#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 3.09 0.16 1.64 0.41 -1.26 -5.03 118.70 117.71 1cdb s GLU 2 Ca 0.00 0.94 -0.30 0.00 -0.41 0.00 0.00 54.97 55.20 1cdb s GLU 2 Cb 0.00 -2.01 -0.07 0.00 -1.78 0.00 0.00 34.13 30.27 1cdb s GLU 2 CO 0.00 -0.98 1.07 0.42 -0.49 0.00 0.00 175.26 175.28 1cdb s ILE 3 N -3.02 4.00 0.59 -1.63 -1.09 -1.26 -5.02 121.20 113.78 1cdb s ILE 3 Ca 0.58 1.72 -0.18 0.00 -2.23 0.00 0.00 60.65 60.54 1cdb s ILE 3 Cb -0.14 -4.10 -0.03 0.00 -1.58 0.00 0.00 42.46 36.61 1cdb s ILE 3 CO 0.53 0.29 1.15 0.42 -1.23 0.00 0.00 174.94 176.10 1cdb s THR 4 N -0.20 3.02 -0.44 2.92 -4.23 -1.26 -5.02 115.64 110.43 1cdb s THR 4 Ca 0.49 0.59 0.07 0.00 -1.18 0.00 0.00 61.69 61.65 1cdb s THR 4 Cb -0.28 -3.18 0.23 0.00 1.34 0.00 0.00 72.50 70.61 1cdb s THR 4 CO 0.34 -0.19 0.65 -0.46 -0.54 0.00 0.00 174.62 174.42 1cdb n ASN 5 N -1.71 -1.41 -3.01 3.99 6.94 -1.26 -4.68 115.26 114.11 1cdb n ASN 5 Ca 0.12 -2.89 -0.32 0.00 -0.02 0.00 0.00 54.58 51.47 1cdb n ASN 5 Cb 0.51 0.52 -0.01 0.00 -2.36 0.00 0.00 39.78 38.43 1cdb n ASN 5 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1cdb n ALA 6 N 1.85 5.30 -3.35 -2.53 0.00 -0.36 -4.61 120.51 116.81 1cdb n ALA 6 Ca 0.18 -4.54 0.02 0.00 0.00 0.00 0.00 53.44 49.09 1cdb n ALA 6 Cb 0.56 -1.18 -0.04 0.00 0.00 0.00 0.00 19.45 18.80 1cdb n ALA 6 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1cdb s LEU 7 N -3.76 -0.52 -0.44 0.00 2.96 -0.81 -4.64 118.68 111.48 1cdb s LEU 7 Ca 0.47 0.67 -0.22 0.00 -0.22 0.00 0.00 54.13 54.83 1cdb s LEU 7 Cb 0.30 1.57 0.02 0.00 0.50 0.00 0.00 46.19 48.59 1cdb s LEU 7 CO -0.18 -0.10 0.70 -1.61 -1.32 0.00 0.00 176.35 173.84 1cdb s GLU 8 N 2.44 3.34 -0.19 1.98 0.41 -1.26 -1.39 118.70 124.04 1cdb s GLU 8 Ca -0.02 -0.25 -0.00 0.00 -0.41 0.00 0.00 54.97 54.29 1cdb s GLU 8 Cb -0.06 -3.94 0.01 0.00 -1.78 0.00 0.00 34.13 28.37 1cdb s GLU 8 CO -0.17 -1.04 -0.16 0.99 -0.49 0.00 0.00 175.26 174.39 1cdb s THR 9 N 2.99 2.37 -0.02 3.63 2.01 -0.95 -5.00 115.64 120.67 1cdb s THR 9 Ca 0.25 -0.83 0.03 0.00 0.31 0.00 0.00 61.69 61.45 1cdb s THR 9 Cb -0.13 -2.02 -0.00 0.00 0.01 0.00 0.00 72.50 70.35 1cdb s THR 9 CO 0.20 0.51 -0.12 0.26 -0.69 0.00 0.00 174.62 174.78 1cdb s TRP 10 N 1.32 1.20 -0.29 4.92 0.52 -1.26 -1.51 118.94 123.84 1cdb s TRP 10 Ca 0.05 -0.28 -0.14 0.00 0.02 0.00 0.00 56.10 55.75 1cdb s TRP 10 Cb -0.13 -0.81 0.13 0.00 -1.15 0.00 0.00 33.47 31.51 1cdb s TRP 10 CO -0.11 -0.08 0.82 0.20 0.02 0.00 0.00 176.95 177.80 1cdb s GLY 11 N -0.04 -0.41 0.51 0.98 0.00 -1.08 -5.01 107.32 102.27 1cdb s GLY 11 Ca 0.00 2.72 -0.20 0.00 0.00 0.00 0.00 44.72 47.24 1cdb s GLY 11 CO 0.00 2.83 1.10 0.00 0.00 0.00 0.00 173.10 177.03 1cdb s ALA 12 N 2.11 2.81 0.44 3.20 0.00 -1.26 -3.79 121.76 125.27 1cdb s ALA 12 Ca -0.07 0.75 -0.23 0.00 0.00 0.00 0.00 51.96 52.41 1cdb s ALA 12 Cb -0.07 -3.32 -0.10 0.00 0.00 0.00 0.00 23.12 19.63 1cdb s ALA 12 CO -0.18 -0.56 0.88 1.28 0.00 0.00 0.00 175.76 177.18 1cdb n LEU 13 N -1.02 2.04 -3.19 0.00 4.77 -1.26 -4.16 117.00 114.18 1cdb n LEU 13 Ca 0.10 0.97 -0.10 0.00 -0.03 0.00 0.00 56.01 56.96 1cdb n LEU 13 Cb 0.51 -1.29 0.04 0.00 -2.33 0.00 0.00 43.42 40.35 1cdb n LEU 13 CO 0.42 -1.90 0.15 0.61 -1.33 0.00 0.00 177.39 175.34 1cdb n GLY 14 N 1.36 -1.19 3.15 -0.72 0.00 -1.06 -4.88 105.19 101.84 1cdb n GLY 14 Ca 0.10 0.54 0.03 0.00 0.00 0.00 0.00 46.02 46.70 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 -3.89 0.60 0.10 1.61 0.74 -1.26 -4.68 119.66 112.89 1cdb s GLN 15 Ca 0.29 0.37 -0.36 0.00 0.05 