#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cdb s GLU 2 N 0.00 1.89 -0.13 -1.58 -6.30 -1.26 -5.10 118.70 106.22 1cdb s GLU 2 Ca 0.00 -1.74 -0.06 0.00 -2.50 0.00 0.00 54.97 50.67 1cdb s GLU 2 Cb 0.00 -3.36 -0.04 0.00 0.00 0.00 0.00 34.13 30.73 1cdb s GLU 2 CO 0.00 -0.94 0.09 0.42 0.02 0.00 0.00 175.26 174.85 1cdb s ILE 3 N 1.07 5.05 1.02 -3.70 1.09 -1.26 -5.11 121.20 119.36 1cdb s ILE 3 Ca 0.06 0.04 -0.11 0.00 -1.10 0.00 0.00 60.65 59.54 1cdb s ILE 3 Cb -0.21 -3.21 0.20 0.00 -1.06 0.00 0.00 42.46 38.18 1cdb s ILE 3 CO -0.05 0.56 1.09 -0.89 -0.10 0.00 0.00 174.94 175.55 1cdb s THR 4 N -0.53 2.14 -0.84 2.92 2.01 -1.26 -4.98 115.64 115.10 1cdb s THR 4 Ca 0.11 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.16 1cdb s THR 4 Cb -0.12 -2.14 0.34 0.00 0.01 0.00 0.00 72.50 70.60 1cdb s THR 4 CO 0.02 -0.06 1.66 -0.46 -0.69 0.00 0.00 174.62 175.09 1cdb n ASN 5 N -4.48 6.65 -4.35 3.53 0.23 -1.26 -5.02 115.26 110.55 1cdb n ASN 5 Ca 0.07 -3.74 -0.28 0.00 -0.53 0.00 0.00 54.58 50.11 1cdb n ASN 5 Cb 0.53 -0.96 -0.13 0.00 -2.08 0.00 0.00 39.78 37.14 1cdb n ASN 5 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1cdb s ALA 6 N -4.04 2.21 -0.15 -2.53 0.00 -1.26 -2.58 121.76 113.41 1cdb s ALA 6 Ca 0.45 -1.36 -0.03 0.00 0.00 0.00 0.00 51.96 51.02 1cdb s ALA 6 Cb 0.30 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 23.02 1cdb s ALA 6 CO -0.22 0.50 -0.07 -0.51 0.00 0.00 0.00 175.76 175.46 1cdb s LEU 7 N -1.81 3.03 -0.68 0.00 1.43 -1.12 -4.94 118.68 114.59 1cdb s LEU 7 Ca 0.12 -0.23 -0.27 0.00 -1.03 0.00 0.00 54.13 52.72 1cdb s LEU 7 Cb -0.10 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.42 1cdb s LEU 7 CO 0.05 0.15 1.34 -1.83 0.23 0.00 0.00 176.35 176.28 1cdb s GLU 8 N 0.49 3.20 -0.43 1.70 -1.05 -1.26 -2.44 118.70 118.90 1cdb s GLU 8 Ca -0.05 0.01 -0.06 0.00 -0.15 0.00 0.00 54.97 54.72 1cdb s GLU 8 Cb -0.15 -4.17 0.11 0.00 -0.44 0.00 0.00 34.13 29.49 1cdb s GLU 8 CO 0.03 -2.11 0.26 0.99 0.95 0.00 0.00 175.26 175.39 1cdb s THR 9 N 5.99 3.72 0.07 1.83 2.01 -0.87 -5.02 115.64 123.38 1cdb s THR 9 Ca 0.42 -1.90 0.02 0.00 0.31 0.00 0.00 61.69 60.54 1cdb s THR 9 Cb -0.09 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 1cdb s THR 9 CO 0.18 -0.71 0.12 0.26 -0.69 0.00 0.00 174.62 173.79 1cdb s TRP 10 N 1.25 3.30 -0.14 4.92 0.52 -1.26 -2.26 118.94 125.27 1cdb s TRP 10 Ca 0.07 0.13 -0.30 0.00 0.02 0.00 0.00 56.10 56.02 1cdb s TRP 10 Cb -0.24 -1.67 0.11 0.00 -1.15 0.00 0.00 33.47 30.52 1cdb s TRP 10 CO -0.02 0.54 0.90 0.20 0.02 0.00 0.00 176.95 178.59 1cdb s GLY 11 N -2.43 -0.36 0.13 0.98 0.00 -1.19 -4.98 107.32 99.47 1cdb s GLY 11 Ca 0.31 1.86 -0.25 0.00 0.00 0.00 0.00 44.72 46.64 1cdb s GLY 11 CO 0.24 1.09 0.78 0.00 0.00 0.00 0.00 173.10 175.21 1cdb s ALA 12 N -1.00 3.42 0.50 3.20 0.00 -1.26 -2.53 121.76 124.09 1cdb s ALA 12 Ca -0.04 0.35 -0.23 0.00 0.00 0.00 0.00 51.96 52.04 1cdb s ALA 12 Cb -0.01 -2.99 -0.06 0.00 0.00 0.00 0.00 23.12 20.06 1cdb s ALA 12 CO 0.04 0.21 1.36 -0.48 0.00 0.00 0.00 175.76 176.89 1cdb s LEU 13 N -0.79 3.98 -0.15 0.00 0.05 -1.26 -4.26 118.68 116.25 1cdb s LEU 13 Ca 0.37 2.78 -0.01 0.00 0.05 0.00 0.00 54.13 57.32 1cdb s LEU 13 Cb -0.22 -4.13 -0.01 0.00 -2.05 0.00 0.00 46.19 39.78 1cdb s LEU 13 CO 0.26 -1.33 0.13 0.61 -0.55 0.00 0.00 176.35 175.47 1cdb n GLY 14 N 0.65 0.13 3.47 -3.48 0.00 -1.26 -4.83 105.19 99.87 1cdb n GLY 14 Ca 0.08 -0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 1cdb n GLY 14 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1cdb s GLN 15 N -3.12 0.93 0.11 1.61 