#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1leb n LYS 2 N 0.00 0.00 -2.45 0.03 5.02 -1.26 -4.77 118.16 114.73 1leb n LYS 2 Ca 0.00 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.90 1leb n LYS 2 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1leb n LYS 2 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1leb s ALA 3 N 0.00 2.88 0.10 7.82 0.00 -1.26 -4.93 121.76 126.37 1leb s ALA 3 Ca 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 51.96 49.30 1leb s ALA 3 Cb 0.00 -4.64 0.00 0.00 0.00 0.00 0.00 23.12 18.48 1leb s ALA 3 CO 0.00 -3.80 0.00 1.47 0.00 0.00 0.00 175.76 173.43 1leb n LEU 4 N 9.93 0.00 -4.18 0.00 -0.00 -1.26 -5.00 117.00 116.49 1leb n LEU 4 Ca 0.46 0.45 -0.13 0.00 -0.00 0.00 0.00 56.01 56.80 1leb n LEU 4 Cb 0.47 -1.29 -0.10 0.00 -0.00 0.00 0.00 43.42 42.49 1leb n LEU 4 CO 0.73 -1.72 -0.40 0.42 -0.00 0.00 0.00 177.39 176.42 1leb s THR 5 N -0.68 0.86 0.37 1.47 -4.23 -1.26 -4.76 115.64 107.41 1leb s THR 5 Ca 0.00 -1.75 0.09 0.00 -1.18 0.00 0.00 61.69 58.84 1leb s THR 5 Cb 0.00 -1.48 0.31 0.00 1.34 0.00 0.00 72.50 72.67 1leb s THR 5 CO 0.00 -0.67 1.93 0.00 -0.54 0.00 0.00 174.62 175.34 1leb h ALA 6 N 3.33 1.81 -0.12 3.99 0.00 -1.99 -1.56 119.26 124.72 1leb h ALA 6 Ca -0.36 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1leb h ALA 6 Cb 1.18 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1leb h ALA 6 CO 0.57 0.03 -0.09 0.00 0.00 0.00 0.00 179.25 179.76 1leb h ARG 7 N 0.67 0.28 -0.18 0.00 3.08 -2.00 -2.63 114.38 113.59 1leb h ARG 7 Ca 0.35 -0.13 -0.09 0.00 0.07 0.00 0.00 59.98 60.18 1leb h ARG 7 Cb 0.48 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 1leb h ARG 7 CO -0.13 0.65 -0.28 -0.56 -1.07 0.00 0.00 179.97 178.58 1leb h GLN 8 N -0.09 0.35 -0.73 0.04 3.07 -1.85 -2.33 115.11 113.56 1leb h GLN 8 Ca 0.02 -0.13 -0.05 0.00 0.09 0.00 0.00 58.65 58.59 1leb h GLN 8 Cb 0.58 -0.02 -0.03 0.00 0.08 0.00 0.00 27.48 28.09 1leb h GLN 8 CO 0.02 0.60 0.27 0.37 0.09 0.00 0.00 178.83 180.19 1leb h GLN 9 N 0.31 1.10 -0.87 0.06 5.75 -1.40 -1.48 115.11 118.58 1leb h GLN 9 Ca 0.05 -0.21 0.06 0.00 -0.15 0.00 0.00 58.65 58.40 1leb h GLN 9 Cb 0.65 -0.18 -0.06 0.00 1.07 0.00 0.00 27.48 28.97 1leb h GLN 9 CO 0.05 0.91 0.54 0.93 -2.65 0.00 0.00 178.83 178.61 1leb h GLU 10 N 1.07 0.97 -0.43 1.69 5.08 -1.34 0.19 114.58 121.80 1leb h GLU 10 Ca 0.24 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.60 1leb h GLU 10 Cb 0.24 -0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.22 1leb h GLU 10 CO -0.02 0.64 0.13 0.28 -1.00 0.00 0.00 179.01 179.05 1leb h VAL 11 N 1.00 0.83 -0.50 3.13 2.07 -1.31 -2.81 116.25 118.66 1leb h VAL 11 Ca 0.38 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.83 1leb h VAL 11 Cb 0.16 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 