#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qho s GLN 2 N 0.00 4.20 0.23 3.17 0.74 -1.26 -1.43 119.66 125.30 2qho s GLN 2 Ca 0.00 0.31 0.06 0.00 0.05 0.00 0.00 55.36 55.78 2qho s GLN 2 Cb 0.00 -3.38 -0.05 0.00 1.10 0.00 0.00 33.01 30.68 2qho s GLN 2 CO 0.00 0.32 -0.07 0.96 -0.55 0.00 0.00 175.29 175.95 2qho s ILE 3 N 0.14 1.45 0.01 -2.34 -4.36 -0.43 -0.72 121.20 114.95 2qho s ILE 3 Ca 0.22 -2.12 0.05 0.00 -0.26 0.00 0.00 60.65 58.54 2qho s ILE 3 Cb -0.15 -2.23 -0.03 0.00 1.25 0.00 0.00 42.46 41.30 2qho s ILE 3 CO 0.09 -0.45 -0.12 -0.36 0.24 0.00 0.00 174.94 174.34 2qho s PHE 4 N -3.15 2.75 -0.20 1.37 0.40 -0.42 -1.04 117.98 117.70 2qho s PHE 4 Ca 0.26 -0.13 0.01 0.00 -0.60 0.00 0.00 56.93 56.47 2qho s PHE 4 Cb 0.03 -1.56 0.04 0.00 0.51 0.00 0.00 43.02 42.04 2qho s PHE 4 CO 0.08 0.31 -0.13 0.08 0.70 0.00 0.00 175.22 176.26 2qho s VAL 5 N -0.94 1.83 -0.13 -0.44 1.01 0.83 -0.47 120.40 122.10 2qho s VAL 5 Ca 0.16 -1.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 2qho s VAL 5 Cb -0.11 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 2qho s VAL 5 CO 0.06 0.27 0.00 -0.75 0.00 0.00 0.00 175.10 174.68 2qho s LYS 6 N 1.33 3.45 0.81 2.72 2.47 0.40 -0.56 119.74 130.36 2qho s LYS 6 Ca -0.00 -0.43 -0.09 0.00 -1.56 0.00 0.00 55.97 53.89 2qho s LYS 6 Cb -0.16 -2.93 0.13 0.00 -1.46 0.00 0.00 37.83 33.41 2qho s LYS 6 CO -0.09 0.45 1.14 0.95 0.16 0.00 0.00 175.35 177.95 2qho s THR 7 N -0.18 2.12 0.43 3.43 -4.23 0.06 -0.10 115.64 117.17 2qho s THR 7 Ca 0.05 -0.23 0.09 0.00 -1.18 0.00 0.00 61.69 60.42 2qho s THR 7 Cb -0.13 -2.89 0.24 0.00 1.34 0.00 0.00 72.50 71.07 2qho s THR 7 CO 0.02 0.00 2.05 0.25 -0.54 0.00 0.00 174.62 176.40 2qho h LEU 8 N -1.00 0.32 -0.10 4.79 5.85 -1.90 0.24 115.31 123.52 2qho h LEU 8 Ca -0.43 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.27 2qho h LEU 8 Cb 1.28 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2qho h LEU 8 CO 0.48 0.28 -0.20 0.41 -0.34 0.00 0.00 178.44 179.07 2qho n THR 9 N -4.45 0.00 0.00 1.05 -1.04 -1.26 -4.92 114.28 103.67 2qho n THR 9 Ca 0.01 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2qho n THR 9 Cb 0.11 -0.10 0.00 0.00 -1.82 0.00 0.00 70.33 68.52 2qho n THR 9 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qho n GLY 10 N 1.42 0.31 3.70 3.41 0.00 0.07 -5.06 105.19 109.04 2qho n GLY 10 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2qho n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qho n LYS 11 N -1.92 2.64 -4.32 1.61 3.00 -1.26 -4.71 118.16 113.20 2qho n LYS 11 Ca 0.00 0.96 -0.34 0.00 -0.00 0.00 0.00 58.31 58.93 2qho n LYS 11 Cb 0.00 -2.80 -0.12 0.00 0.00 0.00 0.00 35.03 32.11 2qho n LYS 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 2qho s THR 12 N 1.71 4.09 -0.15 3.15 2.01 -1.26 -0.76 115.64 124.44 2qho s THR 12 Ca 0.79 -0.29 -0.01 0.00 0.31 0.00 0.00 61.69 62.49 2qho s THR 12 Cb -0.54 -2.80 -0.02 0.00 0.01 0.00 0.00 72.50 69.15 2qho s THR 12 CO 0.36 0.49 -0.10 -0.63 -0.69 0.00 0.00 174.62 174.04 2qho s ILE 13 N 0.34 3.24 -0.14 1.82 1.01 0.28 -4.98 121.20 122.77 2qho s ILE 13 Ca -0.03 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 59.97 2qho s ILE 13 Cb -0.14 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 2qho s ILE 13 CO 0.02 0.51 0.10 -0.89 0.00 0.00 0.00 174.94 174.68 2qho s THR 14 N 0.51 5.12 0.07 2.92 2.01 -1.26 -0.12 115.64 124.89 2qho s THR 14 Ca -0.07 0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.08 2qho s THR 14 Cb -0.15 -3.25 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 2qho s THR 14 CO 0.04 0.55 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.54 2qho s LEU 15 N -0.48 2.22 -0.27 4.42 1.43 -0.20 -4.98 118.68 120.81 2qho s LEU 15 Ca 0.11 -0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 52.51 2qho s LEU 15 Cb -0.12 -0.99 -0.05 0.00 0.03 0.00 0.00 46.19 45.06 2qho s LEU 15 CO 0.02 0.14 0.18 -1.61 0.23 0.00 0.00 176.35 175.31 2qho s GLU 16 N -1.47 3.96 0.21 1.70 0.41 -1.26 -1.31 118.70 120.94 2qho s GLU 16 Ca 0.08 -0.32 -0.01 0.00 -0.41 0.00 0.00 54.97 54.32 2qho s GLU 16 Cb -0.09 -3.64 -0.04 0.00 -1.78 0.00 0.00 34.13 28.58 2qho s GLU 16 CO 0.03 -0.15 0.15 0.14 -0.49 0.00 0.00 175.26 174.94 2qho s VAL 17 N 1.67 0.00 0.07 2.63 -7.23 -0.52 -4.94 120.40 112.09 2qho s VAL 17 Ca 0.07 -1.98 0.07 0.00 -1.81 0.00 0.00 61.98 58.33 2qho s VAL 17 Cb -0.16 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.25 2qho s VAL 17 CO 0.10 0.00 -0.17 -1.61 -0.31 0.00 0.00 175.10 173.11 2qho s GLU 18 N -4.10 2.00 0.44 4.82 0.41 -1.26 0.15 118.70 121.16 2qho s GLU 18 Ca 0.39 -1.03 0.24 0.00 -0.41 0.00 0.00 54.97 54.15 2qho s GLU 18 Cb 0.06 -2.18 1.24 0.00 -1.78 0.00 0.00 34.13 31.47 2qho s GLU 18 CO 0.13 0.52 1.77 -1.00 -0.49 0.00 0.00 175.26 176.20 2qho h PRO 19 N 4.25 0.26 -0.00 0.39 0.13 -1.97 0.66 132.00 135.73 2qho h PRO 19 Ca -0.48 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2qho h PRO 19 Cb 1.16 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2qho h PRO 19 CO 0.47 0.17 -0.10 -1.13 -0.23 0.00 0.00 178.00 177.18 2qho n SER 20 N -4.52 0.11 -4.72 1.44 3.41 -1.26 -1.66 113.62 106.42 2qho n SER 20 Ca 0.26 0.32 -0.42 0.00 -0.26 0.00 0.00 58.87 58.77 2qho n SER 20 Cb 1.00 -0.34 -0.01 0.00 -0.26 0.00 0.00 64.21 64.61 2qho n SER 20 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2qho n ASP 21 N -1.49 3.17 -4.88 4.04 8.00 0.22 -4.76 116.55 120.85 2qho n ASP 21 Ca 0.07 1.20 -0.30 0.00 0.71 0.00 0.00 54.79 56.47 2qho n ASP 21 Cb 0.34 -1.53 0.04 0.00 -0.02 0.00 0.00 41.12 39.94 2qho n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2qho s THR 22 N -0.91 3.82 0.26 -3.53 -4.23 -1.26 -1.19 115.64 108.60 2qho s THR 22 Ca 0.57 0.53 -0.03 0.00 -1.18 0.00 0.00 61.69 61.58 2qho s THR 22 Cb -0.54 -3.58 0.15 0.00 1.34 0.00 0.00 72.50 69.87 