72 -1.26 -0.84 117.46 120.60 3fbg n PHE 63 Ca 0.00 -2.18 -0.11 0.00 -0.05 0.00 0.00 57.45 55.11 3fbg n PHE 63 Cb 0.00 -0.28 -0.11 0.00 -0.94 0.00 0.00 39.48 38.15 3fbg n PHE 63 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3fbg s ASP 64 N -3.71 -0.48 -0.02 4.37 1.01 -1.26 -4.47 116.67 112.12 3fbg s ASP 64 Ca 0.39 0.84 -0.25 0.00 0.71 0.00 0.00 52.55 54.24 3fbg s ASP 64 Cb 0.36 0.74 0.06 0.00 1.01 0.00 0.00 42.92 45.09 3fbg s ASP 64 CO -0.00 -0.18 0.56 0.00 0.21 0.00 0.00 175.17 175.75 3fbg s ALA 65 N 1.23 -1.44 0.03 5.23 0.00 -0.51 -3.06 121.76 123.24 3fbg s ALA 65 Ca -0.08 0.92 0.03 0.00 0.00 0.00 0.00 51.96 52.83 3fbg s ALA 65 Cb -0.08 0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.14 3fbg s ALA 65 CO -0.11 -0.38 -0.11 -1.50 0.00 0.00 0.00 175.76 173.67 3fbg s ILE 66 N -1.54 0.82 0.00 0.00 2.07 -0.95 -1.74 121.20 119.86 3fbg s ILE 66 Ca -0.10 -0.85 0.00 0.00 -1.41 0.00 0.00 60.65 58.29 3fbg s ILE 66 Cb -0.01 -0.77 0.00 0.00 0.13 0.00 0.00 42.46 41.81 3fbg s ILE 66 CO 0.06 -0.06 0.00 0.61 -1.91 0.00 0.00 174.94 173.63 3fbg n GLY 67 N 2.02 0.65 3.51 1.50 0.00 -0.36 -0.91 105.19 111.60 3fbg n GLY 67 Ca -0.18 -0.75 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 3fbg n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fbg s VAL 68 N -2.09 4.06 -0.29 1.61 1.01 -0.61 -0.80 120.40 123.29 3fbg s VAL 68 Ca 0.00 -0.30 -0.28 0.00 0.00 0.00 0.00 61.98 61.40 3fbg s VAL 68 Cb 0.00 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 3fbg s VAL 68 CO 0.00 0.48 1.95 -0.69 0.00 0.00 0.00 175.10 176.84 3fbg s VAL 69 N 0.46 3.31 -0.07 2.92 1.01 -0.29 -0.58 120.40 127.16 3fbg s VAL 69 Ca -0.02 0.31 -0.19 0.00 0.00 0.00 0.00 61.98 62.09 3fbg s VAL 69 Cb -0.14 -3.41 -0.14 0.00 0.00 0.00 0.00 36.38 32.69 3fbg s VAL 69 CO 0.02 -0.26 0.71 -0.08 0.00 0.00 0.00 175.10 175.49 3fbg h GLU 70 N 13.67 -0.17 -3.94 2.72 4.57 -1.01 0.17 114.58 130.60 3fbg h GLU 70 Ca -0.36 0.01 -0.11 0.00 -1.18 0.00 0.00 59.36 57.72 3fbg h GLU 70 Cb 1.19 0.04 -0.13 0.00 -0.16 0.00 0.00 28.75 29.70 3fbg h GLU 70 CO 1.00 0.25 -0.34 -1.54 -1.18 0.00 0.00 179.01 177.21 3fbg s SER 71 N -5.55 0.05 0.17 1.04 1.04 -1.13 -4.72 113.70 104.60 3fbg s SER 71 Ca -0.11 -0.92 -0.00 0.00 0.48 0.00 0.00 55.95 55.39 3fbg s SER 71 Cb -0.00 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.51 3fbg s SER 71 CO 0.42 -0.90 0.07 0.68 0.98 0.00 0.00 173.24 174.49 3fbg s VAL 72 N -3.99 0.21 0.45 5.02 -7.23 -1.26 0.58 120.40 114.18 3fbg s VAL 72 Ca 0.19 -1.96 0.05 0.00 -1.81 0.00 0.00 61.98 58.46 3fbg s VAL 72 Cb 0.03 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.72 3fbg s VAL 72 CO 0.01 -0.27 0.62 -0.83 -0.31 0.00 0.00 175.10 174.32 3fbg s GLY 73 N -3.13 1.84 0.33 2.32 0.00 -0.58 -4.90 107.32 103.20 3fbg s GLY 73 Ca 0.30 -1.50 0.26 0.00 0.00 0.00 0.00 44.72 43.78 3fbg s GLY 73 CO 0.07 -1.30 1.78 3.43 0.00 0.00 0.00 173.10 177.07 3fbg h ASN 74 N 0.49 0.00 -0.05 1.64 -0.26 -1.83 -0.73 115.58 114.84 3fbg h ASN 74 Ca -0.42 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.32 3fbg h ASN 74 Cb 1.28 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.54 3fbg h ASN 74 CO 0.49 0.00 0.00 -0.62 -1.06 0.00 0.00 177.43 176.24 3fbg n GLU 75 N -2.43 2.24 -2.36 0.81 1.02 -0.65 -4.93 120.64 114.35 3fbg n GLU 75 Ca 0.01 -1.81 -0.43 0.00 -0.02 0.00 0.00 57.16 54.92 3fbg n GLU 75 Cb 0.22 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.15 3fbg n GLU 75 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3fbg s VAL 76 N -1.97 4.11 -0.32 2.62 1.01 -0.28 -4.85 120.40 120.71 3fbg s VAL 76 Ca 0.30 1.39 0.04 0.00 0.00 0.00 0.00 61.98 63.72 3fbg s VAL 76 Cb 0.20 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 3fbg s VAL 76 CO 0.31 -0.07 0.33 0.35 0.00 0.00 0.00 175.10 176.01 3fbg n THR 77 N 5.06 0.00 0.09 3.92 -2.24 -1.26 -4.81 114.28 115.04 3fbg n THR 77 Ca 0.13 -0.43 0.03 0.00 -2.27 0.00 0.00 64.05 61.51 3fbg n THR 77 Cb 0.45 1.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.69 3fbg n THR 77 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3fbg h MET 78 N 0.30 0.00 -4.16 -0.78 2.86 -1.96 -3.48 114.93 107.71 3fbg h MET 78 Ca 0.00 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 3fbg h MET 78 Cb 0.13 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 31.66 3fbg h MET 78 CO 0.00 0.30 -0.43 -0.06 1.06 0.00 0.00 176.91 177.78 3fbg s PHE 79 N -3.02 0.73 0.11 -0.22 0.08 -1.26 -5.04 117.98 109.35 3fbg s PHE 79 Ca 0.00 -1.04 0.04 0.00 0.12 0.00 0.00 56.93 56.05 3fbg s PHE 79 Cb 0.08 -0.24 -0.04 0.00 -0.57 0.00 0.00 43.02 42.26 3fbg s PHE 79 CO 0.78 -0.73 -0.10 -0.80 -0.10 0.00 0.00 175.22 174.27 3fbg s ASN 80 N -3.06 1.55 0.29 1.36 0.01 -1.26 -5.00 114.94 108.83 3fbg s ASN 80 Ca 0.27 -0.85 -0.29 0.00 -0.71 0.00 0.00 52.86 51.29 3fbg s ASN 80 Cb 0.04 0.00 -0.14 0.00 0.41 0.00 0.00 41.25 41.57 3fbg s ASN 80 CO 0.07 -0.27 1.12 1.67 -1.51 0.00 0.00 177.10 178.18 3fbg n GLN 81 N 0.43 1.59 0.00 -0.60 7.27 -1.26 -1.85 117.38 122.96 3fbg n GLN 81 Ca -0.15 0.56 0.00 0.00 0.07 0.00 0.00 57.00 57.48 3fbg n GLN 81 Cb 0.58 -2.01 0.00 0.00 2.41 0.00 0.00 30.24 31.22 3fbg n GLN 81 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3fbg n GLY 82 N 1.22 2.58 3.71 1.69 0.00 0.59 -4.97 105.19 110.02 3fbg n GLY 82 Ca 0.09 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 3fbg n GLY 82 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fbg n ASP 83 N 0.27 3.06 -4.59 1.61 8.00 -0.77 -4.54 116.55 119.60 3fbg n ASP 83 Ca 0.00 1.19 -0.40 0.00 0.71 0.00 0.00 54.79 56.30 3fbg n ASP 83 Cb 0.00 -1.51 -0.09 0.00 -0.02 0.00 0.00 41.12 39.50 3fbg n ASP 83 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fbg s ILE 84 N -0.81 5.13 0.10 0.53 1.01 -1.26 -1.14 121.20 124.77 3fbg s ILE 84 Ca 0.58 0.47 0.05 0.00 0.00 0.00 0.00 60.65 61.75 3fbg s ILE 84 Cb -0.56 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.10 3fbg s ILE 84 CO 0.59 0.04 -0.13 0.68 0.00 0.00 0.00 174.94 176.12 3fbg s VAL 85 N 2.14 1.18 0.13 2.92 -7.23 0.02 -1.13 120.40 118.43 3fbg s VAL 85 Ca 0.16 -1.56 0.02 0.00 -1.81 0.00 0.00 61.98 58.80 3fbg s VAL 85 Cb -0.16 -1.34 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 3fbg s VAL 85 CO 0.11 -0.37 -0.06 -0.72 -0.31 0.00 0.00 175.10 173.75 3fbg s TYR 86 N -1.89 1.09 -0.02 2.82 -0.00 -0.56 -1.23 117.35 117.56 3fbg s TYR 86 Ca 0.04 -0.90 -0.30 0.00 -0.00 0.00 0.00 57.07 55.92 3fbg s TYR 86 Cb -0.06 -0.60 0.11 0.00 -0.00 0.00 0.00 41.96 41.41 3fbg s TYR 86 CO 0.02 -0.10 1.29 1.52 -0.00 0.00 0.00 175.55 178.28 3fbg s TYR 87 N -3.55 -0.01 -0.17 -3.49 -0.85 -0.71 -2.41 117.35 106.15 3fbg s TYR 87 Ca 0.17 -0.10 -0.05 0.00 -0.52 0.00 0.00 57.07 56.56 3fbg s TYR 87 Cb 0.05 0.55 -0.09 0.00 0.38 0.00 0.00 41.96 42.85 3fbg s TYR 87 CO -0.01 -0.26 -0.20 0.45 -1.52 0.00 0.00 175.55 174.01 3fbg n SER 88 N -0.76 1.76 0.00 -0.18 2.88 -1.26 -1.42 113.62 114.64 3fbg n SER 88 Ca -0.03 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 3fbg n SER 88 Cb 0.61 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 3fbg n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fbg n GLY 89 N 2.18 0.39 3.59 0.46 0.00 -1.26 -4.10 105.19 106.45 3fbg n GLY 89 Ca -0.33 -0.99 -0.12 0.00 0.00 0.00 0.00 46.02 44.58 3fbg n GLY 89 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3fbg s SER 90 N -4.00 -0.50 0.00 1.61 0.15 -1.26 -4.96 113.70 104.73 3fbg s SER 90 Ca 0.00 0.73 0.28 0.00 0.70 0.00 0.00 55.95 57.66 3fbg s SER 90 Cb 0.00 0.65 1.60 0.00 -1.71 0.00 0.00 66.02 66.56 3fbg s SER 90 CO 0.00 -0.34 2.02 -0.81 1.20 0.00 0.00 173.24 175.31 3fbg n PRO 91 N 1.41 0.70 -0.69 5.44 -0.04 -1.26 -2.35 135.00 138.21 3fbg n PRO 91 Ca -0.13 0.01 0.08 0.00 -0.04 0.00 0.00 63.50 63.42 3fbg n PRO 91 Cb 0.57 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.88 3fbg n PRO 91 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3fbg n ASP 92 N -1.12 4.94 -4.13 3.54 5.75 -1.26 -4.89 116.55 119.38 3fbg n ASP 92 Ca 0.18 -2.79 -0.17 0.00 -0.01 0.00 0.00 54.79 52.00 3fbg n ASP 92 Cb 0.15 -0.61 -0.12 0.00 -1.03 0.00 0.00 41.12 39.51 3fbg n ASP 92 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3fbg s GLN 93 N -2.47 0.73 0.41 0.11 -1.52 -0.99 -5.12 119.66 110.80 3fbg s GLN 93 Ca 0.49 -0.88 -0.25 0.00 -1.95 0.00 0.00 55.36 52.78 3fbg s GLN 93 Cb 0.36 -0.66 -0.11 0.00 -0.22 0.00 0.00 33.01 32.39 3fbg s GLN 93 CO 0.16 0.14 1.08 0.09 -0.25 0.00 0.00 175.29 176.52 3fbg n ASN 94 N 1.38 1.63 -2.51 5.90 4.13 -1.26 -4.84 115.26 119.68 3fbg n ASN 94 Ca -0.22 1.07 0.00 0.00 1.68 0.00 0.00 54.58 57.11 3fbg n ASN 94 Cb 0.54 -1.39 0.00 0.00 -1.54 0.00 0.00 39.78 37.39 3fbg n ASN 94 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3fbg n GLY 95 N 1.08 -1.67 0.47 7.41 0.00 0.19 -4.90 105.19 107.78 3fbg n GLY 95 Ca 0.09 -1.55 0.08 0.00 0.00 0.00 0.00 46.02 44.64 3fbg n GLY 95 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fbg n SER 96 N -2.19 1.38 -1.78 1.61 3.41 -0.02 -4.38 113.62 111.64 3fbg n SER 96 Ca 0.00 -1.76 -0.06 0.00 -0.26 0.00 0.00 58.87 56.79 3fbg n SER 96 Cb 0.00 -0.12 -0.08 0.00 -0.26 0.00 0.00 64.21 63.75 3fbg n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3fbg n ASN 97 N 0.17 5.03 -3.85 4.04 4.13 -0.49 -4.79 115.26 119.50 3fbg n ASN 97 Ca 0.14 -2.39 -0.10 0.00 1.68 0.00 0.00 54.58 53.91 3fbg n ASN 97 Cb 0.26 -1.22 -0.06 0.00 -1.54 0.00 0.00 39.78 37.23 3fbg n ASN 97 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3fbg s ALA 98 N 0.61 -0.42 0.28 5.41 0.00 -1.26 -1.35 121.76 