#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lea s LYS 2 N 0.00 0.32 0.05 2.12 -2.85 -1.26 -5.12 119.74 113.00 1lea s LYS 2 Ca 0.00 -0.71 -0.27 0.00 -1.00 0.00 0.00 55.97 53.99 1lea s LYS 2 Cb 0.00 -1.31 -0.05 0.00 -2.06 0.00 0.00 37.83 34.41 1lea s LYS 2 CO 0.00 -1.04 0.84 0.00 0.10 0.00 0.00 175.35 175.25 1lea s ALA 3 N 1.90 3.31 -0.17 0.59 0.00 -1.26 -4.72 121.76 121.41 1lea s ALA 3 Ca 0.10 0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.37 1lea s ALA 3 Cb -0.17 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1lea s ALA 3 CO -0.31 -0.00 0.07 -0.51 0.00 0.00 0.00 175.76 175.01 1lea s LEU 4 N 0.13 3.86 0.70 0.00 1.43 -1.26 -5.11 118.68 118.42 1lea s LEU 4 Ca 0.42 0.12 -0.14 0.00 -1.03 0.00 0.00 54.13 53.50 1lea s LEU 4 Cb -0.21 -1.97 0.02 0.00 0.03 0.00 0.00 46.19 44.06 1lea s LEU 4 CO 0.25 0.21 1.12 0.42 0.23 0.00 0.00 176.35 178.58 1lea s THR 5 N 0.16 3.06 0.20 5.49 -4.23 -1.26 -4.71 115.64 114.34 1lea s THR 5 Ca 0.05 0.47 -0.13 0.00 -1.18 0.00 0.00 61.69 60.90 1lea s THR 5 Cb -0.12 -2.97 0.17 0.00 1.34 0.00 0.00 72.50 70.91 1lea s THR 5 CO 0.00 -0.33 1.66 0.00 -0.54 0.00 0.00 174.62 175.42 1lea h ALA 6 N -0.25 0.46 -0.03 3.99 0.00 -1.99 -0.34 119.26 121.11 1lea h ALA 6 Ca -0.46 0.19 -0.20 0.00 0.00 0.00 0.00 54.91 54.43 1lea h ALA 6 Cb 1.25 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 1lea h ALA 6 CO 0.52 -0.41 -0.85 -0.09 0.00 0.00 0.00 179.25 178.42 1lea h ARG 7 N 0.06 0.36 -0.65 0.00 9.65 -2.00 -1.99 114.38 119.81 1lea h ARG 7 Ca 0.27 -0.35 -0.08 0.00 -1.10 0.00 0.00 59.98 58.72 1lea h ARG 7 Cb 0.43 0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 29.07 1lea h ARG 7 CO -0.51 1.02 0.09 -0.56 2.80 0.00 0.00 179.97 182.82 1lea h GLN 8 N 0.22 1.08 -0.83 0.20 3.07 -1.85 -2.78 115.11 114.22 1lea h GLN 8 Ca -0.05 -0.29 0.07 0.00 0.09 0.00 0.00 58.65 58.46 1lea h GLN 8 Cb 1.46 -0.12 -0.05 0.00 0.08 0.00 0.00 27.48 28.84 1lea h GLN 8 CO 0.14 1.00 0.54 0.37 0.09 0.00 0.00 178.83 180.98 1lea h GLN 9 N 1.01 0.88 -0.51 0.06 5.75 -1.08 -0.74 115.11 120.48 1lea h GLN 9 Ca 0.20 -0.05 0.05 0.00 -0.15 0.00 0.00 58.65 58.69 1lea h GLN 9 Cb 0.45 -0.20 -0.05 0.00 1.07 0.00 0.00 27.48 28.76 1lea h GLN 9 CO 0.02 0.58 0.25 0.93 -2.65 0.00 0.00 178.83 177.96 1lea h GLU 10 N 0.91 0.48 -0.20 1.69 5.08 -1.28 -0.11 114.58 121.14 1lea h GLU 10 Ca 0.36 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.73 1lea h GLU 10 Cb 0.23 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1lea h GLU 10 CO -0.13 0.32 -0.02 0.28 -1.00 0.00 0.00 179.01 178.46 1lea h VAL 11 N 0.49 0.84 -0.45 3.13 2.07 -1.19 -2.11 116.25 119.02 1lea h VAL 11 Ca 0.23 -0.01 0.05 0.00 0.82 0.00 0.00 66.70 67.78 1lea h VAL 11 Cb 0.15 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 1lea h VAL 11 CO -0.17 0.01 0.19 0.15 