2qho s THR 22 CO 0.60 -0.74 1.80 0.40 -0.54 0.00 0.00 174.62 176.14 2qho h ILE 23 N -0.52 1.24 -0.56 2.99 1.08 -1.09 -1.41 117.51 119.25 2qho h ILE 23 Ca -0.45 -0.85 0.09 0.00 -0.39 0.00 0.00 64.86 63.26 2qho h ILE 23 Cb 1.24 0.63 -0.07 0.00 -3.07 0.00 0.00 36.82 35.54 2qho h ILE 23 CO 0.63 0.32 0.17 -0.08 -0.69 0.00 0.00 178.15 178.50 2qho h GLU 24 N 0.88 0.31 -0.92 2.37 4.57 -1.37 -0.54 114.58 119.87 2qho h GLU 24 Ca 0.19 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.39 2qho h GLU 24 Cb 0.31 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 28.77 2qho h GLU 24 CO -0.00 0.21 0.60 -0.91 -1.18 0.00 0.00 179.01 177.73 2qho h ASN 25 N 0.32 0.98 -0.46 1.04 2.35 -1.67 -0.63 115.58 117.52 2qho h ASN 25 Ca 0.28 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.91 2qho h ASN 25 Cb 0.36 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 2qho h ASN 25 CO -0.32 0.66 -0.13 0.58 -1.65 0.00 0.00 177.43 176.57 2qho h VAL 26 N 1.13 1.27 -0.37 2.81 2.07 -0.87 -1.59 116.25 120.70 2qho h VAL 26 Ca 0.37 -1.27 -0.08 0.00 0.82 0.00 0.00 66.70 66.55 2qho h VAL 26 Cb 0.06 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 2qho h VAL 26 CO -0.12 0.44 -0.09 0.11 0.02 0.00 0.00 177.57 177.93 2qho h LYS 27 N 0.83 0.63 -0.29 1.57 1.57 -0.33 -1.24 116.57 119.30 2qho h LYS 27 Ca 0.13 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2qho h LYS 27 Cb 0.68 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 2qho h LYS 27 CO 0.05 0.71 -0.10 0.00 -0.57 0.00 0.00 179.45 179.54 2qho h ALA 28 N 1.33 1.28 -0.68 3.86 0.00 -0.90 0.09 119.26 124.23 2qho h ALA 28 Ca 0.11 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 2qho h ALA 28 Cb 0.50 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2qho h ALA 28 CO 0.03 0.48 0.14 0.87 0.00 0.00 0.00 179.25 180.77 2qho h LYS 29 N 0.45 1.10 -0.29 0.00 1.57 -0.66 0.38 116.57 119.12 2qho h LYS 29 Ca 0.09 -0.27 -0.13 0.00 -1.87 0.00 0.00 60.65 58.46 2qho h LYS 29 Cb 0.46 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2qho h LYS 29 CO 0.03 0.99 -0.36 0.82 -0.57 0.00 0.00 179.45 180.35 2qho h ILE 30 N 1.04 1.29 -0.49 1.86 2.04 -0.80 -1.06 117.51 121.39 2qho h ILE 30 Ca 0.21 -1.51 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 2qho h ILE 30 Cb 0.39 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 2qho h ILE 30 CO 0.01 0.49 0.13 -0.61 0.00 0.00 0.00 178.15 178.16 2qho h GLN 31 N 0.55 0.78 -0.45 2.37 4.15 -0.68 0.21 115.11 122.04 2qho h GLN 31 Ca 0.05 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.29 2qho h GLN 31 Cb 0.87 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.43 2qho h GLN 31 CO 0.08 0.75 0.28 -0.44 -1.93 0.00 0.00 178.83 177.56 2qho h ASP 32 N 0.67 0.53 0.42 -0.69 3.45 -0.74 -0.12 116.42 119.94 2qho h ASP 32 Ca 0.16 -0.04 -0.31 0.00 0.43 0.00 0.00 57.03 57.26 2qho h ASP 32 Cb 0.31 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 