125.04 3fbg s ALA 98 Ca 0.33 -0.58 0.06 0.00 0.00 0.00 0.00 51.96 51.77 3fbg s ALA 98 Cb 0.16 0.82 0.40 0.00 0.00 0.00 0.00 23.12 24.50 3fbg s ALA 98 CO 0.00 -0.70 1.67 0.93 0.00 0.00 0.00 175.76 177.66 3fbg h GLU 99 N 2.42 0.26 -4.70 0.00 5.08 -1.35 -3.43 114.58 112.86 3fbg h GLU 99 Ca -0.31 -0.13 -0.27 0.00 -1.00 0.00 0.00 59.36 57.65 3fbg h GLU 99 Cb 1.24 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.31 3fbg h GLU 99 CO 0.44 0.66 -0.73 0.71 -1.00 0.00 0.00 179.01 179.10 3fbg s TYR 100 N -4.08 0.83 -0.16 4.33 2.02 -1.26 -1.68 117.35 117.35 3fbg s TYR 100 Ca -0.05 -0.64 -0.14 0.00 -0.37 0.00 0.00 57.07 55.87 3fbg s TYR 100 Cb 0.13 -0.48 0.05 0.00 -0.40 0.00 0.00 41.96 41.26 3fbg s TYR 100 CO 0.78 -0.08 0.43 -1.14 -1.57 0.00 0.00 175.55 173.96 3fbg s GLN 101 N -2.45 0.48 0.06 -0.62 0.74 -0.47 -4.95 119.66 112.44 3fbg s GLN 101 Ca -0.01 0.65 -0.20 0.00 0.05 0.00 0.00 55.36 55.85 3fbg s GLN 101 Cb -0.04 0.18 -0.06 0.00 1.10 0.00 0.00 33.01 34.18 3fbg s GLN 101 CO -0.01 -0.08 0.58 -0.51 -0.55 0.00 0.00 175.29 174.72 3fbg s LEU 102 N 0.51 4.51 -0.13 3.68 1.43 -1.26 -1.64 118.68 125.78 3fbg s LEU 102 Ca -0.02 1.25 -0.16 0.00 -1.03 0.00 0.00 54.13 54.17 3fbg s LEU 102 Cb -0.04 -2.91 0.04 0.00 0.03 0.00 0.00 46.19 43.31 3fbg s LEU 102 CO -0.03 0.24 0.44 -0.51 0.23 0.00 0.00 176.35 176.72 3fbg s ILE 103 N -0.94 0.01 0.35 -0.59 2.07 -1.07 -4.96 121.20 116.07 3fbg s ILE 103 Ca 0.30 -0.08 -0.28 0.00 -1.41 0.00 0.00 60.65 59.17 3fbg s ILE 103 Cb -0.19 -0.65 -0.10 0.00 0.13 0.00 0.00 42.46 41.65 3fbg s ILE 103 CO 0.19 -0.04 1.31 0.21 -1.91 0.00 0.00 174.94 174.69 3fbg s ASN 104 N -0.12 6.67 0.52 4.50 3.84 -1.26 -1.98 114.94 127.11 3fbg s ASN 104 Ca -0.03 2.69 0.26 0.00 0.21 0.00 0.00 52.86 55.99 3fbg s ASN 104 Cb -0.03 -2.65 1.46 0.00 -0.55 0.00 0.00 41.25 39.48 3fbg s ASN 104 CO 0.02 -0.61 2.09 1.05 -2.79 0.00 0.00 177.10 176.86 3fbg h GLU 105 N 3.22 0.00 0.00 0.43 4.11 -1.76 -2.69 114.58 117.89 3fbg h GLU 105 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3fbg h GLU 105 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 3fbg h GLU 105 CO 0.65 0.11 0.00 0.54 0.07 0.00 0.00 179.01 180.37 3fbg n ARG 106 N -3.76 0.08 -0.39 1.06 1.74 -1.26 -2.99 116.66 111.14 3fbg n ARG 106 Ca -0.02 0.05 0.08 0.00 -0.77 0.00 0.00 57.85 57.19 3fbg n ARG 106 Cb 0.21 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.42 3fbg n ARG 106 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3fbg n LEU 107 N -1.45 3.86 -4.20 0.55 4.77 -1.01 -2.66 117.00 116.86 3fbg n LEU 107 Ca 0.08 -2.30 -0.17 0.00 -0.03 0.00 0.00 56.01 53.59 3fbg n LEU 107 Cb 0.28 -0.44 -0.11 0.00 -2.33 0.00 0.00 43.42 40.82 3fbg n LEU 107 CO 0.23 0.80 -0.45 -0.69 -1.33 0.00 0.00 177.39 175.95 3fbg s VAL 108 N -1.55 1.15 0.05 4.08 1.01 -1.16 -4.39 120.40 119.60 3fbg s VAL 108 Ca 0.40 -1.54 -0.06 0.00 0.00 0.00 0.00 61.98 60.78 3fbg s VAL 108 Cb 0.25 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 3fbg s VAL 108 CO 0.21 -0.37 0.11 0.00 0.00 0.00 0.00 175.10 175.04 3fbg s ALA 109 N -1.86 -0.05 0.39 5.51 0.00 -1.01 -4.51 121.76 120.23 3fbg s ALA 109 Ca 0.04 -0.61 -0.27 0.00 0.00 0.00 0.00 51.96 51.11 3fbg s ALA 109 Cb -0.06 0.29 -0.10 0.00 0.00 0.00 0.00 23.12 23.25 3fbg s ALA 109 CO 0.02 -0.36 1.45 0.15 0.00 0.00 0.00 175.76 177.02 3fbg s LYS 110 N -2.96 4.03 0.47 0.00 1.02 -1.26 -1.49 119.74 119.54 3fbg s LYS 110 Ca -0.02 2.49 -0.12 0.00 0.02 0.00 0.00 55.97 58.35 3fbg s LYS 110 Cb 0.01 -2.90 -0.06 0.00 -0.52 0.00 0.00 37.83 34.36 3fbg s LYS 110 CO -0.06 -0.57 0.86 0.00 -0.92 0.00 0.00 175.35 174.66 3fbg s ALA 111 N -1.15 3.25 0.70 5.17 0.00 -0.28 -4.74 121.76 124.71 3fbg s ALA 111 Ca 0.54 -0.12 -0.15 0.00 0.00 0.00 0.00 51.96 52.24 3fbg s ALA 111 Cb -0.45 -2.84 0.02 0.00 0.00 0.00 0.00 23.12 19.85 3fbg s ALA 111 CO 0.60 -0.19 1.14 -1.25 0.00 0.00 0.00 175.76 176.07 3fbg s PRO 112 N -4.16 2.47 0.00 0.00 0.04 -1.26 -4.94 135.00 127.14 3fbg s PRO 112 Ca 0.53 1.52 0.04 0.00 0.04 0.00 0.00 61.00 63.13 3fbg s PRO 112 Cb -0.10 -1.90 0.03 0.00 0.04 0.00 0.00 34.50 32.57 3fbg s PRO 112 CO 0.35 -1.53 0.63 1.63 0.04 0.00 0.00 177.00 178.12 3fbg n LYS 113 N -2.64 -0.37 -0.05 4.56 5.02 -1.26 -4.49 118.16 118.93 3fbg n LYS 113 Ca 0.11 -0.75 0.12 0.00 -2.02 0.00 0.00 58.31 55.78 3fbg n LYS 113 Cb 0.51 -1.08 0.30 0.00 -0.02 0.00 0.00 35.03 34.75 3fbg n LYS 113 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3fbg n ASN 114 N 0.23 2.38 -4.28 4.39 6.94 -1.26 -4.87 115.26 118.78 3fbg n ASN 114 Ca 0.02 -1.79 -0.15 0.00 -0.02 0.00 0.00 54.58 52.64 3fbg n ASN 114 Cb 0.11 -0.07 -0.10 0.00 -2.36 0.00 0.00 39.78 37.36 3fbg n ASN 114 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3fbg s ILE 115 N -1.87 1.16 0.68 1.53 -4.36 -1.26 -5.10 121.20 111.98 3fbg s ILE 115 Ca 0.34 -2.06 -0.15 0.00 -0.26 0.00 0.00 60.65 58.52 3fbg s ILE 115 Cb 0.20 -2.03 0.01 0.00 1.25 0.00 0.00 42.46 41.89 3fbg s ILE 115 CO 0.31 -0.59 1.13 -0.94 0.24 0.00 0.00 174.94 175.08 3fbg s SER 116 N -3.22 4.86 0.23 4.36 1.04 -1.26 -4.81 113.70 114.90 3fbg s SER 116 Ca 0.21 2.06 -0.06 0.00 0.48 0.00 0.00 55.95 58.64 3fbg s SER 116 Cb 0.03 -2.56 0.36 0.00 0.10 0.00 0.00 66.02 63.95 3fbg s SER 116 CO 0.04 -1.80 1.78 0.00 0.98 0.00 0.00 173.24 174.24 3fbg h ALA 117 N -0.13 1.03 0.00 5.32 0.00 -1.99 -0.61 119.26 122.87 3fbg h ALA 117 Ca -0.47 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3fbg h ALA 117 Cb 1.25 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 3fbg h ALA 117 CO 0.53 -0.03 -0.10 1.05 0.00 0.00 0.00 179.25 180.70 3fbg h GLU 118 N 0.63 0.00 0.15 0.00 4.11 -1.97 -1.47 114.58 116.03 3fbg h GLU 118 Ca 0.36 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.50 3fbg h GLU 118 Cb 0.38 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.64 3fbg h GLU 118 CO -0.27 0.10 -1.46 1.96 0.07 0.00 0.00 179.01 179.40 3fbg h GLN 119 N 0.00 0.32 0.00 1.06 1.08 -1.72 -3.37 115.11 112.48 3fbg h GLN 119 Ca -0.00 -0.55 -0.06 0.00 -1.45 0.00 0.00 58.65 56.60 3fbg h GLN 119 Cb 0.32 0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 3fbg h GLN 119 CO 0.01 1.26 -0.27 0.00 -0.95 0.00 0.00 178.83 178.89 3fbg h ALA 120 N 0.03 1.39 0.00 3.87 0.00 -0.50 -2.38 119.26 121.68 3fbg h ALA 120 Ca -0.30 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3fbg h ALA 120 Cb 1.88 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.63 3fbg h ALA 120 CO 0.12 0.33 0.00 1.55 0.00 0.00 0.00 179.25 181.25 3fbg n VAL 121 N -3.98 0.00 0.59 0.00 3.14 -0.61 -2.05 118.33 115.41 3fbg n VAL 121 Ca -0.02 0.00 0.12 0.00 -2.96 0.00 0.00 64.34 61.48 3fbg n VAL 121 Cb 0.34 -0.60 0.46 0.00 -1.06 0.00 0.00 33.84 32.98 3fbg n VAL 121 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3fbg n SER 122 N -1.00 0.52 -0.06 6.55 3.41 -0.90 -4.33 113.62 117.81 3fbg n SER 122 Ca 0.19 0.58 -0.02 0.00 -0.26 0.00 0.00 58.87 59.36 3fbg n SER 122 Cb 0.09 -0.71 -0.15 0.00 -0.26 0.00 0.00 64.21 63.18 3fbg n SER 122 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3fbg n LEU 123 N -2.02 0.00 0.23 1.04 4.77 -0.87 -4.54 117.00 115.60 3fbg n LEU 123 Ca 0.04 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.88 3fbg n LEU 123 Cb 0.31 0.28 -0.08 0.00 -2.33 0.00 0.00 43.42 41.61 3fbg n LEU 123 CO 0.24 0.28 0.51 -0.65 -1.33 0.00 0.00 177.39 176.44 3fbg h PRO 124 N 0.00 -0.58 -0.07 3.23 0.11 -1.76 0.29 132.00 133.22 3fbg h PRO 124 Ca -0.31 0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 3fbg h PRO 124 Cb 1.68 0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.92 3fbg h PRO 124 CO 0.02 -0.28 0.02 1.25 -0.21 0.00 0.00 178.00 178.80 3fbg h LEU 125 N -0.90 0.11 -0.67 2.35 6.46 -1.85 -0.61 115.31 120.19 3fbg h LEU 125 Ca -0.06 -0.21 -0.06 0.00 -0.12 0.00 0.00 57.88 57.43 3fbg h LEU 125 Cb 0.57 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.45 3fbg h LEU 125 CO 0.10 0.29 0.18 0.71 -0.62 0.00 0.00 178.44 179.10 3fbg h THR 126 N -0.08 1.26 -0.11 1.05 1.35 -1.80 -1.25 112.91 113.32 3fbg h THR 126 Ca 0.02 -0.93 -0.03 0.00 -0.55 0.00 0.00 66.41 64.93 3fbg h THR 126 Cb 0.22 0.58 -0.00 0.00 -1.73 0.00 0.00 68.15 67.22 3fbg h THR 126 CO -0.00 0.35 -0.03 1.23 -0.25 0.00 0.00 175.52 176.82 3fbg h GLY 127 N 0.99 0.24 0.65 5.82 0.00 -0.32 -0.91 103.07 109.54 3fbg h GLY 127 Ca 0.21 -0.20 0.06 0.00 0.00 0.00 0.00 47.33 47.40 3fbg h GLY 127 CO -0.00 0.18 0.34 -2.22 0.00 0.00 0.00 176.54 174.84 3fbg h ILE 128 N -0.11 0.94 -0.66 2.60 2.04 -1.11 0.99 117.51 122.19 3fbg h ILE 128 Ca 0.03 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 3fbg h ILE 128 Cb 0.46 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 3fbg h ILE 128 CO 0.01 0.11 0.37 0.74 0.00 0.00 0.00 178.15 179.39 3fbg h THR 129 N 0.63 1.21 -0.39 -0.27 2.02 -1.07 0.08 112.91 115.11 3fbg h THR 129 Ca 0.29 -0.51 -0.12 0.00 0.77 0.00 0.00 66.41 66.84 3fbg h THR 129 Cb 0.20 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 3fbg h THR 129 CO -0.19 0.22 -0.24 0.00 0.37 0.00 0.00 175.52 175.68 3fbg h ALA 130 N 1.18 0.56 -0.76 6.16 0.00 -0.94 -0.82 119.26 124.63 3fbg h ALA 130 Ca 0.23 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3fbg h ALA 130 Cb 0.03 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3fbg h ALA 130 CO -0.04 0.55 0.30 1.88 0.00 0.00 0.00 179.25 181.94 3fbg h TYR 131 N 0.66 1.15 -0.74 0.00 -1.99 -0.45 -0.73 116.97 114.88 3fbg h TYR 131 Ca 0.08 -0.09 -0.06 0.00 2.00 0.00 0.00 58.73 60.67 3fbg h TYR 131 Cb 0.81 -0.35 -0.03 0.00 2.00 0.00 0.00 36.73 39.16 3fbg h TYR 131 CO 0.06 