#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c7m s GLN 2 N 0.00 3.26 0.18 3.17 -0.21 -1.26 -1.23 119.66 123.57 2c7m s GLN 2 Ca 0.00 -0.29 0.08 0.00 0.02 0.00 0.00 55.36 55.17 2c7m s GLN 2 Cb 0.00 -2.99 -0.04 0.00 1.00 0.00 0.00 33.01 30.98 2c7m s GLN 2 CO 0.00 0.69 -0.17 0.96 -2.12 0.00 0.00 175.29 174.65 2c7m s ILE 3 N -0.82 1.83 -0.06 1.08 -4.36 -1.12 0.89 121.20 118.65 2c7m s ILE 3 Ca 0.13 -2.04 0.04 0.00 -0.26 0.00 0.00 60.65 58.52 2c7m s ILE 3 Cb -0.12 -1.93 -0.02 0.00 1.25 0.00 0.00 42.46 41.64 2c7m s ILE 3 CO 0.03 -0.41 -0.18 -0.36 0.24 0.00 0.00 174.94 174.25 2c7m s PHE 4 N -2.37 2.60 -0.33 1.37 0.08 0.38 -1.37 117.98 118.34 2c7m s PHE 4 Ca 0.19 -0.39 -0.02 0.00 0.12 0.00 0.00 56.93 56.83 2c7m s PHE 4 Cb -0.04 -1.63 0.07 0.00 -0.57 0.00 0.00 43.02 40.85 2c7m s PHE 4 CO 0.07 0.01 0.06 0.08 -0.10 0.00 0.00 175.22 175.34 2c7m s VAL 5 N -0.44 3.03 0.03 -0.44 1.01 -0.38 0.17 120.40 123.38 2c7m s VAL 5 Ca 0.05 -1.63 -0.24 0.00 0.00 0.00 0.00 61.98 60.16 2c7m s VAL 5 Cb -0.12 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 2c7m s VAL 5 CO 0.02 -0.30 0.72 -0.54 0.00 0.00 0.00 175.10 175.00 2c7m s LYS 6 N 1.20 4.45 0.53 2.72 1.02 -0.62 -0.42 119.74 128.62 2c7m s LYS 6 Ca -0.00 0.98 0.04 0.00 0.02 0.00 0.00 55.97 57.01 2c7m s LYS 6 Cb -0.21 -3.36 0.04 0.00 -0.52 0.00 0.00 37.83 33.79 2c7m s LYS 6 CO -0.02 0.31 0.74 0.95 -0.92 0.00 0.00 175.35 176.40 2c7m s THR 7 N -0.10 2.66 -1.37 2.17 -4.23 -0.57 -0.50 115.64 113.69 2c7m s THR 7 Ca 0.37 -0.79 0.30 0.00 -1.18 0.00 0.00 61.69 60.39 2c7m s THR 7 Cb -0.20 -2.87 0.48 0.00 1.34 0.00 0.00 72.50 71.26 2c7m s THR 7 CO 0.21 0.00 2.03 0.18 -0.54 0.00 0.00 174.62 176.51 2c7m n LEU 8 N -2.24 0.01 -1.05 4.79 4.77 -1.26 -4.22 117.00 117.80 2c7m n LEU 8 Ca 0.09 0.31 -0.03 0.00 -0.03 0.00 0.00 56.01 56.35 2c7m n LEU 8 Cb 0.60 -0.31 0.18 0.00 -2.33 0.00 0.00 43.42 41.56 2c7m n LEU 8 CO 0.42 0.00 0.51 0.35 -1.33 0.00 0.00 177.39 177.35 2c7m n THR 9 N -1.31 2.44 -1.13 -5.08 -2.24 -1.26 -4.98 114.28 100.72 2c7m n THR 9 Ca 0.13 -3.13 0.00 0.00 -2.27 0.00 0.00 64.05 58.78 2c7m n THR 9 Cb 0.26 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 2c7m n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c7m n GLY 10 N -1.08 0.81 2.92 3.38 0.00 -1.26 -5.06 105.19 104.91 2c7m n GLY 