1leb h VAL 11 CO -0.17 0.05 0.28 0.15 0.02 0.00 0.00 177.57 177.90 1leb h PHE 12 N 0.29 0.51 -0.94 1.57 3.57 -0.88 -3.12 116.94 117.94 1leb h PHE 12 Ca 0.21 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.85 1leb h PHE 12 Cb 0.22 -0.16 -0.09 0.00 2.79 0.00 0.00 35.95 38.72 1leb h PHE 12 CO -0.17 0.28 0.56 -0.44 -2.23 0.00 0.00 178.31 176.31 1leb h ASP 13 N 0.54 0.80 0.14 0.41 5.19 -0.91 -0.85 116.42 121.74 1leb h ASP 13 Ca 0.21 0.06 -0.01 0.00 -0.62 0.00 0.00 57.03 56.67 1leb h ASP 13 Cb 0.07 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.48 1leb h ASP 13 CO -0.12 0.41 -0.07 -0.07 -3.12 0.00 0.00 179.24 176.28 1leb h LEU 14 N 0.87 -0.16 -0.50 1.55 3.38 -1.44 -1.21 115.31 117.80 1leb h LEU 14 Ca 0.48 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.35 1leb h LEU 14 Cb 0.52 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1leb h LEU 14 CO -0.28 -0.05 0.15 0.16 0.09 0.00 0.00 178.44 178.51 1leb h ILE 15 N -0.26 1.23 -0.46 1.22 3.07 -1.50 -2.62 117.51 118.19 1leb h ILE 15 Ca -0.02 -0.79 -0.02 0.00 1.55 0.00 0.00 64.86 65.59 1leb h ILE 15 Cb 0.20 0.79 -0.02 0.00 -0.27 0.00 0.00 36.82 37.52 1leb h ILE 15 CO 0.03 0.29 0.23 -0.09 -1.05 0.00 0.00 178.15 177.56 1leb h ARG 16 N 0.69 0.66 -0.08 0.16 2.43 -1.22 -1.63 114.38 115.40 1leb h ARG 16 Ca 0.16 -0.09 0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1leb h ARG 16 Cb 0.29 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 1leb h ARG 16 CO -0.00 0.55 -0.20 0.22 -1.51 0.00 0.00 179.97 179.03 1leb h ASP 17 N 0.61 -0.60 -0.09 -3.80 3.58 -1.28 -1.99 116.42 112.86 1leb h ASP 17 Ca 0.16 0.10 -0.13 0.00 0.42 0.00 0.00 57.03 57.57 1leb h ASP 17 Cb 0.10 0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 1leb h ASP 17 CO -0.02 -0.25 -0.38 -0.74 -2.88 0.00 0.00 179.24 174.96 1leb h HIS 18 N -0.28 0.71 -0.36 0.28 2.76 -1.44 -0.34 115.15 116.49 1leb h HIS 18 Ca 0.08 -0.20 0.06 0.00 -2.20 0.00 0.00 60.37 58.11 1leb h HIS 18 Cb 0.39 -0.15 -0.05 0.00 1.55 0.00 0.00 27.41 29.15 1leb h HIS 18 CO -0.28 0.89 0.03 0.82 -1.30 0.00 0.00 177.93 178.10 1leb h ILE 19 N 0.50 0.77 -0.17 6.26 1.08 -1.36 -0.67 117.51 123.92 1leb h ILE 19 Ca 0.05 -0.05 -0.13 0.00 -0.39 0.00 0.00 64.86 64.34 1leb h ILE 19 Cb 0.88 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 35.24 1leb h ILE 19 CO 0.08 0.03 -0.44 -1.28 -0.69 0.00 0.00 178.15 175.85 1leb h SER 20 N 0.14 0.42 0.01 1.72 0.87 -1.16 -2.88 113.55 112.67 1leb h SER 20 Ca 0.17 -0.19 -0.40 0.00 -1.23 0.00 0.00 61.79 60.14 1leb h SER 20 Cb 0.22 -0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 62.00 1leb h SER 20 CO -0.26 0.81 -2.40 0.00 -0.53 0.00 0.00 176.83 174.45 1leb n GLN 21 N -4.01 0.64 -0.09 2.24 6.02 -0.16 -4.75 117.38 117.28 1leb n GLN 21 Ca -0.02 0.21 -0.23 0.00 -0.01 0.00 