0.88 0.23 0.93 -0.00 0.00 0.00 178.16 180.26 3fbg h GLU 132 N 1.11 1.15 -0.29 4.88 5.08 -0.74 0.31 114.58 126.07 3fbg h GLU 132 Ca 0.25 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3fbg h GLU 132 Cb 0.21 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 3fbg h GLU 132 CO -0.02 0.98 0.11 1.15 -1.00 0.00 0.00 179.01 180.23 3fbg h THR 133 N 1.10 1.18 -0.03 1.13 2.02 -0.70 0.39 112.91 118.00 3fbg h THR 133 Ca 0.24 -0.56 -0.07 0.00 0.77 0.00 0.00 66.41 66.79 3fbg h THR 133 Cb 0.31 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 3fbg h THR 133 CO -0.01 0.19 -0.25 -0.07 0.37 0.00 0.00 175.52 175.76 3fbg h LEU 134 N 0.31 0.27 0.10 2.58 3.38 -0.98 0.27 115.31 121.24 3fbg h LEU 134 Ca 0.10 -0.70 -0.35 0.00 0.09 0.00 0.00 57.88 57.01 3fbg h LEU 134 Cb 0.19 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3fbg h LEU 134 CO -0.01 0.93 -1.96 0.49 0.09 0.00 0.00 178.44 177.98 3fbg n PHE 135 N -4.51 1.13 -0.09 1.13 3.72 0.08 -1.82 117.46 117.11 3fbg n PHE 135 Ca -0.09 0.26 -0.18 0.00 -0.05 0.00 0.00 57.45 57.40 3fbg n PHE 135 Cb 0.48 -1.14 -0.12 0.00 -0.94 0.00 0.00 39.48 37.75 3fbg n PHE 135 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3fbg h ASP 136 N -0.07 0.00 0.24 4.37 3.32 -1.33 -3.22 116.42 119.73 3fbg h ASP 136 Ca -0.43 -0.77 -0.01 0.00 0.02 0.00 0.00 57.03 55.84 3fbg h ASP 136 Cb 1.94 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.49 3fbg h ASP 136 CO 0.03 1.24 -0.12 0.58 -1.72 0.00 0.00 179.24 179.25 3fbg h VAL 137 N -0.99 0.00 0.00 -1.35 2.07 -0.93 -3.36 116.25 111.68 3fbg h VAL 137 Ca -0.17 -0.57 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 3fbg h VAL 137 Cb 1.15 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 3fbg h VAL 137 CO -0.10 0.00 -0.53 -0.26 0.02 0.00 0.00 177.57 176.71 3fbg h PHE 138 N -0.90 0.00 -1.57 1.57 0.04 -0.99 -3.48 116.94 111.61 3fbg h PHE 138 Ca -0.03 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.66 3fbg h PHE 138 Cb 0.25 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.42 3fbg h PHE 138 CO 0.01 0.53 -0.12 0.41 -0.60 0.00 0.00 178.31 178.53 3fbg n GLY 139 N 0.63 0.54 3.77 -1.45 0.00 -0.77 -5.01 105.19 102.89 3fbg n GLY 139 Ca 0.00 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 3fbg n GLY 139 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fbg s ILE 140 N -2.83 3.25 0.42 -0.61 -4.36 -0.76 -5.00 121.20 111.31 3fbg s ILE 140 Ca 0.08 0.41 -0.20 0.00 -0.26 0.00 0.00 60.65 60.68 3fbg s ILE 140 Cb -0.04 -2.93 -0.11 0.00 1.25 0.00 0.00 42.46 40.63 3fbg s ILE 140 CO 0.10 -0.53 0.92 -0.55 0.24 0.00 0.00 174.94 175.13 3fbg s SER 141 N -3.47 6.93 0.18 4.36 0.15 -1.26 -4.75 113.70 115.84 3fbg s SER 141 Ca 0.61 1.64 0.23 0.00 0.70 0.00 0.00 55.95 59.13 3fbg s SER 141 Cb -0.17 -2.52 0.90 0.00 -1.71 0.00 0.00 66.02 62.52 3fbg s SER 141 CO 0.56 -0.34 1.70 0.54 1.20 0.00 0.00 173.24 176.90 3fbg n ARG 142 N -0.59 0.16 -3.20 5.44 1.74 -1.26 -4.58 116.66 114.38 3fbg n ARG 142 Ca 0.07 0.32 -0.42 0.00 -0.77 0.00 0.00 57.85 57.04 3fbg n ARG 142 Cb 0.54 -1.76 -0.07 0.00 -1.02 0.00 0.00 32.46 30.14 3fbg n ARG 142 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3fbg s ASN 143 N -3.99 6.33 0.35 0.55 0.01 -1.26 -4.96 114.94 111.97 3fbg s ASN 143 Ca 0.07 -0.10 0.11 0.00 -0.71 0.00 0.00 52.86 52.23 3fbg s ASN 143 Cb 0.11 -2.29 0.90 0.00 0.41 0.00 0.00 41.25 40.38 3fbg s ASN 143 CO 0.42 -0.57 1.78 -0.09 -1.51 0.00 0.00 177.10 177.14 3fbg h ARG 144 N 8.56 0.58 0.00 -0.60 2.43 -1.81 0.80 114.38 124.34 3fbg h ARG 144 Ca -0.27 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.85 3fbg h ARG 144 Cb 1.12 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3fbg h ARG 144 CO 0.81 0.38 -0.06 -0.91 -1.51 0.00 0.00 179.97 178.68 3fbg h ASN 145 N 0.59 0.00 0.78 -3.80 2.35 -1.93 -2.71 115.58 110.87 3fbg h ASN 145 Ca 0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 3fbg h ASN 145 Cb 1.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.50 3fbg h ASN 145 CO -0.34 0.06 -0.16 -0.62 -1.65 0.00 0.00 177.43 174.72 3fbg n GLU 146 N -3.16 0.07 -0.23 0.81 1.02 0.27 -2.37 120.64 117.06 3fbg n GLU 146 Ca 0.01 -0.02 0.12 0.00 -0.02 0.00 0.00 57.16 57.25 3fbg n GLU 146 Cb 0.39 -1.50 0.24 0.00 -0.02 0.00 0.00 31.44 30.55 3fbg n GLU 146 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3fbg n ASN 147 N -1.45 3.56 -4.63 1.62 3.02 -1.02 -4.83 115.26 111.53 3fbg n ASN 147 Ca 0.07 -1.99 -0.48 0.00 -0.03 0.00 0.00 54.58 52.16 3fbg n ASN 147 Cb 0.33 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 39.16 3fbg n ASN 147 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3fbg n GLU 148 N 1.50 1.67 -0.26 3.52 0.00 -1.00 -1.60 120.64 124.48 3fbg n GLU 148 Ca 0.20 0.60 0.00 0.00 0.00 0.00 0.00 57.16 57.96 3fbg n GLU 148 Cb 0.60 -2.27 0.00 0.00 0.00 0.00 0.00 31.44 29.78 3fbg n GLU 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3fbg n GLY 149 N 2.69 1.62 3.79 8.31 0.00 -1.26 -5.02 105.19 115.31 3fbg n GLY 149 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 3fbg n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fbg s LYS 150 N -0.30 4.50 -0.04 1.61 1.02 -0.63 -4.98 119.74 120.92 3fbg s LYS 150 Ca 0.00 1.13 0.05 0.00 0.02 0.00 0.00 55.97 57.17 3fbg s LYS 150 Cb 0.00 -3.07 -0.01 0.00 -0.52 0.00 0.00 37.83 34.23 3fbg s LYS 150 CO 0.00 0.47 -0.20 0.99 -0.92 0.00 0.00 175.35 175.69 3fbg s THR 151 N -1.34 1.61 -0.10 2.17 2.01 -1.26 -1.37 115.64 117.35 3fbg s THR 151 Ca 0.41 -0.83 0.01 0.00 0.31 0.00 0.00 61.69 61.59 3fbg s THR 151 Cb -0.21 -1.37 -0.02 0.00 0.01 0.00 0.00 72.50 70.92 3fbg s THR 151 CO 0.25 0.46 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.28 3fbg s LEU 152 N -0.11 2.75 -0.20 4.42 2.96 -0.09 -1.94 118.68 126.46 3fbg s LEU 152 Ca -0.01 -0.27 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 3fbg s LEU 152 Cb -0.11 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 3fbg s LEU 152 CO 0.02 0.23 0.04 -0.22 -1.32 0.00 0.00 176.35 175.10 3fbg s LEU 153 N -0.06 3.49 -0.29 -0.68 2.96 -0.19 -0.97 118.68 122.94 3fbg s LEU 153 Ca -0.02 -0.10 -0.06 0.00 -0.22 0.00 0.00 54.13 53.72 3fbg s LEU 153 Cb -0.14 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 44.67 3fbg s LEU 153 CO 0.04 0.08 0.06 -0.63 -1.32 0.00 0.00 176.35 174.59 3fbg s ILE 154 N 0.89 3.86 -0.21 6.68 1.01 0.81 -0.66 121.20 133.58 3fbg s ILE 154 Ca 0.02 -0.70 -0.28 0.00 0.00 0.00 0.00 60.65 59.70 3fbg s ILE 154 Cb -0.14 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.35 3fbg s ILE 154 CO 0.02 0.11 0.96 -0.63 0.00 0.00 0.00 174.94 175.40 3fbg s ILE 155 N 1.49 4.76 -0.24 2.92 1.01 0.53 -2.24 121.20 129.42 3fbg s ILE 155 Ca 0.03 1.87 -0.02 0.00 0.00 0.00 0.00 60.65 62.52 3fbg s ILE 155 Cb -0.17 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.06 3fbg s ILE 155 CO 0.02 -0.10 0.25 -3.20 0.00 0.00 0.00 174.94 171.91 3fbg n ASN 156 N 5.94 -4.24 0.20 3.58 5.15 -1.24 -2.36 115.26 122.29 3fbg n ASN 156 Ca 0.09 0.05 0.15 0.00 -0.60 0.00 0.00 54.58 54.27 3fbg n ASN 156 Cb 0.47 -2.66 0.60 0.00 -0.53 0.00 0.00 39.78 37.66 3fbg n ASN 156 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 3fbg h GLY 157 N 0.38 0.00 1.09 8.20 0.00 -1.53 -3.32 103.07 107.90 3fbg h GLY 157 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fbg h GLY 157 CO 0.10 0.00 -0.57 0.00 0.00 0.00 0.00 176.54 176.07 3fbg n ALA 158 N -1.91 3.19 -1.05 3.60 0.00 -1.26 -2.29 120.51 120.78 3fbg n ALA 158 Ca 0.01 -0.29 -0.29 0.00 0.00 0.00 0.00 53.44 52.86 3fbg n ALA 158 Cb 0.25 -1.15 0.22 0.00 0.00 0.00 0.00 19.45 18.77 3fbg n ALA 158 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3fbg s GLY 159 N -3.35 1.56 0.12 0.00 0.00 -1.25 -2.00 107.32 102.41 3fbg s GLY 159 Ca 0.08 -0.72 -0.23 0.00 0.00 0.00 0.00 44.72 43.86 3fbg s GLY 159 CO 0.71 0.08 1.68 -1.33 0.00 0.00 0.00 173.10 174.23 3fbg h GLY 160 N -2.41 -0.12 0.89 0.20 0.00 -1.90 -0.46 103.07 99.27 3fbg h GLY 160 Ca -0.49 0.16 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 3fbg h GLY 160 CO 0.43 -0.14 -0.35 -2.08 0.00 0.00 0.00 176.54 174.40 3fbg h VAL 161 N -0.20 1.34 -0.73 4.60 2.07 -1.94 -3.03 116.25 118.36 3fbg h VAL 161 Ca 0.07 -1.59 0.14 0.00 0.82 0.00 0.00 66.70 66.14 3fbg h VAL 161 Cb 0.29 1.90 -0.10 0.00 -1.52 0.00 0.00 31.29 31.86 3fbg h VAL 161 CO -0.18 0.49 0.26 1.23 0.02 0.00 0.00 177.57 179.40 3fbg h GLY 162 N 0.22 1.08 0.86 2.17 0.00 -1.77 0.13 103.07 105.77 3fbg h GLY 162 Ca 0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 3fbg h GLY 162 CO 0.08 -0.12 -0.03 1.76 0.00 0.00 0.00 176.54 178.23 3fbg h SER 163 N 0.40 -0.07 0.47 0.19 0.02 -0.65 -1.84 113.55 112.07 3fbg h SER 163 Ca 0.40 -0.13 -0.20 0.00 -0.84 0.00 0.00 61.79 61.02 3fbg h SER 163 Cb 0.62 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 3fbg h SER 163 CO -0.42 0.09 -0.85 -0.29 -1.14 0.00 0.00 176.83 174.22 3fbg h ILE 164 N -0.22 1.45 -0.47 3.27 6.09 -1.39 -3.21 117.51 123.04 3fbg h ILE 164 Ca -0.01 -2.47 -0.03 0.00 -1.37 0.00 0.00 64.86 60.98 3fbg h ILE 164 Cb 0.19 2.37 -0.02 0.00 0.47 0.00 0.00 36.82 39.84 3fbg h ILE 164 CO 0.01 0.73 0.16 0.00 -3.07 0.00 0.00 178.15 175.98 3fbg h ALA 165 N 0.93 1.40 -0.39 0.18 0.00 -0.64 -0.95 119.26 119.80 3fbg h ALA 165 Ca -0.05 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.75 3fbg h ALA 165 Cb 1.46 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 3fbg h ALA 165 CO 0.14 0.44 0.19 1.15 0.00 0.00 0.00 179.25 181.17 3fbg h THR 166 N 0.67 0.97 -0.52 0.00 2.02 -1.34 -0.08 112.91 114.64 3fbg h THR 166 Ca 0.16 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 67.15 3fbg h THR 166 Cb 0.18 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 3fbg h THR 166 CO -0.01 0.07 0.10 1.56 0.37 0.00 0.00 175.52 177.61 3fbg h GLN 167 N 0.39 0.85 -0.14 6.66 4.20 -1.32 -2.21 115.11 123.54 3fbg h GLN 167 Ca 0.16 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 3fbg h GLN 167 Cb 0.07 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.74 3fbg h GLN 167 CO -0.12 0.82 -0.00 0.82 -0.67 0.00 0.00 178.83 179.69 3fbg h ILE 168 N 0.74 1.25 -0.95 2.54 2.04 -0.98 -1.56 117.51 120.59 3fbg h ILE 168 Ca 0.16 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 65.21 3fbg h ILE 168 Cb 0.37 1.