0.74 -1.26 -4.81 119.66 113.85 1cdb s GLN 15 Ca 0.04 0.29 -0.29 0.00 0.05 0.00 0.00 55.36 55.45 1cdb s GLN 15 Cb -0.01 0.44 -0.06 0.00 1.10 0.00 0.00 33.01 34.48 1cdb s GLN 15 CO 0.12 -0.26 0.93 -0.51 -0.55 0.00 0.00 175.29 175.02 1cdb s ASP 16 N -0.93 7.46 0.06 6.67 1.11 -1.26 -1.69 116.67 128.09 1cdb s ASP 16 Ca -0.09 1.75 0.01 0.00 0.18 0.00 0.00 52.55 54.39 1cdb s ASP 16 Cb -0.02 -2.57 -0.03 0.00 1.07 0.00 0.00 42.92 41.37 1cdb s ASP 16 CO 0.07 -0.04 -0.06 -0.63 1.18 0.00 0.00 175.17 175.70 1cdb s ILE 17 N -0.08 0.47 -0.06 0.77 -1.09 -0.87 -4.96 121.20 115.37 1cdb s ILE 17 Ca 0.45 -1.49 0.02 0.00 -2.23 0.00 0.00 60.65 57.40 1cdb s ILE 17 Cb -0.23 -1.11 0.01 0.00 -1.58 0.00 0.00 42.46 39.55 1cdb s ILE 17 CO 0.29 -0.69 -0.12 0.20 -1.23 0.00 0.00 174.94 173.38 1cdb s ASN 18 N -2.33 1.78 -0.49 3.58 -0.87 -1.26 -1.61 114.94 113.74 1cdb s ASN 18 Ca 0.00 -0.30 -0.18 0.00 -1.57 0.00 0.00 52.86 50.81 1cdb s ASN 18 Cb -0.01 -0.81 0.05 0.00 -0.02 0.00 0.00 41.25 40.46 1cdb s ASN 18 CO -0.04 0.04 0.56 -0.76 -2.57 0.00 0.00 177.10 174.33 1cdb s LEU 19 N 0.64 5.06 -0.19 0.60 2.01 -0.22 -4.90 118.68 121.68 1cdb s LEU 19 Ca -0.14 -0.94 -0.08 0.00 0.01 0.00 0.00 54.13 52.98 1cdb s LEU 19 Cb -0.16 -2.40 0.08 0.00 0.01 0.00 0.00 46.19 43.73 1cdb s LEU 19 CO 0.04 -0.80 0.42 1.51 1.01 0.00 0.00 176.35 178.53 1cdb s ASP 20 N 2.53 -0.33 -0.45 2.29 -4.77 -1.26 -0.95 116.67 113.74 1cdb s ASP 20 Ca 0.13 0.99 0.07 0.00 -3.30 0.00 0.00 52.55 50.43 1cdb s ASP 20 Cb -0.20 1.24 0.23 0.00 -1.09 0.00 0.00 42.92 43.11 1cdb s ASP 20 CO 0.11 -0.22 0.53 0.00 0.70 0.00 0.00 175.17 176.29 1cdb n ILE 21 N 5.14 -0.11 -1.91 2.11 0.13 -1.26 -5.06 119.36 118.40 1cdb n ILE 21 Ca -0.12 -4.18 -0.26 0.00 -1.10 0.00 0.00 62.75 57.09 1cdb n ILE 21 Cb 0.51 -1.95 0.18 0.00 -0.84 0.00 0.00 39.64 37.54 1cdb n ILE 21 CO 0.00 0.00 0.00 -0.81 2.80 0.00 0.00 176.55 178.54 1cdb n PRO 22 N 1.55 -1.07 -1.50 9.51 -0.04 -1.26 -4.88 135.00 137.32 1cdb n PRO 22 Ca 0.24 -1.93 0.00 0.00 -0.04 0.00 0.00 63.50 61.77 1cdb n PRO 22 Cb 0.49 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.77 1cdb n PRO 22 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1cdb n SER 23 N -3.70 -1.99 -4.96 3.54 2.88 -1.26 -5.12 113.62 103.01 1cdb n SER 23 Ca 0.15 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.47 1cdb n SER 23 Cb 0.53 -0.65 0.03 0.00 -0.75 0.00 0.00 64.21 63.37 1cdb n SER 23 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1cdb s PHE 24 N -3.00 2.98 -0.55 0.66 5.36 -1.26 -5.07 117.98 117.10 1cdb s PHE 24 Ca 0.00 0.15 -0.28 0.00 -0.96 0.00 0.00 56.93 55.83 1cdb s PHE 24 Cb 0.00 -2.70 0.02 0.00 -0.34 0.00 0.00 43.02 40.00 1cdb s PHE 24 CO 0.00 -0.81 1.33 -0.65 -1.46 0.00 0.00 175.22 173.63 1cdb s GLN 25 N -4.79 3.41 0.04 10.12 1.11 -1.26 -5.01 119.66 123.28 1cdb s GLN 25 Ca 0.55 0.44 -0.08 0.00 0.01 0.00 0.00 55.36 56.28 1cdb s GLN 25 Cb -0.10 -4.07 -0.05 0.00 -1.01 0.00 0.00 33.01 27.77 1cdb s GLN 25 CO 0.39 -1.80 0.33 -1.64 0.01 0.00 0.00 175.29 172.59 1cdb s MET 26 N 5.24 3.68 0.00 2.91 -1.94 -1.26 -5.09 119.30 122.83 1cdb s MET 26 Ca 0.50 0.06 0.00 0.00 -1.71 0.00 0.00 55.69 54.54 1cdb s MET 26 Cb -0.10 -3.06 0.00 0.00 2.01 0.00 0.00 34.83 33.69 1cdb s MET 26 CO 0.26 0.62 0.00 -1.13 -0.01 0.00 0.00 175.02 174.76 1cdb n SER 27 N 1.09 0.00 -2.97 3.03 3.41 -1.26 -5.02 113.62 111.90 1cdb n SER 27 Ca -0.10 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.36 1cdb n SER 27 Cb 0.53 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.46 1cdb n SER 27 