0.00 0.00 55.36 55.71 1cdb s GLN 15 Cb -0.04 0.19 -0.17 0.00 1.10 0.00 0.00 33.01 34.10 1cdb s GLN 15 CO 0.75 -1.08 1.23 -3.47 -0.55 0.00 0.00 175.29 172.17 1cdb n ASP 16 N 5.22 1.25 -3.91 6.67 2.03 -1.26 -4.50 116.55 122.05 1cdb n ASP 16 Ca 0.06 1.13 -0.11 0.00 0.52 0.00 0.00 54.79 56.39 1cdb n ASP 16 Cb 0.54 -1.16 -0.13 0.00 -0.72 0.00 0.00 41.12 39.66 1cdb n ASP 16 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1cdb s ILE 17 N 0.17 0.04 0.24 5.18 2.07 -1.09 -5.01 121.20 122.81 1cdb s ILE 17 Ca 0.81 -0.31 0.08 0.00 -1.41 0.00 0.00 60.65 59.83 1cdb s ILE 17 Cb -0.96 -0.10 -0.04 0.00 0.13 0.00 0.00 42.46 41.49 1cdb s ILE 17 CO 0.50 -0.17 0.05 0.20 -1.91 0.00 0.00 174.94 173.62 1cdb s ASN 18 N -0.49 4.87 -0.10 4.50 -0.87 -1.26 -1.38 114.94 120.21 1cdb s ASN 18 Ca -0.05 -0.47 0.04 0.00 -1.57 0.00 0.00 52.86 50.80 1cdb s ASN 18 Cb -0.03 -1.04 0.00 0.00 -0.02 0.00 0.00 41.25 40.15 1cdb s ASN 18 CO -0.00 0.01 -0.24 -0.76 -2.57 0.00 0.00 177.10 173.54 1cdb s LEU 19 N -3.53 2.10 -0.02 0.60 1.43 -1.07 -4.98 118.68 113.20 1cdb s LEU 19 Ca 0.31 -0.56 -0.06 0.00 -1.03 0.00 0.00 54.13 52.78 1cdb s LEU 19 Cb -0.08 -1.41 0.01 0.00 0.03 0.00 0.00 46.19 44.74 1cdb s LEU 19 CO 0.21 0.16 0.14 -1.81 0.23 0.00 0.00 176.35 175.28 1cdb s ASP 20 N 0.37 -0.04 -0.65 2.29 1.01 -1.26 -1.66 116.67 116.72 1cdb s ASP 20 Ca -0.18 -0.01 -0.02 0.00 0.71 0.00 0.00 52.55 53.05 1cdb s ASP 20 Cb -0.18 0.25 0.17 0.00 1.01 0.00 0.00 42.92 44.17 1cdb s ASP 20 CO 0.08 -0.24 0.47 0.27 0.21 0.00 0.00 175.17 175.96 1cdb s ILE 21 N -0.81 3.72 0.60 0.77 -4.36 -1.26 -5.10 121.20 114.78 1cdb s ILE 21 Ca -0.09 -3.10 -0.07 0.00 -0.26 0.00 0.00 60.65 57.13 1cdb s ILE 21 Cb -0.05 -3.42 0.00 0.00 1.25 0.00 0.00 42.46 40.24 1cdb s ILE 21 CO 0.01 -0.90 0.93 -2.16 0.24 0.00 0.00 174.94 173.06 1cdb s PRO 22 N -0.25 3.00 -1.20 0.37 0.04 -1.26 -4.54 135.00 131.16 1cdb s PRO 22 Ca 0.18 0.13 -0.05 0.00 0.04 0.00 0.00 61.00 61.31 1cdb s PRO 22 Cb -0.19 -2.23 0.01 0.00 0.04 0.00 0.00 34.50 32.13 1cdb s PRO 22 CO -0.04 -0.71 1.03 0.43 0.04 0.00 0.00 177.00 177.75 1cdb n SER 23 N -2.64 -4.29 -3.41 6.66 7.64 -1.26 -5.02 113.62 111.29 1cdb n SER 23 Ca 0.05 -0.54 -0.20 0.00 1.01 0.00 0.00 58.87 59.19 1cdb n SER 23 Cb 0.57 -4.76 -0.10 0.00 -1.01 0.00 0.00 64.21 58.91 1cdb n SER 23 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1cdb s PHE 24 N -3.31 -0.15 -0.42 1.43 0.08 -1.26 -5.12 117.98 109.23 1cdb s PHE 24 Ca 0.30 -0.69 -0.08 0.00 0.12 0.00 0.00 56.93 56.59 1cdb s PHE 24 Cb -0.13 -0.55 0.09 0.00 -0.57 0.00 0.00 43.02 41.85 1cdb s PHE 24 CO 0.68 -0.92 0.25 -1.14 -0.10 0.00 0.00 175.22 173.99 1cdb s GLN 25 N 1.81 2.47 -0.12 0.44 2.00 -1.26 -5.06 119.66 119.95 1cdb s GLN 25 Ca 0.13 -1.57 -0.08 0.00 -2.00 0.00 0.00 55.36 51.85 1cdb s GLN 25 Cb -0.16 -3.74 0.04 0.00 0.80 0.00 0.00 33.01 29.95 1cdb s GLN 25 CO -0.18 -1.00 0.30 1.41 -0.50 0.00 0.00 175.29 175.32 1cdb s MET 26 N 1.36 0.29 -0.33 1.67 1.75 -1.26 -5.12 119.30 117.65 1cdb s MET 26 Ca 0.04 0.55 0.01 0.00 -1.25 0.00 0.00 55.69 55.04 1cdb s MET 26 Cb -0.23 -0.01 0.10 0.00 2.84 0.00 0.00 34.83 37.53 1cdb s MET 26 CO 0.00 -0.12 0.10 -1.54 -0.65 0.00 0.00 175.02 172.81 1cdb s SER 27 N 0.95 4.24 0.00 1.11 1.04 -1.26 -4.92 113.70 114.85 1cdb s SER 27 Ca -0.06 -1.91 0.00 0.00 0.48 0.00 0.00 55.95 54.45 1cdb s SER 27 Cb -0.07 -1.13 0.00 0.00 0.10 0.00 0.00 66.02 64.91 1cdb s SER 27 CO -0.07 -0.39 0.00 -0.67 0.98 0.00 0.00 173.24 173.09 1cdb n ASP 28 N 4.51 0.00 0.00 7.02 2.03 -1.26 -5.13 116.55 