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.93 3fbg h ILE 168 CO 0.01 0.24 0.63 0.00 0.00 0.00 0.00 178.15 179.03 3fbg h ALA 169 N 0.76 1.33 -0.30 1.87 0.00 -0.98 -1.37 119.26 120.57 3fbg h ALA 169 Ca 0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3fbg h ALA 169 Cb 0.37 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3fbg h ALA 169 CO 0.01 0.62 0.08 0.87 0.00 0.00 0.00 179.25 180.83 3fbg h LYS 170 N 1.28 0.48 -0.06 0.00 1.79 -1.29 -0.97 116.57 117.80 3fbg h LYS 170 Ca 0.35 -0.11 -0.02 0.00 -2.18 0.00 0.00 60.65 58.70 3fbg h LYS 170 Cb -0.13 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.45 3fbg h LYS 170 CO -0.08 0.54 -0.03 0.00 -1.08 0.00 0.00 179.45 178.79 3fbg h ALA 171 N 0.92 1.84 -0.55 3.86 0.00 -0.67 -2.25 119.26 122.40 3fbg h ALA 171 Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3fbg h ALA 171 Cb 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3fbg h ALA 171 CO -0.00 0.13 0.00 0.66 0.00 0.00 0.00 179.25 180.04 3fbg n TYR 172 N -4.45 1.42 -0.35 0.00 4.02 -0.57 -4.90 117.16 112.32 3fbg n TYR 172 Ca -0.02 -0.54 0.00 0.00 -0.01 0.00 0.00 57.90 57.33 3fbg n TYR 172 Cb 0.15 -0.28 0.00 0.00 -0.02 0.00 0.00 39.34 39.19 3fbg n TYR 172 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3fbg n GLY 173 N 0.91 0.81 3.92 2.72 0.00 -0.85 -4.30 105.19 108.41 3fbg n GLY 173 Ca 0.23 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 3fbg n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fbg s LEU 174 N 0.00 3.98 0.05 0.99 1.02 -0.40 -4.43 118.68 119.89 3fbg s LEU 174 Ca 0.00 0.64 -0.26 0.00 0.02 0.00 0.00 54.13 54.53 3fbg s LEU 174 Cb 0.00 -3.49 -0.05 0.00 0.02 0.00 0.00 46.19 42.66 3fbg s LEU 174 CO 0.00 -0.29 0.79 -0.60 0.02 0.00 0.00 176.35 176.27 3fbg s ARG 175 N -4.03 4.52 -0.18 1.70 3.52 -0.47 -4.41 118.95 119.59 3fbg s ARG 175 Ca 0.43 1.12 0.01 0.00 -0.13 0.00 0.00 55.73 57.15 3fbg s ARG 175 Cb -0.10 -3.37 0.02 0.00 -1.56 0.00 0.00 34.95 29.94 3fbg s ARG 175 CO 0.35 0.27 -0.19 0.08 -0.81 0.00 0.00 175.30 174.99 3fbg s VAL 176 N -0.03 2.12 -0.21 7.11 1.01 -1.26 -0.91 120.40 128.22 3fbg s VAL 176 Ca 0.40 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 3fbg s VAL 176 Cb -0.21 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 3fbg s VAL 176 CO 0.24 0.53 0.05 -0.63 0.00 0.00 0.00 175.10 175.30 3fbg s ILE 177 N 1.29 4.43 0.44 2.22 1.01 -0.14 -0.69 121.20 129.76 3fbg s ILE 177 Ca 0.05 -0.15 0.05 0.00 0.00 0.00 0.00 60.65 60.60 3fbg s ILE 177 Cb -0.13 -3.03 -0.06 0.00 0.01 0.00 0.00 42.46 39.25 3fbg s ILE 177 CO -0.12 0.40 0.01 0.42 0.00 0.00 0.00 174.94 175.64 3fbg s THR 178 N 1.02 1.72 -0.03 2.92 -4.23 -0.43 -0.13 115.64 116.48 3fbg s THR 178 Ca 0.04 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.61 3fbg s THR 178 Cb -0.14 -2.74 -0.01 0.00 1.34 0.00 0.00 72.50 70.94 3fbg s THR 178 CO 0.03 0.00 -0.23 0.42 -0.54 0.00 0.00 174.62 174.30 3fbg s THR 179 N -2.78 1.83 -0.25 3.99 -4.23 -0.95 -0.62 115.64 112.64 3fbg s THR 179 Ca 0.26 -0.97 -0.26 0.00 -1.18 0.00 0.00 61.69 59.54 3fbg s THR 179 Cb 0.07 -1.53 0.07 0.00 1.34 0.00 0.00 72.50 72.46 3fbg s THR 179 CO 0.13 0.52 0.73 0.00 -0.54 0.00 0.00 174.62 175.46 3fbg s ALA 180 N -0.39 -1.79 -0.11 3.99 0.00 -0.10 -1.92 121.76 121.43 3fbg s ALA 180 Ca 0.05 1.95 0.15 0.00 0.00 0.00 0.00 51.96 54.11 3fbg s ALA 180 Cb -0.10 -1.08 0.25 0.00 0.00 0.00 0.00 23.12 22.19 3fbg s ALA 180 CO 0.00 -0.34 1.13 -1.13 0.00 0.00 0.00 175.76 175.42 3fbg n SER 181 N 2.49 1.77 -3.64 0.00 3.41 -1.26 -4.32 113.62 112.07 3fbg n SER 181 Ca -0.14 -2.92 -0.16 0.00 -0.26 0.00 0.00 58.87 55.39 3fbg n SER 181 Cb 0.55 -0.39 -0.07 0.00 -0.26 0.00 0.00 64.21 64.04 3fbg n SER 181 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fbg s ARG 182 N -2.25 0.86 0.44 4.33 1.70 -1.26 -5.03 118.95 117.73 3fbg s ARG 182 Ca 0.26 0.02 0.24 0.00 -0.47 0.00 0.00 55.73 55.79 3fbg s ARG 182 Cb 0.24 0.39 1.26 0.00 -0.57 0.00 0.00 34.95 36.27 3fbg s ARG 182 CO 0.01 -0.25 1.76 -0.91 -1.08 0.00 0.00 175.30 174.82 3fbg h ASN 183 N 3.44 0.31 -0.09 -2.89 2.35 -1.98 0.12 115.58 116.84 3fbg h ASN 183 Ca -0.28 0.07 -0.20 0.00 -0.55 0.00 0.00 56.30 55.34 3fbg h ASN 183 Cb 1.16 0.02 0.01 0.00 0.05 0.00 0.00 38.32 39.57 3fbg h ASN 183 CO 0.40 0.03 -0.73 -0.33 -1.65 0.00 0.00 177.43 175.15 3fbg h GLU 184 N 0.26 0.65 0.00 0.81 3.07 -1.99 -1.77 114.58 115.60 3fbg h GLU 184 Ca 0.62 -0.58 -0.17 0.00 -0.50 0.00 0.00 59.36 58.73 3fbg h GLU 184 Cb 1.84 0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 29.86 3fbg h GLU 184 CO -0.24 1.19 -0.83 1.79 -1.40 0.00 0.00 179.01 179.52 3fbg h THR 185 N 0.30 1.48 -0.06 1.13 1.35 -1.48 -2.91 112.91 112.73 3fbg h THR 185 Ca -0.07 -2.95 -0.01 0.00 -0.55 0.00 0.00 66.41 62.84 3fbg h THR 185 Cb 1.38 2.64 -0.00 0.00 -1.73 0.00 0.00 68.15 70.44 3fbg h THR 185 CO 0.15 0.81 -0.00 0.40 -0.25 0.00 0.00 175.52 176.63 3fbg h ILE 186 N 0.00 1.25 -0.52 6.82 2.04 -0.84 -2.09 117.51 124.16 3fbg h ILE 186 Ca -0.01 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.06 3fbg h ILE 186 Cb 1.57 1.65 -0.03 0.00 -0.74 0.00 0.00 36.82 39.28 3fbg h ILE 186 CO 0.11 0.22 0.28 -0.33 0.00 0.00 0.00 178.15 178.42 3fbg h GLU 187 N -0.18 0.72 0.18 2.37 4.39 -1.38 -2.07 114.58 118.61 3fbg h GLU 187 Ca 0.02 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 3fbg h GLU 187 Cb 0.34 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 3fbg h GLU 187 CO 0.00 0.54 -0.09 2.35 -1.16 0.00 0.00 179.01 180.66 3fbg h TRP 188 N 0.73 -0.22 -0.42 4.33 2.91 -1.45 -0.89 115.95 120.94 3fbg h TRP 188 Ca 0.19 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.18 3fbg h TRP 188 Cb 0.03 0.07 -0.02 0.00 -0.51 0.00 0.00 29.16 28.73 3fbg h TRP 188 CO 0.00 0.14 0.17 0.00 -1.03 0.00 0.00 178.44 177.73 3fbg h THR 189 N -0.63 1.16 -0.65 2.65 1.03 -1.35 0.63 112.91 115.75 3fbg h THR 189 Ca -0.02 -0.50 -0.06 0.00 -0.01 0.00 0.00 66.41 65.82 3fbg h THR 189 Cb 0.46 0.66 -0.03 0.00 -1.07 0.00 0.00 68.15 68.17 3fbg h THR 189 CO 0.04 0.19 0.18 0.11 -0.01 0.00 0.00 175.52 176.04 3fbg h LYS 190 N 0.60 1.02 -0.33 0.00 1.57 -1.26 -2.00 116.57 116.17 3fbg h LYS 190 Ca 0.15 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3fbg h LYS 190 Cb 0.12 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 3fbg h LYS 190 CO -0.02 0.91 0.22 -0.22 -0.57 0.00 0.00 179.45 179.77 3fbg h LYS 191 N 0.95 0.43 0.00 3.15 3.64 0.35 -1.31 116.57 123.78 3fbg h LYS 191 Ca 0.21 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3fbg h LYS 191 Cb 0.33 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 3fbg h LYS 191 CO -0.00 0.28 0.00 -1.33 -2.27 0.00 0.00 179.45 176.13 3fbg n MET 192 N -4.49 0.19 0.00 1.90 2.81 0.05 -4.89 117.12 112.69 3fbg n MET 192 Ca 0.02 0.29 0.00 0.00 -1.81 0.00 0.00 57.70 56.20 3fbg n MET 192 Cb 0.07 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.79 3fbg n MET 192 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3fbg n GLY 193 N 0.65 1.35 3.74 3.03 0.00 -0.49 -3.94 105.19 109.52 3fbg n GLY 193 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3fbg n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fbg n ALA 194 N -0.69 1.95 0.05 4.61 0.00 -0.88 -4.86 120.51 120.68 3fbg n ALA 194 Ca 0.00 0.36 -0.17 0.00 0.00 0.00 0.00 53.44 53.63 3fbg n ALA 194 Cb 0.00 -2.36 -0.14 0.00 0.00 0.00 0.00 19.45 16.95 3fbg n ALA 194 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3fbg h ASP 195 N 3.22 0.37 -3.67 0.00 3.32 -1.26 -3.45 116.42 114.95 3fbg h ASP 195 Ca -0.48 -0.55 -0.32 0.00 0.02 0.00 0.00 57.03 55.70 3fbg h ASP 195 Cb 1.26 -0.12 -0.31 0.00 0.22 0.00 0.00 39.33 40.37 3fbg h ASP 195 CO 0.67 1.46 -0.75 -0.63 -1.72 0.00 0.00 179.24 178.27 3fbg s ILE 196 N -2.61 0.25 -0.18 0.35 1.01 -1.18 -5.05 121.20 113.80 3fbg s ILE 196 Ca -0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 60.65 60.50 3fbg s ILE 196 Cb 0.07 -0.27 0.01 0.00 0.01 0.00 0.00 42.46 42.27 3fbg s ILE 196 CO 0.84 0.12 -0.15 -0.69 0.00 0.00 0.00 174.94 175.06 3fbg s VAL 197 N 0.46 2.54 0.35 2.92 1.01 -1.26 -1.32 120.40 125.10 3fbg s VAL 197 Ca -0.05 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.22 3fbg s VAL 197 Cb -0.08 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 3fbg s VAL 197 CO -0.01 0.51 0.27 -0.76 0.00 0.00 0.00 175.10 175.11 3fbg s LEU 198 N 1.15 3.47 -0.33 3.92 1.43 0.21 -4.95 118.68 123.57 3fbg s LEU 198 Ca 0.01 -0.62 -0.09 0.00 -1.03 0.00 0.00 54.13 52.40 3fbg s LEU 198 Cb -0.14 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.04 3fbg s LEU 198 CO -0.06 -0.40 0.16 0.21 0.23 0.00 0.00 176.35 176.49 3fbg s ASN 199 N -3.98 5.52 0.10 2.29 3.84 -1.26 -0.93 114.94 120.52 3fbg s ASN 199 Ca 0.41 -0.78 0.22 0.00 0.21 0.00 0.00 52.86 52.92 3fbg s ASN 199 Cb -0.04 -1.98 0.88 0.00 -0.55 0.00 0.00 41.25 39.56 3fbg s ASN 199 CO 0.26 -0.28 