38.95 2qho h ASP 32 CO -0.00 0.42 -1.51 0.50 -1.57 0.00 0.00 179.24 177.08 2qho h LYS 33 N 0.60 0.32 0.00 3.56 3.64 -1.12 -3.39 116.57 120.17 2qho h LYS 33 Ca 0.16 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 2qho h LYS 33 Cb -0.02 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2qho h LYS 33 CO -0.03 1.21 -0.46 0.39 -2.27 0.00 0.00 179.45 178.29 2qho n GLU 34 N -3.52 3.88 -1.01 1.90 -0.58 0.72 -4.99 120.64 117.04 2qho n GLU 34 Ca -0.16 -0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2qho n GLU 34 Cb 1.05 -0.94 -0.00 0.00 -0.57 0.00 0.00 31.44 30.98 2qho n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qho n GLY 35 N 1.23 0.45 3.58 0.62 0.00 -0.06 -5.01 105.19 106.01 2qho n GLY 35 Ca 0.02 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 2qho n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qho s ILE 36 N -1.89 4.92 0.49 -0.61 1.01 -1.25 -4.99 121.20 118.88 2qho s ILE 36 Ca 0.00 0.68 -0.24 0.00 0.00 0.00 0.00 60.65 61.10 2qho s ILE 36 Cb 0.00 -4.03 -0.07 0.00 0.01 0.00 0.00 42.46 38.37 2qho s ILE 36 CO 0.00 -0.22 1.37 -2.84 0.00 0.00 0.00 174.94 173.25 2qho s PRO 37 N 2.63 3.48 0.48 2.79 0.02 -1.26 -3.48 135.00 139.66 2qho s PRO 37 Ca 0.24 2.29 0.22 0.00 0.02 0.00 0.00 61.00 63.77 2qho s PRO 37 Cb -0.15 -2.48 1.25 0.00 0.02 0.00 0.00 34.50 33.14 2qho s PRO 37 CO 0.13 -0.93 1.92 -1.35 -0.33 0.00 0.00 177.00 176.44 2qho h PRO 38 N 1.98 0.20 0.00 5.54 0.11 -1.95 -1.52 132.00 136.35 2qho h PRO 38 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2qho h PRO 38 Cb 1.28 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2qho h PRO 38 CO 0.60 0.13 0.00 -0.40 -0.21 0.00 0.00 178.00 178.12 2qho n ASP 39 N -4.41 0.21 0.01 -2.05 5.68 -1.26 -1.53 116.55 113.20 2qho n ASP 39 Ca 0.15 0.56 0.11 0.00 -0.50 0.00 0.00 54.79 55.12 2qho n ASP 39 Cb 0.68 -0.61 0.06 0.00 -1.14 0.00 0.00 41.12 40.12 2qho n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2qho n GLN 40 N -1.75 0.11 -3.61 0.11 1.13 -0.57 -4.86 117.38 107.94 2qho n GLN 40 Ca 0.02 -0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.71 2qho n GLN 40 Cb 0.14 -1.53 -0.08 0.00 0.11 0.00 0.00 30.24 28.87 2qho n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2qho s GLN 41 N -3.08 4.15 -0.26 -1.09 -0.21 -0.58 -0.88 119.66 117.71 2qho s GLN 41 Ca 0.07 -0.12 -0.02 0.00 0.02 0.00 0.00 55.36 55.31 2qho s GLN 41 Cb 0.16 -3.49 0.03 0.00 1.00 0.00 0.00 33.01 30.71 2qho s GLN 41 CO 0.79 0.13 -0.04 1.03 -2.12 0.00 0.00 175.29 175.08 2qho s ARG 42 N 0.84 2.78 -0.23 2.91 0.52 0.45 -4.96 118.95 121.24 2qho s ARG 42 Ca 0.11 -1.02 -0.10 0.00 -0.52 0.00 0.00 55.73 54.20 2qho s ARG 42 Cb -0.13 -3.05 -0.05 0.00 0.52 0.00 0.00 34.95 32.24 2qho s ARG 42 CO 0.03 -0.44 0.14 -0.51 0.02 0.00 0.00 175.30 174.54 2qho s LEU 43 N 1.32 4.02 -0.04 2.53 1.43 -1.26 -1.26 118.68 125.42 2qho s LEU 43 Ca -0.01 