#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cbg n ALA 7 N 0.00 -0.36 -0.86 7.33 0.00 -1.26 -3.55 120.51 121.81 2cbg n ALA 7 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 2cbg n ALA 7 Cb 0.00 0.13 0.39 0.00 0.00 0.00 0.00 19.45 19.96 2cbg n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cbg n ALA 8 N -2.21 3.66 0.00 0.00 0.00 -1.26 -4.95 120.51 115.75 2cbg n ALA 8 Ca 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 53.44 51.55 2cbg n ALA 8 Cb 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.38 2cbg n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cbg n GLY 9 N 0.64 2.08 3.53 0.00 0.00 -1.23 -5.04 105.19 105.17 2cbg n GLY 9 Ca 0.27 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.95 2cbg n GLY 9 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2cbg n GLU 10 N -2.00 0.07 -2.95 1.61 0.00 -1.26 -5.03 120.64 111.08 2cbg n GLU 10 Ca 0.00 0.08 -0.18 0.00 0.00 0.00 0.00 57.16 57.07 2cbg n GLU 10 Cb 0.00 -2.06 0.02 0.00 0.00 0.00 0.00 31.44 29.40 2cbg n GLU 10 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 2cbg s GLN 11 N -3.52 2.77 -0.30 3.44 -2.07 -1.26 -4.89 119.66 113.83 2cbg s GLN 11 Ca 0.66 -1.18 0.14 0.00 -1.82 0.00 0.00 55.36 53.16 2cbg s GLN 11 Cb -0.29 -2.71 0.47 0.00 -1.09 0.00 0.00 33.01 29.39 2cbg s GLN 11 CO 0.58 -0.36 1.11 0.72 -1.32 0.00 0.00 175.29 176.03 2cbg n HIS 12 N -1.94 2.06 -3.58 9.60 8.25 -1.26 -5.02 115.22 123.33 2cbg n HIS 12 Ca 0.08 -2.41 -0.13 0.00 -0.26 0.00 0.00 57.72 55.00 2cbg n HIS 12 Cb 0.59 -0.27 -0.06 0.00 1.12 0.00 0.00 29.99 31.37 2cbg n HIS 12 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2cbg s VAL 13 N -4.22 0.00 -0.12 1.59 0.11 -1.26 -1.66 120.40 114.84 2cbg s VAL 13 Ca 0.38 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.45 2cbg s VAL 13 Cb 0.38 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 34.25 2cbg s VAL 13 CO -0.02 0.00 -0.17 -0.63 -3.33 0.00 0.00 175.10 170.95 2cbg s ILE 14 N -0.55 1.65 -0.20 7.04 1.01 -0.46 -4.95 121.20 124.74 2cbg s ILE 14 Ca -0.03 -0.73 -0.29 0.00 0.00 0.00 0.00 60.65 59.59 2cbg s ILE 14 Cb -0.02 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.94 2cbg s ILE 14 CO 0.02 0.47 1.38 -1.58 0.00 0.00 0.00 174.94 175.23 2cbg s GLN 15 N 0.96 4.06 -0.00 2.79 0.74 -1.26 -1.47 119.66 125.47 2cbg s GLN 15 Ca -0.06 1.60 0.21 0.00 0.05 0.00 0.00 55.36 57.16 2cbg s GLN 15 Cb -0.15 -3.87 -0.22 0.00 1.10 0.00 0.00 33.01 29.87 2cbg s GLN 15 CO -0.02 -0.95 0.84 1.28 -0.55 0.00 0.00 175.29 175.89 2cbg n LEU 16 N 7.28 0.77 -3.94 3.68 4.77 0.41 -4.98 117.00 125.00 2cbg n LEU 16 Ca 0.15 -0.37 -0.11 0.00 -0.03 0.00 0.00 56.01 55.65 2cbg n LEU 16 Cb 0.45 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 2cbg n LEU 16 CO 0.60 0.19 0.34 0.54 -1.33 0.00 0.00 177.39 177.73 2cbg s ASN 17 N -3.34 0.37 0.24 -1.43 2.20 -1.25 -4.72 114.94 107.01 2cbg s ASN 17 Ca 0.05 -1.24 -0.31 0.00 -0.94 0.00 0.00 52.86 50.41 2cbg s ASN 17 Cb 0.16 0.75 -0.13 0.00 -2.00 0.00 0.00 41.25 40.02 2cbg s ASN 17 CO 0.87 -1.47 1.53 0.00 -2.94 0.00 0.00 177.10 175.09 2cbg n GLN 18 N -0.53 2.35 -1.40 3.55 1.13 -1.26 -4.69 117.38 116.52 2cbg n GLN 18 Ca -0.04 0.84 -0.38 0.00 -1.94 0.00 0.00 57.00 55.48 2cbg n GLN 18 Cb 0.61 -2.57 0.04 0.00 0.11 0.00 0.00 30.24 28.43 2cbg n GLN 18 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2cbg n GLN 19 N 2.49 0.42 0.00 -1.09 6.02 -1.26 -4.32 117.38 119.63 2cbg n GLN 19 Ca 0.12 0.17 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 2cbg n GLN 19 Cb 0.33 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 29.93 2cbg n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cbg n GLY 20 N 1.84 4.41 7.00 1.08 0.00 -1.26 -4.87 105.19 113.39 2cbg n GLY 20 Ca 0.11 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.74 2cbg n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cbg n GLY 21 N -1.84 0.99 3.76 -0.02 0.00 -1.26 -2.08 105.19 104.75 2cbg n GLY 21 Ca 0.00 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 2cbg n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cbg s LYS 22 N 0.00 3.24 -0.03 1.61 -0.14 -1.26 -4.68 119.74 118.49 2cbg s LYS 22 Ca 0.00 1.77 -0.30 0.00 -1.36 0.00 0.00 55.97 56.08 2cbg s LYS 22 Cb 0.00 -2.05 -0.03 0.00 -1.68 0.00 0.00 37.83 34.06 2cbg s LYS 22 CO 0.00 -0.98 1.15 -0.80 -0.76 0.00 0.00 175.35 173.96 2cbg s ASN 23 N -1.57 7.12 -0.32 2.83 0.01 -1.26 -0.15 114.94 121.59 2cbg s ASN 23 Ca 0.73 1.80 0.01 0.00 -0.71 0.00 0.00 52.86 54.69 2cbg s ASN 23 Cb -0.29 -2.56 0.08 0.00 0.41 0.00 0.00 41.25 38.89 2cbg s ASN 23 CO 0.32 -0.50 0.03 -0.22 -1.51 0.00 0.00 177.10 175.22 2cbg s LEU 24 N 1.79 4.32 -0.46 0.60 2.96 0.67 -4.18 118.68 124.39 2cbg s LEU 24 Ca 0.55 -1.71 -0.24 0.00 -0.22 0.00 0.00 54.13 52.51 2cbg s LEU 24 Cb -0.24 -1.68 0.03 0.00 0.50 0.00 0.00 46.19 44.80 2cbg s LEU 24 CO 0.24 -0.34 0.84 -0.36 -1.32 0.00 0.00 176.35 175.41 2cbg s PHE 25 N 1.10 2.96 -0.17 5.38 0.08 -1.08 -2.08 117.98 124.16 2cbg s PHE 25 Ca 0.01 0.25 -0.08 0.00 0.12 0.00 0.00 56.93 57.23 2cbg s PHE 25 Cb -0.20 -3.80 -0.04 0.00 -0.57 0.00 0.00 43.02 38.41 2cbg s PHE 25 CO -0.05 -1.04 0.09 0.00 -0.10 0.00 0.00 175.22 174.12 2cbg s PHE 27 N 0.05 2.87 0.85 0.00 0.08 0.10 -1.14 117.98 120.79 2cbg s PHE 27 Ca 0.07 -0.65 -0.13 0.00 0.12 0.00 0.00 56.93 56.34 2cbg s PHE 27 Cb -0.12 -1.91 0.11 0.00 -0.57 0.00 0.00 43.02 40.54 2cbg s PHE 27 CO 0.00 -0.25 1.22 -1.25 -0.10 0.00 0.00 175.22 174.85 2cbg s PRO 28 N 0.55 1.59 1.10 0.24 0.04 -1.26 -1.93 135.00 135.34 2cbg s PRO 28 Ca -0.07 -0.03 -0.18 0.00 0.04 0.00 0.00 61.00 60.75 2cbg s PRO 28 Cb -0.15 -1.92 0.26 0.00 0.04 0.00 0.00 34.50 32.73 2cbg s PRO 28 CO 0.03 -1.83 1.25 -1.25 0.04 0.00 0.00 177.00 175.24 2cbg s PRO 29 N -5.67 -0.46 0.56 0.56 0.05 -1.20 -1.12 135.00 127.72 2cbg s PRO 29 Ca 0.65 -0.37 0.24 0.00 0.05 0.00 0.00 61.00 61.57 2cbg s PRO 29 Cb -0.09 -1.71 1.61 0.00 0.05 0.00 0.00 34.50 34.36 2cbg s PRO 29 CO 0.50 -3.16 2.21 0.97 0.05 0.00 0.00 177.00 177.58 2cbg h ILE 30 N -2.18 0.71 -0.12 0.56 6.09 -1.94 -0.79 117.51 119.84 2cbg h ILE 30 Ca -0.43 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.09 2cbg h ILE 30 Cb 1.24 1.00 -0.00 0.00 0.47 0.00 0.00 36.82 39.53 2cbg h ILE 30 CO 0.31 0.00 0.10 0.77 -3.07 0.00 0.00 178.15 176.26 2cbg h SER 31 N 0.00 0.00 0.00 2.19 4.64 -1.92 -3.38 113.55 115.08 2cbg h SER 31 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2cbg h SER 31 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2cbg h SER 31 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2cbg n GLY 32 N -1.49 0.83 3.15 -0.77 0.00 -0.30 -4.14 105.19 102.46 2cbg n GLY 32 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2cbg n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cbg s PHE 33 N -2.05 2.42 0.61 1.61 0.08 -1.26 -0.08 117.98 119.30 2cbg s PHE 33 Ca 0.00 -1.13 0.27 0.00 0.12 0.00 0.00 56.93 56.19 2cbg s PHE 33 Cb 0.00 -1.66 1.22 0.00 -0.57 0.00 0.00 43.02 42.01 2cbg s PHE 33 CO 0.00 -0.51 1.63 0.78 -0.10 0.00 0.00 175.22 177.02 2cbg h GLY 34 N 7.16 0.00 2.00 4.36 0.00 -1.47 -1.99 103.07 113.13 2cbg h GLY 34 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2cbg