123.72 1cdb n ASP 28 Ca 0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1cdb n ASP 28 Cb 0.41 0.15 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 1cdb n ASP 28 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1cdb n ASP 29 N -2.04 0.00 -2.12 1.67 8.00 -1.26 -5.09 116.55 115.71 1cdb n ASP 29 Ca 0.00 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.48 1cdb n ASP 29 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1cdb n ASP 29 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1cdb n ILE 30 N 0.00 -8.04 -0.03 0.53 5.41 -1.26 -4.80 119.36 111.17 1cdb n ILE 30 Ca 0.00 1.32 -0.06 0.00 1.00 0.00 0.00 62.75 65.02 1cdb n ILE 30 Cb 0.00 -5.34 -0.02 0.00 -0.71 0.00 0.00 39.64 33.57 1cdb n ILE 30 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1cdb n ASP 31 N 0.71 0.70 -4.62 4.38 2.03 -1.20 -4.78 116.55 113.77 1cdb n ASP 31 Ca -0.14 0.06 -0.34 0.00 0.52 0.00 0.00 54.79 54.88 1cdb n ASP 31 Cb 0.22 -0.15 -0.10 0.00 -0.72 0.00 0.00 41.12 40.37 1cdb n ASP 31 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1cdb s ASP 32 N -5.39 5.37 -0.26 1.67 -1.08 -0.70 -4.21 116.67 112.07 1cdb s ASP 32 Ca -0.08 0.07 -0.02 0.00 -0.52 0.00 0.00 52.55 52.00 1cdb s ASP 32 Cb 0.03 -1.81 0.09 0.00 -1.46 0.00 0.00 42.92 39.76 1cdb s ASP 32 CO 0.10 0.23 0.08 -0.63 0.52 0.00 0.00 175.17 175.48 1cdb s ILE 33 N 0.00 0.50 -0.08 4.11 1.09 -1.07 -2.65 121.20 123.10 1cdb s ILE 33 Ca 0.04 -0.92 0.02 0.00 -1.10 0.00 0.00 60.65 58.69 1cdb s ILE 33 Cb -0.13 -1.25 -0.02 0.00 -1.06 0.00 0.00 42.46 40.00 1cdb s ILE 33 CO 0.01 -0.52 -0.14 -0.75 -0.10 0.00 0.00 174.94 173.44 1cdb s LYS 34 N 1.83 2.89 -0.09 2.79 2.20 -0.84 -1.91 119.74 126.62 1cdb s LYS 34 Ca 0.06 -0.70 0.01 0.00 -0.36 0.00 0.00 55.97 54.98 1cdb s LYS 34 Cb -0.17 -2.48 0.02 0.00 -1.51 0.00 0.00 37.83 33.69 1cdb s LYS 34 CO -0.22 0.44 -0.09 -1.58 -0.36 0.00 0.00 175.35 173.54 1cdb s TRP 35 N -0.24 1.41 -0.18 4.03 0.52 -1.04 -2.55 118.94 120.87 1cdb s TRP 35 Ca 0.01 -0.60 -0.09 0.00 0.02 0.00 0.00 56.10 55.44 1cdb s TRP 35 Cb -0.13 -1.11 0.07 0.00 -1.15 0.00 0.00 33.47 31.15 1cdb s TRP 35 CO 0.03 -0.38 0.43 -1.83 0.02 0.00 0.00 176.95 175.22 1cdb s GLU 36 N 1.18 0.40 0.39 4.98 -1.05 -0.82 -2.73 118.70 121.04 1cdb s GLU 36 Ca -0.05 0.86 -0.27 0.00 -0.15 0.00 0.00 54.97 55.37 1cdb s GLU 36 Cb -0.14 0.05 -0.09 0.00 -0.44 0.00 0.00 34.13 33.51 1cdb s GLU 36 CO -0.02 -0.18 1.32 0.21 0.95 0.00 0.00 175.26 177.54 1cdb s LYS 37 N 1.65 4.06 -0.15 -4.83 2.20 -1.26 -1.23 119.74 120.18 1cdb s LYS 37 Ca -0.08 2.20 -0.09 0.00 -0.36 0.00 0.00 55.97 57.64 1cdb s LYS 37 Cb -0.09 -2.84 -0.24 0.00 -1.51 0.00 0.00 37.83 33.16 1cdb s LYS 37 CO -0.13 -0.43 0.26 0.25 -0.36 0.00 0.00 175.35 174.94 1cdb n THR 38 N 0.29 1.70 0.08 3.43 -2.24 -1.25 -1.87 114.28 114.44 1cdb n THR 38 Ca 0.03 -0.52 -0.13 0.00 -2.27 0.00 0.00 64.05 61.16 1cdb n THR 38 Cb 0.43 -1.77 -0.07 0.00 -2.10 0.00 0.00 70.33 66.81 1cdb n THR 38 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1cdb h SER 39 N -0.17 -0.10 -1.96 3.42 0.87 -1.95 -3.39 113.55 110.28 1cdb h SER 39 Ca -0.43 -0.02 -0.51 0.00 -1.23 0.00 0.00 61.79 59.60 1cdb h SER 39 Cb 1.87 0.03 -0.39 0.00 -0.44 0.00 0.00 62.40 63.47 1cdb h SER 39 CO 0.00 -0.05 -1.14 -0.90 -0.53 0.00 0.00 176.83 174.21 1cdb n ASP 40 N -5.13 0.45 -0.91 6.23 5.75 -1.26 -5.09 116.55 116.59 1cdb n ASP 40 Ca -0.08 -2.87 0.00 0.00 -0.01 0.00 0.00 54.79 51.83 1cdb n ASP 40 Cb 0.08 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.60 1cdb n ASP 40 