0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.24 2qho s LEU 43 Cb -0.17 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 2qho s LEU 43 CO -0.03 0.07 -0.23 -0.63 0.23 0.00 0.00 176.35 175.76 2qho s ILE 44 N 1.00 2.25 -0.11 -0.59 -1.09 0.40 0.04 121.20 123.10 2qho s ILE 44 Ca 0.07 -1.02 -0.11 0.00 -2.23 0.00 0.00 60.65 57.36 2qho s ILE 44 Cb -0.13 -1.81 0.03 0.00 -1.58 0.00 0.00 42.46 38.96 2qho s ILE 44 CO 0.04 0.58 0.32 0.12 -1.23 0.00 0.00 174.94 174.76 2qho s PHE 45 N -0.43 -0.34 -1.19 3.97 5.36 -0.80 -0.45 117.98 124.10 2qho s PHE 45 Ca 0.05 0.81 0.00 0.00 -0.96 0.00 0.00 56.93 56.82 2qho s PHE 45 Cb -0.12 0.12 0.00 0.00 -0.34 0.00 0.00 43.02 42.68 2qho s PHE 45 CO 0.01 -0.19 0.00 0.00 -1.46 0.00 0.00 175.22 173.58 2qho n ALA 46 N 2.76 -0.73 -0.88 11.12 0.00 -1.26 -2.36 120.51 129.15 2qho n ALA 46 Ca -0.14 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2qho n ALA 46 Cb 0.58 -1.62 0.00 0.00 0.00 0.00 0.00 19.45 18.41 2qho n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qho n GLY 47 N -0.82 0.86 3.21 0.00 0.00 -1.26 -5.03 105.19 102.15 2qho n GLY 47 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 2qho n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qho s LYS 48 N -0.12 1.22 0.20 1.61 -0.14 -1.00 -5.12 119.74 116.40 2qho s LYS 48 Ca 0.00 -0.87 -0.30 0.00 -1.36 0.00 0.00 55.97 53.44 2qho s LYS 48 Cb 0.00 -1.29 -0.09 0.00 -1.68 0.00 0.00 37.83 34.77 2qho s LYS 48 CO 0.00 0.33 1.36 -0.65 -0.76 0.00 0.00 175.35 175.63 2qho s GLN 49 N -1.15 4.34 0.26 1.68 -0.21 -1.26 -1.90 119.66 121.42 2qho s GLN 49 Ca 0.05 2.13 -0.21 0.00 0.02 0.00 0.00 55.36 57.35 2qho s GLN 49 Cb -0.08 -3.18 -0.09 0.00 1.00 0.00 0.00 33.01 30.66 2qho s GLN 49 CO 0.02 -0.33 0.79 -0.51 -2.12 0.00 0.00 175.29 173.13 2qho s LEU 50 N 0.02 4.31 -0.09 2.90 1.43 0.11 -4.95 118.68 122.41 2qho s LEU 50 Ca 0.59 1.53 -0.20 0.00 -1.03 0.00 0.00 54.13 55.02 2qho s LEU 50 Cb -0.38 -3.77 -0.04 0.00 0.03 0.00 0.00 46.19 42.02 2qho s LEU 50 CO 0.38 -0.03 0.55 -1.61 0.23 0.00 0.00 176.35 175.88 2qho s GLU 51 N -2.12 4.35 0.42 1.70 2.02 -1.26 -4.74 118.70 119.08 2qho s GLU 51 Ca 0.46 0.61 0.19 0.00 0.02 0.00 0.00 54.97 56.25 2qho s GLU 51 Cb -0.16 -3.42 1.13 0.00 0.10 0.00 0.00 34.13 31.77 2qho s GLU 51 CO 0.21 0.17 1.82 -0.44 0.02 0.00 0.00 175.26 177.05 2qho h ASP 52 N 6.53 0.39 1.31 -0.19 3.45 -1.97 -2.41 116.42 123.53 2qho h ASP 52 Ca -0.42 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.10 2qho h ASP 52 Cb 1.19 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.94 2qho h ASP 52 CO 0.74 0.12 -0.38 1.23 -1.57 0.00 0.00 179.24 179.38 2qho h GLY 53 N 0.37 0.00 -1.27 2.75 0.00 -1.95 -0.55 103.07 102.42 2qho h GLY 53 Ca 0.52 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.36 2qho h GLY 53 CO -0.21 0.00 0.32 0.50 0.00 0.00 0.00 176.54 177.16 2qho s ARG 54 N -3.19 2.96 0.40 4.80 0.52 -0.91 -4.84 118.95 118.69 