h GLY 34 CO 0.51 0.00 0.00 1.19 0.00 0.00 0.00 176.54 178.24 2cbg h ILE 35 N 0.00 0.00 -1.08 2.60 6.09 -1.87 -1.29 117.51 121.96 2cbg h ILE 35 Ca 0.30 -0.30 0.34 0.00 -1.37 0.00 0.00 64.86 63.83 2cbg h ILE 35 Cb 1.86 1.20 -0.14 0.00 0.47 0.00 0.00 36.82 40.22 2cbg h ILE 35 CO -0.00 0.00 0.65 0.22 -3.07 0.00 0.00 178.15 175.94 2cbg h TYR 36 N 0.00 0.80 -0.07 2.19 3.20 -1.75 -2.09 116.97 119.24 2cbg h TYR 36 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2cbg h TYR 36 Cb 0.32 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.38 2cbg h TYR 36 CO 0.00 -0.15 0.00 1.19 -1.64 0.00 0.00 178.16 177.56 2cbg n PHE 37 N -4.91 0.11 -0.15 -3.82 3.72 -0.49 -4.21 117.46 107.72 2cbg n PHE 37 Ca 0.32 -0.05 -0.03 0.00 -0.05 0.00 0.00 57.45 57.64 2cbg n PHE 37 Cb 1.07 -0.02 0.06 0.00 -0.94 0.00 0.00 39.48 39.65 2cbg n PHE 37 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2cbg h LYS 38 N 0.43 0.17 -0.14 -1.08 3.11 -1.58 -0.11 116.57 117.37 2cbg h LYS 38 Ca 0.00 -0.01 -0.21 0.00 -2.81 0.00 0.00 60.65 57.62 2cbg h LYS 38 Cb 0.16 -0.04 0.01 0.00 -1.00 0.00 0.00 32.23 31.36 2cbg h LYS 38 CO 0.01 0.11 -0.75 -0.44 -2.81 0.00 0.00 179.45 175.56 2cbg h ASP 39 N 0.17 0.83 -0.60 4.20 3.32 -1.80 -0.28 116.42 122.27 2cbg h ASP 39 Ca 0.24 -0.54 0.12 0.00 0.02 0.00 0.00 57.03 56.87 2cbg h ASP 39 Cb 0.34 -0.25 -0.11 0.00 0.22 0.00 0.00 39.33 39.53 2cbg h ASP 39 CO -0.35 1.33 -0.08 0.25 -1.72 0.00 0.00 179.24 178.67 2cbg h LEU 40 N 0.48 -0.42 -0.17 1.55 5.85 -1.62 -1.72 115.31 119.26 2cbg h LEU 40 Ca -0.04 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2cbg h LEU 40 Cb 1.37 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 42.71 2cbg h LEU 40 CO 0.15 -0.16 0.08 0.00 -0.34 0.00 0.00 178.44 178.17 2cbg h ALA 41 N 1.58 0.22 -0.05 1.25 0.00 -0.50 -2.34 119.26 119.41 2cbg h ALA 41 Ca 0.30 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2cbg h ALA 41 Cb 0.48 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 2cbg h ALA 41 CO -0.57 -0.23 -0.45 -0.07 0.00 0.00 0.00 179.25 177.93 2cbg h LEU 42 N 0.15 -1.39 -1.44 0.00 3.38 -0.80 0.18 115.31 115.39 2cbg h LEU 42 Ca 0.06 0.17 0.37 0.00 0.09 0.00 0.00 57.88 58.57 2cbg h LEU 42 Cb 0.11 0.55 -0.11 0.00 0.09 0.00 0.00 40.66 41.30 2cbg h LEU 42 CO -0.01 -0.46 0.79 1.56 0.09 0.00 0.00 178.44 180.41 2cbg h GLN 43 N -0.57 0.19 -0.19 1.13 1.08 -1.03 -1.75 115.11 113.97 2cbg h GLN 43 Ca 0.05 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 2cbg h GLN 43 Cb 0.66 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 2cbg h GLN 43 CO -0.36 0.13 0.00 1.28 -0.95 0.00 0.00 178.83 178.93 2cbg n LEU 44 N -4.62 2.74 -4.68 1.46 4.77 -0.91 -4.94 117.00 110.82 2cbg n LEU 44 Ca 0.32 -2.27 -0.54 0.00 -0.03 0.00 0.00 56.01 53.49 2cbg n LEU 44 Cb 1.22 -0.23 -0.06 0.00 -2.33 0.00 0.00 43.42 42.02 2cbg n LEU 44 CO 0.24 0.65 1.28 -3.20 -1.33 0.00 0.00 177.39 175.03 2cbg n ASN 45 N -0.15 2.53 0.00 -1.43 5.15 0.60 -0.54 115.26 121.43 2cbg n ASN 45 Ca 0.10 1.06 0.00 0.00 -0.60 0.00 0.00 54.58 55.14 2cbg n ASN 45 Cb 0.47 -1.22 0.00 0.00 -0.53 0.00 0.00 39.78 38.50 2cbg n ASN 45 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 2cbg n HIS 46 N 5.02 0.00 -0.13 1.20 8.25 -1.26 -4.84 115.22 123.46 2cbg n HIS 46 Ca 0.24 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.46 2cbg n HIS 46 Cb 0.19 -0.76 -0.11 0.00 1.12 0.00 0.00 29.99 30.43 2cbg n HIS 46 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2cbg n LYS 47 N -1.51 0.62 -3.75 -0.41 5.02 0.30 -4.85 118.16 113.57 2cbg n LYS 47 Ca 0.00 0.22 -0.13 0.00 -2.02 0.00 0.00 58.31 56.38 2cbg n LYS 47 Cb 0.17 -1.52 -0.09 0.00 -0.02 0.00 0.00 35.03 33.57 2cbg n LYS 47 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cbg s ALA 48 N -2.51 -0.82 -0.33 7.82 0.00 -0.72 -4.10 121.76 121.09 2cbg s ALA 48 Ca -0.36 0.46 -0.22 0.00 0.00 0.00 0.00 51.96 51.84 2cbg s ALA 48 Cb 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.20 2cbg s ALA 48 CO 0.55 -0.25 0.70 0.00 0.00 0.00 0.00 175.76 176.77 2cbg s ALA 49 N -1.05 3.49 -0.24 0.00 0.00 0.79 -4.65 121.76 120.09 2cbg s ALA 49 Ca -0.11 -0.66 -0.16 0.00 0.00 0.00 0.00 51.96 51.02 2cbg s ALA 49 Cb -0.05 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2cbg s ALA 49 CO 0.04 -1.27 0.43 0.08 0.00 0.00 0.00 175.76 175.04 2cbg s VAL 50 N 2.82 5.15 -0.21 0.00 1.01 -1.26 -0.24 120.40 127.67 2cbg s VAL 50 Ca 0.28 0.73 -0.03 0.00 0.00 0.00 0.00 61.98 62.96 2cbg s VAL 50 Cb -0.14 -3.75 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 2cbg s VAL 50 CO 0.14 0.17 -0.08 -0.31 0.00 0.00 0.00 175.10 175.02 2cbg s TYR 51 N 1.86 2.91 -0.29 5.22 2.02 -0.88 -0.44 117.35 127.75 2cbg s TYR 51 Ca 0.19 -1.12 -0.07 0.00 -0.37 0.00 0.00 57.07 55.70 2cbg s TYR 51 Cb -0.15 -2.06 0.00 0.00 -0.40 0.00 0.00 41.96 39.35 2cbg s TYR 51 CO 0.09 -0.61 0.08 0.20 -1.57 0.00 0.00 175.55 173.73 2cbg s GLY 52 N 1.42 1.78 0.32 0.71 0.00 -0.54 -1.09 107.32 109.92 2cbg s GLY 52 Ca 0.05 -1.39 -0.15 0.00 0.00 0.00 0.00 44.72 43.23 2cbg s GLY 52 CO -0.06 0.62 0.74 -1.36 0.00 0.00 0.00 173.10 173.05 2cbg s PHE 53 N 1.52 3.38 0.35 1.90 0.08 -0.29 -1.36 117.98 123.56 2cbg s PHE 53 Ca 0.03 1.24 -0.10 0.00 0.12 0.00 0.00 56.93 58.22 2cbg s PHE 53 Cb -0.17 -2.55 -0.07 0.00 -0.57 0.00 0.00 43.02 39.66 2cbg s PHE 53 CO 0.02 0.10 0.70 -1.01 -0.10 0.00 0.00 175.22 174.94 2cbg s HIS 54 N -1.97 3.45 -0.01 0.36 3.76 -0.66 -1.64 115.29 118.58 2cbg s HIS 54 Ca 0.54 0.99 -0.30 0.00 -0.15 0.00 0.00 55.06 56.14 2cbg s HIS 54 Cb -0.10 -2.39 -0.06 0.00 1.11 0.00 0.00 32.58 31.13 2cbg s HIS 54 CO 0.17 0.02 1.65 0.12 -0.85 0.00 0.00 174.74 175.85 2cbg s PHE 55 N -2.19 2.14 -0.24 1.40 5.36 0.88 -4.90 117.98 120.44 2cbg s PHE 55 Ca 0.50 0.24 -0.20 0.00 -0.96 0.00 0.00 56.93 56.52 2cbg s PHE 55 Cb -0.10 -3.93 -0.02 0.00 -0.34 0.00 0.00 43.02 38.63 2cbg s PHE 55 CO 0.27 -3.83 0.60 0.42 -1.46 0.00 0.00 175.22 171.22 2cbg s ILE 56 N 3.52 5.02 -0.16 3.12 1.01 -1.26 -4.96 121.20 127.49 2cbg s ILE 56 Ca 0.74 1.08 0.29 0.00 0.00 0.00 0.00 60.65 62.76 2cbg s ILE 56 Cb -0.35 -3.91 0.36 0.00 0.01 0.00 0.00 42.46 38.57 2cbg s ILE 56 CO 0.31 0.07 1.84 -0.33 0.00 0.00 0.00 174.94 176.82 2cbg h GLU 57 N 7.78 0.00 -7.32 2.79 5.08 -1.96 -3.43 114.58 117.51 2cbg h GLU 57 Ca -0.29 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.56 2cbg h GLU 57 Cb 1.13 0.00 0.13 0.00 0.50 0.00 0.00 28.75 30.52 2cbg h GLU 57 CO 0.76 0.00 0.31 -1.21 -1.00 0.00 0.00 179.01 177.87 2cbg s GLU 58 N -3.47 2.10 0.50 2.33 8.01 -1.26 -4.90 118.70 122.01 2cbg s GLU 58 Ca 0.04 1.10 0.26 0.00 0.01 0.00 0.00 54.97 56.37 2cbg s GLU 58 Cb 0.08 -1.88 1.30 0.00 -4.31 0.00 0.00 34.13 29.32 2cbg s GLU 58 CO 0.57 -1.73 2.01 -0.44 0.01 0.00 0.00 175.26 175.68 2cbg h ASP 59 N -1.19 0.00 -0.14 -0.19 3.32 -2.06 -2.05 116.42 114.11 2cbg h ASP 59 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2cbg h ASP 59 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2cbg h ASP 59 CO 0.52 0.16 0.00 -1.54 -1.72 0.00 0.00 179.24 176.66 2cbg n SER 60 N -3.62 0.94 -0.33 6.45 3.41 -1.26 -4.57 113.62 114.64 2cbg n SER 60 Ca -0.01 -2.03 0.23 0.00 -0.26 0.00 0.00 58.87 56.79 2cbg n SER 60 Cb 