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1cdb n ASP 28 N 0.00 -1.66 -3.00 4.04 2.03 -1.26 -5.07 116.55 111.63 1cdb n ASP 28 Ca 0.00 -2.96 0.01 0.00 0.52 0.00 0.00 54.79 52.36 1cdb n ASP 28 Cb 0.00 0.73 -0.00 0.00 -0.72 0.00 0.00 41.12 41.13 1cdb n ASP 28 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 1cdb s ASP 29 N -1.05 -1.03 -0.23 1.67 -4.77 -1.26 -5.06 116.67 104.94 1cdb s ASP 29 Ca 0.33 -0.57 -0.09 0.00 -3.30 0.00 0.00 52.55 48.92 1cdb s ASP 29 Cb 0.16 1.32 0.10 0.00 -1.09 0.00 0.00 42.92 43.41 1cdb s ASP 29 CO -0.17 -0.11 0.50 0.27 0.70 0.00 0.00 175.17 176.35 1cdb s ILE 30 N 1.83 -0.60 0.14 2.11 -5.25 -1.26 -4.46 121.20 113.70 1cdb s ILE 30 Ca 0.16 0.10 0.00 0.00 -0.99 0.00 0.00 60.65 59.93 1cdb s ILE 30 Cb -0.01 -0.77 0.00 0.00 2.95 0.00 0.00 42.46 44.64 1cdb s ILE 30 CO -0.10 0.04 0.00 -0.67 -1.79 0.00 0.00 174.94 172.42 1cdb n ASP 31 N 5.17 -0.65 -4.78 4.36 2.03 -1.25 -4.78 116.55 116.66 1cdb n ASP 31 Ca -0.12 0.25 -0.36 0.00 0.52 0.00 0.00 54.79 55.08 1cdb n ASP 31 Cb 0.51 0.77 -0.07 0.00 -0.72 0.00 0.00 41.12 41.60 1cdb n ASP 31 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1cdb s ASP 32 N -3.90 6.15 -0.03 1.67 1.01 -0.75 -4.85 116.67 115.97 1cdb s ASP 32 Ca 0.00 0.31 0.01 0.00 0.71 0.00 0.00 52.55 53.57 1cdb s ASP 32 Cb 0.00 -2.03 0.02 0.00 1.01 0.00 0.00 42.92 41.92 1cdb s ASP 32 CO 0.00 0.29 -0.02 -0.63 0.21 0.00 0.00 175.17 175.02 1cdb s ILE 33 N -0.30 0.29 -0.03 0.77 1.09 -1.10 -2.18 121.20 119.74 1cdb s ILE 33 Ca 0.11 -0.02 0.02 0.00 -1.10 0.00 0.00 60.65 59.66 1cdb s ILE 33 Cb -0.12 -0.35 0.01 0.00 -1.06 0.00 0.00 42.46 40.95 1cdb s ILE 33 CO 0.01 0.15 -0.07 -0.75 -0.10 0.00 0.00 174.94 174.18 1cdb s LYS 34 N 0.78 0.92 -0.11 2.79 2.36 -1.00 -1.63 119.74 123.85 1cdb s LYS 34 Ca -0.09 -0.24 -0.01 0.00 -2.55 0.00 0.00 55.97 53.09 1cdb s LYS 34 Cb -0.12 -0.87 0.03 0.00 -1.05 0.00 0.00 37.83 35.83 1cdb s LYS 34 CO -0.01 0.05 -0.03 -1.58 1.55 0.00 0.00 175.35 175.32 1cdb s TRP 35 N 0.42 1.15 0.05 4.03 0.52 -0.96 -2.55 118.94 121.60 1cdb s TRP 35 Ca -0.06 -0.57 0.01 0.00 0.02 0.00 0.00 56.10 55.50 1cdb s TRP 35 Cb -0.10 -1.06 -0.03 0.00 -1.15 0.00 0.00 33.47 31.13 1cdb s TRP 35 CO 0.01 -0.46 -0.06 -2.00 0.02 0.00 0.00 176.95 174.45 1cdb s GLU 36 N 1.82 0.55 0.45 4.98 2.12 -1.08 -2.78 118.70 124.75 1cdb s GLU 36 Ca 0.04 -0.91 -0.22 0.00 0.36 0.00 0.00 54.97 54.25 1cdb s GLU 36 Cb -0.13 -0.12 -0.09 0.00 0.26 0.00 0.00 34.13 34.05 1cdb s GLU 36 CO -0.07 -0.01 1.02 0.21 -0.54 0.00 0.00 175.26 175.87 1cdb s LYS 37 N -2.34 4.00 0.06 4.30 2.20 -0.02 -0.83 119.74 127.11 1cdb s LYS 37 Ca -0.04 1.35 -0.18 0.00 -0.36 0.00 0.00 55.97 56.73 1cdb s LYS 37 Cb -0.04 -2.25 -0.13 0.00 -1.51 0.00 0.00 37.83 33.90 1cdb s LYS 37 CO -0.02 -0.25 1.35 1.79 -0.36 0.00 0.00 175.35 177.85 1cdb h THR 38 N 1.83 1.34 0.87 3.43 1.35 -1.79 -3.21 112.91 116.72 1cdb h THR 38 Ca -0.49 -1.41 -0.04 0.00 -0.55 0.00 0.00 66.41 63.91 1cdb h THR 38 Cb 1.21 1.82 0.01 0.00 -1.73 0.00 0.00 68.15 69.46 1cdb h THR 38 CO 0.60 0.43 -0.42 0.28 -0.25 0.00 0.00 175.52 176.16 1cdb h SER 39 N 0.14 -0.99 -0.03 5.36 0.02 -1.95 -3.35 113.55 112.75 1cdb h SER 39 Ca 0.02 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 1cdb h SER 39 Cb 0.78 0.26 -0.10 0.00 0.14 0.00 0.00 62.40 63.48 1cdb h SER 39 CO 0.05 -0.66 -0.63 -0.67 -1.14 0.00 0.00 176.83 173.79 1cdb n ASP 40 N -5.44 1.65 -3.04 3.07 2.03 -1.26 -5.05 116.55 108.50 1cdb n ASP 40 Ca -0.15 -3.49 -0.01 0.00 0.52 0.00 0.00 54.79 51.67 1cdb n ASP 40 Cb 0.46 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 