2qho s ARG 54 Ca 0.06 0.32 0.04 0.00 -0.52 0.00 0.00 55.73 55.63 2qho s ARG 54 Cb 0.11 -2.12 -0.00 0.00 0.52 0.00 0.00 34.95 33.45 2qho s ARG 54 CO 0.69 -0.86 0.58 0.95 0.02 0.00 0.00 175.30 176.68 2qho s THR 55 N -3.20 3.85 0.19 0.02 -4.23 -1.26 -1.31 115.64 109.70 2qho s THR 55 Ca 0.56 -0.78 -0.13 0.00 -1.18 0.00 0.00 61.69 60.16 2qho s THR 55 Cb -0.11 -3.37 0.11 0.00 1.34 0.00 0.00 72.50 70.47 2qho s THR 55 CO 0.49 -0.20 1.71 -0.07 -0.54 0.00 0.00 174.62 176.02 2qho h LEU 56 N 0.62 -0.03 -0.53 4.79 3.38 -1.09 -2.59 115.31 119.87 2qho h LEU 56 Ca -0.45 0.09 0.11 0.00 0.09 0.00 0.00 57.88 57.72 2qho h LEU 56 Cb 1.26 0.13 -0.10 0.00 0.09 0.00 0.00 40.66 42.04 2qho h LEU 56 CO 0.54 0.01 -0.18 0.28 0.09 0.00 0.00 178.44 179.19 2qho h SER 57 N 0.22 -0.63 -0.90 -0.43 0.02 -1.50 -0.26 113.55 110.08 2qho h SER 57 Ca 0.25 0.17 0.23 0.00 -0.84 0.00 0.00 61.79 61.60 2qho h SER 57 Cb 0.34 0.38 -0.05 0.00 0.14 0.00 0.00 62.40 63.20 2qho h SER 57 CO -0.34 -0.21 0.61 0.44 -1.14 0.00 0.00 176.83 176.19 2qho h ASP 58 N -0.05 0.22 -0.61 3.07 3.45 -1.75 0.14 116.42 120.88 2qho h ASP 58 Ca 0.25 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.74 2qho h ASP 58 Cb 0.44 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.19 2qho h ASP 58 CO -0.57 0.08 0.00 -1.22 -1.57 0.00 0.00 179.24 175.96 2qho n TYR 59 N -4.41 0.81 -2.32 4.55 4.02 -0.52 -4.94 117.16 114.35 2qho n TYR 59 Ca 0.19 -0.40 -0.15 0.00 -0.01 0.00 0.00 57.90 57.53 2qho n TYR 59 Cb 0.82 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.13 2qho n TYR 59 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2qho n ASN 60 N 1.52 -4.39 -4.68 7.72 3.02 0.47 -4.95 115.26 113.96 2qho n ASN 60 Ca 0.22 0.16 -0.42 0.00 -0.03 0.00 0.00 54.58 54.51 2qho n ASN 60 Cb 0.59 -3.74 -0.03 0.00 -0.61 0.00 0.00 39.78 36.00 2qho n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qho s ILE 61 N -2.68 4.25 0.00 2.41 1.01 -0.22 -4.99 121.20 120.98 2qho s ILE 61 Ca 0.00 1.57 0.00 0.00 0.00 0.00 0.00 60.65 62.22 2qho s ILE 61 Cb 0.00 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.46 2qho s ILE 61 CO 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 174.94 174.91 2qho n GLN 62 N 5.51 0.00 -1.72 2.79 10.64 -1.26 -4.26 117.38 129.08 2qho n GLN 62 Ca 0.12 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.86 2qho n GLN 62 Cb 0.46 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.83 2qho n GLN 62 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 2qho n LYS 63 N 0.00 2.36 -0.72 2.61 2.85 -1.26 -1.34 118.16 122.66 2qho n LYS 63 Ca 0.00 0.83 0.00 0.00 -1.05 0.00 0.00 58.31 58.09 2qho n LYS 63 Cb 0.00 -2.50 0.00 0.00 -0.65 0.00 0.00 35.03 31.88 2qho n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2qho n GLU 64 N 0.97 -0.15 -2.01 -1.58 -0.58 0.10 -5.00 120.64 112.39 2qho n GLU 64 Ca 0.05 0.04 -0.36 0.00 -0.42 0.00 0.00 57.16 56.47 2qho n GLU 64 Cb 