0.28 -0.17 0.45 0.00 -0.26 0.00 0.00 64.21 64.52 2cbg n SER 60 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2cbg h ARG 61 N 0.81 0.21 0.05 4.33 0.11 -1.64 -1.62 114.38 116.63 2cbg h ARG 61 Ca 0.00 -0.01 -0.00 0.00 0.10 0.00 0.00 59.98 60.06 2cbg h ARG 61 Cb 0.29 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.32 2cbg h ARG 61 CO 0.02 0.14 -0.02 0.82 0.10 0.00 0.00 179.97 181.02 2cbg h ILE 62 N 0.22 1.18 -0.77 0.08 1.08 -1.88 -0.67 117.51 116.75 2cbg h ILE 62 Ca 0.71 -0.78 0.07 0.00 -0.39 0.00 0.00 64.86 64.47 2cbg h ILE 62 Cb 1.65 1.70 -0.06 0.00 -3.07 0.00 0.00 36.82 37.04 2cbg h ILE 62 CO -0.67 0.20 0.45 -0.33 -0.69 0.00 0.00 178.15 177.11 2cbg h GLU 63 N -0.42 0.79 -0.35 2.37 4.39 -1.82 -1.22 114.58 118.32 2cbg h GLU 63 Ca -0.01 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 2cbg h GLU 63 Cb 0.37 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2cbg h GLU 63 CO 0.01 0.52 0.15 1.96 -1.16 0.00 0.00 179.01 180.50 2cbg h GLN 64 N 0.82 0.49 -0.06 2.33 4.20 -0.82 0.53 115.11 122.60 2cbg h GLN 64 Ca 0.35 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.91 2cbg h GLN 64 Cb 0.21 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2cbg h GLN 64 CO -0.19 0.40 -0.32 1.88 -0.67 0.00 0.00 178.83 179.92 2cbg h TYR 65 N 0.49 0.43 -0.73 2.96 0.05 -0.84 0.65 116.97 119.98 2cbg h TYR 65 Ca 0.12 -0.20 -0.05 0.00 0.05 0.00 0.00 58.73 58.66 2cbg h TYR 65 Cb 0.08 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 37.72 2cbg h TYR 65 CO 0.00 0.94 0.27 0.28 -1.05 0.00 0.00 178.16 178.61 2cbg h VAL 66 N -0.20 1.25 -0.33 -2.88 2.07 -0.93 0.12 116.25 115.36 2cbg h VAL 66 Ca -0.02 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.63 2cbg h VAL 66 Cb 0.99 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2cbg h VAL 66 CO 0.07 0.32 -0.03 -1.28 0.02 0.00 0.00 177.57 176.67 2cbg h SER 67 N 1.06 0.59 -0.41 0.57 0.87 0.29 -2.33 113.55 114.20 2cbg h SER 67 Ca 0.24 -0.33 -0.04 0.00 -1.23 0.00 0.00 61.79 60.43 2cbg h SER 67 Cb 0.22 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 2cbg h SER 67 CO -0.02 0.78 0.10 -0.09 -0.53 0.00 0.00 176.83 177.07 2cbg h ARG 68 N 0.39 0.65 -0.57 2.24 9.65 -0.45 -1.58 114.38 124.71 2cbg h ARG 68 Ca 0.09 -0.16 0.09 0.00 -1.10 0.00 0.00 59.98 58.90 2cbg h ARG 68 Cb 0.50 -0.09 -0.07 0.00 -1.39 0.00 0.00 29.97 28.92 2cbg h ARG 68 CO 0.02 0.67 0.20 0.82 2.80 0.00 0.00 179.97 184.48 2cbg h ILE 69 N 0.52 0.77 0.00 1.20 2.04 -0.67 -1.55 117.51 119.81 2cbg h ILE 69 Ca 0.13 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2cbg h ILE 69 Cb 0.31 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2cbg h ILE 69 CO 0.00 0.07 0.00 0.71 0.00 0.00 0.00 178.15 178.93 2cbg h THR 70 N 0.37 0.00 -0.60 -0.27 1.35 -1.04 0.25 112.91 112.97 2cbg h THR 70 Ca 0.29 -0.80 -0.10 0.00 -0.55 0.00 0.00 66.41 65.25 2cbg h THR 70 Cb 0.35 1.79 -0.02 0.00 -1.73 0.00 0.00 68.15 68.55 2cbg h THR 70 CO -0.30 0.00 -0.01 -0.33 -0.25 0.00 0.00 175.52 174.63 2cbg h GLU 71 N 0.00 1.06 0.10 4.72 5.08 -0.66 -2.73 114.58 122.14 2cbg h GLU 71 Ca 0.00 -0.34 -0.28 0.00 -1.00 0.00 0.00 59.36 57.74 2cbg h GLU 71 Cb 0.89 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2cbg h GLU 71 CO 0.00 1.04 -1.36 0.82 -1.00 0.00 0.00 179.01 178.50 2cbg h ILE 72 N 0.96 1.34 -2.95 3.13 2.04 -0.36 -3.39 117.51 118.27 2cbg h ILE 72 Ca 0.17 -2.98 -0.59 0.00 1.00 0.00 0.00 64.86 62.46 2cbg h ILE 72 Cb 0.57 2.82 -0.40 0.00 -0.74 0.00 0.00 36.82 39.07 2cbg h ILE 72 CO 0.03 0.85 -0.77 -1.58 0.00 0.00 0.00 178.15 176.68 2cbg s GLN 73 N -2.64 0.89 0.38 2.37 0.74 -0.01 -5.02 119.66 116.37 2cbg s GLN 73 Ca -0.05 -1.49 0.07 0.00 0.05 0.00 0.00 55.36 53.94 2cbg s GLN 73 Cb 0.07 -1.96 0.77 0.00 1.10 0.00 0.00 33.01 32.99 2cbg s GLN 73 CO 0.86 -1.11 1.98 -1.35 -0.55 0.00 0.00 175.29 175.12 2cbg h PRO 74 N 7.33 0.49 -5.19 1.67 0.11 -1.70 -3.38 132.00 131.33 2cbg h PRO 74 Ca -0.05 -0.06 -0.61 0.00 0.11 0.00 0.00 66.00 65.39 2cbg h PRO 74 Cb 0.97 -0.09 -0.13 0.00 0.11 0.00 0.00 31.00 31.85 2cbg h PRO 74 CO 0.43 0.42 -0.50 -1.21 -0.21 0.00 0.00 178.00 176.93 2cbg s GLU 75 N -5.21 4.12 1.23 1.05 0.41 -1.26 -4.99 118.70 114.04 2cbg s GLU 75 Ca -0.08 -0.25 -0.17 0.00 -0.41 0.00 0.00 54.97 54.06 2cbg s GLU 75 Cb 0.16 -3.45 0.27 0.00 -1.78 0.00 0.00 34.13 29.33 2cbg s GLU 75 CO 0.74 0.20 0.69 0.41 -0.49 0.00 0.00 175.26 176.81 2cbg n GLY 76 N 3.84 -2.65 3.85 -1.39 0.00 -1.26 -4.81 105.19 102.77 2cbg n GLY 76 Ca -0.16 -1.19 -0.31 0.00 0.00 0.00 0.00 46.02 44.37 2cbg n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cbg s PRO 77 N -4.23 3.12 -0.08 1.61 0.04 -1.26 -5.06 135.00 129.14 2cbg s PRO 77 Ca 0.63 0.75 -0.00 0.00 0.04 0.00 0.00 61.00 62.42 2cbg s PRO 77 Cb -0.18 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.30 2cbg s PRO 77 CO 0.61 -0.92 -0.06 0.71 0.04 0.00 0.00 177.00 177.39 2cbg s TYR 78 N -3.17 2.97 -0.15 0.56 1.51 0.13 -4.86 117.35 114.34 2cbg s TYR 78 Ca 0.57 -0.02 -0.03 0.00 -1.01 0.00 0.00 57.07 56.58 2cbg s TYR 78 Cb -0.12 -1.76 -0.02 0.00 -0.11 0.00 0.00 41.96 39.94 2cbg s TYR 78 CO 0.54 0.28 -0.05 0.08 -1.11 0.00 0.00 175.55 175.29 2cbg s VAL 79 N -0.62 3.74 0.24 0.71 1.01 -1.26 -1.10 120.40 123.11 2cbg s VAL 79 Ca 0.09 -0.41 0.11 0.00 0.00 0.00 0.00 61.98 61.78 2cbg s VAL 79 Cb -0.12 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 2cbg s VAL 79 CO 0.02 0.49 -0.19 -0.76 0.00 0.00 0.00 175.10 174.66 2cbg s LEU 80 N 0.41 2.61 0.00 3.92 1.02 -1.06 -2.65 118.68 122.95 2cbg s LEU 80 Ca -0.05 -0.92 0.00 0.00 0.02 0.00 0.00 54.13 53.19 2cbg s LEU 80 Cb -0.14 -1.21 -0.00 0.00 0.02 0.00 0.00 46.19 44.85 2cbg s LEU 80 CO 0.03 0.07 -0.01 -0.22 0.02 0.00 0.00 176.35 176.24 2cbg s LEU 81 N -3.21 2.05 0.01 1.79 0.20 0.18 -1.08 118.68 118.63 2cbg s LEU 81 Ca 0.27 -0.11 0.04 0.00 0.69 0.00 0.00 54.13 55.02 2cbg s LEU 81 Cb -0.06 0.02 -0.01 0.00 -0.43 0.00 0.00 46.19 45.70 2cbg s LEU 81 CO 0.14 -0.06 -0.13 -0.83 -0.29 0.00 0.00 176.35 175.18 2cbg s GLY 82 N -0.31 0.66 -0.16 7.98 0.00 -0.55 0.00 107.32 114.94 2cbg s GLY 82 Ca -0.03 -0.64 0.01 0.00 0.00 0.00 0.00 44.72 44.06 2cbg s GLY 82 CO -0.00 -0.58 -0.18 -0.47 0.00 0.00 0.00 173.10 171.87 2cbg s TYR 83 N -0.52 2.76 0.00 1.90 5.04 -0.81 -1.57 117.35 124.15 2cbg s TYR 83 Ca 0.03 -1.29 0.00 0.00 -2.44 0.00 0.00 57.07 53.37 2cbg s TYR 83 Cb -0.06 -1.89 0.00 0.00 0.35 0.00 0.00 41.96 40.36 2cbg s TYR 83 CO 0.00 -0.61 0.00 0.45 -1.34 0.00 0.00 175.55 174.05 2cbg n SER 84 N 4.27 0.00 -0.33 4.32 2.88 -0.30 -0.15 113.62 124.30 2cbg n SER 84 Ca -0.20 0.00 0.23 0.00 -1.33 0.00 0.00 58.87 57.58 2cbg n SER 84 Cb 0.51 0.00 0.51 0.00 -0.75 0.00 0.00 64.21 64.48 2cbg n SER 84 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2cbg h ALA 85 N -0.94 2.24 0.00 -1.46 0.00 -1.82 0.19 119.26 117.46 2cbg h ALA 85 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2cbg h ALA 85 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2cbg h ALA 85 CO 0.00 -0.66 0.00 0.78 0.00 0.00 0.00 179.25 179.37 2cbg h GLY 86 N 0.38 0.00 0.97 0.00 0.00 0.10 -2.39 103.07 102.14 2cbg h GLY 86 Ca 0.61 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.94 2cbg h GLY 86 