0.00 57.00 56.96 1leb n GLN 21 Cb 0.52 -1.54 -0.12 0.00 1.02 0.00 0.00 30.24 30.12 1leb n GLN 21 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1leb n THR 22 N -3.62 1.59 0.00 5.09 -1.04 -0.53 -5.07 114.28 110.70 1leb n THR 22 Ca -0.47 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.12 1leb n THR 22 Cb 0.95 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 67.71 1leb n THR 22 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1leb n GLY 23 N 1.76 0.65 3.94 3.41 0.00 -0.37 -5.01 105.19 109.57 1leb n GLY 23 Ca -0.41 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.35 1leb n GLY 23 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1leb s MET 24 N -0.00 3.43 -0.09 1.61 0.23 -1.26 -4.75 119.30 118.47 1leb s MET 24 Ca 0.00 -0.62 -0.30 0.00 -1.03 0.00 0.00 55.69 53.74 1leb s MET 24 Cb 0.00 -2.95 -0.03 0.00 -1.53 0.00 0.00 34.83 30.32 1leb s MET 24 CO 0.00 0.51 1.27 -2.14 -2.03 0.00 0.00 175.02 172.63 1leb s PRO 25 N -3.30 4.29 0.39 3.16 0.02 -1.26 -3.67 135.00 134.64 1leb s PRO 25 Ca 0.34 1.73 -0.23 0.00 0.02 0.00 0.00 61.00 62.87 1leb s PRO 25 Cb -0.11 -3.65 -0.11 0.00 0.02 0.00 0.00 34.50 30.65 1leb s PRO 25 CO 0.28 -0.58 0.95 -1.25 -0.33 0.00 0.00 177.00 176.07 1leb s PRO 26 N 2.79 4.35 0.88 5.54 0.04 -1.26 -4.44 135.00 142.89 1leb s PRO 26 Ca 0.57 1.19 -0.12 0.00 0.04 0.00 0.00 61.00 62.68 1leb s PRO 26 Cb -0.25 -2.39 0.12 0.00 0.04 0.00 0.00 34.50 32.02 1leb s PRO 26 CO 0.20 0.08 1.10 0.95 0.04 0.00 0.00 177.00 179.36 1leb s THR 27 N -1.99 2.69 0.48 1.26 -4.23 -1.26 -4.79 115.64 107.81 1leb s THR 27 Ca 0.58 0.23 0.24 0.00 -1.18 0.00 0.00 61.69 61.55 1leb s THR 27 Cb -0.12 -2.79 0.42 0.00 1.34 0.00 0.00 72.50 71.34 1leb s THR 27 CO 0.17 -0.29 1.90 0.08 -0.54 0.00 0.00 174.62 175.93 1leb h ARG 28 N -1.45 0.18 -0.48 3.99 0.11 -1.97 -1.47 114.38 113.29 1leb h ARG 28 Ca -0.49 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 59.55 1leb h ARG 28 Cb 1.28 -0.04 -0.02 0.00 1.11 0.00 0.00 29.97 32.30 1leb h ARG 28 CO 0.56 0.12 0.20 0.00 0.10 0.00 0.00 179.97 180.96 1leb h ALA 29 N 1.62 0.63 -0.70 0.08 0.00 -1.95 -2.53 119.26 116.41 1leb h ALA 29 Ca 0.40 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1leb h ALA 29 Cb 1.30 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1leb h ALA 29 CO -0.08 0.22 0.34 0.93 0.00 0.00 0.00 179.25 180.67 1leb h GLU 30 N 0.64 0.98 -0.37 0.00 3.07 -1.72 -0.49 114.58 116.69 1leb h GLU 30 Ca 0.16 -0.13 0.06 0.00 -0.50 0.00 0.00 59.36 58.95 1leb h GLU 30 Cb 0.17 -0.19 -0.05 0.00 -0.84 0.00 0.00 28.75 27.85 1leb h GLU 30 CO -0.02 0.75 0.07 0.82 -1.40 0.00 0.00 179.01 179.23 1leb h ILE 31 N 0.98 0.80 -0.80 3.13 2.04 -1.31 -0.88 117.51 121.48 1leb h ILE 31 Ca 0.24 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 66.03 1leb h ILE 31 Cb 