#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k53 s LYS 2 N 0.00 3.18 0.28 0.03 2.36 -1.26 -4.83 119.74 119.50 2k53 s LYS 2 Ca 0.00 0.22 -0.29 0.00 -2.55 0.00 0.00 55.97 53.34 2k53 s LYS 2 Cb 0.00 -4.18 -0.10 0.00 -1.05 0.00 0.00 37.83 32.51 2k53 s LYS 2 CO 0.00 -2.11 1.21 0.42 1.55 0.00 0.00 175.35 176.41 2k53 s ILE 3 N 6.32 3.17 0.29 5.43 -1.09 -1.26 -5.05 121.20 129.01 2k53 s ILE 3 Ca 0.48 1.14 0.10 0.00 -2.23 0.00 0.00 60.65 60.14 2k53 s ILE 3 Cb -0.10 -3.73 -0.05 0.00 -1.58 0.00 0.00 42.46 37.00 2k53 s ILE 3 CO 0.21 0.26 -0.15 0.42 -1.23 0.00 0.00 174.94 174.44 2k53 s THR 4 N -0.94 2.26 0.17 2.92 -4.23 -1.26 -4.83 115.64 109.73 2k53 s THR 4 Ca 0.48 -2.31 0.32 0.00 -1.18 0.00 0.00 61.69 59.00 2k53 s THR 4 Cb -0.35 -2.38 0.36 0.00 1.34 0.00 0.00 72.50 71.46 2k53 s THR 4 CO 0.45 -0.36 1.99 0.07 -0.54 0.00 0.00 174.62 176.23 2k53 h LYS 5 N 2.23 0.00 0.00 3.99 2.10 -1.96 -2.41 116.57 120.52 2k53 h LYS 5 Ca -0.40 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.22 2k53 h LYS 5 Cb 1.25 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2k53 h LYS 5 CO 0.64 0.06 -0.12 0.22 -2.00 0.00 0.00 179.45 178.24 2k53 h ASP 6 N 0.00 0.00 -4.14 7.07 3.58 -1.96 0.06 116.42 121.03 2k53 h ASP 6 Ca -0.00 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.91 2k53 h ASP 6 Cb 0.51 0.00 0.14 0.00 1.72 0.00 0.00 39.33 41.70 2k53 h ASP 6 CO 0.01 0.12 0.44 -0.04 -2.88 0.00 0.00 179.24 176.89 2k53 s MET 7 N -3.44 2.50 -0.03 0.28 -1.94 -0.91 -4.59 119.30 111.18 2k53 s MET 7 Ca 0.03 1.83 -0.26 0.00 -1.71 0.00 0.00 55.69 55.58 2k53 s MET 7 Cb 0.08 -1.87 -0.04 0.00 2.01 0.00 0.00 34.83 35.01 2k53 s MET 7 CO 0.63 -1.57 0.81 0.42 -0.01 0.00 0.00 175.02 175.30 2k53 s ILE 8 N -1.75 4.94 0.18 2.53 -1.09 -1.26 -0.91 121.20 123.84 2k53 s ILE 8 Ca 0.77 1.70 -0.13 0.00 -2.23 0.00 0.00 60.65 60.76 2k53 s ILE 8 Cb -0.31 -4.16 0.10 0.00 -1.58 0.00 0.00 42.46 36.51 2k53 s ILE 8 CO 0.40 0.23 1.73 0.40 -1.23 0.00 0.00 174.94 176.47 2k53 h ILE 9 N 4.70 0.77 -0.57 2.92 2.04 -1.57 0.38 117.51 126.18 2k53 h ILE 9 Ca -0.41 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 2k53 h ILE 9 Cb 1.21 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 2k53 h ILE 9 CO 0.75 0.05 0.35 0.00 0.00 0.00 0.00 178.15 179.30 2k53 h ALA 10 N 1.35 1.55 -0.46 1.87 0.00 -0.81 -1.28 119.26 121.48 2k53 h ALA 10 Ca 0.24 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 2k53 h ALA 10 Cb 0.29 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2k53 h ALA 10 CO -0.28 0.40 -0.26 0.22 0.00 0.00 0.00 179.25 179.33 2k53 h ASP 11 N 0.78 1.03 -0.84 0.00 3.58 -1.34 -1.11 116.42 118.52 2k53 h ASP 11 Ca 0.21 -0.41 0.03 0.00 0.42 0.00 0.00 57.03 57.27 2k53 h ASP 11 Cb -0.05 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 40.67 2k53 h ASP 11 CO -0.04 1.21 0.54 0.58 -2.88 0.00 0.00 179.24 178.66 2k53 h VAL 12 N 0.84 1.15 0.00 2.25 2.07 -0.52 -0.01 116.25 122.03 2k53 h VAL 12 Ca 0.10 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2k53 h VAL 12 Cb 0.84 