CO -0.32 0.00 0.23 -1.33 0.00 0.00 0.00 176.54 175.12 2cbg h GLY 87 N 1.72 0.60 0.80 4.60 0.00 -0.70 0.35 103.07 110.45 2cbg h GLY 87 Ca 0.00 -0.27 0.06 0.00 0.00 0.00 0.00 47.33 47.12 2cbg h GLY 87 CO 0.00 0.26 0.63 3.43 0.00 0.00 0.00 176.54 180.86 2cbg h ASN 88 N 0.53 1.00 -0.03 0.19 4.21 -1.53 -1.67 115.58 118.28 2cbg h ASN 88 Ca 0.14 0.01 -0.19 0.00 1.21 0.00 0.00 56.30 57.47 2cbg h ASN 88 Cb 0.04 -0.21 0.01 0.00 -1.12 0.00 0.00 38.32 37.05 2cbg h ASN 88 CO -0.02 0.64 -0.72 0.25 -1.29 0.00 0.00 177.43 176.29 2cbg h LEU 89 N 1.13 0.68 -1.37 1.61 5.85 -1.36 -3.21 115.31 118.64 2cbg h LEU 89 Ca 0.41 -0.73 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 2cbg h LEU 89 Cb 0.16 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 2cbg h LEU 89 CO -0.16 1.32 0.27 0.00 -0.34 0.00 0.00 178.44 179.52 2cbg h ALA 90 N 0.38 1.52 0.04 1.25 0.00 -0.13 -2.40 119.26 119.92 2cbg h ALA 90 Ca -0.08 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.77 2cbg h ALA 90 Cb 1.40 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 2cbg h ALA 90 CO 0.14 0.40 -0.33 0.35 0.00 0.00 0.00 179.25 179.81 2cbg h PHE 91 N 0.70 -0.92 -0.95 0.00 3.57 -1.31 0.67 116.94 118.70 2cbg h PHE 91 Ca 0.18 0.03 0.26 0.00 3.53 0.00 0.00 57.97 61.97 2cbg h PHE 91 Cb 0.04 0.40 -0.14 0.00 2.79 0.00 0.00 35.95 39.04 2cbg h PHE 91 CO 0.00 -0.43 0.46 0.93 -2.23 0.00 0.00 178.31 177.05 2cbg h GLU 92 N -0.51 0.37 -0.46 1.11 4.39 -1.51 -1.69 114.58 116.28 2cbg h GLU 92 Ca 0.05 -0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.63 2cbg h GLU 92 Cb 0.58 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2cbg h GLU 92 CO -0.25 0.24 -0.09 0.28 -1.16 0.00 0.00 179.01 178.03 2cbg h VAL 93 N 0.38 1.27 -0.41 3.13 2.07 -0.66 0.63 116.25 122.66 2cbg h VAL 93 Ca 0.63 -1.21 0.05 0.00 0.82 0.00 0.00 66.70 66.99 2cbg h VAL 93 Cb 1.30 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 32.13 2cbg h VAL 93 CO -0.57 0.42 0.14 0.58 0.02 0.00 0.00 177.57 178.16 2cbg h VAL 94 N 0.72 0.87 -0.14 2.57 2.07 -0.16 1.16 116.25 123.33 2cbg h VAL 94 Ca 0.12 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 2cbg h VAL 94 Cb 0.63 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2cbg h VAL 94 CO 0.04 0.05 0.07 1.56 0.02 0.00 0.00 177.57 179.31 2cbg h GLN 95 N 0.30 0.20 -0.26 1.57 4.20 -1.00 0.63 115.11 120.74 2cbg h GLN 95 Ca 0.19 -0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.92 2cbg h GLN 95 Cb 0.18 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.88 2cbg h GLN 95 CO -0.20 0.25 -0.03 0.00 -0.67 0.00 0.00 178.83 178.18 2cbg h ALA 96 N 0.94 0.20 0.20 3.87 0.00 -0.45 0.42 119.26 124.43 2cbg h ALA 96 Ca 0.05 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2cbg h ALA 96 Cb 0.12 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2cbg h ALA 96 CO -0.01 -0.45 -0.10 0.52 0.00 0.00 0.00 179.25 179.22 2cbg h MET 97 N 0.04 -0.26 -0.70 0.00 2.86 0.23 -2.57 114.93 114.53 2cbg h MET 97 Ca 0.12 0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.83 2cbg h MET 97 Cb 0.18 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 2cbg h MET 97 CO -0.24 -0.17 0.46 0.93 1.06 0.00 0.00 176.91 178.95 2cbg h GLU 98 N -0.27 0.78 -0.56 1.72 5.08 0.56 -0.52 114.58 121.38 2cbg h GLU 98 Ca -0.03 -0.05 0.13 0.00 -1.00 0.00 0.00 59.36 58.42 2cbg h GLU 98 Cb 0.20 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 2cbg h GLU 98 CO 0.04 0.52 0.39 0.37 -1.00 0.00 0.00 179.01 179.33 2cbg h GLN 99 N 0.81 0.17 -0.39 2.33 5.75 0.23 -1.20 115.11 122.80 2cbg h GLN 99 Ca 0.29 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.78 2cbg h GLN 99 Cb 0.13 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.64 2cbg h GLN 99 CO -0.09 0.11 0.00 1.63 -2.65 0.00 0.00 178.83 177.83 2cbg n LYS 100 N -4.43 2.03 -0.68 1.69 5.02 -0.28 -4.89 118.16 116.61 2cbg n LYS 100 Ca 0.10 -1.58 0.00 0.00 -2.02 0.00 0.00 58.31 54.81 2cbg n LYS 100 Cb 0.51 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 2cbg n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cbg n GLY 101 N 1.23 0.81 3.80 0.72 0.00 -0.45 -5.03 105.19 106.27 2cbg n GLY 101 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2cbg n GLY 101 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cbg s LEU 102 N 0.00 4.03 -0.39 0.99 1.43 -0.74 -4.97 118.68 119.03 2cbg s LEU 102 Ca 0.00 1.80 -0.16 0.00 -1.03 0.00 0.00 54.13 54.74 2cbg s LEU 102 Cb 0.00 -4.39 0.01 0.00 0.03 0.00 0.00 46.19 41.84 2cbg s LEU 102 CO 0.00 -0.38 0.39 -0.70 0.23 0.00 0.00 176.35 175.89 2cbg s GLU 103 N -2.87 3.23 -0.57 1.70 2.12 -1.26 -3.89 118.70 117.15 2cbg s GLU 103 Ca 0.60 -0.69 -0.20 0.00 0.36 0.00 0.00 54.97 55.04 2cbg s GLU 103 Cb -0.14 -3.92 0.08 0.00 0.26 0.00 0.00 34.13 30.41 2cbg s GLU 103 CO 0.18 -0.73 0.74 0.08 -0.54 0.00 0.00 175.26 174.99 2cbg s VAL 104 N 2.03 4.73 0.22 3.70 1.01 -1.26 0.21 120.40 131.04 2cbg s VAL 104 Ca 0.11 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.50 2cbg s VAL 104 Cb -0.17 -4.46 -0.08 0.00 0.00 0.00 0.00 36.38 31.67 2cbg s VAL 104 CO 0.12 -1.08 1.51 0.77 0.00 0.00 0.00 175.10 176.43 2cbg h SER 105 N 9.20 0.16 -4.26 3.32 4.64 -1.45 -3.29 113.55 121.87 2cbg h SER 105 Ca -0.28 -0.11 -0.12 0.00 -0.47 0.00 0.00 61.79 60.81 2cbg h SER 105 Cb 1.09 -0.05 -0.23 0.00 -0.31 0.00 0.00 62.40 62.90 2cbg h SER 105 CO 1.07 0.81 -0.22 -1.81 -0.87 0.00 0.00 176.83 175.81 2cbg s ASP 106 N -6.88 -0.38 -0.15 4.97 1.01 -1.23 -1.66 116.67 112.36 2cbg s ASP 106 Ca -0.02 0.61 -0.01 0.00 0.71 0.00 0.00 52.55 53.84 2cbg s ASP 106 Cb 0.12 0.67 0.04 0.00 1.01 0.00 0.00 42.92 44.76 2cbg s ASP 106 CO 0.80 -0.26 -0.06 0.12 0.21 0.00 0.00 175.17 175.98 2cbg s PHE 107 N -0.30 1.59 -0.31 4.23 5.36 0.28 -2.55 117.98 126.28 2cbg s PHE 107 Ca -0.04 -0.94 -0.12 0.00 -0.96 0.00 0.00 56.93 54.86 2cbg s PHE 107 Cb -0.03 -1.27 -0.03 0.00 -0.34 0.00 0.00 43.02 41.35 2cbg s PHE 107 CO 0.02 -0.58 0.21 0.42 -1.46 0.00 0.00 175.22 173.83 2cbg s ILE 108 N 1.67 5.22 -0.29 3.12 1.01 -0.24 -1.21 121.20 130.49 2cbg s ILE 108 Ca 0.02 -0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.57 2cbg s ILE 108 Cb -0.14 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 38.76 2cbg s ILE 108 CO -0.08 0.13 0.04 -0.63 0.00 0.00 0.00 174.94 174.40 2cbg s ILE 109 N 1.73 3.60 -0.33 2.92 1.01 0.15 -1.48 121.20 128.80 2cbg s ILE 109 Ca 0.06 -0.90 -0.08 0.00 0.00 0.00 0.00 60.65 59.74 2cbg s ILE 109 Cb -0.17 -2.90 0.02 0.00 0.01 0.00 0.00 42.46 39.43 2cbg s ILE 109 CO 0.10 0.05 0.12 -0.69 0.00 0.00 0.00 174.94 174.53 2cbg s VAL 110 N 1.42 4.13 -1.39 2.92 1.01 -0.61 -0.37 120.40 127.52 2cbg s VAL 110 Ca 0.01 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 2cbg s VAL 110 Cb -0.18 -3.23 0.01 0.00 0.00 0.00 0.00 36.38 32.98 2cbg s VAL 110 CO 0.01 -0.07 0.93 -0.67 0.00 0.00 0.00 175.10 175.30 2cbg n ASP 111 N 4.90 -6.16 -4.14 3.32 2.03 0.19 -1.15 116.55 115.53 2cbg n ASP 111 Ca -0.13 -0.43 -0.20 0.00 0.52 0.00 0.00 54.79 54.55 2cbg n ASP 111 Cb 0.47 -4.86 -0.13 0.00 -0.72 0.00 0.00 41.12 35.88 2cbg n ASP 111 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cbg s ALA 112 N -3.25 1.15 -0.03 -1.67 0.00 -1.26 -3.25 121.76 113.45 