0.02 0.00 0.00 177.57 177.78 1lea h PHE 12 N 0.04 0.35 -0.90 1.57 3.57 -1.07 -2.43 116.94 118.08 1lea h PHE 12 Ca 0.10 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.66 1lea h PHE 12 Cb 0.13 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.73 1lea h PHE 12 CO -0.19 0.15 0.58 -0.44 -2.23 0.00 0.00 178.31 176.18 1lea h ASP 13 N 0.39 0.95 -0.63 0.41 3.32 -0.98 -1.84 116.42 118.05 1lea h ASP 13 Ca 0.21 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 1lea h ASP 13 Cb 0.16 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1lea h ASP 13 CO -0.18 0.65 0.29 0.25 -1.72 0.00 0.00 179.24 178.52 1lea h LEU 14 N 1.11 0.86 0.10 1.55 5.85 -1.26 0.06 115.31 123.58 1lea h LEU 14 Ca 0.36 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1lea h LEU 14 Cb 0.04 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 1lea h LEU 14 CO -0.13 0.75 -0.09 0.40 -0.34 0.00 0.00 178.44 179.03 1lea h ILE 15 N 0.94 0.79 -0.56 4.05 2.04 -1.22 -1.89 117.51 121.66 1lea h ILE 15 Ca 0.22 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.08 1lea h ILE 15 Cb 0.14 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 1lea h ILE 15 CO -0.02 0.00 0.35 0.03 0.00 0.00 0.00 178.15 178.50 1lea h ARG 16 N -0.21 0.76 -0.48 2.37 3.08 -1.30 -2.71 114.38 115.89 1lea h ARG 16 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1lea h ARG 16 Cb 0.20 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1lea h ARG 16 CO -0.02 0.54 0.31 0.22 -1.07 0.00 0.00 179.97 179.94 1lea h ASP 17 N 0.76 0.56 -0.25 7.04 -0.00 -1.00 -0.90 116.42 122.63 1lea h ASP 17 Ca 0.20 -0.03 -0.11 0.00 -0.00 0.00 0.00 57.03 57.09 1lea h ASP 17 Cb -0.03 -0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 39.14 1lea h ASP 17 CO -0.04 0.42 -0.22 -0.74 -0.00 0.00 0.00 179.24 178.67 1lea h HIS 18 N 0.65 0.81 -0.26 0.28 2.76 -1.39 -1.97 115.15 116.03 1lea h HIS 18 Ca 0.17 -0.18 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 1lea h HIS 18 Cb -0.05 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 28.70 1lea h HIS 18 CO -0.04 0.87 0.13 0.82 -1.30 0.00 0.00 177.93 178.41 1lea h ILE 19 N 0.63 1.13 0.00 6.26 2.04 -1.41 -0.71 117.51 125.46 1lea h ILE 19 Ca 0.09 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.56 1lea h ILE 19 Cb 0.70 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1lea h ILE 19 CO 0.05 0.13 -0.13 -1.28 0.00 0.00 0.00 178.15 176.93 1lea h SER 20 N 0.29 0.00 0.07 1.72 0.87 -1.14 -0.69 113.55 114.67 1lea h SER 20 Ca 0.09 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.45 1lea h SER 20 Cb 0.09 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 1lea h SER 20 CO -0.01 0.13 -1.04 1.56 -0.53 0.00 0.00 176.83 176.93 1lea h GLN 21 N 0.00 0.15 0.00 2.24 4.20 -1.36 -3.44 115.11 116.90 1lea h GLN 21 Ca -0.00 