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1cdb n LYS 41 N 0.82 0.00 0.00 0.11 4.81 -1.26 -4.90 118.16 117.74 1cdb n LYS 41 Ca 0.23 0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 1cdb n LYS 41 Cb 0.60 -0.61 0.00 0.00 0.02 0.00 0.00 35.03 35.04 1cdb n LYS 41 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1cdb n LYS 42 N 0.26 0.00 0.00 1.64 -0.00 -0.78 -4.55 118.16 114.73 1cdb n LYS 42 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1cdb n LYS 42 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 1cdb n LYS 42 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1cdb n LYS 43 N 0.00 0.00 0.01 -1.58 2.85 -1.26 -4.79 118.16 113.39 1cdb n LYS 43 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1cdb n LYS 43 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1cdb n LYS 43 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1cdb n ILE 44 N 0.00 0.10 -3.69 0.58 5.41 -1.22 -4.79 119.36 115.75 1cdb n ILE 44 Ca 0.00 0.03 -0.10 0.00 1.00 0.00 0.00 62.75 63.68 1cdb n ILE 44 Cb 0.00 -0.87 -0.10 0.00 -0.71 0.00 0.00 39.64 37.96 1cdb n ILE 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1cdb s ALA 45 N -2.00 -1.15 -0.15 -1.39 0.00 -1.10 -4.92 121.76 111.05 1cdb s ALA 45 Ca 0.00 1.61 -0.10 0.00 0.00 0.00 0.00 51.96 53.47 1cdb s ALA 45 Cb 0.00 -0.97 0.05 0.00 0.00 0.00 0.00 23.12 22.20 1cdb s ALA 45 CO 0.00 -0.27 0.37 1.14 0.00 0.00 0.00 175.76 177.00 1cdb s GLN 46 N 1.31 0.38 0.13 0.00 -2.07 -0.93 -2.50 119.66 115.99 1cdb s GLN 46 Ca -0.09 0.67 -0.01 0.00 -1.82 0.00 0.00 55.36 54.11 1cdb s GLN 46 Cb -0.07 0.03 -0.04 0.00 -1.09 0.00 0.00 33.01 31.83 1cdb s GLN 46 CO -0.12 -0.13 0.32 -0.06 -1.32 0.00 0.00 175.29 173.98 1cdb s PHE 47 N 1.01 3.49 0.29 9.60 0.40 -0.80 -1.78 117.98 130.19 1cdb s PHE 47 Ca -0.07 0.35 0.00 0.00 -0.60 0.00 0.00 56.93 56.62 1cdb s PHE 47 Cb -0.07 -1.85 0.00 0.00 0.51 0.00 0.00 43.02 41.61 1cdb s PHE 47 CO -0.08 0.47 0.00 -2.13 0.70 0.00 0.00 175.22 174.18 1cdb n ARG 48 N -0.13 0.00 0.00 0.44 0.63 -1.15 -2.60 116.66 113.85 1cdb n ARG 48 Ca -0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 1cdb n ARG 48 Cb 0.52 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.43 1cdb n ARG 48 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1cdb n LYS 49 N -3.32 0.00 -1.82 -0.14 0.00 -1.16 -4.12 118.16 107.60 1cdb n LYS 49 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.31 58.30 1cdb n LYS 49 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 1cdb n LYS 49 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1cdb n GLU 50 N -0.67 -0.46 -0.56 1.64 4.71 -1.26 -4.68 120.64 119.36 1cdb n GLU 50 Ca 0.00 0.82 0.00 0.00 -0.01 0.00 0.00 57.16 57.97 1cdb n GLU 50 Cb 0.00 -2.45 0.00 0.00 -1.01 0.00 0.00 31.44 27.98 1cdb n GLU 50 CO 0.00 0.00 0.00 0.36 0.09 0.00 0.00 177.13 177.58 1cdb n LYS 51 N -0.70 0.00 -3.14 3.49 2.85 -1.26 -4.97 118.16 114.42 1cdb n LYS 51 Ca 0.02 0.00 0.05 0.00 -1.05 0.00 0.00 58.31 57.33 1cdb n LYS 51 Cb 0.24 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.62 1cdb n LYS 51 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 1cdb s GLU 52 N 0.00 0.18 -0.24 -1.58 2.56 -1.26 -5.15 118.70 113.21 1cdb s GLU 52 Ca 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 54.97 55.11 1cdb s GLU 52 Cb 0.00 0.08 0.12 0.00 2.00 0.00 0.00 34.13 36.33 1cdb s GLU 52 CO 0.00 -0.33 0.30 0.99 -0.56 0.00 0.00 175.26 175.66 1cdb s THR 53 N 2.93 -0.45 -0.56 -1.70 2.01 -1.26 -2.93 115.64 113.67 1cdb s THR 53 Ca 0.26 -0.18 -0.18 0.00 0.31 0.00 