2cbg s ALA 112 Ca 0.46 -0.83 0.07 0.00 0.00 0.00 0.00 51.96 51.67 2cbg s ALA 112 Cb -0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 2cbg s ALA 112 CO 0.57 0.21 -0.25 0.71 0.00 0.00 0.00 175.76 177.00 2cbg s TYR 113 N -0.87 2.37 0.18 0.00 2.02 -1.26 -4.93 117.35 114.86 2cbg s TYR 113 Ca 0.01 -0.47 -0.31 0.00 -0.37 0.00 0.00 57.07 55.93 2cbg s TYR 113 Cb -0.08 -1.53 -0.10 0.00 -0.40 0.00 0.00 41.96 39.85 2cbg s TYR 113 CO 0.01 -0.05 1.58 0.21 -1.57 0.00 0.00 175.55 175.73 2cbg s LYS 114 N -0.55 4.20 -0.45 -0.62 2.20 -0.30 -4.86 119.74 119.37 2cbg s LYS 114 Ca 0.08 2.40 -0.14 0.00 -0.36 0.00 0.00 55.97 57.95 2cbg s LYS 114 Cb -0.11 -3.13 0.07 0.00 -1.51 0.00 0.00 37.83 33.15 2cbg s LYS 114 CO -0.00 -0.61 0.35 0.21 -0.36 0.00 0.00 175.35 174.94 2cbg s LYS 115 N 0.93 2.90 -0.02 4.03 2.20 -1.26 -4.89 119.74 123.64 2cbg s LYS 115 Ca 0.69 -1.33 0.16 0.00 -0.36 0.00 0.00 55.97 55.14 2cbg s LYS 115 Cb -0.45 -4.03 -0.23 0.00 -1.51 0.00 0.00 37.83 31.61 2cbg s LYS 115 CO 0.33 -0.98 0.45 -0.40 -0.36 0.00 0.00 175.35 174.39 2cbg n ASP 116 N 5.14 1.11 -4.44 1.43 5.68 -1.26 -0.15 116.55 124.06 2cbg n ASP 116 Ca -0.12 -0.24 -0.21 0.00 -0.50 0.00 0.00 54.79 53.72 2cbg n ASP 116 Cb 0.44 1.55 -0.11 0.00 -1.14 0.00 0.00 41.12 41.86 2cbg n ASP 116 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2cbg s GLN 117 N -2.97 1.61 0.30 0.11 -2.07 -1.26 -4.85 119.66 110.53 2cbg s GLN 117 Ca -0.03 -1.87 -0.12 0.00 -1.82 0.00 0.00 55.36 51.52 2cbg s GLN 117 Cb 0.11 -0.89 -0.08 0.00 -1.09 0.00 0.00 33.01 31.06 2cbg s GLN 117 CO 0.68 -0.14 0.66 -1.54 -1.32 0.00 0.00 175.29 173.63 2cbg s SER 118 N -3.46 6.66 0.41 12.60 1.04 -1.26 -4.78 113.70 124.91 2cbg s SER 118 Ca 0.35 1.09 0.00 0.00 0.48 0.00 0.00 55.95 57.87 2cbg s SER 118 Cb 0.08 -2.30 -0.00 0.00 0.10 0.00 0.00 66.02 63.90 2cbg s SER 118 CO 0.14 -0.19 0.01 2.30 0.98 0.00 0.00 173.24 176.49 2cbg n ILE 119 N -0.47 0.00 -2.75 -1.02 -6.64 -0.95 -5.04 119.36 102.49 2cbg n ILE 119 Ca 0.02 -1.98 -0.38 0.00 -1.77 0.00 0.00 62.75 58.64 2cbg n ILE 119 Cb 0.53 0.43 -0.06 0.00 -1.44 0.00 0.00 39.64 39.10 2cbg n ILE 119 CO 0.00 0.00 0.00 -0.89 -1.77 0.00 0.00 176.55 173.89 2cbg s THR 120 N -2.54 4.13 0.11 7.28 2.01 -1.26 -4.55 115.64 120.81 2cbg s THR 120 Ca 0.02 1.83 -0.31 0.00 0.31 0.00 0.00 61.69 63.53 2cbg s THR 120 Cb 0.00 -4.04 -0.10 0.00 0.01 0.00 0.00 72.50 68.37 2cbg s THR 120 CO 0.01 0.20 1.83 0.00 -0.69 0.00 0.00 174.62 175.98 2cbg s ALA 121 N -1.53 3.75 0.00 7.40 0.00 -1.26 -4.94 121.76 125.18 2cbg s ALA 121 Ca 0.49 1.43 0.00 0.00 0.00 0.00 0.00 51.96 53.88 2cbg s ALA 121 Cb -0.21 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.15 2cbg s ALA 121 CO 0.26 -1.25 0.00 -3.47 0.00 0.00 0.00 175.76 171.30 2cbg n ASP 122 N 5.84 0.00 0.00 0.00 2.03 -1.26 -5.05 116.55 118.10 2cbg n ASP 122 Ca 0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.49 2cbg n ASP 122 Cb 0.38 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.78 2cbg n ASP 122 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2cbg n LEU 132 N 0.00 -1.31 -4.62 -2.67 4.77 -1.26 -5.01 117.00 106.89 2cbg n LEU 132 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 2cbg n LEU 132 Cb 0.00 0.93 0.02 0.00 -2.33 0.00 0.00 43.42 42.05 2cbg n LEU 132 CO 0.00 0.00 0.62 -2.65 -1.33 0.00 0.00 177.39 174.03 2cbg n PRO 133 N -0.59 1.34 -0.33 3.23 -0.02 -1.26 -4.53 135.00 132.84 2cbg n PRO 133 Ca 0.00 0.48 0.19 0.00 -2.02 0.00 0.00 63.50 62.15 2cbg n PRO 133 Cb 0.00 -2.12 0.36 0.00 -0.02 0.00 0.00 33.50 31.71 2cbg n PRO 133 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2cbg n GLU 134 N -0.13 -0.07 0.16 -0.52 0.00 -1.26 -0.00 120.64 118.81 2cbg n GLU 134 Ca 0.10 1.41 -0.16 0.00 0.00 0.00 0.00 57.16 58.51 2cbg n GLU 134 Cb 0.41 -2.31 -0.09 0.00 0.00 0.00 0.00 31.44 29.45 2cbg n GLU 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2cbg h ALA 135 N 1.92 -0.90 -0.18 4.31 0.00 -2.00 -1.55 119.26 120.86 2cbg h ALA 135 Ca 0.64 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.41 2cbg h ALA 135 Cb 1.45 0.76 -0.01 0.00 0.00 0.00 0.00 17.79 19.99 2cbg h ALA 135 CO -0.86 -1.07 -0.01 0.28 0.00 0.00 0.00 179.25 177.59 2cbg h VAL 136 N -0.76 1.26 -0.83 0.00 2.07 -1.71 -2.96 116.25 113.32 2cbg h VAL 136 Ca -0.01 -0.90 0.17 0.00 0.82 0.00 0.00 66.70 66.79 2cbg h VAL 136 Cb 0.75 1.49 -0.16 0.00 -1.52 0.00 0.00 31.29 31.86 2cbg h VAL 136 CO -0.21 0.27 -0.18 -0.09 0.02 0.00 0.00 177.57 177.38 2cbg h ARG 137 N 0.07 0.01 0.00 1.57 2.43 -0.43 -1.25 114.38 116.78 2cbg h ARG 137 Ca 0.05 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.15 2cbg h ARG 137 Cb 0.41 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2cbg h ARG 137 CO 0.01 0.01 -0.34 1.49 -1.51 0.00 0.00 179.97 179.63 2cbg h GLU 138 N 0.01 0.00 0.04 0.20 4.22 -1.20 -2.70 114.58 115.15 2cbg h GLU 138 Ca 0.41 0.00 -0.08 0.00 0.08 0.00 0.00 59.36 59.76 2cbg h GLU 138 Cb 0.64 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.90 2cbg h GLU 138 CO -0.84 0.34 -0.35 1.15 -2.18 0.00 0.00 179.01 177.13 2cbg h THR 139 N 0.00 1.61 -0.66 0.32 2.02 -1.16 -3.29 112.91 111.75 2cbg h THR 139 Ca -0.00 -2.24 0.03 0.00 0.77 0.00 0.00 66.41 64.97 2cbg h THR 139 Cb 0.65 3.07 -0.04 0.00 -1.74 0.00 0.00 68.15 70.10 2cbg h THR 139 CO 0.04 0.61 0.44 0.58 0.37 0.00 0.00 175.52 177.56 2cbg h VAL 140 N -0.60 1.11 -0.00 3.16 2.07 -1.22 -3.13 116.25 117.64 2cbg h VAL 140 Ca -0.05 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2cbg h VAL 140 Cb 1.19 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2cbg h VAL 140 CO 0.07 0.15 -0.59 0.23 0.02 0.00 0.00 177.57 177.45 2cbg n MET 141 N -4.46 0.23 0.18 1.57 2.00 -1.03 -4.32 117.12 111.30 2cbg n MET 141 Ca 0.08 -0.16 0.06 0.00 0.00 0.00 0.00 57.70 57.68 2cbg n MET 141 Cb 0.11 -1.50 0.19 0.00 0.00 0.00 0.00 33.22 32.03 2cbg n MET 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 175.97 175.41 2cbg h GLN 142 N 0.38 0.00 0.19 0.03 3.07 -1.61 -2.15 115.11 115.02 2cbg h GLN 142 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 2cbg h GLN 142 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.08 2cbg h GLN 142 CO 0.00 0.36 -0.09 -0.22 0.09 0.00 0.00 178.83 178.97 2cbg h LYS 143 N 0.00 -0.25 -0.60 0.06 3.64 -1.78 -0.98 116.57 116.66 2cbg h LYS 143 Ca -0.00 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2cbg h LYS 143 Cb 1.12 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.96 2cbg h LYS 143 CO 0.05 0.01 0.39 -0.22 -2.27 0.00 0.00 179.45 177.41 2cbg h LYS 144 N -0.49 0.77 -0.35 1.90 3.64 -1.71 0.22 116.57 120.55 2cbg h LYS 144 Ca -0.03 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.25 2cbg h LYS 144 Cb 0.37 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2cbg h LYS 144 CO 0.04 0.51 -0.04 0.00 -2.27 0.00 0.00 179.45 177.69 2cbg h ARG 145 N 0.79 0.56 -0.05 1.90 -0.00 -1.44 0.32 114.38 116.47 2cbg h ARG 145 Ca 0.23 -0.14 -0.24 0.00 -0.50 0.00 0.00 59.98 59.33 2cbg h ARG 145 Cb -0.06 -0.07 0.02 0.00 0.00 0.00 0.00 29.97 29.86 2cbg h ARG 145 CO -0.06 0.62 -0.89 0.00 0.00 0.00 0.00 179.97 179.63 2cbg h TYR 147 N 0.38 0.15 -0.88 0.00 -0.00 -0.29 -0.56 116.97 115.76 2cbg h TYR 147 Ca -0.10 -0.00 0.18 0.00 -0.00 0.00 0.00 58.73 58.81 2cbg h TYR 147 Cb 1.54 -0.05 -0.07 0.00 -0.00 0.00 0.00 36.73 38.16 2cbg h TYR 147 CO 0.10 0.17 0.58 1.96 -0.00 0.00 0.00 178.16 180.97 2cbg h GLN 148 N 0.08 0.47 0.07 1.82 4.20 -0.33 0.35 115.11 121.78 2cbg h GLN 148 Ca 0.04 -0.03 -0.29 0.00 0.06 0.00 0.00 58.65 58.43 2cbg h GLN 148 Cb 0.07 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 2cbg h GLN 148 CO -0.01 0.31 -1.53 1.49 -0.67 0.00 0.00 178.83 178.42 2cbg h GLU 149 N 0.48 0.15 -0.76 1.46 4.81 -1.28 -0.93 114.58 118.52 2cbg h GLU 149 Ca 0.45 -0.26 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 2cbg h GLU 149 Cb 1.01 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.46 2cbg h GLU 149 CO -0.18 0.96 0.27 -0.92 -0.73 0.00 0.00 179.01 178.40 2cbg h TYR 150 N 0.04 1.19 0.18 0.92 3.20 -0.70 -3.07 116.97 118.74 2cbg h TYR 150 Ca -0.23 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.52 2cbg h TYR 150 Cb 1.98 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.90 2cbg h TYR 150 CO 0.04 0.92 -0.09 2.35 -1.64 0.00 0.00 178.16 179.74 2cbg h TRP 151 N 1.12 -0.23 -0.99 -3.82 7.01 -0.94 -1.64 115.95 116.46 2cbg h TRP 151 Ca 0.25 -0.01 0.26 0.00 2.11 0.00 0.00 58.89 61.50 2cbg h TRP 151 Cb 0.26 0.07 -0.19 0.00 -2.10 0.00 0.00 29.16 27.21 2cbg h TRP 151 CO 0.02 0.19 -0.04 0.00 -2.79 0.00 0.00 178.44 175.83 2cbg n ALA 152 N -2.51 0.45 0.81 2.65 0.00 -0.36 -0.76 120.51 120.79 2cbg n ALA 152 Ca -0.08 1.07 0.13 0.00 0.00 0.00 0.00 53.44 54.55 2cbg n ALA 152 Cb 0.26 -0.75 0.39 0.00 0.00 0.00 0.00 19.45 19.35 2cbg n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cbg n GLN 153 N -5.51 0.13 -2.50 0.00 -0.00 -1.14 -2.24 117.38 106.13 2cbg n GLN 153 Ca 0.22 0.08 -0.40 0.00 -0.00 0.00 0.00 57.00 56.89 2cbg n GLN 153 Cb 0.70 -1.62 -0.04 0.00 -0.00 0.00 0.00 30.24 29.28 2cbg n GLN 153 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 2cbg s LEU 154 N -3.67 4.53 -0.09 2.61 2.96 0.06 -4.74 118.68 120.33 2cbg s LEU 154 Ca 0.11 2.23 -0.01 0.00 -0.22 0.00 0.00 54.13 56.24 2cbg s LEU 154 Cb 0.16 -3.67 0.03 0.00 0.50 0.00 0.00 46.19 43.21 2cbg s LEU 154 CO 0.63 -0.15 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.85 2cbg s ILE 155 N -1.20 0.66 -0.23 6.68 1.01 -1.26 -4.48 121.20 122.38 2cbg s ILE 155 Ca 0.45 -0.07 -0.26 0.00 0.00 0.00 0.00 60.65 60.77 2cbg s ILE 155 Cb -0.31 -0.77 -0.00 0.00 0.01 0.00 0.00 42.46 41.39 2cbg s ILE 155 CO 0.39 0.29 0.90 0.20 0.00 0.00 0.00 174.94 176.73 2cbg s ASN 156 N 1.86 6.94 0.03 3.58 0.02 0.79 -5.02 114.94 123.14 2cbg s ASN 156 Ca 0.05 1.17 0.06 0.00 -1.02 0.00 0.00 52.86 53.12 2cbg s ASN 156 Cb -0.12 -2.47 -0.03 0.00 0.02 0.00 0.00 41.25 38.64 2cbg s ASN 156 CO -0.07 -0.55 -0.15 -1.61 0.02 0.00 0.00 177.10 174.75 2cbg s GLU 157 N 2.85 2.21 6.24 -0.60 2.02 -1.26 -4.63 118.70 125.53 2cbg s GLU 157 Ca 0.38 -0.91 0.00 0.00 0.02 0.00 0.00 54.97 54.47 2cbg s GLU 157 Cb -0.15 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.80 2cbg s GLU 157 CO 0.08 0.56 0.00 0.41 0.02 0.00 0.00 175.26 176.32 2cbg n GLY 158 N 1.54 2.93 3.40 -1.39 0.00 -1.26 -4.95 105.19 105.45 2cbg n GLY 158 Ca -0.16 -0.35 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 2cbg n GLY 158 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cbg s ARG 159 N 0.00 1.66 0.03 1.61 0.52 -1.26 -4.16 118.95 117.36 2cbg s ARG 159 Ca 0.00 -1.96 0.00 0.00 -0.52 0.00 0.00 55.73 53.26 2cbg s ARG 159 Cb 0.00 -0.38 -0.02 0.00 0.52 0.00 0.00 34.95 35.07 2cbg s ARG 159 CO 0.00 -0.39 -0.04 0.96 0.02 0.00 0.00 175.30 175.85 2cbg s ILE 160 N -3.48 0.22 -0.05 1.52 -4.36 -0.41 -4.95 121.20 109.70 2cbg s ILE 160 Ca 0.33 -1.12 0.12 0.00 -0.26 0.00 0.00 60.65 59.72 2cbg s ILE 160 Cb 0.05 -0.58 -0.03 0.00 1.25 0.00 0.00 42.46 43.16 2cbg s ILE 160 CO 0.16 -0.58 1.40 0.50 0.24 0.00 0.00 174.94 176.66 2cbg h LYS 161 N 4.32 0.00 -6.11 0.37 3.64 -1.92 -1.99 116.57 114.89 2cbg h LYS 161 Ca -0.33 0.00 -0.72 0.00 -1.27 0.00 0.00 60.65 58.33 2cbg h LYS 161 Cb 1.20 0.00 0.07 0.00 -0.41 0.00 0.00 32.23 33.09 2cbg h LYS 161 CO 0.46 0.67 0.01 0.45 -2.27 0.00 0.00 179.45 178.77 2cbg n SER 162 N -3.28 0.18 -4.65 4.20 2.88 -1.24 -4.49 113.62 107.23 2cbg n SER 162 Ca 0.01 1.15 -0.44 0.00 -1.33 0.00 0.00 58.87 58.26 2cbg n SER 162 Cb 0.80 -1.02 -0.02 0.00 -0.75 0.00 0.00 64.21 63.22 2cbg n SER 162 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2cbg n ASN 163 N 1.82 2.18 -4.60 -3.46 3.02 -0.67 -4.53 115.26 109.02 2cbg n ASN 163 Ca 0.18 1.18 -0.35 0.00 -0.03 0.00 0.00 54.58 55.57 2cbg n ASN 163 Cb 0.17 -1.39 -0.10 0.00 -0.61 0.00 0.00 39.78 37.85 2cbg n ASN 163 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2cbg s ILE 164 N -0.83 4.70 -0.35 2.41 1.01 -0.44 0.99 121.20 128.69 2cbg s ILE 164 Ca 0.60 -0.06 -0.05 0.00 0.00 0.00 0.00 60.65 61.14 2cbg s ILE 164 Cb -0.65 -3.13 0.06 0.00 0.01 0.00 0.00 42.46 38.75 2cbg s ILE 164 CO 0.58 0.44 0.11 -1.00 0.00 0.00 0.00 174.94 175.07 2cbg s HIS 165 N 0.59 3.34 -0.46 3.97 3.76 -0.35 -1.55 115.29 124.58 2cbg s HIS 165 Ca 0.03 -1.79 -0.20 0.00 -0.15 0.00 0.00 55.06 52.96 2cbg s HIS 165 Cb -0.13 -2.50 0.03 0.00 1.11 0.00 0.00 32.58 31.09 2cbg s HIS 165 CO 0.01 -0.82 0.62 0.12 -0.85 0.00 0.00 174.74 173.82 2cbg s PHE 166 N 1.30 3.07 -0.37 1.40 5.36 0.71 0.33 117.98 129.78 2cbg s PHE 166 Ca -0.00 -0.26 -0.12 0.00 -0.96 0.00 0.00 56.93 55.59 2cbg s PHE 166 Cb -0.21 -3.36 0.02 0.00 -0.34 0.00 0.00 43.02 39.13 2cbg s PHE 166 CO 0.00 -0.91 0.22 0.42 -1.46 0.00 0.00 175.22 173.49 2cbg s ILE 167 N 2.69 4.75 0.47 3.12 1.01 0.50 -0.36 121.20 133.38 2cbg s ILE 167 Ca 0.19 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 60.16 2cbg s ILE 167 Cb -0.16 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.72 2cbg s ILE 167 CO 0.16 -0.20 0.65 -1.83 0.00 0.00 0.00 174.94 173.72 2cbg s GLU 168 N 1.59 2.71 0.42 2.79 -1.05 -0.20 -0.64 118.70 124.32 2cbg s GLU 168 Ca 0.03 -1.07 -0.26 0.00 -0.15 0.00 0.00 54.97 53.53 2cbg s GLU 168 Cb -0.19 -2.65 -0.09 0.00 -0.44 0.00 0.00 34.13 30.76 2cbg s GLU 168 CO 0.07 -0.45 1.34 0.00 0.95 0.00 0.00 175.26 177.17 2cbg s ALA 169 N -2.51 3.25 -0.41 -0.84 0.00 -1.26 -0.89 121.76 119.10 2cbg s ALA 169 Ca 0.56 1.30 0.24 0.00 0.00 0.00 0.00 51.96 54.06 2cbg s ALA 169 Cb -0.10 -3.51 0.51 0.00 0.00 0.00 0.00 23.12 20.02 2cbg s ALA 169 CO 0.35 -0.93 1.67 0.78 0.00 0.00 0.00 175.76 177.63 2cbg h GLY 170 N 2.57 0.00 -6.52 0.00 0.00 -1.07 -3.42 103.07 94.63 2cbg h GLY 170 Ca -0.50 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.16 2cbg h GLY 170 CO 0.62 0.00 -0.82 -0.42 0.00 0.00 0.00 176.54 175.92 2cbg s ILE 171 N -3.25 2.37 -0.30 2.60 1.01 -0.99 -4.79 121.20 117.85 2cbg s ILE 171 Ca 0.07 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 59.73 2cbg s ILE 171 Cb 0.06 -2.09 0.10 0.00 0.01 0.00 0.00 42.46 40.54 2cbg s ILE 171 CO 0.64 0.41 0.10 -1.10 0.00 0.00 0.00 174.94 174.99 2cbg s GLN 172 N 1.30 0.61 -0.69 2.79 -0.21 -1.26 -4.25 119.66 117.94 2cbg s GLN 172 Ca 0.03 -0.93 0.05 0.00 0.02 0.00 0.00 55.36 54.53 2cbg s GLN 172 Cb -0.14 -1.83 0.20 0.00 1.00 0.00 0.00 33.01 32.23 2cbg s GLN 172 CO -0.10 -0.97 0.58 0.25 -2.12 0.00 0.00 