1.68 0.00 -2.79 0.00 0.00 177.10 175.97 3fbg n HIS 200 N 4.95 0.36 1.30 0.43 1.44 -1.26 -2.56 115.22 119.88 3fbg n HIS 200 Ca -0.13 0.13 0.14 0.00 -2.01 0.00 0.00 57.72 55.85 3fbg n HIS 200 Cb 0.47 -0.70 0.63 0.00 0.12 0.00 0.00 29.99 30.51 3fbg n HIS 200 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3fbg n LYS 201 N -1.81 0.41 -4.45 -1.40 5.02 -1.26 -4.82 118.16 109.85 3fbg n LYS 201 Ca 0.04 -0.09 -0.23 0.00 -2.02 0.00 0.00 58.31 56.02 3fbg n LYS 201 Cb 0.26 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.67 3fbg n LYS 201 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3fbg s GLU 202 N -2.65 1.61 -0.45 1.97 2.02 -1.06 -5.07 118.70 115.07 3fbg s GLU 202 Ca 0.24 -1.74 -0.44 0.00 0.02 0.00 0.00 54.97 53.05 3fbg s GLU 202 Cb 0.20 -1.63 -0.18 0.00 0.10 0.00 0.00 34.13 32.61 3fbg s GLU 202 CO 0.50 0.29 1.78 0.45 0.02 0.00 0.00 175.26 178.30 3fbg n SER 203 N -0.58 1.41 -0.06 -0.19 2.88 -1.26 -4.84 113.62 110.98 3fbg n SER 203 Ca -0.06 1.01 -0.15 0.00 -1.33 0.00 0.00 58.87 58.35 3fbg n SER 203 Cb 0.60 -0.96 -0.06 0.00 -0.75 0.00 0.00 64.21 63.05 3fbg n SER 203 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3fbg h LEU 204 N 6.73 0.85 -1.06 2.46 3.38 -1.90 -2.93 115.31 122.83 3fbg h LEU 204 Ca -0.36 -0.56 -0.05 0.00 0.09 0.00 0.00 57.88 57.01 3fbg h LEU 204 Cb 1.37 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 3fbg h LEU 204 CO 1.00 1.25 0.15 0.25 0.09 0.00 0.00 178.44 181.19 3fbg h LEU 205 N 0.48 0.76 -0.57 1.67 5.85 -1.95 -0.73 115.31 120.83 3fbg h LEU 205 Ca 0.00 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.64 3fbg h LEU 205 Cb 1.13 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 3fbg h LEU 205 CO 0.11 0.74 0.31 0.78 -0.34 0.00 0.00 178.44 180.04 3fbg h ASN 206 N 0.80 0.46 -0.74 1.25 -0.26 -1.94 0.19 115.58 115.34 3fbg h ASN 206 Ca 0.18 0.02 -0.06 0.00 -0.56 0.00 0.00 56.30 55.89 3fbg h ASN 206 Cb 0.26 -0.07 -0.03 0.00 -1.06 0.00 0.00 38.32 37.42 3fbg h ASN 206 CO -0.01 0.31 0.24 1.56 -1.06 0.00 0.00 177.43 178.47 3fbg h GLN 207 N 0.59 1.14 -0.53 0.81 4.20 -1.13 0.10 115.11 120.30 3fbg h GLN 207 Ca 0.25 -0.24 0.07 0.00 0.06 0.00 0.00 58.65 58.78 3fbg h GLN 207 Cb 0.12 -0.17 -0.06 0.00 0.30 0.00 0.00 27.48 27.68 3fbg h GLN 207 CO -0.15 0.97 0.21 0.74 -0.67 0.00 0.00 178.83 179.93 3fbg h PHE 208 N 1.09 0.37 -0.08 2.96 -1.00 -0.46 -1.47 116.94 118.36 3fbg h PHE 208 Ca 0.24 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 61.03 3fbg h PHE 208 Cb 0.30 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.77 3fbg h PHE 208 CO 0.02 0.13 0.01 0.87 -1.61 0.00 0.00 178.31 177.74 3fbg h LYS 209 N 0.41 0.13 -0.99 1.51 1.57 -0.37 0.33 116.57 119.14 3fbg h LYS 209 Ca 0.25 -0.04 0.13 0.00 -1.87 0.00 0.00 60.65 59.13 3fbg h LYS 209 Cb 0.25 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.46 3fbg h LYS 209 CO -0.24 0.36 0.63 1.15 -0.57 0.00 0.00 179.45 180.78 3fbg h THR 210 N -0.12 0.89 -0.13 -0.16 2.02 -0.65 -2.86 112.91 111.90 3fbg h THR 210 Ca 0.02 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.88 3fbg h THR 210 Cb 0.30 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 3fbg h THR 210 CO 0.00 0.17 0.00 0.00 0.37 0.00 0.00 175.52 176.06 3fbg n GLN 211 N -4.63 2.37 -2.15 6.66 6.02 -0.57 -4.95 117.38 120.14 3fbg n GLN 211 Ca 0.19 -2.03 -0.08 0.00 -0.01 0.00 0.00 57.00 55.07 3fbg n GLN 211 Cb 0.39 -1.47 -0.00 0.00 1.02 0.00 0.00 30.24 30.17 3fbg n GLN 211 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3fbg n GLY 212 N 1.39 0.06 3.67 1.08 0.00 -0.75 -5.01 105.19 105.63 3fbg n GLY 212 Ca 0.16 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.21 3fbg n GLY 212 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fbg s ILE 213 N -2.39 5.02 0.58 -0.61 1.01 0.03 -5.04 121.20 119.81 3fbg s ILE 213 Ca 0.00 1.23 -0.15 0.00 0.00 0.00 0.00 60.65 61.73 3fbg s ILE 213 Cb -0.00 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 3fbg s ILE 213 CO 0.00 0.12 1.04 -1.61 0.00 0.00 0.00 174.94 174.49 3fbg s GLU 214 N 1.78 3.48 0.33 2.79 2.02 -1.26 -4.67 118.70 123.17 3fbg s GLU 214 Ca 0.30 1.09 -0.27 0.00 0.02 0.00 0.00 54.97 56.11 3fbg s GLU 214 Cb -0.16 -2.06 -0.13 0.00 0.10 0.00 0.00 34.13 31.88 3fbg s GLU 214 CO 0.11 -0.67 1.00 1.28 0.02 0.00 0.00 175.26 176.99 3fbg n LEU 215 N -2.05 1.99 -4.92 1.80 4.77 -1.26 -4.95 117.00 112.38 3fbg n LEU 215 Ca 0.08 1.13 -0.27 0.00 -0.03 0.00 0.00 56.01 56.92 3fbg n LEU 215 Cb 0.53 -1.31 -0.02 0.00 -2.33 0.00 0.00 43.42 40.30 3fbg n LEU 215 CO 0.48 -1.46 0.24 0.68 -1.33 0.00 0.00 177.39 176.01 3fbg s VAL 216 N -1.14 5.03 0.12 4.08 -7.23 -0.64 -4.50 120.40 116.11 3fbg s VAL 216 Ca 0.60 -0.10 -0.13 0.00 -1.81 0.00 0.00 61.98 60.54 3fbg s VAL 216 Cb -0.65 -3.81 -0.07 0.00 0.56 0.00 0.00 36.38 32.41 3fbg s VAL 216 CO 0.59 -0.51 1.43 0.44 -0.31 0.00 0.00 175.10 176.75 3fbg h ASP 217 N 1.06 0.86 -3.91 4.85 3.32 -1.74 -0.26 116.42 120.61 3fbg h ASP 217 Ca -0.48 -0.48 -0.25 0.00 0.02 0.00 0.00 57.03 55.84 3fbg h ASP 217 Cb 1.20 -0.24 -0.27 0.00 0.22 0.00 0.00 39.33 40.24 3fbg h ASP 217 CO 0.63 1.17 -0.73 -0.31 -1.72 0.00 0.00 179.24 178.28 3fbg s TYR 218 N -4.33 0.17 -0.03 4.55 2.02 -1.10 -2.95 117.35 115.67 3fbg s TYR 218 Ca -0.12 -0.08 0.03 0.00 -0.37 0.00 0.00 57.07 56.54 3fbg s TYR 218 Cb 0.10 -0.11 -0.00 0.00 -0.40 0.00 0.00 41.96 41.55 3fbg s TYR 218 CO 0.85 -0.02 -0.13 0.08 -1.57 0.00 0.00 175.55 174.76 3fbg s VAL 219 N -0.19 1.11 -0.12 0.71 1.01 -0.67 -1.02 120.40 121.23 3fbg s VAL 219 Ca -0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 3fbg s VAL 219 Cb -0.02 -0.96 0.03 0.00 0.00 0.00 0.00 36.38 35.43 3fbg s VAL 219 CO -0.00 0.33 -0.07 0.12 0.00 0.00 0.00 175.10 175.48 3fbg s PHE 220 N 0.10 1.46 -0.16 5.22 5.36 0.16 -0.85 117.98 129.26 3fbg s PHE 220 Ca -0.03 -0.75 -0.06 0.00 -0.96 0.00 0.00 56.93 55.13 3fbg s PHE 220 Cb -0.10 -1.22 -0.04 0.00 -0.34 0.00 0.00 43.02 41.33 3fbg s PHE 220 CO 0.01 -0.52 0.05 0.00 -1.46 0.00 0.00 175.22 173.31 3fbg n THR 222 N 3.19 0.04 -3.62 0.00 -2.24 -0.99 -2.08 114.28 108.57 3fbg n THR 222 Ca -0.17 -0.52 -0.15 0.00 -2.27 0.00 0.00 64.05 60.94 3fbg n THR 222 Cb 0.53 1.07 -0.07 0.00 -2.10 0.00 0.00 70.33 69.75 3fbg n THR 222 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3fbg s PHE 223 N -0.38 -0.62 -1.01 4.78 5.36 -1.26 -4.79 117.98 120.06 3fbg s PHE 223 Ca 0.05 1.29 -0.15 0.00 -0.96 0.00 0.00 56.93 57.16 3fbg s PHE 223 Cb 0.04 0.29 0.00 0.00 -0.34 0.00 0.00 43.02 43.01 3fbg s PHE 223 CO 0.05 -0.45 0.71 -1.71 -1.46 0.00 0.00 175.22 172.37 3fbg n ASN 224 N 1.83 -5.35 0.02 6.13 2.85 -1.26 -4.89 115.26 114.58 3fbg n ASN 224 Ca -0.17 -0.92 0.01 0.00 -0.11 0.00 0.00 54.58 53.39 3fbg n ASN 224 Cb 0.56 -2.90 0.34 0.00 1.24 0.00 0.00 39.78 39.03 3fbg n ASN 224 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3fbg h THR 225 N -1.27 1.17 -0.66 -0.44 2.02 -1.85 -2.53 112.91 109.35 3fbg h THR 225 Ca -0.57 -0.64 0.10 0.00 0.77 0.00 0.00 66.41 66.06 3fbg h THR 225 Cb 1.33 0.88 -0.07 0.00 -1.74 0.00 0.00 68.15 68.55 3fbg h THR 225 CO 0.43 0.23 0.28 0.44 0.37 0.00 0.00 175.52 177.27 3fbg h ASP 226 N 0.47 0.32 0.24 4.18 3.32 -1.90 -0.43 116.42 122.62 3fbg h ASP 226 Ca 0.11 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 3fbg h ASP 226 Cb 0.24 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 3fbg h ASP 226 CO 0.00 0.18 -0.09 -0.03 -1.72 0.00 0.00 179.24 177.59 3fbg h MET 227 N 0.49 0.00 -0.01 3.56 4.05 -1.82 -3.30 114.93 117.89 3fbg h MET 227 Ca 0.34 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.76 3fbg h MET 227 Cb 0.40 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.20 3fbg h MET 227 CO -0.30 0.09 0.00 0.66 0.23 0.00 0.00 176.91 177.58 3fbg n TYR 228 N -3.75 0.01 -0.07 1.39 4.01 -0.65 -4.73 117.16 113.37 3fbg n TYR 228 Ca -0.02 -0.06 -0.08 0.00 -0.16 0.00 0.00 57.90 57.58 3fbg n TYR 228 Cb 0.19 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.20 3fbg n TYR 228 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 3fbg h TYR 229 N 0.40 -0.73 -0.48 -0.72 3.20 -1.20 0.11 116.97 117.56 3fbg h TYR 229 Ca 0.00 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 3fbg h TYR 229 Cb 0.14 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 3fbg h TYR 229 CO 0.00 -0.34 0.01 -0.44 -1.64 0.00 0.00 178.16 175.75 3fbg h ASP 230 N -0.26 0.76 -0.21 -2.11 3.32 -1.85 -2.47 116.42 113.60 3fbg h ASP 230 Ca 0.15 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 3fbg h ASP 230 Cb 0.49 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3fbg h ASP 230 CO -0.43 0.82 0.13 0.44 -1.72 0.00 0.00 179.24 178.48 3fbg h ASP 231 N 0.74 0.25 -0.92 6.45 3.32 -1.66 -1.37 116.42 123.23 3fbg h ASP 231 Ca 0.15 -0.04 0.07 0.00 0.02 0.00 0.00 57.03 57.23 3fbg h ASP 231 Cb 0.44 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 39.86 3fbg h ASP 231 CO 0.02 0.21 0.58 0.24 -1.72 0.00 0.00 179.24 178.57 3fbg h MET 232 N 0.26 1.01 -0.45 3.56 2.86 -0.61 -0.97 114.93 120.59 3fbg h MET 232 Ca 0.08 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.54 3fbg h MET 232 Cb 0.01 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.42 3fbg h MET 232 CO -0.01 0.67 -0.17 0.82 1.06 0.00 0.00 176.91 179.28 3fbg h ILE 233 N 1.04 1.27 -0.29 -1.22 2.04 -1.09 -2.45 117.51 116.81 3fbg h ILE 233 Ca 0.41 -1.28 -0.10 0.00 1.00 0.00 0.00 64.86 64.88 3fbg h ILE 233 Cb 0.20 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 3fbg h ILE 233 CO -0.18 0.44 -0.26 -0.61 0.00 0.00 0.00 178.15 177.54 3fbg h GLN 234 N 0.76 0.57 0.00 