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1lea h GLN 21 Cb 0.23 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1lea h GLN 21 CO 0.02 1.12 -1.48 0.25 -0.67 0.00 0.00 178.83 178.07 1lea n THR 22 N -4.19 0.00 0.00 -0.54 -2.24 -0.27 -5.04 114.28 102.00 1lea n THR 22 Ca -0.22 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1lea n THR 22 Cb 0.76 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1lea n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lea n GLY 23 N 1.72 2.58 3.92 3.38 0.00 -0.27 -5.02 105.19 111.51 1lea n GLY 23 Ca -0.02 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 45.12 1lea n GLY 23 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1lea s MET 24 N 0.00 3.55 0.71 1.61 0.23 -1.26 -4.71 119.30 119.44 1lea s MET 24 Ca 0.00 -0.23 -0.11 0.00 -1.03 0.00 0.00 55.69 54.32 1lea s MET 24 Cb 0.00 -2.75 0.02 0.00 -1.53 0.00 0.00 34.83 30.57 1lea s MET 24 CO 0.00 0.30 1.07 -1.25 -2.03 0.00 0.00 175.02 173.11 1lea s PRO 25 N -3.56 2.80 0.62 3.16 0.04 -1.26 -3.07 135.00 133.73 1lea s PRO 25 Ca 0.40 0.91 -0.09 0.00 0.04 0.00 0.00 61.00 62.27 1lea s PRO 25 Cb -0.11 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.45 1lea s PRO 25 CO 0.30 -1.18 0.98 -1.25 0.04 0.00 0.00 177.00 175.88 1lea s PRO 26 N -5.06 3.08 0.64 0.56 0.04 -1.26 -4.52 135.00 128.48 1lea s PRO 26 Ca 0.58 0.30 -0.14 0.00 0.04 0.00 0.00 61.00 61.79 1lea s PRO 26 Cb -0.14 -2.17 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1lea s PRO 26 CO 0.55 -0.74 1.06 0.95 0.04 0.00 0.00 177.00 178.86 1lea s THR 27 N -3.12 3.86 0.51 1.26 -4.23 -1.26 -4.30 115.64 108.36 1lea s THR 27 Ca 0.55 0.77 0.17 0.00 -1.18 0.00 0.00 61.69 61.99 1lea s THR 27 Cb -0.11 -3.36 0.30 0.00 1.34 0.00 0.00 72.50 70.67 1lea s THR 27 CO 0.49 -0.63 2.11 0.03 -0.54 0.00 0.00 174.62 176.07 1lea h ARG 28 N -0.05 0.07 -0.26 3.99 -0.00 -1.98 -2.07 114.38 114.09 1lea h ARG 28 Ca -0.46 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.01 1lea h ARG 28 Cb 1.22 -0.02 -0.01 0.00 0.00 0.00 0.00 29.97 31.16 1lea h ARG 28 CO 0.57 0.05 0.13 0.00 0.00 0.00 0.00 179.97 180.72 1lea h ALA 29 N 1.91 0.34 -0.71 0.04 0.00 -1.95 -2.29 119.26 116.60 1lea h ALA 29 Ca 0.07 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.98 1lea h ALA 29 Cb 0.20 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1lea h ALA 29 CO -0.01 -0.11 0.38 0.93 0.00 0.00 0.00 179.25 180.44 1lea h GLU 30 N 0.30 0.65 -0.22 0.00 5.08 -1.86 -0.35 114.58 118.18 1lea h GLU 30 Ca 0.09 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1lea h GLU 30 Cb 0.10 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1lea h GLU 30 CO -0.01 0.43 0.13 0.82 -1.00 0.00 0.00 179.01 179.38 1lea h ILE 31 N 0.67 1.04 -0.35 3.13 2.04 -1.41 -1.18 117.51 121.45 1lea h ILE 31 Ca 0.33 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 