0.36 -3.84 0.03 0.00 -0.57 0.00 0.00 31.44 27.43 2qho n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2qho s SER 65 N -2.32 5.22 -0.19 1.62 0.01 -0.45 -4.72 113.70 112.87 2qho s SER 65 Ca 0.00 2.34 -0.03 0.00 1.31 0.00 0.00 55.95 59.57 2qho s SER 65 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 2qho s SER 65 CO 0.00 -1.57 -0.05 -0.89 0.41 0.00 0.00 173.24 171.13 2qho s THR 66 N -1.67 3.46 0.13 1.44 2.01 -1.26 -1.29 115.64 118.46 2qho s THR 66 Ca 0.76 -0.48 -0.07 0.00 0.31 0.00 0.00 61.69 62.21 2qho s THR 66 Cb -0.29 -2.54 -0.06 0.00 0.01 0.00 0.00 72.50 69.62 2qho s THR 66 CO 0.33 0.45 0.40 -0.76 -0.69 0.00 0.00 174.62 174.36 2qho s LEU 67 N 1.04 4.28 -0.21 4.42 1.02 0.38 -4.87 118.68 124.74 2qho s LEU 67 Ca 0.01 0.69 -0.05 0.00 0.02 0.00 0.00 54.13 54.79 2qho s LEU 67 Cb -0.15 -3.25 -0.02 0.00 0.02 0.00 0.00 46.19 42.79 2qho s LEU 67 CO 0.00 0.07 0.01 -1.00 0.02 0.00 0.00 176.35 175.45 2qho s HIS 68 N -1.60 3.05 -0.33 0.29 3.76 0.40 -0.45 115.29 120.41 2qho s HIS 68 Ca 0.39 -0.45 -0.13 0.00 -0.15 0.00 0.00 55.06 54.72 2qho s HIS 68 Cb -0.13 -2.10 -0.02 0.00 1.11 0.00 0.00 32.58 31.44 2qho s HIS 68 CO 0.22 -0.25 0.26 -1.17 -0.85 0.00 0.00 174.74 172.95 2qho s LEU 69 N 1.07 4.42 -0.15 0.89 2.96 0.86 -0.45 118.68 128.28 2qho s LEU 69 Ca 0.02 -0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 53.59 2qho s LEU 69 Cb -0.14 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.34 2qho s LEU 69 CO 0.02 -0.23 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.09 2qho s VAL 70 N 1.79 3.86 0.03 1.68 1.01 -0.39 -3.71 120.40 124.68 2qho s VAL 70 Ca 0.08 -0.37 -0.13 0.00 0.00 0.00 0.00 61.98 61.55 2qho s VAL 70 Cb -0.17 -2.69 -0.06 0.00 0.00 0.00 0.00 36.38 33.47 2qho s VAL 70 CO 0.11 0.50 0.42 -0.76 0.00 0.00 0.00 175.10 175.36 2qho s LEU 71 N 0.31 4.43 0.60 3.92 1.02 -1.26 -0.42 118.68 127.28 2qho s LEU 71 Ca -0.04 0.93 -0.19 0.00 0.02 0.00 0.00 54.13 54.85 2qho s LEU 71 Cb -0.14 -2.73 -0.04 0.00 0.02 0.00 0.00 46.19 43.29 2qho s LEU 71 CO 0.03 0.27 1.07 0.54 0.02 0.00 0.00 176.35 178.28 2qho n ARG 72 N 1.51 1.03 -1.68 1.70 5.12 -0.06 -4.96 116.66 119.32 2qho n ARG 72 Ca -0.12 0.40 -0.33 0.00 -1.93 0.00 0.00 57.85 55.87 2qho n ARG 72 Cb 0.52 -2.27 0.05 0.00 -1.16 0.00 0.00 32.46 29.60 2qho n ARG 72 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2qho s LEU 73 N -2.56 3.33 0.20 0.55 2.01 -1.26 -4.97 118.68 115.97 2qho s LEU 73 Ca 0.76 1.95 -0.31 0.00 0.01 0.00 0.00 54.13 56.54 2qho s LEU 73 Cb -0.41 -4.54 -0.16 0.00 0.01 0.00 0.00 46.19 41.09 2qho s LEU 73 CO 0.46 -1.68 1.05 0.54 1.01 0.00 0.00 176.35 177.73 2qho n ARG 74 N -2.61 1.04 -0.89 1.70 1.74 -1.26 -5.15 116.66 111.22 2qho n ARG 74 Ca 0.10 0.37 0.00 0.00 -0.77 0.00 0.00 57.85 57.55 2qho n ARG 74 Cb 0.52 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2qho n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52