2.37 4.15 -0.66 -3.26 115.11 119.04 3fbg h GLN 234 Ca 0.11 -0.22 -0.02 0.00 0.77 0.00 0.00 58.65 59.29 3fbg h GLN 234 Cb 0.69 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.35 3fbg h GLN 234 CO 0.05 0.77 -0.90 -0.07 -1.93 0.00 0.00 178.83 176.76 3fbg h LEU 235 N 0.50 0.00 -9.99 -2.39 3.38 -1.04 -3.47 115.31 102.30 3fbg h LEU 235 Ca 0.07 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.55 3fbg h LEU 235 Cb 0.71 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 3fbg h LEU 235 CO 0.05 0.06 0.14 0.54 0.09 0.00 0.00 178.44 179.33 3fbg s VAL 236 N -3.30 4.61 0.71 1.22 0.11 -0.94 -1.62 120.40 121.20 3fbg s VAL 236 Ca 0.00 1.09 -0.13 0.00 -2.93 0.00 0.00 61.98 60.02 3fbg s VAL 236 Cb 0.09 -3.65 0.02 0.00 -1.53 0.00 0.00 36.38 31.31 3fbg s VAL 236 CO 0.78 -0.14 1.09 -1.59 -3.33 0.00 0.00 175.10 171.91 3fbg s LYS 237 N -2.84 2.63 0.33 1.54 -2.85 -0.11 -4.74 119.74 113.70 3fbg s LYS 237 Ca 0.53 1.22 -0.29 0.00 -1.00 0.00 0.00 55.97 56.44 3fbg s LYS 237 Cb -0.11 -1.94 -0.12 0.00 -2.06 0.00 0.00 37.83 33.60 3fbg s LYS 237 CO 0.17 -1.36 1.37 -2.30 0.10 0.00 0.00 175.35 173.33 3fbg n PRO 238 N -2.95 2.25 -1.15 1.78 -0.02 -1.26 -1.00 135.00 132.66 3fbg n PRO 238 Ca 0.09 0.79 -0.05 0.00 -2.02 0.00 0.00 63.50 62.32 3fbg n PRO 238 Cb 0.53 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 3fbg n PRO 238 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3fbg n ARG 239 N 0.94 -0.97 -0.04 -0.52 1.74 0.15 -5.00 116.66 112.96 3fbg n ARG 239 Ca 0.06 0.55 0.00 0.00 -0.77 0.00 0.00 57.85 57.69 3fbg n ARG 239 Cb 0.36 -4.45 0.00 0.00 -1.02 0.00 0.00 32.46 27.35 3fbg n ARG 239 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fbg n GLY 240 N -1.13 -0.98 2.78 -0.13 0.00 -0.17 -4.76 105.19 100.81 3fbg n GLY 240 Ca -0.05 -1.68 -0.17 0.00 0.00 0.00 0.00 46.02 44.11 3fbg n GLY 240 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3fbg s HIS 241 N -0.83 0.25 0.13 1.61 2.46 -1.15 -2.15 115.29 115.61 3fbg s HIS 241 Ca 0.00 0.05 0.10 0.00 0.47 0.00 0.00 55.06 55.68 3fbg s HIS 241 Cb 0.00 -0.41 -0.04 0.00 -0.13 0.00 0.00 32.58 31.99 3fbg s HIS 241 CO 0.00 -0.15 -0.23 0.96 -2.47 0.00 0.00 174.74 172.86 3fbg s ILE 242 N 1.27 2.52 0.11 0.89 -4.36 -0.11 -1.67 121.20 119.85 3fbg s ILE 242 Ca -0.06 -1.69 -0.12 0.00 -0.26 0.00 0.00 60.65 58.51 3fbg s ILE 242 Cb -0.13 -2.15 0.01 0.00 1.25 0.00 0.00 42.46 41.45 3fbg s ILE 242 CO -0.02 0.06 0.29 0.00 0.24 0.00 0.00 174.94 175.51 3fbg s ALA 243 N -1.18 -0.52 0.12 2.27 0.00 -0.03 -0.97 121.76 121.44 3fbg s ALA 243 Ca 0.17 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.77 3fbg s ALA 243 Cb -0.10 0.61 -0.04 0.00 0.00 0.00 0.00 23.12 23.59 3fbg s ALA 243 CO 0.08 -0.58 -0.08 -0.08 0.00 0.00 0.00 175.76 175.10 3fbg s THR 244 N -3.84 0.91 0.00 0.00 -1.32 -0.50 -0.81 115.64 110.08 3fbg s THR 244 Ca 0.05 -1.96 0.00 0.00 -1.21 0.00 0.00 61.69 58.58 3fbg s THR 244 Cb 0.03 -1.71 0.00 0.00 -1.51 0.00 0.00 72.50 69.31 3fbg s THR 244 CO -0.10 -0.79 0.96 2.30 -2.21 0.00 0.00 174.62 174.77 3fbg n ILE 245 N -0.04 0.92 -4.83 5.08 -5.35 -0.88 -1.07 119.36 113.18 3fbg n ILE 245 Ca -0.12 -0.96 -0.33 0.00 -0.27 0.00 0.00 62.75 61.08 3fbg n ILE 245 Cb 0.60 0.54 -0.15 0.00 -1.74 0.00 0.00 39.64 38.89 3fbg n ILE 245 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3fbg s VAL 246 N -0.92 2.60 0.61 7.28 1.01 -1.26 -4.97 120.40 124.75 3fbg s VAL 246 Ca 0.00 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 60.97 3fbg s VAL 246 Cb 0.00 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 3fbg s VAL 246 CO 0.00 0.53 1.30 0.00 0.00 0.00 0.00 175.10 176.93 3fbg s ALA 247 N 0.50 2.53 0.38 5.51 0.00 -1.26 -4.73 121.76 124.70 3fbg s ALA 247 Ca -0.12 1.22 -0.21 0.00 0.00 0.00 0.00 51.96 52.85 3fbg s ALA 247 Cb -0.16 -3.54 -0.10 0.00 0.00 0.00 0.00 23.12 19.31 3fbg s ALA 247 CO 0.05 -1.46 0.90 -0.06 0.00 0.00 0.00 175.76 175.19 3fbg s PHE 248 N -1.40 3.40 -0.03 0.00 0.08 -1.26 -4.71 117.98 114.06 3fbg s PHE 248 Ca 0.79 1.56 0.12 0.00 0.12 0.00 0.00 56.93 59.52 3fbg s PHE 248 Cb -0.37 -2.80 -0.11 0.00 -0.57 0.00 0.00 43.02 39.17 3fbg s PHE 248 CO 0.41 0.00 1.19 0.93 -0.10 0.00 0.00 175.22 177.65 3fbg h GLU 249 N 2.26 0.00 -4.99 0.44 4.39 -1.98 -3.47 114.58 111.22 3fbg h GLU 249 Ca -0.48 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 58.91 3fbg h GLU 249 Cb 1.18 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 29.68 3fbg h GLU 249 CO 0.63 0.65 -0.71 -0.80 -1.16 0.00 0.00 179.01 177.62 3fbg s ASN 250 N -6.40 1.66 0.71 1.42 0.01 -1.26 -5.14 114.94 105.93 3fbg s ASN 250 Ca 0.01 -1.00 -0.16 0.00 -0.71 0.00 0.00 52.86 50.99 3fbg s ASN 250 Cb 0.09 0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.76 3fbg s ASN 250 CO 0.79 -0.35 1.00 0.47 -1.51 0.00 0.00 177.10 177.50 3fbg n ASP 251 N -0.13 0.65 -4.35 -1.22 9.92 -1.26 -5.01 116.55 115.14 3fbg n ASP 251 Ca -0.11 0.69 -0.18 0.00 -0.53 0.00 0.00 54.79 54.66 3fbg n ASP 251 Cb 0.60 -1.42 -0.10 0.00 -0.64 0.00 0.00 41.12 39.56 3fbg n ASP 251 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 3fbg s GLN 252 N -3.33 1.40 -0.61 -1.24 -1.52 -1.26 -5.10 119.66 108.01 3fbg s GLN 252 Ca 0.74 -1.72 -0.22 0.00 -1.95 0.00 0.00 55.36 52.22 3fbg s GLN 252 Cb -0.35 -0.70 0.07 0.00 -0.22 0.00 0.00 33.01 31.81 3fbg s GLN 252 CO 0.49 -0.10 0.87 0.34 -0.25 0.00 0.00 175.29 176.64 3fbg s ASP 253 N -3.34 6.21 0.46 5.90 2.15 -1.26 -4.87 116.67 121.91 3fbg s ASP 253 Ca 0.30 -0.95 0.31 0.00 0.43 0.00 0.00 52.55 52.64 3fbg s ASP 253 Cb 0.06 -2.38 1.46 0.00 -0.30 0.00 0.00 42.92 41.75 3fbg s ASP 253 CO 0.10 -1.27 1.94 -0.07 -0.17 0.00 0.00 175.17 175.70 3fbg h LEU 254 N 10.82 0.00 -1.56 -1.34 3.38 -2.03 -2.33 115.31 122.25 3fbg h LEU 254 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3fbg h LEU 254 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3fbg h LEU 254 CO 1.12 0.00 0.00 0.78 0.09 0.00 0.00 178.44 180.43 3fbg h ASN 255 N 0.00 0.00 0.37 -0.43 2.35 -2.04 -2.26 115.58 113.57 3fbg h ASN 255 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3fbg h ASN 255 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 3fbg h ASN 255 CO 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.78 3fbg h ALA 256 N 2.06 1.00 0.00 -0.83 0.00 -1.84 -1.10 119.26 118.55 3fbg h ALA 256 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fbg h ALA 256 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3fbg h ALA 256 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 3fbg n LEU 257 N -3.08 0.08 -0.05 0.00 4.77 -0.85 -4.38 117.00 113.49 3fbg n LEU 257 Ca -0.02 0.51 -0.13 0.00 -0.03 0.00 0.00 56.01 56.34 3fbg n LEU 257 Cb 0.15 -0.48 -0.08 0.00 -2.33 0.00 0.00 43.42 40.69 3fbg n LEU 257 CO 0.23 -0.02 0.61 0.50 -1.33 0.00 0.00 177.39 177.38 3fbg h LYS 258 N 0.00 0.28 -0.75 3.23 3.64 -1.35 -0.91 116.57 120.71 3fbg h LYS 258 Ca 0.00 -0.15 0.06 0.00 -1.27 0.00 0.00 60.65 59.30 3fbg h LYS 258 Cb 0.52 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 3fbg h LYS 258 CO 0.00 0.68 0.49 -1.35 -2.27 0.00 0.00 179.45 177.00 3fbg h PRO 259 N -0.12 0.78 -0.52 1.90 0.11 -1.77 0.48 132.00 132.86 3fbg h PRO 259 Ca 0.02 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3fbg h PRO 259 Cb 0.63 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.56 3fbg h PRO 259 CO 0.03 0.51 0.00 1.63 -0.21 0.00 0.00 178.00 179.96 3fbg n LYS 260 N -4.48 2.58 -3.64 1.05 5.02 -1.25 -4.98 118.16 112.47 3fbg n LYS 260 Ca 0.11 -2.42 -0.21 0.00 -2.02 0.00 0.00 58.31 53.77 3fbg n LYS 260 Cb 0.21 -1.54 0.04 0.00 -0.02 0.00 0.00 35.03 33.73 3fbg n LYS 260 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3fbg n SER 261 N 1.55 -2.10 -4.92 4.39 2.88 0.16 0.34 113.62 115.91 3fbg n SER 261 Ca 0.21 -0.82 -0.26 0.00 -1.33 0.00 0.00 58.87 56.68 3fbg n SER 261 Cb 0.61 -4.17 0.02 0.00 -0.75 0.00 0.00 64.21 59.92 3fbg n SER 261 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3fbg s LEU 262 N -6.52 3.42 -0.00 2.46 1.43 -0.38 -4.07 118.68 115.02 3fbg s LEU 262 Ca 0.09 0.65 0.03 0.00 -1.03 0.00 0.00 54.13 53.87 3fbg s LEU 262 Cb -0.02 -3.51 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 3fbg s LEU 262 CO 0.80 -0.87 -0.08 -0.44 0.23 0.00 0.00 176.35 175.99 3fbg s SER 263 N -4.24 4.53 -0.08 2.29 0.01 -0.91 -4.92 113.70 110.38 3fbg s SER 263 Ca 0.51 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.64 3fbg s SER 263 Cb -0.10 -1.04 0.01 0.00 0.21 0.00 0.00 66.02 65.10 3fbg s SER 263 CO 0.43 0.29 -0.13 0.12 0.41 0.00 0.00 173.24 174.37 3fbg s PHE 264 N -0.96 1.59 0.03 2.43 5.36 -1.26 -0.93 117.98 124.25 3fbg s PHE 264 Ca 0.16 -0.64 0.08 0.00 -0.96 0.00 0.00 56.93 55.57 3fbg s PHE 264 Cb -0.11 -1.17 -0.02 0.00 -0.34 0.00 0.00 43.02 41.37 3fbg s PHE 264 CO 0.06 -0.34 -0.23 -1.12 -1.46 0.00 0.00 175.22 172.13 3fbg s SER 265 N 0.81 2.75 -0.45 6.13 0.01 -0.14 -5.00 113.70 117.81 3fbg s SER 265 Ca -0.12 -0.52 -0.08 0.00 1.31 0.00 0.00 55.95 56.54 3fbg s SER 265 Cb -0.15 -0.25 0.11 0.00 0.21 0.00 0.00 66.02 65.93 3fbg s SER 265 CO 0.02 0.22 0.30 -2.28 0.41 0.00 0.00 173.24 171.91 3fbg s HIS 266 N -0.75 3.42 0.04 2.43 2.46 -1.26 -1.41 115.29 120.22 3fbg s HIS 266 Ca 0.09 -1.84 -0.30 0.00 0.47 0.00 0.00 55.06 53.48 3fbg s HIS 266 Cb -0.09 -3.30 -0.04 0.00 -0.13 0.00 0.00 32.58 29.02 3fbg s HIS 266 CO 0.01 -0.95 1.08 -2.00 -2.47 0.00 0.00 174.74 170.41 3fbg s GLU 267 N 1.35 4.51 -0.19 2.88 2.56 -0.23 -4.98 118.70 124.59 3fbg s GLU 267 Ca 0.05 1.59 -0.05 0.00 0.00 0.00 0.00 54.97 56.56 3fbg s GLU 267 Cb -0.25 -3.40 0.07 