0.00 61.69 61.91 1cdb s THR 53 Cb -0.02 -0.80 0.11 0.00 0.01 0.00 0.00 72.50 71.80 1cdb s THR 53 CO -0.23 -0.23 0.61 -0.36 -0.69 0.00 0.00 174.62 173.72 1cdb s PHE 54 N 2.42 3.10 -0.08 4.92 0.08 -0.74 -5.00 117.98 122.68 1cdb s PHE 54 Ca 0.10 -1.05 -0.23 0.00 0.12 0.00 0.00 56.93 55.86 1cdb s PHE 54 Cb -0.15 -3.87 0.05 0.00 -0.57 0.00 0.00 43.02 38.48 1cdb s PHE 54 CO -0.18 -1.16 0.53 -1.59 -0.10 0.00 0.00 175.22 172.72 1cdb s LYS 55 N 2.25 0.83 0.00 0.44 -2.85 -1.26 -2.19 119.74 116.96 1cdb s LYS 55 Ca 0.08 0.26 0.00 0.00 -1.00 0.00 0.00 55.97 55.31 1cdb s LYS 55 Cb -0.26 0.39 0.00 0.00 -2.06 0.00 0.00 37.83 35.90 1cdb s LYS 55 CO 0.05 -0.22 0.00 -1.91 0.10 0.00 0.00 175.35 173.38 1cdb n GLU 56 N 1.52 0.00 -3.15 1.78 4.07 -1.26 -5.14 120.64 118.46 1cdb n GLU 56 Ca -0.18 0.00 -0.23 0.00 -0.06 0.00 0.00 57.16 56.69 1cdb n GLU 56 Cb 0.56 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.95 1cdb n GLU 56 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 1cdb s LYS 57 N -0.99 3.19 0.13 5.31 -2.85 -1.26 -5.05 119.74 118.22 1cdb s LYS 57 Ca 0.00 -0.50 -0.08 0.00 -1.00 0.00 0.00 55.97 54.39 1cdb s LYS 57 Cb 0.00 -2.62 -0.09 0.00 -2.06 0.00 0.00 37.83 33.07 1cdb s LYS 57 CO 0.00 -0.11 1.34 -0.44 0.10 0.00 0.00 175.35 176.24 1cdb h ASP 58 N 0.55 0.77 0.00 0.03 3.32 -1.96 -3.31 116.42 115.82 1cdb h ASP 58 Ca -0.47 -0.52 0.00 0.00 0.02 0.00 0.00 57.03 56.06 1cdb h ASP 58 Cb 1.24 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1cdb h ASP 58 CO 0.58 1.30 0.22 0.71 -1.72 0.00 0.00 179.24 180.33 1cdb h THR 59 N 0.43 0.00 -2.72 0.35 1.35 -1.88 -3.24 112.91 107.20 1cdb h THR 59 Ca -0.05 0.00 -0.44 0.00 -0.55 0.00 0.00 66.41 65.37 1cdb h THR 59 Cb 1.41 0.73 -0.38 0.00 -1.73 0.00 0.00 68.15 68.17 1cdb h THR 59 CO 0.15 0.00 -0.72 -0.47 -0.25 0.00 0.00 175.52 174.23 1cdb s TYR 60 N -4.04 0.04 0.09 4.73 5.04 -1.24 -2.81 117.35 119.16 1cdb s TYR 60 Ca -0.04 -0.38 0.06 0.00 -2.44 0.00 0.00 57.07 54.28 1cdb s TYR 60 Cb 0.09 -0.66 -0.03 0.00 0.35 0.00 0.00 41.96 41.71 1cdb s TYR 60 CO 0.30 -0.70 -0.15 -1.59 -1.34 0.00 0.00 175.55 172.06 1cdb s LYS 61 N 2.20 0.95 -0.09 4.97 -2.85 -0.94 -4.29 119.74 119.68 1cdb s LYS 61 Ca 0.07 -1.09 0.03 0.00 -1.00 0.00 0.00 55.97 53.98 1cdb s LYS 61 Cb -0.16 -0.97 -0.01 0.00 -2.06 0.00 0.00 37.83 34.64 1cdb s LYS 61 CO -0.23 0.21 -0.20 -0.51 0.10 0.00 0.00 175.35 174.72 1cdb s LEU 62 N -2.01 2.35 0.50 2.77 2.01 -1.26 -1.19 118.68 121.85 1cdb s LEU 62 Ca 0.03 -0.44 -0.05 0.00 0.01 0.00 0.00 54.13 53.69 1cdb s LEU 62 Cb -0.08 -1.48 -0.03 0.00 0.01 0.00 0.00 46.19 44.61 1cdb s LEU 62 CO 0.03 0.20 0.80 0.12 1.01 0.00 0.00 176.35 178.51 1cdb s PHE 63 N 0.09 3.48 -0.01 0.29 5.36 -0.26 -4.93 117.98 122.01 1cdb s PHE 63 Ca -0.09 0.74 -0.23 0.00 -0.96 0.00 0.00 56.93 56.39 1cdb s PHE 63 Cb -0.15 -2.39 -0.14 0.00 -0.34 0.00 0.00 43.02 40.00 1cdb s PHE 63 CO 0.06 -0.39 1.02 -0.22 -1.46 0.00 0.00 175.22 174.23 1cdb h LYS 64 N 0.16 -0.51 -1.01 10.12 1.63 -2.01 -3.30 116.57 121.65 1cdb h LYS 64 Ca -0.47 0.03 0.24 0.00 -0.85 0.00 0.00 60.65 59.61 1cdb h LYS 64 Cb 1.22 0.12 -0.12 0.00 -0.60 0.00 0.00 32.23 32.84 1cdb h LYS 64 CO 0.61 -0.21 0.60 -0.91 -3.45 0.00 0.00 179.45 176.10 1cdb h ASN 65 N -0.97 0.68 0.00 4.20 4.21 -2.01 -3.44 115.58 118.25 1cdb h ASN 65 Ca -0.05 0.13 0.00 0.00 1.21 0.00 0.00 56.30 57.58 1cdb h ASN 65 Cb 0.54 0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.76 1cdb h ASN 65 CO 0.09 0.13 0.00 0.61 -1.29 0.00 0.00 177.43 176.97 1cdb n GLY 66 N -1.32 -0.73 