66.08 1lea h ILE 31 Cb 0.28 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1lea h ILE 31 CO -0.23 0.05 0.17 0.00 0.00 0.00 0.00 178.15 178.14 1lea h ALA 32 N 1.09 0.46 0.01 1.87 0.00 -1.32 -3.28 119.26 118.09 1lea h ALA 32 Ca 0.08 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1lea h ALA 32 Cb -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1lea h ALA 32 CO -0.03 0.02 -0.18 1.96 0.00 0.00 0.00 179.25 181.03 1lea h GLN 33 N 0.43 0.10 -0.23 0.00 4.20 -1.06 -1.14 115.11 117.41 1lea h GLN 33 Ca 0.12 -0.12 -0.19 0.00 0.06 0.00 0.00 58.65 58.52 1lea h GLN 33 Cb 0.13 0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1lea h GLN 33 CO -0.01 0.93 -0.60 0.00 -0.67 0.00 0.00 178.83 178.48 1lea h ARG 34 N -0.68 0.81 0.00 1.46 3.08 -1.40 -3.25 114.38 114.40 1lea h ARG 34 Ca -0.03 -0.57 0.00 0.00 0.07 0.00 0.00 59.98 59.46 1lea h ARG 34 Cb 1.00 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.14 1lea h ARG 34 CO 0.03 1.19 0.00 -0.07 -1.07 0.00 0.00 179.97 180.05 1lea h LEU 35 N 0.56 0.00 -1.79 3.04 3.38 -1.74 -3.49 115.31 115.27 1lea h LEU 35 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1lea h LEU 35 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1lea h LEU 35 CO 0.13 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.27 1lea n GLY 36 N 0.93 0.29 3.35 0.83 0.00 -1.19 -5.10 105.19 104.30 1lea n GLY 36 Ca 0.04 -0.43 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 1lea n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lea s PHE 37 N -2.60 2.92 0.25 1.61 0.08 -0.44 -5.04 117.98 114.77 1lea s PHE 37 Ca 0.00 -0.79 -0.02 0.00 0.12 0.00 0.00 56.93 56.24 1lea s PHE 37 Cb 0.00 -2.00 0.31 0.00 -0.57 0.00 0.00 43.02 40.76 1lea s PHE 37 CO 0.00 -0.39 1.74 0.00 -0.10 0.00 0.00 175.22 176.48 1lea h ARG 38 N 7.49 0.80 -4.93 0.44 3.08 -1.99 -3.41 114.38 115.86 1lea h ARG 38 Ca -0.36 -0.22 -0.67 0.00 0.07 0.00 0.00 59.98 58.80 1lea h ARG 38 Cb 1.18 -0.09 -0.30 0.00 0.08 0.00 0.00 29.97 30.84 1lea h ARG 38 CO 0.59 0.82 -0.73 -1.12 -1.07 0.00 0.00 179.97 178.47 1lea s SER 39 N -6.65 4.35 0.59 7.04 0.01 -1.26 -5.04 113.70 112.74 1lea s SER 39 Ca -0.10 -0.66 0.29 0.00 1.31 0.00 0.00 55.95 56.79 1lea s SER 39 Cb 0.14 -1.71 1.49 0.00 0.21 0.00 0.00 66.02 66.15 1lea s SER 39 CO 0.81 -0.09 1.91 -0.65 0.41 0.00 0.00 173.24 175.64 1lea h PRO 40 N 8.08 0.00 -0.09 12.44 0.11 -1.95 -1.84 132.00 148.74 1lea h PRO 40 Ca -0.37 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.76 1lea h PRO 40 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1lea h PRO 40 CO 0.59 0.00 0.07 -0.91 -0.21 0.00 0.00 178.00 177.54 1lea h ASN 41 N 0.00 0.06 -0.49 -2.05 4.21 -1.98 -2.05 115.58 113.28 1lea h ASN 41 Ca 0.20 -0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.65 1lea h ASN 41 Cb 1.12 -0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 38.29 1lea h ASN 41 CO -0.00 0.04 0.05 0.00 -1.29 0.00 0.00 177.43 176.23 1lea h ALA 42 N 1.95 0.66 -0.44 -0.83 0.00 -1.77 -0.58 119.26 118.25 1lea h ALA 42 Ca 0.04 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1lea h ALA 42 Cb 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1lea h ALA 42 CO -0.01 0.42 0.19 0.00 0.00 0.00 0.00 179.25 179.86 1lea h ALA 43 N 0.95 0.54 -0.67 0.00 0.00 -1.64 -2.39 119.26 116.07 1lea h ALA 43 Ca 0.15 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1lea h ALA 43 Cb 0.44 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 1lea h ALA 43 CO 0.02 -0.18 0.39 1.49 0.00 0.00 0.00 179.25 180.97 1lea h GLU 44 N 0.39 0.72 -0.53 0.00 4.81 -1.39 -2.24 114.58 116.34 1lea h GLU 44 Ca 0.20 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1lea h GLU 44 Cb 0.14 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1lea h GLU 44 CO -0.16 0.47 0.26 1.49 -0.73 0.00 0.00 179.01 180.34 1lea h GLU 45 N 0.74 0.76 -0.82 1.92 4.81 -1.00 -0.37 114.58 120.62 1lea h GLU 45 Ca 0.29 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1lea h GLU 45 Cb 0.12 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 1lea h GLU 45 CO -0.15 0.62 0.35 0.45 -0.73 0.00 0.00 179.01 179.55 1lea h HIS 46 N 0.71 1.22 -0.37 0.92 3.86 -1.47 -1.60 115.15 118.42 1lea h HIS 46 Ca 0.18 -0.08 0.04 0.00 -1.16 0.00 0.00 60.37 59.35 1lea h HIS 46 Cb 0.10 -0.37 -0.04 0.00 1.06 0.00 0.00 27.41 28.17 1lea h HIS 46 CO -0.01 0.90 0.15 1.25 0.86 0.00 0.00 177.93 181.09 1lea h LEU 47 N 1.18 0.19 -0.39 2.43 5.85 -1.29 -2.15 115.31 121.13 1lea h LEU 47 Ca 0.28 0.03 0.06 0.00 0.84 0.00 0.00 57.88 59.09 1lea h LEU 47 Cb 0.18 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 1lea h LEU 47 CO -0.03 0.15 0.08 0.11 -0.34 0.00 0.00 178.44 178.41 1lea h LYS 48 N 0.32 0.20 -0.86 1.25 1.57 -1.02 -2.58 116.57 115.45 1lea h LYS 48 Ca 0.16 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 59.05 1lea h LYS 48 Cb 0.12 -0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.32 1lea h LYS 48 CO -0.15 0.13 0.55 0.00 -0.57 0.00 0.00 179.45 179.42 1lea h ALA 49 N 1.29 1.76 -0.07 3.86 0.00 -1.22 -0.24 119.26 124.64 1lea h ALA 49 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1lea h ALA 49 Cb 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1lea h ALA 49 CO -0.24 0.05 0.04 -0.07 0.00 0.00 0.00 179.25 179.02 1lea h LEU 50 N 0.75 0.08 -0.60 0.00 3.38 -1.21 -2.50 115.31 115.22 1lea h LEU 50 Ca 0.41 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.31 1lea h LEU 50 Cb 0.54 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1lea h LEU 50 CO -0.17 0.11 0.31 0.00 0.09 0.00 0.00 178.44 178.78 1lea h ALA 51 N 0.98 0.77 -0.74 1.53 0.00 -1.22 -2.46 119.26 118.12 1lea h ALA 51 Ca 