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2k53 h VAL 12 CO 0.07 0.19 -0.03 -0.07 0.02 0.00 0.00 177.57 177.76 2k53 h LEU 13 N 1.06 0.00 -0.23 2.57 3.38 -0.82 -1.47 115.31 119.80 2k53 h LEU 13 Ca 0.33 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.11 2k53 h LEU 13 Cb -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2k53 h LEU 13 CO -0.11 0.03 -0.90 1.56 0.09 0.00 0.00 178.44 179.11 2k53 h GLN 14 N 0.00 0.05 -0.16 1.13 1.08 0.27 -3.13 115.11 114.34 2k53 h GLN 14 Ca -0.00 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 57.07 2k53 h GLN 14 Cb 0.23 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.68 2k53 h GLN 14 CO 0.00 0.91 -0.16 0.52 -0.95 0.00 0.00 178.83 179.15 2k53 h MET 15 N 0.02 0.39 -2.05 1.46 2.86 -0.60 -3.46 114.93 113.56 2k53 h MET 15 Ca -0.02 -0.21 0.02 0.00 -2.06 0.00 0.00 59.70 57.44 2k53 h MET 15 Cb 1.57 0.01 -0.21 0.00 0.06 0.00 0.00 31.60 33.02 2k53 h MET 15 CO 0.12 0.77 -0.05 0.34 1.06 0.00 0.00 176.91 179.16 2k53 s ASP 16 N -6.17 -0.96 0.48 1.22 -1.08 -0.66 -5.03 116.67 104.47 2k53 s ASP 16 Ca -0.14 1.49 0.23 0.00 -0.52 0.00 0.00 52.55 53.61 2k53 s ASP 16 Cb 0.05 1.59 1.23 0.00 -1.46 0.00 0.00 42.92 44.33 2k53 s ASP 16 CO 0.76 -0.23 2.00 0.03 0.52 0.00 0.00 175.17 178.25 2k53 h ARG 17 N 7.29 0.00 0.00 4.34 2.47 -1.81 -3.02 114.38 123.64 2k53 h ARG 17 Ca -0.27 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 2k53 h ARG 17 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 2k53 h ARG 17 CO 0.15 0.18 0.00 0.41 0.56 0.00 0.00 179.97 181.27 2k53 n GLY 18 N -0.64 -0.29 0.05 0.04 0.00 -1.26 -1.33 105.19 101.76 2k53 n GLY 18 Ca -0.02 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.08 2k53 n GLY 18 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2k53 n THR 19 N -1.06 0.28 -0.07 2.61 -2.24 -1.14 -4.30 114.28 108.37 2k53 n THR 19 Ca 0.05 -0.18 -0.07 0.00 -2.27 0.00 0.00 64.05 61.58 2k53 n THR 19 Cb 0.03 -0.19 -0.01 0.00 -2.10 0.00 0.00 70.33 68.06 2k53 n THR 19 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k53 h ALA 20 N 2.68 0.06 -0.44 6.98 0.00 -1.46 -1.56 119.26 125.53 2k53 h ALA 20 Ca 0.00 0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.10 2k53 h ALA 20 Cb 0.66 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2k53 h ALA 20 CO 0.00 -0.55 0.30 -1.00 0.00 0.00 0.00 179.25 178.00 2k53 h PRO 21 N -0.12 0.22 -0.08 0.00 0.13 -1.82 -1.05 132.00 129.28 2k53 h PRO 21 Ca 0.15 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 2k53 h PRO 21 Cb 0.34 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.42 2k53 h PRO 21 CO -0.35 0.15 0.00 0.82 -0.23 0.00 0.00 178.00 178.38 2k53 h ILE 22 N 0.23 1.25 -0.24 -3.56 2.04 -1.55 0.40 117.51 116.07 2k53 h ILE 22 Ca 0.20 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.29 2k53 h ILE 22 Cb 0.51 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 2k53 h ILE 22 CO -0.04 0.22 0.16 -0.26 0.00 0.00 0.00 178.15 178.23 2k53 h PHE 23 N -0.13 0.31 -0.82 1.37 0.04 -0.93 -2.51 116.94 114.28 2k53 h PHE 23 Ca 0.02 0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.82 