175.29 172.94 2cbg n THR 173 N 4.94 1.91 0.00 -0.19 -2.24 -1.26 -4.66 114.28 112.78 2cbg n THR 173 Ca -0.03 -5.00 0.00 0.00 -2.27 0.00 0.00 64.05 56.75 2cbg n THR 173 Cb 0.42 -2.16 0.00 0.00 -2.10 0.00 0.00 70.33 66.49 2cbg n THR 173 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2cbg n GLU 174 N 1.60 0.00 0.00 -0.78 0.00 -1.26 -5.14 120.64 115.06 2cbg n GLU 174 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.39 2cbg n GLU 174 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.81 2cbg n GLU 174 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 2cbg n THR 175 N 0.00 0.00 -2.65 3.84 -1.04 -1.26 -4.93 114.28 108.24 2cbg n THR 175 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 2cbg n THR 175 Cb 0.00 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 2cbg n THR 175 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2cbg s SER 176 N 0.00 6.69 0.00 8.00 0.01 -1.26 -5.00 113.70 122.14 2cbg s SER 176 Ca 0.00 -2.01 0.00 0.00 1.31 0.00 0.00 55.95 55.25 2cbg s SER 176 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2cbg s SER 176 CO 0.00 -1.26 0.00 0.61 0.41 0.00 0.00 173.24 173.00 2cbg n GLY 177 N 5.94 0.00 0.24 3.44 0.00 -1.26 -1.86 105.19 111.69 2cbg n GLY 177 Ca 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.39 2cbg n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cbg n ALA 178 N -1.44 -0.07 0.15 4.61 0.00 -1.26 -2.09 120.51 120.41 2cbg n ALA 178 Ca 0.00 0.61 -0.17 0.00 0.00 0.00 0.00 53.44 53.88 2cbg n ALA 178 Cb 0.00 -0.27 -0.10 0.00 0.00 0.00 0.00 19.45 19.08 2cbg n ALA 178 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2cbg h MET 179 N 0.00 -0.78 -0.69 0.00 -1.53 -1.77 -3.18 114.93 106.99 2cbg h MET 179 Ca 0.21 0.05 0.20 0.00 -3.44 0.00 0.00 59.70 56.73 2cbg h MET 179 Cb 0.37 0.18 -0.03 0.00 -0.55 0.00 0.00 31.60 31.57 2cbg h MET 179 CO -0.61 -0.52 0.63 0.28 0.14 0.00 0.00 176.91 176.83 2cbg h VAL 180 N -0.81 0.38 0.00 -5.77 2.07 -1.65 3.06 116.25 113.53 2cbg h VAL 180 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2cbg h VAL 180 Cb 0.78 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2cbg h VAL 180 CO -0.24 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.53 2cbg n LEU 181 N -3.84 0.20 -2.15 2.57 4.77 -1.03 -4.06 117.00 113.45 2cbg n LEU 181 Ca 0.14 0.53 -0.17 0.00 -0.03 0.00 0.00 56.01 56.48 2cbg n LEU 181 Cb 0.88 -0.48 0.23 0.00 -2.33 0.00 0.00 43.42 41.72 2cbg n LEU 181 CO 0.31 -0.14 1.19 0.00 -1.33 0.00 0.00 177.39 177.42 2cbg n GLN 182 N -1.70 2.87 -0.29 3.23 1.13 1.02 -4.67 117.38 118.98 2cbg n GLN 182 Ca 0.05 -3.05 0.10 0.00 -1.94 0.00 0.00 57.00 52.16 2cbg n GLN 182 Cb 0.30 -2.20 0.27 0.00 0.11 0.00 0.00 30.24 28.72 2cbg n GLN 182 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2cbg n LYS 183 N -0.74 2.38 -0.86 -1.09 5.02 -1.24 -1.15 118.16 120.49 2cbg n LYS 183 Ca 0.53 -2.14 0.00 0.00 -2.02 0.00 0.00 58.31 54.67 2cbg n LYS 183 Cb 1.57 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 35.11 2cbg n LYS 183 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2cbg n TRP 184 N 1.26 0.00 -0.32 2.13 7.02 -1.26 -4.91 117.44 121.35 2cbg n TRP 184 Ca 0.20 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.82 2cbg n TRP 184 Cb 0.51 0.00 0.32 0.00 -2.42 0.00 0.00 31.31 29.72 2cbg n TRP 184 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 2cbg h GLN 185 N 3.02 0.53 -0.17 -0.99 4.20 -1.92 -1.65 115.11 118.13 2cbg h GLN 185 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2cbg h GLN 185 Cb 0.00 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.66 2cbg h GLN 185 CO 0.00 0.35 0.00 -0.40 -0.67 0.00 0.00 178.83 178.11 2cbg n ASP 186 N -4.93 1.14 -0.71 1.46 5.68 -1.26 -3.28 116.55 114.66 2cbg n ASP 186 Ca 0.23 -1.81 0.09 0.00 -0.50 0.00 0.00 54.79 52.80 2cbg n ASP 186 Cb 0.64 -0.11 0.07 0.00 -1.14 0.00 0.00 41.12 40.58 2cbg n ASP 186 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2cbg n ALA 187 N 0.05 2.47 -2.52 2.12 0.00 -0.62 -4.56 120.51 117.44 2cbg n ALA 187 Ca 0.11 -0.64 -0.41 0.00 0.00 0.00 0.00 53.44 52.50 2cbg n ALA 187 Cb 0.21 -0.59 -0.10 0.00 0.00 0.00 0.00 19.45 18.97 2cbg n ALA 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cbg s ALA 188 N -1.46 3.49 0.15 0.00 0.00 -1.21 -1.29 121.76 121.45 2cbg s ALA 188 Ca 0.21 -1.40 0.24 0.00 0.00 0.00 0.00 51.96 51.01 2cbg s ALA 188 Cb 0.15 -2.78 0.96 0.00 0.00 0.00 0.00 23.12 21.45 2cbg s ALA 188 CO 0.22 -1.13 1.84 1.49 0.00 0.00 0.00 175.76 178.18 2cbg h GLU 189 N 8.52 0.00 0.00 0.00 4.81 -1.63 -3.46 114.58 122.82 2cbg h GLU 189 Ca -0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 2cbg h GLU 189 Cb 1.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2cbg h GLU 189 CO 0.68 0.21 0.00 -1.91 -0.73 0.00 0.00 179.01 177.26 2cbg n GLU 190 N -3.39 0.00 -3.65 1.92 4.07 -1.26 -5.02 120.64 113.31 2cbg n GLU 190 Ca 0.00 0.00 -0.31 0.00 -0.06 0.00 0.00 57.16 56.79 2cbg n GLU 190 Cb 0.42 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.75 2cbg n GLU 190 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 2cbg s GLY 191 N 0.00 2.24 -0.06 8.31 0.00 -1.26 -5.01 107.32 111.54 2cbg s GLY 191 Ca 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 44.72 44.16 2cbg s GLY 191 CO 0.00 -0.45 0.13 -0.47 0.00 0.00 0.00 173.10 172.31 2cbg s TYR 192 N -1.68 -0.14 -0.05 1.90 5.04 -1.26 -1.32 117.35 119.83 2cbg s TYR 192 Ca 0.42 0.40 -0.21 0.00 -2.44 0.00 0.00 57.07 55.24 2cbg s TYR 192 Cb -0.12 -0.04 0.04 0.00 0.35 0.00 0.00 41.96 42.20 2cbg s TYR 192 CO 0.24 -0.12 0.46 0.00 -1.34 0.00 0.00 175.55 174.80 2cbg s ALA 193 N 0.70 -1.18 0.05 3.97 0.00 -0.60 -4.98 121.76 119.72 2cbg s ALA 193 Ca -0.05 0.83 0.07 0.00 0.00 0.00 0.00 51.96 52.80 2cbg s ALA 193 Cb -0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 2cbg s ALA 193 CO -0.03 -0.29 -0.18 -2.00 0.00 0.00 0.00 175.76 173.25 2cbg s GLU 194 N -1.02 1.20 -0.20 0.00 2.12 -1.26 -0.21 118.70 119.34 2cbg s GLU 194 Ca -0.10 -0.90 -0.10 0.00 0.36 0.00 0.00 54.97 54.23 2cbg s GLU 194 Cb -0.03 -1.29 0.07 0.00 0.26 0.00 0.00 34.13 33.14 2cbg s GLU 194 CO 0.06 0.32 0.47 0.71 -0.54 0.00 0.00 175.26 176.28 2cbg s TYR 195 N -0.86 -0.77 -0.26 5.30 2.02 0.51 -4.96 117.35 118.34 2cbg s TYR 195 Ca 0.05 1.54 -0.24 0.00 -0.37 0.00 0.00 57.07 58.05 2cbg s TYR 195 Cb -0.09 0.36 -0.01 0.00 -0.40 0.00 0.00 41.96 41.83 2cbg s TYR 195 CO 0.02 -0.43 0.78 0.99 -1.57 0.00 0.00 175.55 175.35 2cbg s THR 196 N 1.85 4.86 0.00 -0.71 2.01 -1.26 -1.03 115.64 121.35 2cbg s THR 196 Ca -0.07 1.42 0.00 0.00 0.31 0.00 0.00 61.69 63.35 2cbg s THR 196 Cb -0.09 -4.09 0.00 0.00 0.01 0.00 0.00 72.50 68.33 2cbg s THR 196 CO -0.14 -0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.32 2cbg n GLY 197 N 3.90 0.80 3.14 4.40 0.00 -0.07 -4.91 105.19 112.45 2cbg n GLY 197 Ca 0.04 -1.76 -0.24 0.00 0.00 0.00 0.00 46.02 44.06 2cbg n GLY 197 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cbg s TYR 198 N 1.07 1.50 0.00 1.61 2.02 -1.26 -2.64 117.35 119.65 2cbg s TYR 198 Ca 0.00 -0.32 0.00 0.00 -0.37 0.00 0.00 57.07 56.38 2cbg s TYR 198 Cb 0.00 -0.98 0.00 0.00 -0.40 0.00 0.00 41.96 40.58 2cbg s TYR 198 CO 0.00 -0.06 0.00 0.41 -1.57 