0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1lea h ALA 51 Cb 0.04 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1lea h ALA 51 CO -0.00 0.31 0.32 0.00 0.00 0.00 0.00 179.25 179.87 1lea h ARG 52 N 0.82 1.08 -0.43 0.00 3.08 -1.11 -3.03 114.38 114.79 1lea h ARG 52 Ca 0.21 -0.17 -0.13 0.00 0.07 0.00 0.00 59.98 59.96 1lea h ARG 52 Cb 0.07 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1lea h ARG 52 CO -0.03 0.86 -0.24 0.87 -1.07 0.00 0.00 179.97 180.36 1lea h LYS 53 N 1.06 0.89 0.00 0.04 1.57 -1.50 -3.49 116.57 115.13 1lea h LYS 53 Ca 0.25 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1lea h LYS 53 Cb 0.17 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1lea h LYS 53 CO -0.03 1.03 0.00 0.41 -0.57 0.00 0.00 179.45 180.29 1lea n GLY 54 N -0.14 1.14 0.00 3.86 0.00 -0.97 -5.05 105.19 104.03 1lea n GLY 54 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1lea n GLY 54 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1lea n VAL 55 N 0.00 0.00 -3.94 1.61 0.24 -0.96 -4.54 118.33 110.73 1lea n VAL 55 Ca 0.00 -0.21 -0.09 0.00 -2.04 0.00 0.00 64.34 62.00 1lea n VAL 55 Cb 0.00 0.39 -0.10 0.00 -1.47 0.00 0.00 33.84 32.66 1lea n VAL 55 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1lea s ILE 56 N -2.48 0.12 -0.26 1.34 -4.36 -1.26 -1.59 121.20 112.71 1lea s ILE 56 Ca -0.02 -0.99 -0.10 0.00 -0.26 0.00 0.00 60.65 59.28 1lea s ILE 56 Cb 0.05 -0.62 -0.04 0.00 1.25 0.00 0.00 42.46 43.10 1lea s ILE 56 CO 0.35 -0.55 0.15 -0.70 0.24 0.00 0.00 174.94 174.43 1lea s GLU 57 N -2.02 3.91 -0.55 0.37 2.12 -0.58 -4.35 118.70 117.60 1lea s GLU 57 Ca -0.10 -0.35 -0.25 0.00 0.36 0.00 0.00 54.97 54.63 1lea s GLU 57 Cb -0.05 -3.53 0.04 0.00 0.26 0.00 0.00 34.13 30.85 1lea s GLU 57 CO -0.02 -0.10 0.98 0.42 -0.54 0.00 0.00 175.26 176.00 1lea s ILE 58 N 1.48 4.34 -0.93 -3.70 1.01 -1.26 -1.22 121.20 120.91 1lea s ILE 58 Ca 0.07 0.41 -0.24 0.00 0.00 0.00 0.00 60.65 60.89 1lea s ILE 58 Cb -0.15 -4.56 0.04 0.00 0.01 0.00 0.00 42.46 37.80 1lea s ILE 58 CO 0.07 -1.12 1.43 -0.69 0.00 0.00 0.00 174.94 174.63 1lea s VAL 59 N 4.08 3.84 -0.70 2.92 1.01 -0.25 -4.95 120.40 126.36 1lea s VAL 59 Ca 0.33 -0.42 -0.27 0.00 0.00 0.00 0.00 61.98 61.62 1lea s VAL 59 Cb -0.12 -4.97 0.03 0.00 0.00 0.00 0.00 36.38 31.33 1lea s VAL 59 CO 0.21 -1.87 1.23 -0.44 0.00 0.00 0.00 175.10 174.23 1lea s SER 60 N 4.80 6.23 0.00 3.32 0.01 -1.26 -2.61 113.70 124.19 1lea s SER 60 Ca 0.44 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.33 1lea s SER 60 Cb -0.03 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1lea s SER 60 CO -0.03 -1.72 0.00 0.61 0.41 0.00 0.00 173.24 172.52 1lea n GLY 61 N 5.30 3.63 3.68 3.44 0.00 -1.26 -5.12 105.19 114.86 1lea n GLY 61 Ca 0.04 -0.58 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 1lea