#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9i s ARG 3 N 0.00 2.41 -0.04 1.61 0.52 -1.26 -5.08 118.95 117.12 2k9i s ARG 3 Ca 0.00 -1.65 -0.27 0.00 -0.52 0.00 0.00 55.73 53.29 2k9i s ARG 3 Cb 0.00 -3.77 -0.03 0.00 0.52 0.00 0.00 34.95 31.67 2k9i s ARG 3 CO 0.00 -1.06 0.84 -1.25 0.02 0.00 0.00 175.30 173.85 2k9i s PRO 4 N 1.33 4.49 0.00 3.54 0.04 -1.26 -4.94 135.00 138.20 2k9i s PRO 4 Ca 0.05 1.14 0.31 0.00 0.04 0.00 0.00 61.00 62.54 2k9i s PRO 4 Cb -0.24 -3.46 1.63 0.00 0.04 0.00 0.00 34.50 32.47 2k9i s PRO 4 CO -0.01 -0.00 2.10 2.48 0.04 0.00 0.00 177.00 181.61 2k9i n TYR 5 N 3.87 0.00 -0.02 0.56 4.11 -1.26 -0.84 117.16 123.58 2k9i n TYR 5 Ca 0.02 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.81 2k9i n TYR 5 Cb 0.51 -0.20 -0.14 0.00 -0.00 0.00 0.00 39.34 39.51 2k9i n TYR 5 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.86 178.03 2k9i n LYS 6 N -1.20 0.66 -0.07 -3.48 3.00 -1.26 -4.31 118.16 111.50 2k9i n LYS 6 Ca 0.17 0.27 -0.22 0.00 -0.00 0.00 0.00 58.31 58.53 2k9i n LYS 6 Cb 0.20 -1.75 -0.12 0.00 0.00 0.00 0.00 35.03 33.35 2k9i n LYS 6 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2k9i n LEU 7 N -3.13 2.46 -4.37 3.14 4.77 -1.12 -4.62 117.00 114.12 2k9i n LEU 7 Ca -0.22 0.19 -0.45 0.00 -0.03 0.00 0.00 56.01 55.50 2k9i n LEU 7 Cb 1.06 -0.99 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2k9i n LEU 7 CO 0.44 0.71 0.85 -0.76 -1.33 0.00 0.00 177.39 177.30 2k9i s LEU 8 N -7.16 6.04 -0.16 2.23 2.01 -0.02 -4.96 118.68 116.67 2k9i s LEU 8 Ca -0.29 -3.11 -0.17 0.00 0.01 0.00 0.00 54.13 50.58 2k9i s LEU 8 Cb 0.08 -2.27 0.04 0.00 0.01 0.00 0.00 46.19 44.06 2k9i s LEU 8 CO 0.65 -0.53 0.46 0.21 1.01 0.00 0.00 176.35 178.15 2k9i s ASN 9 N 2.06 -0.47 -0.28 2.29 3.84 -1.26 -4.53 114.94 116.60 2k9i s ASN 9 Ca 0.30 0.85 -0.22 0.00 0.21 0.00 0.00 52.86 54.01 2k9i s ASN 9 Cb -0.08 0.88 0.10 0.00 -0.55 0.00 0.00 41.25 41.60 2k9i s ASN 9 CO -0.07 -0.20 0.86 -0.83 -2.79 0.00 0.00 177.10 174.07 2k9i s GLY 10 N 0.05 -0.34 0.17 1.21 0.00 -1.26 -5.09 107.32 102.07 2k9i s GLY 10 Ca -0.02 2.50 0.11 0.00 0.00 0.00 0.00 44.72 47.32 2k9i s GLY 10 CO 0.01 2.03 -0.25 -0.42 0.00 0.00 0.00 173.10 174.47 2k9i s ILE 11 N 0.70 2.31 -0.20 0.90 -1.09 -1.26 -5.13 121.20 117.43 2k9i s ILE 11 Ca -0.02 -1.92 -0.10 0.00 -2.23 0.00 0.00 60.65 56.38 2k9i s ILE 11 Cb -0.05 -2.07 -0.05 0.00 -1.58 0.00 0.00 42.46 38.71 2k9i s ILE 11 CO -0.08 -0.04 0.13 -0.54 -1.23 0.00 0.00 174.94 173.19 2k9i s LYS 12 N -2.43 4.15 0.01 2.79 -0.14 -1.26 -5.08 119.74 117.78 2k9i s LYS 12 Ca 0.18 -0.21 0.04 0.00 -1.36 0.00 0.00 55.97 54.62 2k9i s LYS 12 Cb -0.09 -3.41 -0.02 0.00 -1.68 0.00 0.00 37.83 32.64 2k9i s LYS 12 CO 0.08 0.33 -0.13 -0.48 -0.76 0.00 0.00 175.35 174.39 2k9i s LEU 13 N 0.28 2.10 -0.25 3.17 2.34 -1.26 -5.13 118.68 119.93 2k9i s LEU 13 Ca 0.08 -0.34 -0.09 0.00 0.06 0.00 0.00 54.13 53.84 2k9i s LEU 13 Cb -0.11 -0.63 -0.04 0.00 -0.56 0.00 0.00 46.19 44.85 2k9i s LEU 13 CO -0.02 0.09 0.12 -0.83 -1.06 0.00 0.00 176.35 174.66 2k9i s GLY 14 N -0.72 1.88 0.32 -3.48 0.00 -1.26 -5.09 107.32 98.98 2k9i s GLY 14 Ca 0.03 -1.01 0.09 0.00 0.00 0.00 0.00 44.72 43.83 2k9i s GLY 14 CO 0.00 0.46 0.09 0.14 0.00 0.00 0.00 173.10 173.80 2k9i s VAL 15 N 1.34 3.13 -0.04 1.40 1.01 -1.26 -5.14 120.40 120.84 2k9i s VAL 15 Ca 0.06 -1.77 0.00 0.00 0.00 0.00 0.00 61.98 60.28 2k9i s VAL 15 Cb -0.15 -2.94 0.02 0.00 0.00 0.00 0.00 36.38 33.32 2k9i s VAL 15 CO 0.06 -0.24 -0.02 -0.31 0.00 0.00 0.00 175.10 174.59 2k9i s TYR 16 N -2.40 0.60 0.03 5.22 2.02 -1.26 -5.15 117.35 116.41 2k9i s TYR 16 Ca 0.36 -0.13 -0.15 0.00 -0.37 0.00 0.00 57.07 56.77 2k9i s TYR 16 Cb -0.03 -0.60 0.03 0.00 -0.40 0.00 0.00 41.96 40.95 2k9i s TYR 16 CO 0.22 -0.19 0.34 0.96 -1.57 0.00 0.00 175.55 175.30 2k9i s ILE 17 N 1.11 0.07 0.98 2.71 -4.36 -1.26 -5.17 121.20 115.28 2k9i s ILE 17 Ca -0.08 -0.57 -0.11 0.00 -0.26 0.00 0.00 60.65 59.63 2k9i s ILE 17 Cb -0.14 -0.87 0.15 0.00 1.25 0.00 0.00 42.46 42.86 2k9i s ILE 17 CO -0.01 -0.31 0.95 -2.65 0.24 0.00 0.00 174.94 173.15 2k9i n PRO 18 N 0.72 -0.85 -0.03 0.37 -0.02 -1.26 -4.81 135.00 129.12 2k9i n PRO 18 Ca -0.19 -0.19 -0.03 0.00 -2.02 0.00 0.00 63.50 61.07 2k9i n PRO 18 Cb 0.59 -2.22 0.22 0.00 -0.02 0.00 0.00 33.50 32.06 2k9i n PRO 18 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 2k9i h GLN 19 N -2.00 0.60 0.00 -0.52 3.07 -2.02 -1.25 115.11 112.99 2k9i h GLN 19 Ca -0.47 -0.17 0.00 0.00 0.09 0.00 0.00 58.65 58.10 2k9i h GLN 19 Cb 1.29 -0.07 0.00 0.00 0.08 0.00 0.00 27.48 28.78 2k9i h GLN 19 CO 0.41 0.68 0.00 1.05 0.09 0.00 0.00 178.83 181.06 2k9i h GLU 20 N 0.56 0.00 0.03 0.06 9.09 -1.98 0.26 114.58 122.60 2k9i h GLU 20 Ca 0.10 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.46 2k9i h GLU 20 Cb 0.48 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.59 2k9i h GLU 20 CO 0.03 0.00 -0.23 -1.49 0.05 0.00 0.00 179.01 177.37 2k9i h TRP 21 N 0.00 0.17 -0.37 2.06 4.06 -1.57 -2.85 115.95 117.45 2k9i h TRP 21 Ca 0.00 -0.11 -0.01 0.00 2.06 0.00 0.00 58.89 60.82 2k9i h TRP 21 Cb 0.09 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.22 2k9i h TRP 21 CO 0.00 1.05 0.18 0.45 -3.56 0.00 0.00 178.44 176.56 2k9i h HIS 22 N -0.77 0.50 0.19 0.49 3.86 -1.10 0.88 115.15 119.20 2k9i h HIS 22 Ca -0.04 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.17 2k9i h HIS 22 Cb 1.14 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.43 2k9i h HIS 22 CO 0.24 0.37 -0.22 0.22 0.86 0.00 0.00 177.93 179.41 2k9i h ASP 23 N 0.51 -0.58 0.61 2.45 1.82 -0.55 0.14 116.42 120.82 2k9i h ASP 23 Ca 0.13 0.06 -0.15 0.00 -0.39 0.00 0.00 57.03 56.68 2k9i h ASP 23 Cb 0.06 0.21 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 2k9i h ASP 23 CO -0.02 -0.31 -0.68 0.03 -1.61 0.00 0.00 179.24 176.65 2k9i h ARG 24 N -0.45 0.06 0.10 0.28 -0.00 -1.21 -2.70 114.38 110.45 2k9i h