3.64 2.83 0.00 -1.26 -5.13 105.19 103.22 1cdb n GLY 66 Ca 0.26 0.15 -0.11 0.00 0.00 0.00 0.00 46.02 46.32 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 -0.09 2.61 2.01 -1.24 -4.09 115.64 114.84 1cdb s THR 67 Ca 0.00 -1.32 -0.14 0.00 0.31 0.00 0.00 61.69 60.54 1cdb s THR 67 Cb 0.00 -2.66 0.03 0.00 0.01 0.00 0.00 72.50 69.89 1cdb s THR 67 CO 0.00 0.00 0.35 -0.22 -0.69 0.00 0.00 174.62 174.06 1cdb s LEU 68 N -3.14 0.66 -0.13 4.42 0.20 -0.67 -1.10 118.68 118.93 1cdb s LEU 68 Ca 0.23 0.48 -0.01 0.00 0.69 0.00 0.00 54.13 55.52 1cdb s LEU 68 Cb -0.02 1.30 0.04 0.00 -0.43 0.00 0.00 46.19 47.07 1cdb s LEU 68 CO 0.15 -0.27 -0.02 -0.75 -0.29 0.00 0.00 176.35 175.17 1cdb s LYS 69 N -0.45 1.06 -0.74 1.98 2.20 -0.33 -2.60 119.74 120.86 1cdb s LYS 69 Ca -0.06 -0.26 -0.17 0.00 -0.36 0.00 0.00 55.97 55.12 1cdb s LYS 69 Cb -0.04 -1.64 0.15 0.00 -1.51 0.00 0.00 37.83 34.80 1cdb s LYS 69 CO 0.02 -0.40 0.80 0.42 -0.36 0.00 0.00 175.35 175.83 1cdb s ILE 70 N 1.79 5.11 -0.11 5.43 1.01 -0.48 -2.21 121.20 131.73 1cdb s ILE 70 Ca 0.03 -1.67 -0.25 0.00 0.00 0.00 0.00 60.65 58.75 1cdb s ILE 70 Cb -0.14 -4.53 -0.02 0.00 0.01 0.00 0.00 42.46 37.77 1cdb s ILE 70 CO -0.07 -1.16 0.79 -0.54 0.00 0.00 0.00 174.94 173.97 1cdb s LYS 71 N 1.73 4.38 -0.01 2.79 1.02 -1.12 -2.66 119.74 125.85 1cdb s LYS 71 Ca 0.18 1.00 -0.01 0.00 0.02 0.00 0.00 55.97 57.15 1cdb s LYS 71 Cb -0.16 -3.52 0.00 0.00 -0.52 0.00 0.00 37.83 33.64 1cdb s LYS 71 CO -0.03 -0.15 0.03 1.58 -0.92 0.00 0.00 175.35 175.86 1cdb n HIS 72 N 4.54 -2.76 -2.70 3.18 -0.00 -1.26 -4.19 115.22 112.04 1cdb n HIS 72 Ca 0.02 1.64 -0.26 0.00 0.46 0.00 0.00 57.72 59.58 1cdb n HIS 72 Cb 0.50 -3.04 -0.02 0.00 -0.12 0.00 0.00 29.99 27.31 1cdb n HIS 72 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1cdb n LEU 73 N 1.05 4.28 -4.69 0.27 -0.00 -1.26 -4.83 117.00 111.81 1cdb n LEU 73 Ca -0.04 -5.31 -0.30 0.00 -0.00 0.00 0.00 56.01 50.36 1cdb n LEU 73 Cb 0.07 -0.40 0.24 0.00 -0.00 0.00 0.00 43.42 43.33 1cdb n LEU 73 CO 0.04 2.25 0.70 -0.54 -0.00 0.00 0.00 177.39 179.84 1cdb s LYS 74 N -3.45 -0.93 0.04 1.96 1.02 -1.26 -2.56 119.74 114.56 1cdb s LYS 74 Ca 0.47 -0.28 -0.20 0.00 0.02 0.00 0.00 55.97 55.98 1cdb s LYS 74 Cb 0.35 -1.65 -0.14 0.00 -0.52 0.00 0.00 37.83 35.87 1cdb s LYS 74 CO -0.15 -3.48 1.35 1.15 -0.92 0.00 0.00 175.35 173.29 1cdb h THR 75 N -2.41 1.34 -0.67 2.17 2.02 -1.96 -2.84 112.91 110.56 1cdb h THR 75 Ca -0.43 -1.30 -0.71 0.00 0.77 0.00 0.00 66.41 64.74 1cdb h THR 75 Cb 1.26 1.86 -0.06 0.00 -1.74 0.00 0.00 68.15 69.48 1cdb h THR 75 CO 0.31 0.38 2.97 -0.67 0.37 0.00 0.00 175.52 178.88 1cdb n ASP 76 N -4.56 8.32 0.00 4.18 2.03 -1.26 -3.65 116.55 121.62 1cdb n ASP 76 Ca -0.06 -2.90 0.00 0.00 0.52 0.00 0.00 54.79 52.35 1cdb n ASP 76 Cb 0.36 -1.44 0.00 0.00 -0.72 0.00 0.00 41.12 39.32 1cdb n ASP 76 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1cdb n ASP 77 N 2.48 0.00 -4.10 1.67 8.00 -1.07 -5.11 116.55 118.41 1cdb n ASP 77 Ca 0.69 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.97 1cdb n ASP 77 Cb 0.25 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.26 1cdb n ASP 77 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cdb s GLN 78 N 0.00 1.75 0.29 -1.24 1.03 -1.24 -4.90 119.66 115.36 1cdb s GLN 78 Ca 0.00 -2.03 -0.08 0.00 0.04 0.00 0.00 55.36 53.29 1cdb s GLN 78 Cb 0.00 -0.43 0.00 0.00 0.03 0.00 0.00 33.01 32.61 1cdb s GLN 78 CO 0.00 -0.43 0.48 0.34 -2.54 0.00 0.00 175.29 173.14 1cdb s ASP 79 N -3.49 0.32 0.10 12.60 -1.08 -1.26 -5.05 116.67 