2k53 h PHE 23 Cb 0.34 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 38.34 2k53 h PHE 23 CO 0.03 0.21 0.53 0.82 -0.60 0.00 0.00 178.31 179.30 2k53 h ILE 24 N 0.32 1.17 -0.64 -0.55 2.04 -1.17 -0.82 117.51 117.86 2k53 h ILE 24 Ca 0.09 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.62 2k53 h ILE 24 Cb -0.02 0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 36.03 2k53 h ILE 24 CO -0.02 0.19 0.38 -1.13 0.00 0.00 0.00 178.15 177.58 2k53 h ASN 25 N 1.06 0.61 0.77 1.72 -1.24 -0.68 -1.38 115.58 116.44 2k53 h ASN 25 Ca 0.31 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.33 2k53 h ASN 25 Cb -0.06 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 38.87 2k53 h ASN 25 CO -0.09 0.42 0.00 0.59 -1.29 0.00 0.00 177.43 177.06 2k53 n ASN 26 N -4.74 0.00 0.00 1.15 3.02 -0.96 -4.88 115.26 108.85 2k53 n ASN 26 Ca 0.07 0.49 0.00 0.00 -0.03 0.00 0.00 54.58 55.10 2k53 n ASN 26 Cb 0.11 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.78 2k53 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k53 n GLY 27 N 0.82 0.94 3.77 7.41 0.00 -0.52 -4.78 105.19 112.84 2k53 n GLY 27 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2k53 n GLY 27 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k53 s MET 28 N 0.00 4.34 -0.27 1.61 -1.94 -0.35 -4.97 119.30 117.73 2k53 s MET 28 Ca 0.00 2.22 -0.03 0.00 -1.71 0.00 0.00 55.69 56.18 2k53 s MET 28 Cb 0.00 -3.08 0.15 0.00 2.01 0.00 0.00 34.83 33.92 2k53 s MET 28 CO 0.00 -0.22 0.48 -1.01 -0.01 0.00 0.00 175.02 174.27 2k53 s HIS 29 N -0.99 -1.17 -0.29 -0.03 3.76 -1.26 -4.27 115.29 111.05 2k53 s HIS 29 Ca 0.50 1.30 -0.16 0.00 -0.15 0.00 0.00 55.06 56.56 2k53 s HIS 29 Cb -0.40 0.30 0.11 0.00 1.11 0.00 0.00 32.58 33.70 2k53 s HIS 29 CO 0.52 -0.77 0.83 0.00 -0.85 0.00 0.00 174.74 174.47 2k53 n LEU 31 N 4.04 3.63 -3.92 0.00 -0.00 -1.26 -4.08 117.00 115.42 2k53 n LEU 31 Ca -0.19 -3.10 -0.28 0.00 -0.00 0.00 0.00 56.01 52.44 2k53 n LEU 31 Cb 0.58 -1.47 0.01 0.00 -0.00 0.00 0.00 43.42 42.54 2k53 n LEU 31 CO -0.00 -1.08 -0.01 0.61 -0.00 0.00 0.00 177.39 176.90 2k53 n GLY 32 N 5.21 -0.39 3.35 -3.96 0.00 -1.26 -4.98 105.19 103.15 2k53 n GLY 32 Ca 0.47 0.16 -0.24 0.00 0.00 0.00 0.00 46.02 46.41 2k53 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k53 h PRO 34 N 3.53 0.17 -0.86 0.00 0.11 -1.94 -2.42 132.00 130.59 2k53 h PRO 34 Ca -0.45 -0.01 0.17 0.00 0.11 0.00 0.00 66.00 65.82 2k53 h PRO 34 Cb 1.20 -0.04 -0.16 0.00 0.11 0.00 0.00 31.00 32.11 2k53 h PRO 34 CO 0.46 0.11 -0.24 0.77 -0.21 0.00 0.00 178.00 178.90 2k53 h SER 35 N 0.17 -0.87 -0.00 -2.05 0.02 -1.96 0.66 113.55 109.52 2k53 h SER 35 Ca 0.74 0.26 0.00 0.00 -0.84 0.00 0.00 61.79 61.96 2k53 h SER 35 Cb 2.25 0.56 0.00 0.00 0.14 0.00 0.00 62.40 65.34 2k53 h SER 35 CO -0.37 -0.29 -0.05 -1.20 -1.14 0.00 0.00 176.83 173.79 2k53 n SER 36 N -5.55 0.93 -0.09 3.07 7.64 -1.13 -4.59 113.62 113.90 2k53 n SER 36 Ca 0.12 -0.97 -0.11 0.00 1.01 0.00 0.00 58.87 58.92 2k53 n SER 36 Cb 0.43 0.32 -0.04 0.00 -1.01 0.00 0.00 64.21 63.92 2k53 