ARG 24 Ca 0.01 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.43 2k9i h ARG 24 Cb 0.43 0.01 0.00 0.00 0.00 0.00 0.00 29.97 30.41 2k9i h ARG 24 CO -0.07 0.71 -0.05 -0.07 0.00 0.00 0.00 179.97 180.49 2k9i h LEU 25 N 0.04 -0.11 -1.44 3.04 3.38 -0.59 -2.52 115.31 117.12 2k9i h LEU 25 Ca -0.01 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2k9i h LEU 25 Cb 1.20 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 2k9i h LEU 25 CO 0.09 0.10 -0.02 0.24 0.09 0.00 0.00 178.44 178.94 2k9i h MET 26 N -0.32 0.34 0.59 1.13 2.86 -0.70 0.30 114.93 119.13 2k9i h MET 26 Ca -0.01 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 2k9i h MET 26 Cb 0.27 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 31.88 2k9i h MET 26 CO 0.02 0.39 -0.28 1.49 1.06 0.00 0.00 176.91 179.58 2k9i h GLU 27 N 0.33 -0.76 -0.57 1.72 4.57 -1.39 -1.20 114.58 117.27 2k9i h GLU 27 Ca 0.07 0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.27 2k9i h GLU 27 Cb 0.26 0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 2k9i h GLU 27 CO 0.01 -0.46 0.23 0.82 -1.18 0.00 0.00 179.01 178.42 2k9i h ILE 28 N -0.93 1.22 0.00 2.32 2.04 -1.21 -2.35 117.51 118.60 2k9i h ILE 28 Ca -0.08 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 2k9i h ILE 28 Cb 0.65 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2k9i h ILE 28 CO 0.13 0.27 -0.04 0.00 0.00 0.00 0.00 178.15 178.51 2k9i h ALA 29 N 1.08 1.15 0.01 1.87 0.00 -0.39 -1.54 119.26 121.44 2k9i h ALA 29 Ca 0.19 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2k9i h ALA 29 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2k9i h ALA 29 CO -0.02 0.05 -0.01 -0.22 0.00 0.00 0.00 179.25 179.06 2k9i h LYS 30 N 0.00 -0.02 -0.68 0.00 3.64 -0.67 0.19 116.57 119.03 2k9i h LYS 30 Ca -0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 2k9i h LYS 30 Cb 0.21 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2k9i h LYS 30 CO 0.01 0.78 0.20 1.49 -2.27 0.00 0.00 179.45 179.65 2k9i h GLU 31 N -0.93 1.06 -0.01 1.90 4.81 -1.28 -3.12 114.58 117.00 2k9i h GLU 31 Ca -0.00 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 2k9i h GLU 31 Cb 0.80 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2k9i h GLU 31 CO 0.00 0.91 -0.29 1.63 -0.73 0.00 0.00 179.01 180.54 2k9i n LYS 32 N -4.26 1.06 -2.99 1.92 4.01 -0.60 -4.96 118.16 112.34 2k9i n LYS 32 Ca 0.05 -0.72 -0.11 0.00 -0.51 0.00 0.00 58.31 57.02 2k9i n LYS 32 Cb 0.23 -1.49 0.05 0.00 -0.51 0.00 0.00 35.03 33.32 2k9i n LYS 32 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2k9i n ASN 33 N -0.34 -6.14 -4.26 4.39 2.85 -0.82 -5.04 115.26 105.90 2k9i n ASN 33 Ca 0.12 -0.55 -0.14 0.00 -0.11 0.00 0.00 54.58 53.90 2k9i n ASN 33 Cb 0.39 -4.59 -0.10 0.00 1.24 0.00 0.00 39.78 36.72 2k9i n ASN 33 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2k9i s LEU 34 N -4.91 1.85 0.23 1.20 1.43 0.62 -5.04 118.68 114.06 2k9i s LEU 34 Ca 0.35 -1.27 0.08 0.00 -1.03 