n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lea s ALA 62 N 0.00 3.53 0.08 4.61 0.00 -1.07 -5.00 121.76 123.90 1lea s ALA 62 Ca 0.00 0.41 -0.26 0.00 0.00 0.00 0.00 51.96 52.11 1lea s ALA 62 Cb 0.00 -3.51 -0.16 0.00 0.00 0.00 0.00 23.12 19.45 1lea s ALA 62 CO 0.00 -0.83 1.68 0.77 0.00 0.00 0.00 175.76 177.38 1lea h SER 63 N 7.44 -0.25 -2.49 0.00 0.02 -1.98 -3.10 113.55 113.19 1lea h SER 63 Ca -0.29 -0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 59.92 1lea h SER 63 Cb 1.13 0.06 -0.19 0.00 0.14 0.00 0.00 62.40 63.54 1lea h SER 63 CO 0.91 -0.16 1.06 -0.13 -1.14 0.00 0.00 176.83 177.37 1lea s ARG 64 N -6.08 3.98 -0.42 3.45 0.52 -1.26 -4.11 118.95 115.03 1lea s ARG 64 Ca -0.15 -2.50 0.07 0.00 -0.52 0.00 0.00 55.73 52.63 1lea s ARG 64 Cb 0.05 -4.93 0.23 0.00 0.52 0.00 0.00 34.95 30.82 1lea s ARG 64 CO 0.65 -1.67 0.59 0.41 0.02 0.00 0.00 175.30 175.29 1lea n GLY 65 N 4.19 1.90 2.65 -3.53 0.00 -1.18 -4.67 105.19 104.55 1lea n GLY 65 Ca 0.31 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 1lea n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lea s ILE 66 N -0.44 0.38 -0.08 -0.61 1.01 -1.26 -1.09 121.20 119.12 1lea s ILE 66 Ca 0.34 -0.91 -0.24 0.00 0.00 0.00 0.00 60.65 59.83 1lea s ILE 66 Cb 0.15 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 1lea s ILE 66 CO -0.15 -0.58 0.74 -0.13 0.00 0.00 0.00 174.94 174.82 1lea s ARG 67 N 1.88 4.42 -0.21 2.79 0.52 -0.36 -4.68 118.95 123.32 1lea s ARG 67 Ca 0.07 0.94 -0.29 0.00 -0.52 0.00 0.00 55.73 55.93 1lea s ARG 67 Cb -0.17 -3.47 0.01 0.00 0.52 0.00 0.00 34.95 31.84 1lea s ARG 67 CO -0.25 -0.01 1.02 -1.17 0.02 0.00 0.00 175.30 174.91 1lea s LEU 68 N 1.04 4.12 -0.09 2.53 2.96 -1.26 -1.53 118.68 126.45 1lea s LEU 68 Ca 0.39 1.38 -0.05 0.00 -0.22 0.00 0.00 54.13 55.62 1lea s LEU 68 Cb -0.18 -3.52 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 1lea s LEU 68 CO 0.18 -0.63 -0.13 0.18 -1.32 0.00 0.00 176.35 174.63 1lea n LEU 69 N 6.11 0.85 -3.75 -0.68 4.77 -0.62 -4.99 117.00 118.69 1lea n LEU 69 Ca 0.11 0.14 -0.10 0.00 -0.03 0.00 0.00 56.01 56.13 1lea n LEU 69 Cb 0.46 -0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 1lea n LEU 69 CO 0.52 0.07 0.13 -1.58 -1.33 0.00 0.00 177.39 175.20 1lea s GLN 70 N -2.22 1.15 0.00 3.23 -0.44 -1.02 -5.03 119.66 115.34 1lea s GLN 70 Ca -0.14 -0.86 0.00 0.00 -2.50 0.00 0.00 55.36 51.86 1lea s GLN 70 Cb 0.05 0.45 0.00 0.00 -1.64 0.00 0.00 33.01 31.87 1lea s GLN 70 CO 0.18 -0.45 0.00 -1.91 0.50 0.00 0.00 175.29 173.61 1lea n GLU 71 N -0.24 0.00 -0.57 1.67 2.13 -1.26 -4.64 120.64 117.74 1lea n GLU 71 Ca -0.13 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.69 1lea n GLU 71 Cb 0.63 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.34 1lea n GLU 71 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11