n SER 36 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2k53 n MET 37 N -0.21 0.52 0.18 1.43 2.81 -0.89 -4.58 117.12 116.39 2k53 n MET 37 Ca 0.02 0.21 0.07 0.00 -1.81 0.00 0.00 57.70 56.19 2k53 n MET 37 Cb 0.08 -1.41 0.20 0.00 -0.71 0.00 0.00 33.22 31.38 2k53 n MET 37 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 2k53 h GLY 38 N -0.97 0.00 -1.75 3.03 0.00 -1.06 0.21 103.07 102.54 2k53 h GLY 38 Ca -0.09 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.77 2k53 h GLY 38 CO -0.06 0.00 0.37 -0.54 0.00 0.00 0.00 176.54 176.32 2k53 s GLU 39 N -3.24 3.93 0.63 4.80 0.41 -0.98 -4.80 118.70 119.45 2k53 s GLU 39 Ca 0.03 0.94 -0.18 0.00 -0.41 0.00 0.00 54.97 55.35 2k53 s GLU 39 Cb 0.08 -2.14 -0.02 0.00 -1.78 0.00 0.00 34.13 30.27 2k53 s GLU 39 CO 0.69 -0.28 1.22 -1.12 -0.49 0.00 0.00 175.26 175.28 2k53 s SER 40 N -3.12 4.94 0.13 -0.19 0.01 -1.26 -2.87 113.70 111.33 2k53 s SER 40 Ca 0.59 2.41 -0.28 0.00 1.31 0.00 0.00 55.95 59.97 2k53 s SER 40 Cb -0.10 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.47 2k53 s SER 40 CO 0.32 -1.77 1.60 0.40 0.41 0.00 0.00 173.24 174.20 2k53 h ILE 41 N 0.61 0.22 -0.84 1.44 2.04 -0.67 0.12 117.51 120.43 2k53 h ILE 41 Ca -0.50 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 2k53 h ILE 41 Cb 1.30 0.22 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2k53 h ILE 41 CO 0.54 0.00 0.40 1.05 0.00 0.00 0.00 178.15 180.14 2k53 h GLU 42 N -0.50 1.21 0.38 2.37 4.11 -1.28 -0.38 114.58 120.48 2k53 h GLU 42 Ca 0.06 -0.18 -0.02 0.00 0.07 0.00 0.00 59.36 59.30 2k53 h GLU 42 Cb 0.61 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2k53 h GLU 42 CO -0.32 0.93 -0.18 0.22 0.07 0.00 0.00 179.01 179.73 2k53 h ASP 43 N 1.19 -0.43 -0.98 3.06 3.58 -1.67 0.11 116.42 121.28 2k53 h ASP 43 Ca 0.29 -0.10 0.07 0.00 0.42 0.00 0.00 57.03 57.71 2k53 h ASP 43 Cb 0.12 0.11 -0.07 0.00 1.72 0.00 0.00 39.33 41.22 2k53 h ASP 43 CO -0.04 -0.13 0.63 0.00 -2.88 0.00 0.00 179.24 176.82 2k53 h ALA 44 N -0.22 1.38 0.20 -0.78 0.00 -0.74 -0.93 119.26 118.16 2k53 h ALA 44 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2k53 h ALA 44 Cb 0.51 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2k53 h ALA 44 CO 0.09 0.38 -0.15 0.00 0.00 0.00 0.00 179.25 179.57 2k53 h ALA 46 N 0.42 1.04 -0.55 0.00 0.00 -0.17 1.28 119.26 121.28 2k53 h ALA 46 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2k53 h ALA 46 Cb 0.31 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2k53 h ALA 46 CO -0.00 0.16 0.34 0.28 0.00 0.00 0.00 179.25 180.03 2k53 h VAL 47 N 0.83 1.16 -0.01 0.00 2.07 -1.08 -2.68 116.25 116.54 2k53 h VAL 47 Ca 0.34 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2k53 h VAL 47 Cb 0.18 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2k53 h VAL 47 CO -0.18 0.16 -0.13 1.57 0.02 0.00 0.00 177.57 179.02 2k53 n HIS 48 N -4.67 0.00 -2.23 1.57 -0.00 -0.53 -4.94 115.22 104.41 2k53 n HIS 48 Ca 0.03 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.08 2k53 n HIS 48 Cb 0.04 -0.07 -0.01 0.00 -0.12 0.00 0.00 29.99 