0.00 2.00 0.00 0.00 34.13 32.55 3fbg s GLU 267 CO -0.00 -0.13 0.11 0.12 -0.56 0.00 0.00 175.26 174.80 3fbg s PHE 268 N 0.94 0.16 -0.58 5.30 5.36 -1.26 -4.61 117.98 123.29 3fbg s PHE 268 Ca 0.55 -0.35 0.24 0.00 -0.96 0.00 0.00 56.93 56.40 3fbg s PHE 268 Cb -0.25 -0.69 0.93 0.00 -0.34 0.00 0.00 43.02 42.66 3fbg s PHE 268 CO 0.29 -0.58 1.73 0.00 -1.46 0.00 0.00 175.22 175.20 3fbg n MET 269 N 5.28 0.20 -0.01 10.12 0.00 -1.26 -2.21 117.12 129.24 3fbg n MET 269 Ca -0.07 0.35 0.14 0.00 0.00 0.00 0.00 57.70 58.12 3fbg n MET 269 Cb 0.48 -1.84 0.60 0.00 0.00 0.00 0.00 33.22 32.47 3fbg n MET 269 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 3fbg n PHE 270 N -2.21 0.02 -0.29 3.17 3.72 -1.26 -4.02 117.46 116.59 3fbg n PHE 270 Ca 0.03 -0.01 -0.01 0.00 -0.05 0.00 0.00 57.45 57.41 3fbg n PHE 270 Cb 0.29 0.00 0.17 0.00 -0.94 0.00 0.00 39.48 39.00 3fbg n PHE 270 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fbg h ALA 271 N 4.23 1.35 0.51 4.37 0.00 -1.87 -0.74 119.26 127.11 3fbg h ALA 271 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3fbg h ALA 271 Cb 0.38 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.82 3fbg h ALA 271 CO 0.00 0.59 -0.25 0.00 0.00 0.00 0.00 179.25 179.59 3fbg h ARG 272 N 1.18 -0.66 -0.43 0.00 3.08 -1.83 -2.20 114.38 113.52 3fbg h ARG 272 Ca 0.32 0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.36 3fbg h ARG 272 Cb -0.11 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3fbg h ARG 272 CO -0.07 -0.37 0.08 -1.00 -1.07 0.00 0.00 179.97 177.54 3fbg h PRO 273 N -0.87 0.70 -0.81 0.04 0.13 -1.80 -0.74 132.00 128.65 3fbg h PRO 273 Ca -0.07 -0.18 0.04 0.00 -0.87 0.00 0.00 66.00 64.92 3fbg h PRO 273 Cb 0.60 -0.09 -0.05 0.00 0.13 0.00 0.00 31.00 31.59 3fbg h PRO 273 CO 0.12 0.73 0.54 -0.07 -0.23 0.00 0.00 178.00 179.08 3fbg h LEU 274 N 0.57 0.85 -2.70 1.56 3.38 -1.21 -1.35 115.31 116.40 3fbg h LEU 274 Ca 0.13 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3fbg h LEU 274 Cb 0.36 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3fbg h LEU 274 CO 0.01 0.58 0.00 0.59 0.09 0.00 0.00 178.44 179.70 3fbg n ASN 275 N -4.46 4.13 -4.27 -0.43 3.02 -0.83 -4.95 115.26 107.48 3fbg n ASN 275 Ca 0.11 -2.39 -0.32 0.00 -0.03 0.00 0.00 54.58 51.94 3fbg n ASN 275 Cb 0.13 -0.54 -0.07 0.00 -0.61 0.00 0.00 39.78 38.70 3fbg n ASN 275 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fbg n GLN 276 N 0.91 -1.60 -2.14 3.52 1.13 -0.51 -4.85 117.38 113.84 3fbg n GLN 276 Ca 0.22 0.19 -0.35 0.00 -1.94 0.00 0.00 57.00 55.12 3fbg n GLN 276 Cb 0.78 -4.12 0.02 0.00 0.11 0.00 0.00 30.24 27.03 3fbg n GLN 276 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3fbg s THR 277 N -4.00 3.00 0.53 5.09 -4.23 -0.38 -4.87 115.64 110.79 3fbg s THR 277 Ca 0.22 0.61 0.30 0.00 -1.18 0.00 0.00 61.69 61.63 3fbg s THR 277 Cb -0.12 -3.23 0.46 0.00 1.34 0.00 0.00 72.50 70.95 3fbg s THR 277 CO 0.98 -0.15 1.91 0.44 -0.54 0.00 0.00 174.62 177.26 3fbg h ASP 278 N 0.99 0.01 -0.61 3.99 5.19 -1.91 -2.31 116.42 121.78 3fbg h ASP 278 Ca -0.50 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 55.69 3fbg h ASP 278 Cb 1.27 -0.00 -0.13 0.00 0.18 0.00 0.00 39.33 40.65 3fbg h ASP 278 CO 0.56 0.01 0.21 -0.90 -3.12 0.00 0.00 179.24 175.99 3fbg n ASP 279 N -4.30 3.93 0.06 6.45 5.75 -1.26 -4.55 116.55 122.63 3fbg n ASP 279 Ca 0.16 -3.39 0.20 0.00 -0.01 0.00 0.00 54.79 51.75 3fbg n ASP 279 Cb 0.87 -0.70 0.74 0.00 -1.03 0.00 0.00 41.12 41.00 3fbg n ASP 279 CO 0.00 0.00 0.00 0.24 -0.11 0.00 0.00 177.20 177.33 3fbg h MET 280 N 1.83 0.00 -0.05 0.11 2.86 -1.74 -0.78 114.93 117.17 3fbg h MET 280 Ca 0.28 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.93 3fbg h MET 280 Cb 2.12 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.78 3fbg h MET 280 CO 0.63 0.00 0.12 0.97 1.06 0.00 0.00 176.91 179.70 3fbg h ILE 281 N 0.00 0.19 -0.14 -1.22 6.09 -1.80 -1.02 117.51 119.61 3fbg h ILE 281 Ca 0.21 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.74 3fbg h ILE 281 Cb 0.97 0.89 -0.01 0.00 0.47 0.00 0.00 36.82 39.14 3fbg h ILE 281 CO -0.00 0.00 0.11 0.11 -3.07 0.00 0.00 178.15 175.30 3fbg h LYS 282 N 0.00 0.00 -0.16 2.19 1.79 -1.39 -1.21 116.57 117.79 3fbg h LYS 282 Ca 0.02 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 3fbg h LYS 282 Cb 0.27 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 3fbg h LYS 282 CO -0.00 0.00 0.05 0.45 -1.08 0.00 0.00 179.45 178.87 3fbg h HIS 283 N 0.00 0.25 -0.84 -1.35 3.86 -1.40 0.21 115.15 115.89 3fbg h HIS 283 Ca 0.07 -0.02 0.09 0.00 -1.16 0.00 0.00 60.37 59.34 3fbg h HIS 283 Cb 0.29 -0.07 -0.07 0.00 1.06 0.00 0.00 27.41 28.61 3fbg h HIS 283 CO 0.00 0.35 0.49 1.25 0.86 0.00 0.00 177.93 180.89 3fbg h HIS 284 N 0.08 0.90 -0.47 2.45 -0.00 -1.18 -1.06 115.15 115.86 3fbg h HIS 284 Ca 0.05 0.03 -0.09 0.00 -0.00 0.00 0.00 60.37 60.36 3fbg h HIS 284 Cb 0.22 -0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.33 3fbg h HIS 284 CO -0.00 0.38 -0.06 0.93 -0.00 0.00 0.00 177.93 179.18 3fbg h GLU 285 N 0.84 0.83 -0.09 5.26 5.08 -0.71 0.35 114.58 126.13 3fbg h GLU 285 Ca 0.40 -0.26 -0.18 0.00 -1.00 0.00 0.00 59.36 58.32 3fbg h GLU 285 Cb 0.34 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.52 3fbg h GLU 285 CO -0.23 0.87 -0.63 1.88 -1.00 0.00 0.00 179.01 179.90 3fbg h TYR 286 N 0.76 0.81 -0.70 4.33 0.05 -0.26 -1.59 116.97 120.36 3fbg h TYR 286 Ca 0.13 -0.38 -0.00 0.00 0.05 0.00 0.00 58.73 58.54 3fbg h TYR 286 Cb 0.55 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 38.14 3fbg h TYR 286 CO 0.03 1.18 0.44 -0.07 -1.05 0.00 0.00 178.16 178.68 3fbg h LEU 287 N 0.20 0.82 -0.20 3.88 3.38 -1.11 -0.77 115.31 121.52 3fbg h LEU 287 Ca -0.05 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3fbg h LEU 287 Cb 1.28 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 3fbg h LEU 287 CO 0.13 0.62 -0.04 -0.08 0.09 0.00 0.00 178.44 179.16 3fbg h GLU 288 N 0.96 0.38 -0.67 1.13 4.81 -0.77 -0.49 114.58 119.93 3fbg h GLU 288 Ca 0.25 -0.14 0.10 0.00 -0.13 0.00 0.00 59.36 59.44 3fbg h GLU 288 Cb -0.06 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.22 3fbg h GLU 288 CO -0.05 0.63 0.29 0.22 -0.73 0.00 0.00 179.01 179.37 3fbg h ASP 289 N 0.10 0.34 -0.56 1.04 3.58 -1.05 -0.09 116.42 119.78 3fbg h ASP 289 Ca 0.05 0.07 0.06 0.00 0.42 0.00 0.00 57.03 57.63 3fbg h ASP 289 Cb 0.48 0.03 -0.05 0.00 1.72 0.00 0.00 39.33 41.51 3fbg h ASP 289 CO 0.02 0.19 0.28 0.40 -2.88 0.00 0.00 179.24 177.24 3fbg h ILE 290 N 0.50 0.93 -0.15 2.25 2.04 -0.93 -0.64 117.51 121.51 3fbg h ILE 290 Ca 0.34 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 66.02 3fbg h ILE 290 Cb 0.40 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 3fbg h ILE 290 CO -0.30 0.10 0.10 0.74 0.00 0.00 0.00 178.15 178.78 3fbg h THR 291 N 0.52 1.04 -0.83 -0.27 2.02 -0.26 0.80 112.91 115.93 3fbg h THR 291 Ca 0.25 -0.07 0.04 0.00 0.77 0.00 0.00 66.41 67.41 3fbg h THR 291 Cb 0.19 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.37 3fbg h THR 291 CO -0.19 0.04 0.53 0.78 0.37 0.00 0.00 175.52 177.05 3fbg h ASN 292 N 0.20 0.86 1.01 4.18 2.35 -0.75 -1.10 115.58 122.32 3fbg h ASN 292 Ca 0.05 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.67 3fbg h ASN 292 Cb -0.02 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 3fbg h ASN 292 CO -0.01 0.58 -0.64 0.11 -1.65 0.00 0.00 177.43 175.82 3fbg h LYS 293 N 1.01 0.00 -0.26 0.81 1.57 -0.63 -1.36 116.57 117.70 3fbg h LYS 293 Ca 0.34 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.08 3fbg h LYS 293 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3fbg h LYS 293 CO -0.13 0.64 -0.02 0.28 -0.57 0.00 0.00 179.45 179.64 3fbg h VAL 294 N 0.00 1.27 0.00 0.50 2.07 -0.59 0.15 116.25 119.65 3fbg h VAL 294 Ca -0.01 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 3fbg h VAL 294 Cb 1.31 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 32.46 3fbg h VAL 294 CO 0.08 0.30 -0.14 -0.33 0.02 0.00 0.00 177.57 177.50 3fbg h GLU 295 N 0.24 0.00 -0.00 1.57 5.08 -0.93 -0.78 114.58 119.76 3fbg h GLU 295 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3fbg h GLU 295 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3fbg h GLU 295 CO 0.02 0.14 -0.01 1.04 -1.00 0.00 0.00 179.01 179.20 3fbg n GLN 296 N -4.19 1.03 -2.77 2.33 6.02 -0.54 -4.93 117.38 114.33 3fbg n GLN 296 Ca -0.02 -0.18 -0.21 0.00 -0.01 0.00 0.00 57.00 56.58 3fbg n GLN 296 Cb 0.22 -1.50 0.01 0.00 1.02 0.00 0.00 30.24 30.00 3fbg n GLN 296 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3fbg n ASN 297 N -0.83 -5.69 -0.04 1.08 3.02 -0.30 -4.89 115.26 107.61 3fbg n ASN 297 Ca 0.22 -0.15 -0.16 0.00 -0.03 0.00 0.00 54.58 54.45 3fbg n ASN 297 Cb 0.18 -4.67 -0.14 0.00 -0.61 0.00 0.00 39.78 34.54 3fbg n ASN 297 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3fbg n ILE 298 N -4.19 1.64 -4.16 2.41 5.41 0.47 -4.88 119.36 116.06 3fbg n ILE 298 Ca -0.16 -0.71 -0.27 0.00 1.00 0.00 0.00 62.75 62.61 3fbg n ILE 298 Cb 0.64 -1.32 -0.07 0.00 -0.71 0.00 0.00 39.64 38.17 3fbg n ILE 298 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3fbg s TYR 299 N -2.56 2.93 0.11 1.39 2.02 -1.02 -4.98 117.35 115.24 3fbg s TYR 299 Ca -0.18 -0.09 0.09 0.00 -0.37 0.00 0.00 57.07 56.53 3fbg s TYR 299 Cb 0.07 -1.44 -0.04 0.00 -0.40 0.00 0.00 41.96 40.15 3fbg s TYR 299 CO 0.77 0.51 -0.24 1.14 -1.57 0.00 0.00 175.55 176.15 3fbg s GLN 300 N -2.79 1.30 0.85 -0.62 -2.07 -1.26 -4.43 119.66 110.64 3fbg s GLN 300 Ca 0.27 -1.23 -0.12 0.00 -1.82 0.00 0.00 55.36 52.46 3fbg s GLN 300 Cb -0.10 -1.66 