0.09 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1leb h ILE 31 CO -0.03 0.03 0.47 0.00 0.00 0.00 0.00 178.15 178.62 1leb h ALA 32 N 1.29 1.02 -0.24 1.87 0.00 -1.30 -3.12 119.26 118.79 1leb h ALA 32 Ca 0.18 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1leb h ALA 32 Cb 0.21 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1leb h ALA 32 CO -0.24 0.50 0.10 1.96 0.00 0.00 0.00 179.25 181.57 1leb h GLN 33 N 1.10 0.35 0.05 0.00 4.20 -0.92 -2.13 115.11 117.77 1leb h GLN 33 Ca 0.29 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.83 1leb h GLN 33 Cb -0.01 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 27.72 1leb h GLN 33 CO -0.05 0.39 -0.46 0.00 -0.67 0.00 0.00 178.83 178.03 1leb h ARG 34 N 0.24 0.22 0.00 1.46 3.08 -1.24 -3.33 114.38 114.80 1leb h ARG 34 Ca 0.08 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 59.78 1leb h ARG 34 Cb 0.16 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1leb h ARG 34 CO -0.01 1.09 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.60 1leb h LEU 35 N -0.51 0.00 -1.21 3.04 3.38 -1.74 -3.50 115.31 114.77 1leb h LEU 35 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1leb h LEU 35 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1leb h LEU 35 CO 0.09 0.21 0.00 0.61 0.09 0.00 0.00 178.44 179.44 1leb n GLY 36 N 1.16 0.56 3.50 0.83 0.00 -0.93 -5.04 105.19 105.27 1leb n GLY 36 Ca 0.02 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1leb n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1leb s PHE 37 N -2.41 2.74 0.45 1.61 0.08 -0.85 -4.91 117.98 114.68 1leb s PHE 37 Ca 0.00 -0.87 0.11 0.00 0.12 0.00 0.00 56.93 56.29 1leb s PHE 37 Cb 0.00 -4.46 1.01 0.00 -0.57 0.00 0.00 43.02 39.01 1leb s PHE 37 CO 0.00 -1.74 2.06 -0.09 -0.10 0.00 0.00 175.22 175.35 1leb h ARG 38 N 9.44 0.36 -4.96 0.44 9.65 -1.96 -3.32 114.38 124.04 1leb h ARG 38 Ca 0.02 -0.02 -0.69 0.00 -1.10 0.00 0.00 59.98 58.19 1leb h ARG 38 Cb 1.03 -0.08 -0.18 0.00 -1.39 0.00 0.00 29.97 29.35 1leb h ARG 38 CO 1.24 0.24 0.02 -1.12 2.80 0.00 0.00 179.97 183.15 1leb s SER 39 N -6.64 6.23 0.12 -3.80 0.01 -1.26 -5.00 113.70 103.36 1leb s SER 39 Ca -0.07 -0.88 0.16 0.00 1.31 0.00 0.00 55.95 56.47 1leb s SER 39 Cb 0.18 -2.28 0.70 0.00 0.21 0.00 0.00 66.02 64.83 1leb s SER 39 CO 0.72 -0.85 1.49 -0.81 0.41 0.00 0.00 173.24 174.20 1leb n PRO 40 N 6.09 0.08 0.04 12.44 -0.04 -1.25 -1.90 135.00 150.46 1leb n PRO 40 Ca -0.06 0.39 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 1leb n PRO 40 Cb 0.46 -1.67 0.52 0.00 -0.04 0.00 0.00 33.50 32.77 1leb n PRO 40 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 1leb h ASN 41 N 0.00 0.28 -0.40 3.54 -1.07 -1.94 -2.54 115.58 113.44 1leb h ASN 41 Ca 0.00 -0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.35 1leb h ASN 