0.00 0.00 54.13 52.27 2k9i s LEU 34 Cb -0.05 0.04 -0.04 0.00 0.03 0.00 0.00 46.19 46.17 2k9i s LEU 34 CO 0.64 -0.66 0.07 -0.89 0.23 0.00 0.00 176.35 175.74 2k9i s THR 35 N -3.76 3.89 0.35 5.49 2.01 -1.26 -4.53 115.64 117.82 2k9i s THR 35 Ca 0.30 -1.59 0.03 0.00 0.31 0.00 0.00 61.69 60.74 2k9i s THR 35 Cb 0.07 -3.06 0.27 0.00 0.01 0.00 0.00 72.50 69.80 2k9i s THR 35 CO 0.08 -0.29 1.98 0.17 -0.69 0.00 0.00 174.62 175.87 2k9i h LEU 36 N 1.98 0.74 -0.72 4.42 -0.00 -1.96 0.55 115.31 120.31 2k9i h LEU 36 Ca -0.46 -0.01 0.03 0.00 -0.00 0.00 0.00 57.88 57.44 2k9i h LEU 36 Cb 1.23 -0.17 -0.05 0.00 -0.00 0.00 0.00 40.66 41.67 2k9i h LEU 36 CO 0.60 0.51 0.45 0.77 -0.00 0.00 0.00 178.44 180.77 2k9i h SER 37 N 0.86 0.74 -0.32 0.17 4.64 -1.99 -0.96 113.55 116.68 2k9i h SER 37 Ca 0.28 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.57 2k9i h SER 37 Cb 0.04 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 2k9i h SER 37 CO -0.08 0.51 0.07 0.44 -0.87 0.00 0.00 176.83 176.91 2k9i h ASP 38 N 0.88 0.49 -0.00 4.97 3.32 -1.36 -1.89 116.42 122.83 2k9i h ASP 38 Ca 0.29 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 2k9i h ASP 38 Cb 0.03 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 2k9i h ASP 38 CO -0.11 0.60 -0.10 0.58 -1.72 0.00 0.00 179.24 178.49 2k9i h VAL 39 N 0.36 1.16 0.34 -1.35 2.07 -0.83 0.22 116.25 118.23 2k9i h VAL 39 Ca 0.10 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 2k9i h VAL 39 Cb 0.30 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2k9i h VAL 39 CO 0.00 0.22 -0.16 0.00 0.02 0.00 0.00 177.57 177.65 2k9i h ARG 41 N -0.91 0.71 0.00 0.00 -0.00 -1.28 0.16 114.38 113.06 2k9i h ARG 41 Ca -0.05 -0.04 -0.03 0.00 -0.00 0.00 0.00 59.98 59.86 2k9i h ARG 41 Cb 0.53 -0.16 -0.00 0.00 -0.00 0.00 0.00 29.97 30.33 2k9i h ARG 41 CO 0.08 0.47 -0.13 -0.07 -0.00 0.00 0.00 179.97 180.31 2k9i h LEU 42 N 0.73 0.00 -0.66 0.08 3.38 -0.46 -1.45 115.31 116.92 2k9i h LEU 42 Ca 0.24 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.07 2k9i h LEU 42 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2k9i h LEU 42 CO -0.06 0.13 -0.64 0.00 0.09 0.00 0.00 178.44 177.96 2k9i h ALA 43 N 1.87 0.87 -0.06 1.53 0.00 0.13 -2.30 119.26 121.31 2k9i h ALA 43 Ca -0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 2k9i h ALA 43 Cb 0.50 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2k9i h ALA 43 CO 0.02 0.77 0.01 0.82 0.00 0.00 0.00 179.25 180.87 2k9i h ILE 44 N 0.09 1.19 -0.68 0.00 1.08 -0.49 0.29 117.51 119.00 2k9i h ILE 44 Ca -0.01 -0.58 0.04 0.00 -0.39 0.00 0.00 64.86 63.92 2k9i h ILE 44 Cb 1.14 1.47 -0.04 0.00 -3.07 0.00 0.00 36.82 36.32 2k9i h ILE 44 CO 0.09 0.16 0.45 0.50 -0.69 0.00 0.00 178.15 178.66 2k9i h LYS 45 N -0.12 0.76 -0.25 2.37 3.11 -1.45 0.77 116.57 121.75 2k9i h LYS 45 Ca 0.02 -0.05 -0.19 0.00 -2.81 0.00 0.00 60.65 57.63 2k9i h LYS 45 Cb 0.24 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.30 