1cdb n ASP 40 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1cdb n LYS 41 N -0.76 -1.34 -3.51 -0.67 5.02 -1.21 -5.00 118.16 110.69 1cdb n LYS 41 Ca 0.17 1.46 -0.42 0.00 -2.02 0.00 0.00 58.31 57.50 1cdb n LYS 41 Cb 0.80 -5.71 -0.10 0.00 -0.02 0.00 0.00 35.03 30.00 1cdb n LYS 41 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1cdb s LYS 42 N -3.06 2.84 -0.68 1.97 2.20 -1.24 -4.87 119.74 116.91 1cdb s LYS 42 Ca 0.02 -1.26 -0.27 0.00 -0.36 0.00 0.00 55.97 54.10 1cdb s LYS 42 Cb -0.00 -3.91 0.01 0.00 -1.51 0.00 0.00 37.83 32.42 1cdb s LYS 42 CO 0.74 -0.88 1.51 0.15 -0.36 0.00 0.00 175.35 176.51 1cdb s LYS 43 N 1.57 2.99 -0.03 4.03 1.02 -1.26 -0.84 119.74 127.21 1cdb s LYS 43 Ca 0.03 0.13 -0.03 0.00 0.02 0.00 0.00 55.97 56.12 1cdb s LYS 43 Cb -0.22 -4.25 -0.02 0.00 -0.52 0.00 0.00 37.83 32.82 1cdb s LYS 43 CO 0.06 -2.35 0.26 0.82 -0.92 0.00 0.00 175.35 173.22 1cdb h ILE 44 N 6.38 0.00 -3.76 2.17 5.03 -1.94 -3.49 117.51 121.89 1cdb h ILE 44 Ca -0.27 -0.33 -0.08 0.00 -0.12 0.00 0.00 64.86 64.06 1cdb h ILE 44 Cb 1.10 0.00 -0.11 0.00 -3.03 0.00 0.00 36.82 34.77 1cdb h ILE 44 CO 1.25 0.00 -0.23 0.00 -0.68 0.00 0.00 178.15 178.49 1cdb s ALA 45 N -3.11 -0.17 -0.26 1.87 0.00 -1.12 -3.43 121.76 115.53 1cdb s ALA 45 Ca -0.02 -0.80 -0.24 0.00 0.00 0.00 0.00 51.96 50.90 1cdb s ALA 45 Cb 0.00 0.92 0.07 0.00 0.00 0.00 0.00 23.12 24.11 1cdb s ALA 45 CO 0.05 -0.72 0.70 -1.14 0.00 0.00 0.00 175.76 174.66 1cdb s GLN 46 N -3.97 0.82 -0.16 0.00 0.74 -0.68 -2.28 119.66 114.13 1cdb s GLN 46 Ca 0.18 0.97 -0.05 0.00 0.05 0.00 0.00 55.36 56.51 1cdb s GLN 46 Cb 0.02 0.40 -0.03 0.00 1.10 0.00 0.00 33.01 34.49 1cdb s GLN 46 CO 0.02 -0.10 0.00 -0.06 -0.55 0.00 0.00 175.29 174.60 1cdb s PHE 47 N 0.37 3.12 0.05 1.67 0.40 -0.65 -2.36 117.98 120.58 1cdb s PHE 47 Ca -0.00 -0.14 0.00 0.00 -0.60 0.00 0.00 56.93 56.20 1cdb s PHE 47 Cb -0.05 -2.00 -0.03 0.00 0.51 0.00 0.00 43.02 41.45 1cdb s PHE 47 CO 0.01 0.06 -0.04 1.03 0.70 0.00 0.00 175.22 176.98 1cdb s ARG 48 N 0.31 0.54 -0.91 0.44 0.52 -1.26 -2.71 118.95 115.88 1cdb s ARG 48 Ca -0.01 -1.00 -0.08 0.00 -0.52 0.00 0.00 55.73 54.12 1cdb s ARG 48 Cb -0.13 0.06 0.23 0.00 0.52 0.00 0.00 34.95 35.63 1cdb s ARG 48 CO 0.02 -0.06 0.84 0.15 0.02 0.00 0.00 175.30 176.27 1cdb s LYS 49 N -2.90 3.59 -0.31 3.54 -0.14 -1.26 -4.75 119.74 117.51 1cdb s LYS 49 Ca -0.01 -2.93 -0.13 0.00 -1.36 0.00 0.00 55.97 51.54 1cdb s LYS 49 Cb 0.00 -4.26 0.19 0.00 -1.68 0.00 0.00 37.83 32.08 1cdb s LYS 49 CO -0.05 -1.25 1.11 -1.83 -0.76 0.00 0.00 175.35 172.57 1cdb s GLU 50 N -0.73 0.08 0.15 1.68 1.03 -1.26 -5.13 118.70 114.53 1cdb s GLU 50 Ca 0.24 0.02 0.00 0.00 0.03 0.00 0.00 54.97 55.26 1cdb s GLU 50 Cb -0.11 0.02 0.00 0.00 -0.80 0.00 0.00 34.13 33.24 1cdb s GLU 50 CO -0.09 -0.14 0.00 1.63 -1.33 0.00 0.00 175.26 175.34 1cdb n LYS 51 N 4.36 -4.82 -2.49 -4.83 5.02 -1.26 -4.97 118.16 109.17 1cdb n LYS 51 Ca 0.08 3.41 -0.05 0.00 -2.02 0.00 0.00 58.31 59.73 1cdb n LYS 51 Cb 0.61 -3.87 -0.04 0.00 -0.02 0.00 0.00 35.03 31.71 1cdb n LYS 51 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1cdb n GLU 52 N 1.91 -4.16 -2.57 1.97 1.02 -1.26 -4.99 120.64 112.56 1cdb n GLU 52 Ca 0.00 3.18 -0.38 0.00 -0.02 0.00 0.00 57.16 59.95 1cdb n GLU 52 Cb 0.00 -4.71 -0.05 0.00 -0.02 0.00 0.00 31.44 26.67 1cdb n GLU 52 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1cdb s THR 53 N -0.63 3.75 -0.36 2.62 2.01 -1.26 -4.97 115.64 116.80 1cdb s THR 53 Ca -0.26 1.48 -0.26 0.00 0.31 0.00 0.00 61.69 62.96 1cdb s THR 53 Cb 0.02 -3.83 0.01 0.00 0.01 