41 Cb 0.22 -0.06 -0.02 0.00 -2.07 0.00 0.00 38.32 36.39 1leb h ASN 41 CO 0.00 0.19 0.20 0.00 0.07 0.00 0.00 177.43 177.89 1leb h ALA 42 N 1.79 0.52 -0.56 4.14 0.00 -1.77 0.70 119.26 124.09 1leb h ALA 42 Ca 0.16 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.05 1leb h ALA 42 Cb 0.22 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 1leb h ALA 42 CO -0.03 0.07 0.20 0.00 0.00 0.00 0.00 179.25 179.48 1leb h ALA 43 N 1.05 0.70 -0.13 0.00 0.00 -1.70 -2.17 119.26 117.00 1leb h ALA 43 Ca 0.14 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1leb h ALA 43 Cb 0.11 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1leb h ALA 43 CO -0.02 -0.21 0.03 1.49 0.00 0.00 0.00 179.25 180.55 1leb h GLU 44 N 0.37 0.20 -0.66 0.00 4.81 -1.40 -2.74 114.58 115.18 1leb h GLU 44 Ca 0.27 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 1leb h GLU 44 Cb 0.32 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1leb h GLU 44 CO -0.28 0.36 0.13 0.93 -0.73 0.00 0.00 179.01 179.42 1leb h GLU 45 N 0.01 1.06 -0.67 1.92 5.08 -0.86 -0.26 114.58 120.86 1leb h GLU 45 Ca 0.04 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1leb h GLU 45 Cb 0.25 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1leb h GLU 45 CO -0.00 0.96 0.35 0.45 -1.00 0.00 0.00 179.01 179.77 1leb h HIS 46 N 1.00 0.94 -0.93 4.33 3.86 -1.51 -1.52 115.15 121.32 1leb h HIS 46 Ca 0.20 -0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.42 1leb h HIS 46 Cb 0.39 -0.30 -0.05 0.00 1.06 0.00 0.00 27.41 28.51 1leb h HIS 46 CO 0.03 0.68 0.60 1.25 0.86 0.00 0.00 177.93 181.35 1leb h LEU 47 N 0.93 1.01 0.13 2.43 5.85 -1.30 -1.26 115.31 123.10 1leb h LEU 47 Ca 0.23 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1leb h LEU 47 Cb 0.07 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1leb h LEU 47 CO -0.03 0.70 -0.06 0.11 -0.34 0.00 0.00 178.44 178.81 1leb h LYS 48 N 1.18 -0.17 -0.94 1.25 1.57 -0.99 -1.47 116.57 116.99 1leb h LYS 48 Ca 0.37 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 59.27 1leb h LYS 48 Cb -0.01 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.26 1leb h LYS 48 CO -0.12 0.02 0.60 0.00 -0.57 0.00 0.00 179.45 179.39 1leb h ALA 49 N 0.51 1.61 -0.57 3.86 0.00 -1.31 -1.46 119.26 121.89 1leb h ALA 49 Ca -0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1leb h ALA 49 Cb 0.27 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1leb h ALA 49 CO 0.03 0.17 0.26 1.25 0.00 0.00 0.00 179.25 180.96 1leb h LEU 50 N 0.92 0.77 -0.84 0.00 5.85 -1.21 -2.25 115.31 118.53 1leb h LEU 50 Ca 0.45 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.98 1leb h LEU 50 Cb 0.48 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 1leb h LEU 50 CO -0.22 0.70 0.33 0.00 -0.34 0.00 0.00 178.44 178.91 1leb h ALA 51 N 1.10 1.08 -0.37 