2k9i h LYS 45 CO 0.00 0.50 -0.58 1.49 -2.81 0.00 0.00 179.45 178.06 2k9i h GLU 46 N 0.79 0.80 -0.21 1.90 4.57 -1.05 -1.01 114.58 120.37 2k9i h GLU 46 Ca 0.27 -0.52 -0.01 0.00 -1.18 0.00 0.00 59.36 57.92 2k9i h GLU 46 Cb 0.11 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 2k9i h GLU 46 CO -0.08 1.15 0.09 -0.92 -1.18 0.00 0.00 179.01 178.07 2k9i h TYR 47 N 0.60 0.31 0.06 0.92 3.20 0.10 0.22 116.97 122.39 2k9i h TYR 47 Ca 0.01 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 2k9i h TYR 47 Cb 1.17 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.35 2k9i h TYR 47 CO 0.07 0.34 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.83 2k9i h LEU 48 N 0.19 -0.07 -0.62 2.82 3.38 -0.92 -2.75 115.31 117.34 2k9i h LEU 48 Ca 0.07 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 2k9i h LEU 48 Cb 0.16 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2k9i h LEU 48 CO -0.01 0.25 0.02 -0.78 0.09 0.00 0.00 178.44 178.01 2k9i h ASP 49 N -0.40 1.05 1.27 -0.43 3.58 -1.10 0.42 116.42 120.81 2k9i h ASP 49 Ca -0.01 -0.30 -0.13 0.00 0.42 0.00 0.00 57.03 57.01 2k9i h ASP 49 Cb 0.35 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 2k9i h ASP 49 CO 0.01 1.09 -0.63 -0.55 -2.88 0.00 0.00 179.24 176.28 2k9i h ASN 50 N 0.98 0.00 0.00 2.28 7.08 -0.63 -3.19 115.58 122.11 2k9i h ASN 50 Ca 0.18 0.00 -0.03 0.00 -3.08 0.00 0.00 56.30 53.36 2k9i h ASN 50 Cb 0.54 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.77 2k9i h ASN 50 CO 0.03 0.63 -0.53 0.45 -2.08 0.00 0.00 177.43 175.93 2k9i h HIS 51 N 0.00 0.00 -2.83 4.14 3.86 -1.43 -3.41 115.15 115.47 2k9i h HIS 51 Ca -0.01 0.00 -0.78 0.00 -1.16 0.00 0.00 60.37 58.42 2k9i h HIS 51 Cb 1.44 0.00 -0.24 0.00 1.06 0.00 0.00 27.41 29.67 2k9i h HIS 51 CO 0.00 0.24 0.93 -0.25 0.86 0.00 0.00 177.93 179.72 2k9i n ASP 52 N -4.62 5.54 0.00 2.45 8.00 0.13 -4.80 116.55 123.25 2k9i n ASP 52 Ca -0.10 -3.09 0.08 0.00 0.71 0.00 0.00 54.79 52.40 2k9i n ASP 52 Cb 0.29 -1.43 0.46 0.00 -0.02 0.00 0.00 41.12 40.42 2k9i n ASP 52 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2k9i n LYS 53 N 3.46 0.41 -2.59 -1.24 5.02 -1.20 -4.30 118.16 117.72 2k9i n LYS 53 Ca 0.30 0.05 -0.43 0.00 -2.02 0.00 0.00 58.31 56.21 2k9i n LYS 53 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2k9i n LYS 53 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2k9i n GLN 54 N -1.10 3.30 -0.05 1.97 1.13 -1.26 -4.68 117.38 116.69 2k9i n GLN 54 Ca 0.11 -3.47 -0.01 0.00 -1.94 0.00 0.00 57.00 51.69 2k9i n GLN 54 Cb 0.08 -3.19 -0.00 0.00 0.11 0.00 0.00 30.24 27.24 2k9i n GLN 54 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 2k9i h LYS 55 N 6.90 0.00 0.00 -1.09 1.79 -1.97 -3.53 116.57 118.67 2k9i h LYS 55 Ca 0.40 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.87 2k9i h LYS 55 Cb 0.80 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.45 2k9i h LYS 55 CO 1.45 0.00 0.00 1.17 -1.08 0.00 0.00 179.45 180.99