0.00 0.00 72.50 68.71 1cdb s THR 53 CO 0.72 0.14 0.93 0.12 -0.69 0.00 0.00 174.62 175.85 1cdb s PHE 54 N -1.50 3.09 -0.02 4.92 5.36 -1.00 -5.02 117.98 123.80 1cdb s PHE 54 Ca 0.52 0.81 -0.01 0.00 -0.96 0.00 0.00 56.93 57.30 1cdb s PHE 54 Cb -0.24 -3.63 0.02 0.00 -0.34 0.00 0.00 43.02 38.83 1cdb s PHE 54 CO 0.31 -0.81 0.05 0.15 -1.46 0.00 0.00 175.22 173.45 1cdb s LYS 55 N 3.47 -0.00 -0.09 10.12 1.02 -1.26 -1.69 119.74 131.30 1cdb s LYS 55 Ca 0.39 0.18 -0.13 0.00 0.02 0.00 0.00 55.97 56.43 1cdb s LYS 55 Cb -0.12 -0.17 -0.10 0.00 -0.52 0.00 0.00 37.83 36.91 1cdb s LYS 55 CO 0.18 -0.13 0.43 1.49 -0.92 0.00 0.00 175.35 176.41 1cdb h GLU 56 N 7.00 -0.11 -3.40 1.68 4.57 -1.91 -3.49 114.58 118.92 1cdb h GLU 56 Ca -0.40 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 1cdb h GLU 56 Cb 1.14 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.75 1cdb h GLU 56 CO 0.47 0.23 -0.22 1.17 -1.18 0.00 0.00 179.01 179.48 1cdb n LYS 57 N -4.81 -0.73 0.00 1.92 4.81 -1.26 -5.03 118.16 113.05 1cdb n LYS 57 Ca -0.05 0.98 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 1cdb n LYS 57 Cb 0.19 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.42 1cdb n LYS 57 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1cdb n ASP 58 N 0.19 0.00 -2.85 3.14 9.92 -1.26 -4.70 116.55 120.99 1cdb n ASP 58 Ca -0.02 0.00 -0.32 0.00 -0.53 0.00 0.00 54.79 53.92 1cdb n ASP 58 Cb 0.04 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.52 1cdb n ASP 58 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1cdb n THR 59 N 0.00 3.33 -3.00 -3.53 -2.24 -1.26 -5.02 114.28 102.56 1cdb n THR 59 Ca 0.00 -5.12 -0.41 0.00 -2.27 0.00 0.00 64.05 56.26 1cdb n THR 59 Cb 0.00 -1.34 -0.05 0.00 -2.10 0.00 0.00 70.33 66.85 1cdb n THR 59 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1cdb s TYR 60 N -3.75 3.45 -0.30 4.78 1.51 -1.25 -2.67 117.35 119.11 1cdb s TYR 60 Ca 0.48 1.16 -0.02 0.00 -1.01 0.00 0.00 57.07 57.68 1cdb s TYR 60 Cb 0.35 -2.90 0.12 0.00 -0.11 0.00 0.00 41.96 39.42 1cdb s TYR 60 CO -0.22 -0.13 0.22 0.15 -1.11 0.00 0.00 175.55 174.46 1cdb s LYS 61 N 1.72 0.31 -1.15 -0.62 1.02 -0.90 -4.37 119.74 115.75 1cdb s LYS 61 Ca 0.35 -0.47 -0.20 0.00 0.02 0.00 0.00 55.97 55.67 1cdb s LYS 61 Cb -0.17 -0.93 0.07 0.00 -0.52 0.00 0.00 37.83 36.28 1cdb s LYS 61 CO 0.13 -1.06 1.55 -0.51 -0.92 0.00 0.00 175.35 174.55 1cdb s LEU 62 N 2.06 3.87 0.73 3.17 1.43 -1.26 -2.39 118.68 126.28 1cdb s LEU 62 Ca 0.11 -2.03 -0.14 0.00 -1.03 0.00 0.00 54.13 51.03 1cdb s LEU 62 Cb -0.16 -2.55 0.04 0.00 0.03 0.00 0.00 46.19 43.55 1cdb s LEU 62 CO -0.29 -1.28 1.17 0.12 0.23 0.00 0.00 176.35 176.30 1cdb s PHE 63 N 4.25 2.19 0.20 0.29 5.36 0.21 -4.73 117.98 125.74 1cdb s PHE 63 Ca 0.48 1.60 -0.09 0.00 -0.96 0.00 0.00 56.93 57.97 1cdb s PHE 63 Cb 0.01 -3.36 0.11 0.00 -0.34 0.00 0.00 43.02 39.44 1cdb s PHE 63 CO -0.02 -2.34 1.71 -0.22 -1.46 0.00 0.00 175.22 172.89 1cdb h LYS 64 N -0.39 1.13 -0.70 10.12 3.64 -1.89 -3.12 116.57 125.36 1cdb h LYS 64 Ca -0.47 -0.28 0.14 0.00 -1.27 0.00 0.00 60.65 58.77 1cdb h LYS 64 Cb 1.28 -0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 32.85 1cdb h LYS 64 CO 0.50 1.01 0.20 -0.97 -2.27 0.00 0.00 179.45 177.91 1cdb h ASN 65 N 1.06 0.09 0.00 4.20 -0.73 -1.93 -3.46 115.58 114.80 1cdb h ASN 65 Ca 0.22 0.13 0.00 0.00 1.87 0.00 0.00 56.30 58.51 1cdb h ASN 65 Cb 0.39 0.15 0.00 0.00 0.27 0.00 0.00 38.32 39.14 1cdb h ASN 65 CO 0.01 0.02 0.00 0.61 -0.37 0.00 0.00 177.43 177.69 1cdb n GLY 66 N -1.33 -0.70 3.55 1.57 0.00 -1.20 -4.88 105.19 102.20 1cdb n GLY 66 