29.83 2k53 n HIS 48 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2k53 n GLY 49 N 1.26 -0.14 3.87 1.57 0.00 0.40 -5.02 105.19 107.13 2k53 n GLY 49 Ca 0.16 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 2k53 n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k53 s ILE 50 N -2.64 4.86 -0.67 -0.61 1.01 0.11 -4.97 121.20 118.29 2k53 s ILE 50 Ca 0.00 0.53 -0.28 0.00 0.00 0.00 0.00 60.65 60.91 2k53 s ILE 50 Cb 0.00 -3.66 0.03 0.00 0.01 0.00 0.00 42.46 38.84 2k53 s ILE 50 CO 0.00 -0.23 1.24 -0.62 0.00 0.00 0.00 174.94 175.33 2k53 s ASP 51 N -2.65 6.29 0.44 3.58 -1.08 -1.26 -4.40 116.67 117.58 2k53 s ASP 51 Ca 0.49 -0.21 0.24 0.00 -0.52 0.00 0.00 52.55 52.55 2k53 s ASP 51 Cb -0.11 -2.56 0.86 0.00 -1.46 0.00 0.00 42.92 39.66 2k53 s ASP 51 CO 0.24 -1.68 1.80 0.00 0.52 0.00 0.00 175.17 176.05 2k53 h ALA 52 N 9.82 0.99 -0.01 3.66 0.00 -1.93 -3.11 119.26 128.68 2k53 h ALA 52 Ca -0.27 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.46 2k53 h ALA 52 Cb 1.05 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2k53 h ALA 52 CO 1.24 0.28 -0.08 0.22 0.00 0.00 0.00 179.25 180.91 2k53 h ASP 53 N 0.00 -0.23 0.04 0.00 3.58 -2.00 -1.21 116.42 116.60 2k53 h ASP 53 Ca -0.00 0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 2k53 h ASP 53 Cb 0.79 0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2k53 h ASP 53 CO 0.03 -0.11 -0.02 0.11 -2.88 0.00 0.00 179.24 176.36 2k53 h LYS 54 N -0.13 -0.05 0.17 0.28 1.57 -1.98 -2.93 116.57 113.49 2k53 h LYS 54 Ca 0.04 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 2k53 h LYS 54 Cb 0.18 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 2k53 h LYS 54 CO -0.09 0.14 -0.25 1.25 -0.57 0.00 0.00 179.45 179.93 2k53 h LEU 55 N -0.24 -0.69 -0.64 2.94 5.85 -1.46 -1.03 115.31 120.04 2k53 h LEU 55 Ca -0.01 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.81 2k53 h LEU 55 Cb 0.22 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 2k53 h LEU 55 CO 0.01 -0.35 0.40 0.58 -0.34 0.00 0.00 178.44 178.75 2k53 h VAL 56 N -0.48 1.10 -0.67 1.05 2.07 -1.30 -0.67 116.25 117.35 2k53 h VAL 56 Ca 0.02 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2k53 h VAL 56 Cb 0.48 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2k53 h VAL 56 CO -0.11 0.15 0.39 0.11 0.02 0.00 0.00 177.57 178.13 2k53 h LYS 57 N 0.80 0.92 -0.77 1.57 1.57 -1.30 -0.93 116.57 118.43 2k53 h LYS 57 Ca 0.25 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 2k53 h LYS 57 Cb -0.01 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.08 2k53 h LYS 57 CO -0.09 0.67 0.27 0.93 -0.57 0.00 0.00 179.45 180.66 2k53 h GLU 58 N 0.92 1.18 -0.21 3.15 5.08 -0.69 -1.09 114.58 122.91 2k53 h GLU 58 Ca 0.24 -0.24 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2k53 h GLU 58 Cb -0.00 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 2k53 h GLU 58 CO -0.04 0.98 0.11 -0.07 -1.00 0.00 0.00 179.01 178.98 2k53 h LEU 59 N 1.14 0.16 0.38 1.33 3.38 -0.74 -2.01 115.31 118.94 2k53 h LEU 59 Ca 0.25 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 