118.81 1cdb s ASP 79 Ca 0.31 -1.19 -0.30 0.00 -0.52 0.00 0.00 52.55 50.84 1cdb s ASP 79 Cb 0.04 0.62 -0.06 0.00 -1.46 0.00 0.00 42.92 42.07 1cdb s ASP 79 CO 0.16 -1.22 1.01 -0.63 0.52 0.00 0.00 175.17 175.01 1cdb s ILE 80 N -3.52 4.40 0.43 4.11 1.01 -1.26 -1.79 121.20 124.58 1cdb s ILE 80 Ca 0.26 1.93 0.05 0.00 0.00 0.00 0.00 60.65 62.90 1cdb s ILE 80 Cb -0.00 -4.23 -0.06 0.00 0.01 0.00 0.00 42.46 38.17 1cdb s ILE 80 CO 0.14 0.26 0.01 -0.31 0.00 0.00 0.00 174.94 175.04 1cdb s TYR 81 N 0.22 2.32 -0.03 3.97 2.02 -0.93 -3.75 117.35 121.17 1cdb s TYR 81 Ca 0.49 -0.76 -0.24 0.00 -0.37 0.00 0.00 57.07 56.19 1cdb s TYR 81 Cb -0.25 -1.70 0.05 0.00 -0.40 0.00 0.00 41.96 39.66 1cdb s TYR 81 CO 0.30 0.36 0.52 0.21 -1.57 0.00 0.00 175.55 175.38 1cdb s LYS 82 N -3.76 0.90 -0.04 -0.62 2.20 -0.36 -2.42 119.74 115.65 1cdb s LYS 82 Ca 0.28 0.06 0.03 0.00 -0.36 0.00 0.00 55.97 55.97 1cdb s LYS 82 Cb 0.08 0.42 -0.03 0.00 -1.51 0.00 0.00 37.83 36.79 1cdb s LYS 82 CO 0.14 -0.27 -0.10 0.54 -0.36 0.00 0.00 175.35 175.30 1cdb s VAL 83 N -1.30 3.44 0.03 4.02 0.11 -0.38 -1.95 120.40 124.36 1cdb s VAL 83 Ca -0.12 -0.68 0.04 0.00 -2.93 0.00 0.00 61.98 58.29 1cdb s VAL 83 Cb -0.02 -2.42 -0.02 0.00 -1.53 0.00 0.00 36.38 32.40 1cdb s VAL 83 CO 0.07 0.52 -0.13 -0.44 -3.33 0.00 0.00 175.10 171.80 1cdb s SER 84 N -0.99 1.48 -0.07 3.54 0.01 -1.06 -2.61 113.70 114.00 1cdb s SER 84 Ca 0.14 -0.39 0.03 0.00 1.31 0.00 0.00 55.95 57.04 1cdb s SER 84 Cb -0.11 -0.10 0.01 0.00 0.21 0.00 0.00 66.02 66.03 1cdb s SER 84 CO 0.03 0.04 -0.15 -0.63 0.41 0.00 0.00 173.24 172.94 1cdb s ILE 85 N -0.71 1.39 0.04 1.44 1.09 -0.86 -1.99 121.20 121.60 1cdb s ILE 85 Ca 0.01 -0.63 0.05 0.00 -1.10 0.00 0.00 60.65 58.98 1cdb s ILE 85 Cb -0.07 -1.24 -0.02 0.00 -1.06 0.00 0.00 42.46 40.07 1cdb s ILE 85 CO 0.01 0.41 -0.14 -0.31 -0.10 0.00 0.00 174.94 174.81 1cdb s TYR 86 N 0.54 1.22 0.37 3.97 1.51 -1.08 -2.02 117.35 121.86 1cdb s TYR 86 Ca -0.15 -0.36 -0.05 0.00 -1.01 0.00 0.00 57.07 55.51 1cdb s TYR 86 Cb -0.16 -0.73 0.08 0.00 -0.11 0.00 0.00 41.96 41.05 1cdb s TYR 86 CO 0.05 0.03 0.51 -0.25 -1.11 0.00 0.00 175.55 174.78 1cdb n ASP 87 N 1.89 0.23 0.17 2.29 8.00 -1.20 -1.72 116.55 126.19 1cdb n ASP 87 Ca -0.18 -1.30 0.16 0.00 0.71 0.00 0.00 54.79 54.18 1cdb n ASP 87 Cb 0.55 -0.37 0.76 0.00 -0.02 0.00 0.00 41.12 42.04 1cdb n ASP 87 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1cdb h THR 88 N -1.02 0.64 -0.47 -3.53 1.35 -1.87 -2.43 112.91 105.57 1cdb h THR 88 Ca -0.16 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 1cdb h THR 88 Cb 0.50 0.85 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 1cdb h THR 88 CO 0.13 0.00 0.30 0.11 -0.25 0.00 0.00 175.52 175.82 1cdb h LYS 89 N 0.00 0.63 -1.31 4.72 1.79 -2.01 -3.49 116.57 116.90 1cdb h LYS 89 Ca 0.11 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1cdb h LYS 89 Cb 0.52 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1cdb h LYS 89 CO -0.00 0.44 0.00 0.41 -1.08 0.00 0.00 179.45 179.22 1cdb n GLY 90 N -1.17 0.53 3.10 3.86 0.00 -0.92 -5.13 105.19 105.47 1cdb n GLY 90 Ca 0.02 -0.53 -0.07 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.44 0.36 0.06 1.61 2.47 -1.26 -4.95 119.74 115.60 1cdb s LYS 91 Ca 0.00 0.81 -0.31 0.00 -1.56 0.00 0.00 55.97 54.91 1cdb s LYS 91 Cb 0.00 -0.01 -0.06 0.00 -1.46 0.00 0.00 37.83 36.30 1cdb s LYS 91 CO 0.00 -0.47 1.19 1.21 0.16 0.00 0.00 175.35 177.45 1cdb s ASN 92 N 2.61 7.08 0.00 1.43 3.84 -1.26 -3.27 114.94 125.37 1cdb s ASN 92 Ca 0.07 2.02 0.00 0.00 