Ca 0.13 0.02 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1cdb n GLY 66 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cdb s THR 67 N 0.00 0.00 -0.29 2.61 2.01 -1.18 -3.98 115.64 114.81 1cdb s THR 67 Ca 0.00 -1.47 0.02 0.00 0.31 0.00 0.00 61.69 60.55 1cdb s THR 67 Cb 0.00 -2.59 0.17 0.00 0.01 0.00 0.00 72.50 70.09 1cdb s THR 67 CO 0.00 0.00 0.50 -0.22 -0.69 0.00 0.00 174.62 174.21 1cdb s LEU 68 N -3.17 -1.15 -0.17 4.42 0.20 -0.12 -0.62 118.68 118.07 1cdb s LEU 68 Ca 0.27 0.10 -0.29 0.00 0.69 0.00 0.00 54.13 54.90 1cdb s LEU 68 Cb -0.01 1.59 -0.00 0.00 -0.43 0.00 0.00 46.19 47.34 1cdb s LEU 68 CO 0.17 -0.31 1.00 -0.75 -0.29 0.00 0.00 176.35 176.17 1cdb s LYS 69 N 2.69 4.33 -0.25 1.98 2.20 -1.01 -1.05 119.74 128.63 1cdb s LYS 69 Ca 0.12 1.34 -0.09 0.00 -0.36 0.00 0.00 55.97 56.98 1cdb s LYS 69 Cb -0.12 -3.59 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 1cdb s LYS 69 CO -0.25 -0.47 0.13 0.42 -0.36 0.00 0.00 175.35 174.82 1cdb s ILE 70 N 2.59 4.90 -0.51 5.43 1.01 -0.64 -2.12 121.20 131.86 1cdb s ILE 70 Ca 0.45 0.03 -0.17 0.00 0.00 0.00 0.00 60.65 60.95 1cdb s ILE 70 Cb -0.17 -3.30 0.08 0.00 0.01 0.00 0.00 42.46 39.08 1cdb s ILE 70 CO 0.12 0.31 0.54 -0.54 0.00 0.00 0.00 174.94 175.37 1cdb s LYS 71 N 1.50 3.04 0.00 2.79 1.02 -1.09 -2.05 119.74 124.96 1cdb s LYS 71 Ca 0.06 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 54.85 1cdb s LYS 71 Cb -0.15 -4.16 0.00 0.00 -0.52 0.00 0.00 37.83 33.00 1cdb s LYS 71 CO 0.07 -1.21 0.00 0.72 -0.92 0.00 0.00 175.35 174.00 1cdb n HIS 72 N 5.75 0.00 -0.76 3.18 8.25 -1.21 -4.45 115.22 125.98 1cdb n HIS 72 Ca -0.10 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.35 1cdb n HIS 72 Cb 0.44 -1.01 0.30 0.00 1.12 0.00 0.00 29.99 30.84 1cdb n HIS 72 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 1cdb n LEU 73 N 0.00 5.52 -4.18 2.41 -0.00 -0.68 -4.78 117.00 115.29 1cdb n LEU 73 Ca 0.00 -2.85 -0.37 0.00 -0.00 0.00 0.00 56.01 52.79 1cdb n LEU 73 Cb 0.00 -0.70 0.04 0.00 -0.00 0.00 0.00 43.42 42.75 1cdb n LEU 73 CO 0.00 0.70 -0.82 2.29 -0.00 0.00 0.00 177.39 179.55 1cdb n LYS 74 N 0.14 0.03 -0.36 1.47 2.85 -1.26 -4.45 118.16 116.58 1cdb n LYS 74 Ca 0.32 0.02 -0.02 0.00 -1.05 0.00 0.00 58.31 57.59 1cdb n LYS 74 Cb 1.22 -1.16 0.11 0.00 -0.65 0.00 0.00 35.03 34.55 1cdb n LYS 74 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1cdb h THR 75 N -0.58 1.21 0.00 0.58 2.02 -1.95 -0.19 112.91 114.00 1cdb h THR 75 Ca -0.43 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1cdb h THR 75 Cb 1.36 -0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1cdb h THR 75 CO 0.33 0.23 -0.35 -0.67 0.37 0.00 0.00 175.52 175.43 1cdb n ASP 76 N -4.44 0.42 -0.04 4.18 2.03 -1.26 -3.85 116.55 113.59 1cdb n ASP 76 Ca 0.12 0.08 0.00 0.00 0.52 0.00 0.00 54.79 55.51 1cdb n ASP 76 Cb 0.05 -0.04 0.30 0.00 -0.72 0.00 0.00 41.12 40.70 1cdb n ASP 76 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1cdb h ASP 77 N 0.00 0.57 -1.26 1.67 5.19 -1.34 -3.48 116.42 117.76 1cdb h ASP 77 Ca 0.00 -0.08 -0.63 0.00 -0.62 0.00 0.00 57.03 55.70 1cdb h ASP 77 Cb 0.56 -0.15 -0.12 0.00 0.18 0.00 0.00 39.33 39.81 1cdb h ASP 77 CO 0.00 0.55 -0.55 0.00 -3.12 0.00 0.00 179.24 176.13 1cdb s GLN 78 N -5.20 2.08 0.33 3.56 1.03 -1.05 -4.96 119.66 115.45 1cdb s GLN 78 Ca -0.08 -2.13 -0.14 0.00 0.04 0.00 0.00 55.36 53.04 1cdb s GLN 78 Cb 0.16 -1.70 0.03 0.00 0.03 0.00 0.00 33.01 31.53 1cdb s GLN 78 CO 0.77 -0.17 0.66 0.34 -2.54 0.00 0.00 175.29 174.35 1cdb s ASP 79 N -3.82 0.09 0.41 12.60 2.15 -1.26 -5.00 116.67 121.83 