2k53 h LEU 59 Cb 0.27 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2k53 h LEU 59 CO -0.01 0.12 -0.46 0.78 0.09 0.00 0.00 178.44 178.96 2k53 h ASN 60 N 0.23 -1.27 -0.94 -0.43 2.35 -0.86 -2.34 115.58 112.32 2k53 h ASN 60 Ca 0.09 0.11 0.22 0.00 -0.55 0.00 0.00 56.30 56.17 2k53 h ASN 60 Cb 0.02 0.43 -0.12 0.00 0.05 0.00 0.00 38.32 38.70 2k53 h ASN 60 CO -0.06 -0.59 0.49 -0.33 -1.65 0.00 0.00 177.43 175.29 2k53 h GLU 61 N -0.86 0.50 0.44 0.81 5.08 -1.15 -0.64 114.58 118.75 2k53 h GLU 61 Ca -0.03 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 2k53 h GLU 61 Cb 0.78 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2k53 h GLU 61 CO -0.11 0.33 -0.21 -0.92 -1.00 0.00 0.00 179.01 177.10 2k53 h TYR 62 N 0.51 -0.55 -0.78 4.33 3.20 -1.03 -1.14 116.97 121.51 2k53 h TYR 62 Ca 0.59 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.42 2k53 h TYR 62 Cb 1.09 0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.51 2k53 h TYR 62 CO -0.07 -0.29 0.38 0.74 -1.64 0.00 0.00 178.16 177.28 2k53 h PHE 63 N -0.70 1.11 -0.78 -3.82 0.04 -0.86 -2.46 116.94 109.48 2k53 h PHE 63 Ca -0.06 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 2k53 h PHE 63 Cb 0.51 -0.35 -0.04 0.00 2.20 0.00 0.00 35.95 38.28 2k53 h PHE 63 CO -0.02 0.80 0.46 0.93 -0.60 0.00 0.00 178.31 179.88 2k53 h GLU 64 N 1.11 1.07 -0.80 1.51 5.08 -1.07 0.26 114.58 121.74 2k53 h GLU 64 Ca 0.27 -0.11 0.14 0.00 -1.00 0.00 0.00 59.36 58.66 2k53 h GLU 64 Cb 0.10 -0.22 -0.09 0.00 0.50 0.00 0.00 28.75 29.05 2k53 h GLU 64 CO -0.04 0.77 0.39 0.87 -1.00 0.00 0.00 179.01 180.00 2k53 h LYS 65 N 1.07 0.56 -0.18 2.33 1.79 -0.75 0.81 116.57 122.20 2k53 h LYS 65 Ca 0.28 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 58.68 2k53 h LYS 65 Cb -0.01 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.50 2k53 h LYS 65 CO -0.05 0.37 -0.02 0.87 -1.08 0.00 0.00 179.45 179.54 2k53 h LYS 66 N 0.58 0.34 -0.18 3.15 1.57 -1.04 -1.91 116.57 119.08 2k53 h LYS 66 Ca 0.43 -0.12 0.05 0.00 -1.87 0.00 0.00 60.65 59.14 2k53 h LYS 66 Cb 0.59 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2k53 h LYS 66 CO -0.35 0.57 0.16 0.93 -0.57 0.00 0.00 179.45 180.18 2k53 h GLU 67 N 0.07 0.00 -0.05 3.15 5.08 -0.17 0.32 114.58 122.98 2k53 h GLU 67 Ca 0.05 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 2k53 h GLU 67 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2k53 h GLU 67 CO 0.01 0.00 -0.25 0.28 -1.00 0.00 0.00 179.01 178.06 2k53 h VAL 68 N 0.00 1.45 0.29 3.13 2.07 -0.62 -3.39 116.25 119.19 2k53 h VAL 68 Ca 0.08 -1.70 -0.01 0.00 0.82 0.00 0.00 66.70 65.89 2k53 h VAL 68 Cb 0.40 2.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.57 2k53 h VAL 68 CO -0.00 0.48 -0.14 -0.07 0.02 0.00 0.00 177.57 177.85 2k53 h LEU 69 N -0.28 -0.33 0.00 2.57 3.38 -0.37 -3.51 115.31 116.76 2k53 h LEU 69 Ca -0.02 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k53 h LEU 69 Cb 0.90 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2k53 h LEU 69 CO 0.05 -0.03 0.00 -0.62 0.09 0.00 0.00 178.44 177.94