0.21 0.00 0.00 52.86 55.16 1cdb s ASN 92 Cb -0.14 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 37.98 1cdb s ASN 92 CO -0.15 -0.46 0.00 1.33 -2.79 0.00 0.00 177.10 175.03 1cdb n VAL 93 N 3.88 0.00 -3.46 -5.21 0.24 -0.86 -5.03 118.33 107.89 1cdb n VAL 93 Ca 0.09 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 62.01 1cdb n VAL 93 Cb 0.46 -0.54 -0.06 0.00 -1.47 0.00 0.00 33.84 32.24 1cdb n VAL 93 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1cdb s LEU 94 N -1.58 4.44 -0.06 1.34 1.02 -1.26 -4.98 118.68 117.60 1cdb s LEU 94 Ca 0.00 0.94 -0.03 0.00 0.02 0.00 0.00 54.13 55.06 1cdb s LEU 94 Cb 0.00 -2.61 0.04 0.00 0.02 0.00 0.00 46.19 43.64 1cdb s LEU 94 CO 0.00 0.27 0.15 -1.61 0.02 0.00 0.00 176.35 175.17 1cdb s GLU 95 N -0.76 0.10 -0.18 1.70 2.02 -1.26 -2.02 118.70 118.30 1cdb s GLU 95 Ca 0.24 0.35 -0.27 0.00 0.02 0.00 0.00 54.97 55.30 1cdb s GLU 95 Cb -0.16 -0.14 0.07 0.00 0.10 0.00 0.00 34.13 34.00 1cdb s GLU 95 CO 0.13 -0.15 0.73 0.21 0.02 0.00 0.00 175.26 176.20 1cdb s LYS 96 N 1.02 0.90 -0.04 1.61 2.20 -1.07 -5.03 119.74 119.34 1cdb s LYS 96 Ca -0.08 0.68 -0.03 0.00 -0.36 0.00 0.00 55.97 56.18 1cdb s LYS 96 Cb -0.10 0.43 -0.04 0.00 -1.51 0.00 0.00 37.83 36.61 1cdb s LYS 96 CO -0.05 -0.19 0.13 0.42 -0.36 0.00 0.00 175.35 175.30 1cdb s ILE 97 N -0.27 5.19 0.08 5.43 1.01 -1.26 -1.25 121.20 130.13 1cdb s ILE 97 Ca -0.04 -0.16 -0.06 0.00 0.00 0.00 0.00 60.65 60.39 1cdb s ILE 97 Cb -0.03 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 1cdb s ILE 97 CO 0.04 0.41 0.11 -0.36 0.00 0.00 0.00 174.94 175.14 1cdb s PHE 98 N -1.20 0.30 -0.34 3.97 0.40 -1.01 -1.23 117.98 118.86 1cdb s PHE 98 Ca 0.23 -0.77 0.03 0.00 -0.60 0.00 0.00 56.93 55.81 1cdb s PHE 98 Cb -0.12 -0.18 0.15 0.00 0.51 0.00 0.00 43.02 43.38 1cdb s PHE 98 CO 0.13 -0.49 0.39 -0.51 0.70 0.00 0.00 175.22 175.45 1cdb s ASP 99 N -2.89 0.87 -0.05 1.36 1.11 -0.48 -2.20 116.67 114.40 1cdb s ASP 99 Ca 0.06 -1.11 -0.30 0.00 0.18 0.00 0.00 52.55 51.39 1cdb s ASP 99 Cb 0.06 0.78 -0.03 0.00 1.07 0.00 0.00 42.92 44.80 1cdb s ASP 99 CO -0.10 -0.30 1.19 -0.22 1.18 0.00 0.00 175.17 176.92 1cdb s LEU 100 N 1.88 4.29 0.02 1.23 1.98 -0.74 -2.24 118.68 125.10 1cdb s LEU 100 Ca 0.14 1.81 0.01 0.00 -2.89 0.00 0.00 54.13 53.20 1cdb s LEU 100 Cb -0.13 -3.56 -0.02 0.00 0.66 0.00 0.00 46.19 43.14 1cdb s LEU 100 CO -0.15 -0.56 -0.05 -0.54 -1.89 0.00 0.00 176.35 173.16 1cdb s LYS 101 N 2.09 0.37 -0.15 1.98 1.02 -0.57 -4.23 119.74 120.26 1cdb s LYS 101 Ca 0.56 -0.55 -0.06 0.00 0.02 0.00 0.00 55.97 55.94 1cdb s LYS 101 Cb -0.25 -0.11 -0.04 0.00 -0.52 0.00 0.00 37.83 36.91 1cdb s LYS 101 CO 0.22 0.01 0.06 0.42 -0.92 0.00 0.00 175.35 175.14 1cdb s ILE 102 N -1.11 4.78 0.07 2.17 -1.09 -1.26 -2.64 121.20 122.12 1cdb s ILE 102 Ca -0.10 -0.05 -0.31 0.00 -2.23 0.00 0.00 60.65 57.97 1cdb s ILE 102 Cb -0.08 -3.11 -0.08 0.00 -1.58 0.00 0.00 42.46 37.62 1cdb s ILE 102 CO -0.00 0.53 1.57 -1.10 -1.23 0.00 0.00 174.94 174.70 1cdb s GLN 103 N -0.18 4.23 -0.36 2.79 -0.21 -1.25 -4.95 119.66 119.73 1cdb s GLN 103 Ca 0.07 2.24 0.02 0.00 0.02 0.00 0.00 55.36 57.71 1cdb s GLN 103 Cb -0.12 -3.52 0.15 0.00 1.00 0.00 0.00 33.01 30.52 1cdb s GLN 103 CO 0.01 -0.67 0.33 -2.00 -2.12 0.00 0.00 175.29 170.85 1cdb s GLU 104 N 2.33 0.57 0.00 2.91 2.56 -1.26 -4.91 118.70 120.90 1cdb s GLU 104 Ca 0.71 -0.86 0.00 0.00 0.00 0.00 0.00 54.97 54.82 1cdb s GLU 104 Cb -0.38 -0.83 0.00 0.00 2.00 0.00 0.00 34.13 34.91 1cdb s GLU 104 CO 0.31 -1.17 0.00 0.54 -0.56 0.00 0.00 175.26 174.37