1cdb s ASP 79 Ca 0.28 -1.04 -0.21 0.00 0.43 0.00 0.00 52.55 52.01 1cdb s ASP 79 Cb 0.06 0.74 -0.11 0.00 -0.30 0.00 0.00 42.92 43.32 1cdb s ASP 79 CO 0.15 -1.44 0.94 -0.63 -0.17 0.00 0.00 175.17 174.01 1cdb s ILE 80 N -3.13 4.38 0.19 4.11 1.01 -1.26 -1.73 121.20 124.76 1cdb s ILE 80 Ca 0.18 1.51 -0.00 0.00 0.00 0.00 0.00 60.65 62.34 1cdb s ILE 80 Cb -0.04 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 1cdb s ILE 80 CO 0.11 -0.24 0.10 -0.31 0.00 0.00 0.00 174.94 174.61 1cdb s TYR 81 N -2.07 1.16 -0.30 3.97 2.02 -0.98 -4.24 117.35 116.91 1cdb s TYR 81 Ca 0.60 -1.29 -0.12 0.00 -0.37 0.00 0.00 57.07 55.89 1cdb s TYR 81 Cb -0.11 -0.61 0.13 0.00 -0.40 0.00 0.00 41.96 40.97 1cdb s TYR 81 CO 0.15 -0.53 0.71 0.21 -1.57 0.00 0.00 175.55 174.52 1cdb s LYS 82 N -4.10 0.55 -0.02 -0.62 2.36 -0.01 -1.99 119.74 115.92 1cdb s LYS 82 Ca 0.34 1.30 -0.17 0.00 -2.55 0.00 0.00 55.97 54.89 1cdb s LYS 82 Cb 0.07 0.68 -0.05 0.00 -1.05 0.00 0.00 37.83 37.48 1cdb s LYS 82 CO 0.09 -0.17 0.47 0.54 1.55 0.00 0.00 175.35 177.83 1cdb s VAL 83 N 2.59 5.00 0.04 4.02 0.11 -0.53 -2.64 120.40 128.99 1cdb s VAL 83 Ca -0.06 0.97 0.08 0.00 -2.93 0.00 0.00 61.98 60.04 1cdb s VAL 83 Cb -0.10 -3.79 -0.03 0.00 -1.53 0.00 0.00 36.38 30.93 1cdb s VAL 83 CO -0.19 0.50 -0.22 -0.44 -3.33 0.00 0.00 175.10 171.42 1cdb s SER 84 N -0.58 3.49 -0.17 3.54 0.01 -1.06 -2.60 113.70 116.33 1cdb s SER 84 Ca 0.26 -0.50 0.01 0.00 1.31 0.00 0.00 55.95 57.02 1cdb s SER 84 Cb -0.17 -0.46 0.01 0.00 0.21 0.00 0.00 66.02 65.61 1cdb s SER 84 CO 0.14 0.26 -0.18 -0.63 0.41 0.00 0.00 173.24 173.24 1cdb s ILE 85 N -0.85 2.32 0.01 1.44 1.09 -0.69 -2.37 121.20 122.14 1cdb s ILE 85 Ca 0.13 -0.87 0.08 0.00 -1.10 0.00 0.00 60.65 58.90 1cdb s ILE 85 Cb -0.10 -1.98 -0.02 0.00 -1.06 0.00 0.00 42.46 39.30 1cdb s ILE 85 CO 0.03 0.52 -0.25 -0.31 -0.10 0.00 0.00 174.94 174.84 1cdb s TYR 86 N 1.11 2.24 0.00 3.97 2.02 -0.93 -1.01 117.35 124.74 1cdb s TYR 86 Ca 0.00 -0.42 0.00 0.00 -0.37 0.00 0.00 57.07 56.29 1cdb s TYR 86 Cb -0.14 -1.40 0.00 0.00 -0.40 0.00 0.00 41.96 40.02 1cdb s TYR 86 CO -0.07 0.03 0.00 -0.40 -1.57 0.00 0.00 175.55 173.54 1cdb n ASP 87 N 2.17 -0.55 -0.27 2.29 5.68 -1.07 -1.81 116.55 122.99 1cdb n ASP 87 Ca -0.16 -0.43 0.03 0.00 -0.50 0.00 0.00 54.79 53.72 1cdb n ASP 87 Cb 0.52 0.00 0.24 0.00 -1.14 0.00 0.00 41.12 40.74 1cdb n ASP 87 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1cdb h THR 88 N -1.09 1.12 -0.22 2.12 1.35 -1.86 -2.87 112.91 111.45 1cdb h THR 88 Ca 0.00 -0.35 -0.09 0.00 -0.55 0.00 0.00 66.41 65.41 1cdb h THR 88 Cb 0.00 -0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.40 1cdb h THR 88 CO 0.00 0.19 -0.26 0.11 -0.25 0.00 0.00 175.52 175.30 1cdb h LYS 89 N 1.03 0.43 -1.11 4.72 1.57 -1.97 -3.49 116.57 117.75 1cdb h LYS 89 Ca 0.35 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1cdb h LYS 89 Cb 0.08 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1cdb h LYS 89 CO -0.11 0.66 0.00 0.41 -0.57 0.00 0.00 179.45 179.84 1cdb n GLY 90 N -0.39 0.50 3.19 3.86 0.00 -1.08 -5.14 105.19 106.13 1cdb n GLY 90 Ca -0.01 -0.56 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 1cdb n GLY 90 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1cdb s LYS 91 N -2.37 0.29 0.31 1.61 2.20 -1.26 -4.94 119.74 115.58 1cdb s LYS 91 Ca 0.00 0.86 -0.29 0.00 -0.36 0.00 0.00 55.97 56.18 1cdb s LYS 91 Cb 0.00 0.12 -0.11 0.00 -1.51 0.00 0.00 37.83 36.33 1cdb s LYS 91 CO 0.00 -0.23 1.45 1.21 -0.36 0.00 0.00 175.35 177.43 1cdb s ASN 92 N 2.14 6.54 0.00 1.43 3.84 -1.26 -2.59 114.94 