1.25 0.00 -1.07 -2.42 119.26 118.82 1leb h ALA 51 Ca 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1leb h ALA 51 Cb 0.15 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1leb h ALA 51 CO -0.02 0.66 0.14 0.00 0.00 0.00 0.00 179.25 180.03 1leb h ARG 52 N 1.16 0.52 -0.73 0.00 3.08 -1.26 -2.51 114.38 114.63 1leb h ARG 52 Ca 0.27 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 1leb h ARG 52 Cb 0.20 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1leb h ARG 52 CO -0.02 0.44 0.21 -0.22 -1.07 0.00 0.00 179.97 179.31 1leb h LYS 53 N 0.52 1.15 0.00 0.04 1.63 -1.37 -3.49 116.57 115.05 1leb h LYS 53 Ca 0.13 -0.26 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 1leb h LYS 53 Cb 0.12 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 1leb h LYS 53 CO -0.01 0.99 0.00 0.41 -3.45 0.00 0.00 179.45 177.38 1leb n GLY 54 N -0.73 0.67 0.00 5.01 0.00 -0.92 -5.11 105.19 104.11 1leb n GLY 54 Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1leb n GLY 54 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1leb n VAL 55 N 0.00 0.00 -3.84 1.61 0.24 -1.21 -4.47 118.33 110.66 1leb n VAL 55 Ca 0.00 -0.24 -0.12 0.00 -2.04 0.00 0.00 64.34 61.94 1leb n VAL 55 Cb 0.00 1.09 -0.11 0.00 -1.47 0.00 0.00 33.84 33.35 1leb n VAL 55 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1leb s ILE 56 N -0.40 0.05 -0.40 1.34 -0.00 -1.26 -0.99 121.20 119.53 1leb s ILE 56 Ca 0.00 -0.39 -0.24 0.00 -0.00 0.00 0.00 60.65 60.02 1leb s ILE 56 Cb 0.00 -0.37 0.02 0.00 -0.00 0.00 0.00 42.46 42.11 1leb s ILE 56 CO 0.00 -0.21 0.82 -1.83 -0.00 0.00 0.00 174.94 173.71 1leb s GLU 57 N -0.75 3.63 -0.57 0.37 -1.05 -0.93 -4.72 118.70 114.68 1leb s GLU 57 Ca -0.08 0.19 -0.26 0.00 -0.15 0.00 0.00 54.97 54.67 1leb s GLU 57 Cb -0.05 -3.86 0.04 0.00 -0.44 0.00 0.00 34.13 29.81 1leb s GLU 57 CO 0.01 -0.99 1.05 0.42 0.95 0.00 0.00 175.26 176.70 1leb s ILE 58 N 3.29 4.23 -0.09 1.83 1.01 -1.26 -3.90 121.20 126.30 1leb s ILE 58 Ca 0.32 0.54 -0.30 0.00 0.00 0.00 0.00 60.65 61.22 1leb s ILE 58 Cb -0.12 -4.62 -0.03 0.00 0.01 0.00 0.00 42.46 37.70 1leb s ILE 58 CO 0.20 -1.22 1.23 0.54 0.00 0.00 0.00 174.94 175.70 1leb s VAL 59 N 4.39 4.24 -1.37 2.92 0.11 -1.26 -4.98 120.40 124.45 1leb s VAL 59 Ca 0.36 1.55 -0.15 0.00 -2.93 0.00 0.00 61.98 60.81 1leb s VAL 59 Cb -0.10 -4.00 0.08 0.00 -1.53 0.00 0.00 36.38 30.83 1leb s VAL 59 CO 0.22 -0.05 1.97 -0.24 -3.33 0.00 0.00 175.10 173.67 1leb n SER 60 N 5.73 4.47 0.00 3.54 2.88 -1.26 -4.48 113.62 124.50 1leb n SER 60 Ca 0.12 -2.91 0.00 0.00 -1.33 0.00 0.00 58.87 54.75 1leb n SER 60 Cb 0.46 -1.66 0.00 0.00 -0.75 0.00 0.00 64.21 62.26 1leb n SER 60 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1leb n GLY 61 N 4.32 -1.11 3.54 0.46 0.00 -1.26 -5.07 105.19 106.07 1leb n GLY 61 Ca 0.48 