0.10 0.00 -1.09 0.00 0.00 33.01 30.26 3fbg s GLN 300 CO 0.19 0.39 1.12 -1.25 -1.32 0.00 0.00 175.29 174.42 3fbg s PRO 301 N -1.90 1.68 -0.04 9.60 0.04 -1.26 -5.00 135.00 138.11 3fbg s PRO 301 Ca 0.10 0.47 0.06 0.00 0.04 0.00 0.00 61.00 61.67 3fbg s PRO 301 Cb -0.10 -1.89 0.10 0.00 0.04 0.00 0.00 34.50 32.65 3fbg s PRO 301 CO 0.05 -1.86 0.97 0.25 0.04 0.00 0.00 177.00 176.44 3fbg n THR 302 N -3.57 0.98 -2.14 1.26 -2.24 -1.26 -5.03 114.28 102.28 3fbg n THR 302 Ca 0.07 -1.11 -0.42 0.00 -2.27 0.00 0.00 64.05 60.32 3fbg n THR 302 Cb 0.58 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 69.12 3fbg n THR 302 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3fbg s THR 303 N -1.31 3.24 0.00 4.28 2.01 -1.26 -0.73 115.64 121.87 3fbg s THR 303 Ca 0.11 0.87 0.00 0.00 0.31 0.00 0.00 61.69 62.98 3fbg s THR 303 Cb 0.09 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 69.04 3fbg s THR 303 CO 0.01 0.06 0.00 0.35 -0.69 0.00 0.00 174.62 174.35 3fbg n THR 304 N 4.03 0.00 -3.79 -0.82 -2.24 -0.39 -4.84 114.28 106.23 3fbg n THR 304 Ca 0.12 -0.30 -0.16 0.00 -2.27 0.00 0.00 64.05 61.44 3fbg n THR 304 Cb 0.42 0.90 -0.16 0.00 -2.10 0.00 0.00 70.33 69.39 3fbg n THR 304 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3fbg s LYS 305 N -0.83 0.02 -0.07 -0.78 3.01 -1.10 -5.05 119.74 114.94 3fbg s LYS 305 Ca 0.00 0.18 0.05 0.00 -1.01 0.00 0.00 55.97 55.19 3fbg s LYS 305 Cb 0.00 -0.30 -0.00 0.00 -1.01 0.00 0.00 37.83 36.51 3fbg s LYS 305 CO 0.00 -0.17 -0.22 0.08 0.51 0.00 0.00 175.35 175.55 3fbg s VAL 306 N 1.12 1.87 -0.02 3.17 1.01 -1.26 -1.00 120.40 125.29 3fbg s VAL 306 Ca -0.08 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.02 3fbg s VAL 306 Cb -0.13 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 3fbg s VAL 306 CO -0.03 0.52 -0.23 -0.63 0.00 0.00 0.00 175.10 174.74 3fbg s ILE 307 N 0.09 1.79 -0.24 2.22 -1.09 -0.15 -4.98 121.20 118.84 3fbg s ILE 307 Ca -0.09 -0.96 -0.10 0.00 -2.23 0.00 0.00 60.65 57.27 3fbg s ILE 307 Cb -0.15 -1.49 -0.05 0.00 -1.58 0.00 0.00 42.46 39.19 3fbg s ILE 307 CO 0.05 0.51 0.14 -1.61 -1.23 0.00 0.00 174.94 172.79 3fbg s GLU 308 N -0.46 3.99 0.00 2.79 0.41 -1.26 -1.10 118.70 123.07 3fbg s GLU 308 Ca 0.07 -0.31 0.00 0.00 -0.41 0.00 0.00 54.97 54.31 3fbg s GLU 308 Cb -0.09 -3.48 0.00 0.00 -1.78 0.00 0.00 34.13 28.77 3fbg s GLU 308 CO -0.00 0.03 0.00 0.41 -0.49 0.00 0.00 175.26 175.21 3fbg n GLY 309 N 4.36 2.37 3.53 -1.39 0.00 0.28 -4.93 105.19 109.41 3fbg n GLY 309 Ca -0.15 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 3fbg n GLY 309 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3fbg s LEU 310 N 0.00 4.02 0.06 0.99 2.96 -1.26 -4.77 118.68 120.68 3fbg s LEU 310 Ca 0.00 -1.76 0.00 0.00 -0.22 0.00 0.00 54.13 52.16 3fbg s LEU 310 Cb 0.00 -2.52 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 3fbg s LEU 310 CO 0.00 -1.33 -0.05 0.42 -1.32 0.00 0.00 176.35 174.08 3fbg s THR 311 N 4.15 0.40 0.49 3.68 -4.23 -1.26 -4.93 115.64 113.94 3fbg s THR 311 Ca 0.43 -1.72 0.15 0.00 -1.18 0.00 0.00 61.69 59.37 3fbg s THR 311 Cb -0.01 -1.40 0.23 0.00 1.34 0.00 0.00 72.50 72.67 3fbg s THR 311 CO -0.08 -0.87 2.09 0.71 -0.54 0.00 0.00 174.62 175.93 3fbg h THR 312 N 3.32 1.05 -0.18 3.99 1.35 -1.93 -0.93 112.91 119.58 3fbg h THR 312 Ca -0.34 -0.25 -0.17 0.00 -0.55 0.00 0.00 66.41 65.09 3fbg h THR 312 Cb 1.16 1.14 -0.00 0.00 -1.73 0.00 0.00 68.15 68.71 3fbg h THR 312 CO 0.61 0.07 -0.60 -0.33 -0.25 0.00 0.00 175.52 175.03 3fbg h GLU 313 N 0.00 0.61 0.33 4.72 3.07 -1.96 -2.81 114.58 118.54 3fbg h GLU 313 Ca -0.00 -0.41 -0.02 0.00 -0.50 0.00 0.00 59.36 58.43 3fbg h GLU 313 Cb 0.13 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 3fbg h GLU 313 CO 0.01 1.03 -0.16 -0.91 -1.40 0.00 0.00 179.01 177.57 3fbg h ASN 314 N 0.46 -0.38 -0.88 1.42 2.35 -1.56 -2.26 115.58 114.73 3fbg h ASN 314 Ca -0.00 -0.17 0.06 0.00 -0.55 0.00 0.00 56.30 55.64 3fbg h ASN 314 Cb 1.16 0.10 -0.06 0.00 0.05 0.00 0.00 38.32 39.57 3fbg h ASN 314 CO 0.11 0.02 0.57 0.40 -1.65 0.00 0.00 177.43 176.89 3fbg h ILE 315 N -0.84 1.07 -0.53 2.81 1.08 -1.32 0.13 117.51 119.91 3fbg h ILE 315 Ca -0.05 -0.34 -0.02 0.00 -0.39 0.00 0.00 64.86 64.06 3fbg h ILE 315 Cb 0.52 -0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.23 3fbg h ILE 315 CO 0.08 0.18 0.27 0.22 -0.69 0.00 0.00 178.15 178.20 3fbg h TYR 316 N 1.00 0.75 -0.62 1.37 3.20 -1.54 -1.59 116.97 119.54 3fbg h TYR 316 Ca 0.37 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.19 3fbg h TYR 316 Cb 0.18 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 3fbg h TYR 316 CO -0.00 0.57 0.28 0.37 -1.64 0.00 0.00 178.16 177.74 3fbg h GLN 317 N 0.70 0.89 -0.07 1.82 4.15 -0.58 -0.84 115.11 121.18 3fbg h GLN 317 Ca 0.18 -0.13 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 3fbg h GLN 317 Cb 0.10 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 3fbg h GLN 317 CO -0.03 0.71 -0.38 0.00 -1.93 0.00 0.00 178.83 177.20 3fbg h ALA 318 N 1.42 1.22 0.07 3.38 0.00 -0.56 -0.66 119.26 124.12 3fbg h ALA 318 Ca 0.22 -0.38 -0.25 0.00 0.00 0.00 0.00 54.91 54.50 3fbg h ALA 318 Cb 0.13 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.84 3fbg h ALA 318 CO -0.02 0.54 -1.09 0.45 0.00 0.00 0.00 179.25 179.13 3fbg h HIS 319 N 0.13 0.59 -0.45 0.00 3.86 -0.86 -0.56 115.15 117.86 3fbg h HIS 319 Ca 0.01 -0.37 0.01 0.00 -1.16 0.00 0.00 60.37 58.87 3fbg h HIS 319 Cb 0.74 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 29.14 3fbg h HIS 319 CO 0.01 1.23 0.28 1.96 0.86 0.00 0.00 177.93 182.27 3fbg h GLN 320 N 0.17 0.55 -0.13 2.45 4.20 -0.67 -1.79 115.11 119.89 3fbg h GLN 320 Ca -0.11 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 3fbg h GLN 320 Cb 1.76 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 29.41 3fbg h GLN 320 CO 0.19 0.37 0.00 0.82 -0.67 0.00 0.00 178.83 179.54 3fbg h ILE 321 N 0.57 1.25 -0.62 2.54 2.04 -1.10 -2.35 117.51 119.84 3fbg h ILE 321 Ca 0.18 -0.80 0.03 0.00 1.00 0.00 0.00 64.86 65.27 3fbg h ILE 321 Cb -0.02 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 3fbg h ILE 321 CO -0.06 0.23 0.38 -0.07 0.00 0.00 0.00 178.15 178.63 3fbg h LEU 322 N -0.02 0.61 -1.59 1.44 -0.00 -1.02 -2.56 115.31 112.17 3fbg h LEU 322 Ca 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.91 3fbg h LEU 322 Cb 0.35 -0.13 -0.00 0.00 -0.00 0.00 0.00 40.66 40.88 3fbg h LEU 322 CO 0.01 0.42 -0.04 -0.33 -0.00 0.00 0.00 178.44 178.50 3fbg h GLU 323 N 0.74 0.00 0.00 1.13 5.08 -1.26 -1.75 114.58 118.53 3fbg h GLU 323 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3fbg h GLU 323 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3fbg h GLU 323 CO -0.11 0.04 0.00 -1.13 -1.00 0.00 0.00 179.01 176.81 3fbg n SER 324 N -3.17 0.30 -2.91 1.42 3.41 -0.89 -5.10 113.62 106.67 3fbg n SER 324 Ca -0.00 0.61 -0.08 0.00 -0.26 0.00 0.00 58.87 59.14 3fbg n SER 324 Cb 0.30 -0.66 0.01 0.00 -0.26 0.00 0.00 64.21 63.59 3fbg n SER 324 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3fbg n ASN 325 N -1.87 -7.58 0.00 4.04 0.23 -0.66 -5.13 115.26 104.29 3fbg n ASN 325 Ca 0.01 0.77 0.00 0.00 -0.53 0.00 0.00 54.58 54.83 3fbg n ASN 325 Cb 0.08 -4.58 0.00 0.00 -2.08 0.00 0.00 39.78 33.20 3fbg n ASN 325 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 3fbg n MET 327 N 0.23 0.00 -3.61 -3.83 0.00 -1.26 -5.12 117.12 103.52 3fbg n MET 327 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 57.70 57.37 3fbg n MET 327 Cb 0.33 0.00 -0.07 0.00 0.00 0.00 0.00 33.22 33.48 3fbg n MET 327 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 3fbg s ILE 328 N -0.89 5.30 0.00 2.02 1.01 -1.26 -4.70 121.20 122.68 3fbg s ILE 328 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.16 3fbg s ILE 328 Cb 0.00 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.88 3fbg s ILE 328 CO 0.00 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.03 3fbg n GLY 329 N 2.81 3.09 3.38 6.18 0.00 -0.85 -4.62 105.19 115.19 3fbg n GLY 329 Ca -0.14 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 3fbg n GLY 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fbg s LYS 330 N 0.00 1.70 -0.18 1.61 -0.14 0.09 -4.13 119.74 118.68 3fbg s LYS 330 Ca 0.00 -1.18 -0.08 0.00 -1.36 0.00 0.00 55.97 53.35 3fbg s LYS 330 Cb 0.00 -1.98 -0.04 0.00 -1.68 0.00 0.00 37.83 34.12 3fbg s LYS 330 CO 0.00 0.49 0.09 -1.17 -0.76 0.00 0.00 175.35 174.00 3fbg s LEU 331 N -1.58 3.97 0.08 3.17 2.96 -1.26 -1.27 118.68 124.75 3fbg s LEU 331 Ca 0.13 0.15 0.07 0.00 -0.22 0.00 0.00 54.13 54.26 3fbg s LEU 331 Cb -0.10 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 3fbg s LEU 331 CO 0.04 0.19 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.40 3fbg s VAL 332 N 0.26 1.41 -0.08 1.68 1.01 -0.17 -2.38 120.40 122.13 3fbg s VAL 332 Ca 0.05 -1.36 0.03 0.00 0.00 0.00 0.00 61.98 60.70 3fbg s VAL 332 Cb -0.12 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.97 3fbg s VAL 332 CO -0.00 -0.09 -0.18 -0.63 0.00 0.00 0.00 175.10 174.20 3fbg s ILE 333 N -1.14 1.57 -0.18 2.22 1.01 -0.39 -0.97 121.20 123.33 3fbg s ILE 333 Ca 0.03 -0.73 -0.12 0.00 0.00 0.00 0.00 60.65 59.83 3fbg s ILE 333 Cb -0.10 -1.39 -0.05 0.00 0.01 0.00 0.00 42.46 40.93 3fbg s ILE 333 CO 0.03 0.45 0.20 0.20 0.00 0.00 0.00 174.94 175.82 3fbg s ASN 334 N 0.54 6.32 0.00 3.58 0.01 -0.25 -1.08 114.94 124.06 3fbg s ASN 334 Ca -0.16 0.37 0.25 0.00 -0.71 0.00 0.00 52.86 52.60 3fbg s ASN 334 Cb -0.17 -2.13 1.47 0.00 0.41 0.00 0.00 41.25 40.84 3fbg s ASN 334 CO 0.06 0.16 1.83 0.18 -1.51 0.00 0.00 177.10 177.82