125.03 1cdb s ASN 92 Ca -0.04 2.83 0.00 0.00 0.21 0.00 0.00 52.86 55.87 1cdb s ASN 92 Cb -0.11 -2.64 0.00 0.00 -0.55 0.00 0.00 41.25 37.95 1cdb s ASN 92 CO -0.11 -0.75 0.00 0.52 -2.79 0.00 0.00 177.10 173.96 1cdb n VAL 93 N 1.44 0.00 -4.13 -5.21 0.31 -0.18 -4.95 118.33 105.61 1cdb n VAL 93 Ca 0.04 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.06 1cdb n VAL 93 Cb 0.40 -0.17 -0.08 0.00 -0.91 0.00 0.00 33.84 33.08 1cdb n VAL 93 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1cdb s LEU 94 N -0.75 3.52 -0.07 7.52 1.02 -1.24 -4.99 118.68 123.69 1cdb s LEU 94 Ca 0.00 -0.13 -0.01 0.00 0.02 0.00 0.00 54.13 54.00 1cdb s LEU 94 Cb 0.00 -2.22 0.03 0.00 0.02 0.00 0.00 46.19 44.02 1cdb s LEU 94 CO 0.00 0.18 0.00 -1.61 0.02 0.00 0.00 176.35 174.95 1cdb s GLU 95 N -2.25 0.56 0.31 1.70 2.02 -1.26 -1.71 118.70 118.07 1cdb s GLU 95 Ca 0.26 0.12 0.07 0.00 0.02 0.00 0.00 54.97 55.44 1cdb s GLU 95 Cb -0.12 -0.92 -0.06 0.00 0.10 0.00 0.00 34.13 33.13 1cdb s GLU 95 CO 0.18 -0.30 -0.06 0.15 0.02 0.00 0.00 175.26 175.26 1cdb s LYS 96 N 1.94 1.66 0.10 1.61 3.01 -1.07 -5.04 119.74 121.95 1cdb s LYS 96 Ca 0.04 -1.86 0.07 0.00 -1.01 0.00 0.00 55.97 53.22 1cdb s LYS 96 Cb -0.12 -1.32 -0.03 0.00 -1.01 0.00 0.00 37.83 35.34 1cdb s LYS 96 CO -0.05 0.05 -0.19 0.42 0.51 0.00 0.00 175.35 176.09 1cdb s ILE 97 N -2.90 1.58 0.22 2.17 1.01 -1.07 -1.45 121.20 120.76 1cdb s ILE 97 Ca 0.31 -1.54 -0.19 0.00 0.00 0.00 0.00 60.65 59.23 1cdb s ILE 97 Cb 0.04 -1.48 0.03 0.00 0.01 0.00 0.00 42.46 41.05 1cdb s ILE 97 CO 0.14 -0.14 0.59 -0.36 0.00 0.00 0.00 174.94 175.17 1cdb s PHE 98 N -1.33 -0.15 -0.29 3.97 0.08 -0.84 -2.80 117.98 116.62 1cdb s PHE 98 Ca 0.06 -0.21 -0.03 0.00 0.12 0.00 0.00 56.93 56.87 1cdb s PHE 98 Cb -0.09 0.50 0.17 0.00 -0.57 0.00 0.00 43.02 43.03 1cdb s PHE 98 CO 0.04 -1.02 0.59 -0.51 -0.10 0.00 0.00 175.22 174.22 1cdb s ASP 99 N -2.88 -1.21 0.07 1.36 1.11 -1.02 -2.33 116.67 111.76 1cdb s ASP 99 Ca 0.10 0.96 -0.30 0.00 0.18 0.00 0.00 52.55 53.49 1cdb s ASP 99 Cb -0.03 2.10 -0.05 0.00 1.07 0.00 0.00 42.92 46.01 1cdb s ASP 99 CO -0.00 -0.25 1.16 -0.76 1.18 0.00 0.00 175.17 176.49 1cdb s LEU 100 N 2.84 4.38 0.20 1.23 2.01 -0.71 -2.04 118.68 126.59 1cdb s LEU 100 Ca 0.15 1.98 0.09 0.00 0.01 0.00 0.00 54.13 56.35 1cdb s LEU 100 Cb -0.14 -3.58 -0.05 0.00 0.01 0.00 0.00 46.19 42.43 1cdb s LEU 100 CO -0.20 -0.41 -0.17 -0.54 1.01 0.00 0.00 176.35 176.03 1cdb s LYS 101 N 0.89 1.38 -0.18 1.70 1.02 -0.96 -4.41 119.74 119.19 1cdb s LYS 101 Ca 0.57 -1.55 -0.04 0.00 0.02 0.00 0.00 55.97 54.96 1cdb s LYS 101 Cb -0.28 -1.35 -0.02 0.00 -0.52 0.00 0.00 37.83 35.65 1cdb s LYS 101 CO 0.30 0.25 -0.02 0.42 -0.92 0.00 0.00 175.35 175.38 1cdb s ILE 102 N -2.47 3.89 0.03 2.17 -1.09 -1.26 -3.14 121.20 119.33 1cdb s ILE 102 Ca 0.21 -0.34 -0.30 0.00 -2.23 0.00 0.00 60.65 57.98 1cdb s ILE 102 Cb -0.04 -2.73 -0.07 0.00 -1.58 0.00 0.00 42.46 38.04 1cdb s ILE 102 CO 0.08 0.46 1.51 -1.10 -1.23 0.00 0.00 174.94 174.66 1cdb s GLN 103 N 0.72 4.25 -1.18 2.79 -0.21 -1.05 -4.92 119.66 120.05 1cdb s GLN 103 Ca -0.01 2.12 -0.04 0.00 0.02 0.00 0.00 55.36 57.45 1cdb s GLN 103 Cb -0.14 -3.57 0.23 0.00 1.00 0.00 0.00 33.01 30.52 1cdb s GLN 103 CO 0.02 -0.64 1.95 0.39 -2.12 0.00 0.00 175.29 174.90 1cdb n GLU 104 N 5.41 4.68 -0.70 2.91 1.02 -1.26 -4.81 120.64 127.88 1cdb n GLU 104 Ca 0.14 -4.06 0.00 0.00 -0.02 0.00 0.00 57.16 53.23 1cdb n GLU 104 Cb 0.42 -2.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.23 1cdb n GLU 104 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85