0.38 -0.42 0.00 0.00 0.00 0.00 46.02 46.47 1leb n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1leb s ALA 62 N -1.00 2.84 -0.65 4.61 0.00 -1.26 -4.93 121.76 121.37 1leb s ALA 62 Ca 0.00 -2.37 0.08 0.00 0.00 0.00 0.00 51.96 49.67 1leb s ALA 62 Cb 0.00 -4.44 0.44 0.00 0.00 0.00 0.00 23.12 19.12 1leb s ALA 62 CO 0.00 -3.49 1.23 0.45 0.00 0.00 0.00 175.76 173.94 1leb n SER 63 N 8.43 0.21 -0.32 0.00 2.88 -1.26 -2.16 113.62 121.40 1leb n SER 63 Ca 0.31 0.58 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 1leb n SER 63 Cb 0.51 -0.60 0.01 0.00 -0.75 0.00 0.00 64.21 63.37 1leb n SER 63 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1leb n ARG 64 N -1.77 1.06 -1.65 -1.46 1.85 -1.26 -3.70 116.66 109.72 1leb n ARG 64 Ca -0.01 -0.06 -0.35 0.00 -1.00 0.00 0.00 57.85 56.44 1leb n ARG 64 Cb 0.04 -1.31 0.06 0.00 -1.05 0.00 0.00 32.46 30.20 1leb n ARG 64 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1leb n GLY 65 N 0.22 5.83 3.21 2.89 0.00 -0.92 -4.16 105.19 112.26 1leb n GLY 65 Ca 0.01 -2.43 -0.44 0.00 0.00 0.00 0.00 46.02 43.16 1leb n GLY 65 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1leb n ILE 66 N -0.75 4.50 -3.37 -0.61 0.13 -1.24 -4.34 119.36 113.67 1leb n ILE 66 Ca 0.57 -4.94 -0.38 0.00 -1.10 0.00 0.00 62.75 56.90 1leb n ILE 66 Cb 0.56 -2.40 -0.06 0.00 -0.84 0.00 0.00 39.64 36.89 1leb n ILE 66 CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 1leb s ARG 67 N 0.07 4.16 0.05 9.51 1.81 -1.25 -4.82 118.95 128.48 1leb s ARG 67 Ca 0.38 0.49 -0.13 0.00 -1.72 0.00 0.00 55.73 54.76 1leb s ARG 67 Cb 0.00 -3.32 -0.06 0.00 -0.45 0.00 0.00 34.95 31.12 1leb s ARG 67 CO 0.00 0.44 0.42 -0.48 -0.68 0.00 0.00 175.30 175.01 1leb s LEU 68 N -0.32 4.41 -0.34 2.53 0.05 -1.26 -2.19 118.68 121.56 1leb s LEU 68 Ca 0.26 0.91 0.03 0.00 0.05 0.00 0.00 54.13 55.38 1leb s LEU 68 Cb -0.17 -2.83 0.10 0.00 -2.05 0.00 0.00 46.19 41.25 1leb s LEU 68 CO 0.13 0.24 0.06 -1.48 -0.55 0.00 0.00 176.35 174.75 1leb s LEU 69 N -1.52 4.43 -1.11 1.48 2.34 -0.16 -4.98 118.68 119.16 1leb s LEU 69 Ca 0.29 -2.12 -0.22 0.00 0.06 0.00 0.00 54.13 52.14 1leb s LEU 69 Cb -0.15 -1.53 0.02 0.00 -0.56 0.00 0.00 46.19 43.97 1leb s LEU 69 CO 0.16 -0.38 1.67 -1.58 -1.06 0.00 0.00 176.35 175.16 1leb s GLN 70 N 0.95 3.42 -1.09 1.48 -0.44 -1.26 -4.34 119.66 118.38 1leb s GLN 70 Ca 0.11 -1.26 -0.22 0.00 -2.50 0.00 0.00 55.36 51.49 1leb s GLN 70 Cb -0.19 -5.35 0.06 0.00 -1.64 0.00 0.00 33.01 25.88 1leb s GLN 70 CO -0.10 -2.62 1.52 -2.00 0.50 0.00 0.00 175.29 172.59 1leb s GLU 71 N 5.25 3.69 0.00 1.67 2.12 -1.26 -5.14 118.70 125.03 1leb s GLU 71 Ca 0.55 -1.34 0.29 0.00 0.36 0.00 0.00 54.97 54.83 1leb s GLU 71 Cb 0.00 -5.41 1.75 0.00 0.26 0.00 0.00 34.13 30.74 1leb s GLU 71 CO -0.00 -2.22 2.09 -1.91 -0.54 0.00 0.00 175.26 172.67