0.00 0.00 175.55 174.33 2cbg n GLY 199 N 2.79 -0.52 3.92 0.71 0.00 -1.26 -4.45 105.19 106.39 2cbg n GLY 199 Ca -0.15 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 43.84 2cbg n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cbg s ALA 200 N -1.77 2.45 0.00 4.61 0.00 -1.26 -1.66 121.76 124.13 2cbg s ALA 200 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.91 2cbg s ALA 200 Cb 0.00 -2.79 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2cbg s ALA 200 CO 0.00 -2.14 0.35 0.72 0.00 0.00 0.00 175.76 174.69 2cbg n HIS 201 N -3.57 0.00 -0.14 0.00 8.25 -1.26 -1.66 115.22 116.84 2cbg n HIS 201 Ca 0.13 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.64 2cbg n HIS 201 Cb 0.60 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.82 2cbg n HIS 201 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2cbg n LYS 202 N -0.70 -0.03 -0.77 -0.41 2.85 -1.26 -3.33 118.16 114.51 2cbg n LYS 202 Ca 0.00 0.60 -0.01 0.00 -1.05 0.00 0.00 58.31 57.85 2cbg n LYS 202 Cb 0.00 -0.95 0.25 0.00 -0.65 0.00 0.00 35.03 33.68 2cbg n LYS 202 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2cbg n ASP 203 N -4.43 3.74 0.06 -5.58 8.00 -0.66 -4.79 116.55 112.89 2cbg n ASP 203 Ca 0.09 -3.34 -0.20 0.00 0.71 0.00 0.00 54.79 52.06 2cbg n ASP 203 Cb 0.29 -0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 40.64 2cbg n ASP 203 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2cbg h MET 204 N 1.77 0.63 -0.33 -1.24 2.86 -1.60 -3.31 114.93 113.72 2cbg h MET 204 Ca 0.18 -0.73 0.00 0.00 -2.06 0.00 0.00 59.70 57.09 2cbg h MET 204 Cb 1.85 0.22 0.00 0.00 0.06 0.00 0.00 31.60 33.73 2cbg h MET 204 CO 0.47 1.31 0.00 1.28 1.06 0.00 0.00 176.91 181.03 2cbg n LEU 205 N -3.81 3.25 -4.76 1.22 4.77 -1.26 -3.34 117.00 113.07 2cbg n LEU 205 Ca -0.11 -2.31 -0.27 0.00 -0.03 0.00 0.00 56.01 53.29 2cbg n LEU 205 Cb 0.91 -0.33 -0.07 0.00 -2.33 0.00 0.00 43.42 41.60 2cbg n LEU 205 CO 0.56 0.72 -0.16 -1.61 -1.33 0.00 0.00 177.39 175.56 2cbg s GLU 206 N -1.55 2.19 4.00 3.23 2.02 -1.24 -3.87 118.70 123.47 2cbg s GLU 206 Ca 0.29 -2.04 0.00 0.00 0.02 0.00 0.00 54.97 53.25 2cbg s GLU 206 Cb 0.19 -1.86 0.00 0.00 0.10 0.00 0.00 34.13 32.56 2cbg s GLU 206 CO 0.14 -0.25 0.00 0.41 0.02 0.00 0.00 175.26 175.58 2cbg n GLY 207 N -1.30 2.94 0.17 -1.39 0.00 -1.26 -2.61 105.19 101.74 2cbg n GLY 207 Ca -0.06 -0.09 0.06 0.00 0.00 0.00 0.00 46.02 45.93 2cbg n GLY 207 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2cbg h GLU 208 N 0.00 0.00 0.00 1.61 4.11 -1.95 -3.16 114.58 115.19 2cbg h GLU 208 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2cbg h GLU 208 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2cbg h GLU 208 CO 0.00 0.35 -0.30 1.19 0.07 0.00 0.00 179.01 180.32 2cbg n PHE 209 N -3.24 0.06 -0.15 2.06 3.72 -1.07 -3.79 117.46 115.05 2cbg n PHE 209 Ca 0.02 0.02 -0.06 0.00 -0.05 0.00 0.00 57.45 57.38 2cbg n PHE 209 Cb 0.63 -0.39 0.12 0.00 -0.94 0.00 0.00 39.48 38.90 2cbg n PHE 209 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2cbg h ALA 210 N 2.96 1.02 0.06 4.37 0.00 -1.49 0.10 119.26 126.28 2cbg h ALA 210 Ca 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 2cbg h ALA 210 Cb 0.52 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2cbg h ALA 210 CO 0.00 0.61 -0.03 1.49 0.00 0.00 0.00 179.25 181.32 2cbg h GLU 211 N 0.84 -0.08 -0.79 0.00 4.81 -1.79 0.31 114.58 117.88 2cbg h GLU 211 Ca 0.16 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.46 2cbg h GLU 211 Cb 0.47 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.81 2cbg h GLU 211 CO 0.02 0.41 0.47 0.87 -0.73 0.00 0.00 179.01 180.06 2cbg h LYS 212 N -0.61 0.84 0.02 1.92 1.57 -1.69 -1.87 116.57 116.74 2cbg h LYS 212 Ca -0.01 -0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.52 2cbg h LYS 212 Cb 0.53 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 2cbg h LYS 212 CO 0.01 0.55 -0.94 -0.91 -0.57 0.00 0.00 179.45 177.60 2cbg h ASN 213 N 0.86 0.15 -0.90 0.86 -0.26 -0.66 -3.09 115.58 112.54 2cbg h ASN 213 Ca 0.35 -0.14 0.06 0.00 -0.56 0.00 0.00 56.30 56.01 2cbg h ASN 213 Cb 0.19 -0.05 -0.06 0.00 -1.06 0.00 0.00 38.32 37.34 2cbg h ASN 213 CO -0.18 1.00 0.57 0.00 -1.06 0.00 0.00 177.43 177.76 2cbg h ALA 214 N 0.98 1.24 -0.57 -0.83 0.00 -0.15 -2.03 119.26 117.91 2cbg h ALA 214 Ca -0.04 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2cbg h ALA 214 Cb 1.61 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 2cbg h ALA 214 CO 0.14 0.34 0.38 -0.91 0.00 0.00 0.00 179.25 179.19 2cbg h ASN 215 N 1.04 0.50 0.04 0.00 2.35 -1.26 0.21 115.58 118.48 2cbg h ASN 215 Ca 0.39 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.14 2cbg h ASN 215 Cb 0.15 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.41 2cbg h ASN 215 CO -0.17 0.34 -0.02 0.40 -1.65 0.00 0.00 177.43 176.33 2cbg h ILE 216 N 0.58 1.06 -0.34 2.81 2.04 -1.46 -0.81 117.51 121.39 2cbg h ILE 216 Ca 0.24 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 2cbg h ILE 216 Cb 0.21 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2cbg h ILE 216 CO -0.07 0.08 0.20 0.40 0.00 0.00 0.00 178.15 178.77 2cbg h ILE 217 N -0.19 1.12 -0.33 -0.67 2.04 -1.02 0.13 117.51 118.59 2cbg h ILE 217 Ca -0.01 -0.28 0.06 0.00 1.00 0.00 0.00 64.86 65.63 2cbg h ILE 217 Cb 0.17 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 36.89 2cbg h ILE 217 CO 0.01 0.12 -0.02 0.25 0.00 0.00 0.00 178.15 178.50 2cbg h LEU 218 N 0.44 -0.18 -0.95 1.44 5.85 -0.46 0.64 115.31 122.09 2cbg h LEU 218 Ca 0.12 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.93 2cbg h LEU 218 Cb 0.01 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 2cbg h LEU 218 CO -0.02 -0.05 0.62 0.78 -0.34 0.00 0.00 178.44 179.42 2cbg h ASN 219 N 0.06 1.10 0.12 1.25 2.35 -0.56 0.69 115.58 120.59 2cbg h ASN 219 Ca 0.16 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 2cbg h ASN 219 Cb 0.22 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2cbg h ASN 219 CO -0.29 0.80 -0.06 0.40 -1.65 0.00 0.00 177.43 176.64 2cbg h ILE 220 N 1.29 0.89 -0.39 2.81 2.04 -0.23 -1.44 117.51 122.48 2cbg h ILE 220 Ca 0.35 -0.01 0.08 0.00 1.00 0.00 0.00 64.86 66.27 2cbg h ILE 220 Cb -0.13 0.89 -0.07 0.00 -0.74 0.00 0.00 36.82 36.77 2cbg h ILE 220 CO -0.07 0.00 -0.05 -0.07 0.00 0.00 0.00 178.15 177.96 2cbg h LEU 221 N -0.17 -0.27 -1.75 1.44 3.38 -0.00 -2.50 115.31 115.44 2cbg h LEU 221 Ca -0.02 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2cbg h LEU 221 Cb 0.13 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2cbg h LEU 221 CO 0.03 -0.09 -0.13 0.44 0.09 0.00 0.00 178.44 178.78 2cbg h ASP 222 N 0.04 0.00 0.39 -0.43 3.32 0.60 -2.67 116.42 117.68 2cbg h ASP 222 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2cbg h ASP 222 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2cbg h ASP 222 CO -0.37 0.13 -0.18 0.29 -1.72 0.00 0.00 179.24 177.39 2cbg n LYS 223 N -4.38 0.60 0.00 3.56 5.02 -0.56 -5.08 118.16 117.31 2cbg n LYS 223 Ca -0.03 -0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.01 2cbg n LYS 223 Cb 0.20 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 2cbg n LYS 223 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99