10 Ca 0.29 -0.64 -0.17 0.00 0.00 0.00 0.00 46.02 45.50 2c7m n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2c7m s LYS 11 N -2.50 0.55 -0.20 1.61 2.20 -1.26 -5.04 119.74 115.10 2c7m s LYS 11 Ca 0.00 -0.13 -0.01 0.00 -0.36 0.00 0.00 55.97 55.47 2c7m s LYS 11 Cb 0.00 -0.57 0.01 0.00 -1.51 0.00 0.00 37.83 35.75 2c7m s LYS 11 CO 0.00 0.02 -0.13 0.99 -0.36 0.00 0.00 175.35 175.87 2c7m s THR 12 N 0.37 2.69 -0.22 3.43 2.01 -1.26 -1.51 115.64 121.15 2c7m s THR 12 Ca -0.04 -0.73 -0.17 0.00 0.31 0.00 0.00 61.69 61.06 2c7m s THR 12 Cb -0.08 -2.18 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2c7m s THR 12 CO -0.00 0.48 0.48 -0.63 -0.69 0.00 0.00 174.62 174.26 2c7m s ILE 13 N 1.37 5.13 -0.13 1.82 -1.09 0.44 -4.92 121.20 123.81 2c7m s ILE 13 Ca 0.05 0.85 -0.18 0.00 -2.23 0.00 0.00 60.65 59.15 2c7m s ILE 13 Cb -0.14 -3.80 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 2c7m s ILE 13 CO -0.08 0.18 0.46 -0.89 -1.23 0.00 0.00 174.94 173.37 2c7m s THR 14 N 1.70 5.20 0.05 2.92 2.01 -1.26 -1.24 115.64 125.01 2c7m s THR 14 Ca 0.22 0.90 0.07 0.00 0.31 0.00 0.00 61.69 63.18 2c7m s THR 14 Cb -0.15 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.53 2c7m s THR 14 CO 0.09 0.32 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.43 2c7m s LEU 15 N 0.71 2.76 -0.27 4.42 1.43 -0.47 -5.01 118.68 122.25 2c7m s LEU 15 Ca 0.24 -0.39 -0.16 0.00 -1.03 0.00 0.00 54.13 52.80 2c7m s LEU 15 Cb -0.15 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 2c7m s LEU 15 CO 0.09 0.24 0.43 -0.70 0.23 0.00 0.00 176.35 176.65 2c7m s GLU 16 N -1.58 4.04 0.21 1.70 2.56 -1.26 -2.79 118.70 121.57 2c7m s GLU 16 Ca 0.16 0.16 -0.05 0.00 0.00 0.00 0.00 54.97 55.24 2c7m s GLU 16 Cb -0.11 -3.65 -0.03 0.00 2.00 0.00 0.00 34.13 32.34 2c7m s GLU 16 CO 0.07 -0.31 0.25 0.14 -0.56 0.00 0.00 175.26 174.85 2c7m s VAL 17 N 2.17 0.01 0.08 3.70 -7.23 -0.36 -4.91 120.40 113.85 2c7m s VAL 17 Ca 0.18 -1.77 0.09 0.00 -1.81 0.00 0.00 61.98 58.67 2c7m s VAL 17 Cb -0.16 -2.35 -0.03 0.00 0.56 0.00 0.00 36.38 34.40 2c7m s VAL 17 CO 0.10 -0.04 -0.24 -1.61 -0.31 0.00 0.00 175.10 172.99 2c7m s GLU 18 N -4.10 1.48 0.59 4.82 0.41 -1.26 0.13 118.70 120.78 2c7m s GLU 18 Ca 0.32 -1.16 0.29 0.00 -0.41 0.00 0.00 54.97 54.01 2c7m s GLU 18 Cb 0.04 -1.76 1.38 0.00 -1.78 0.00 0.00 34.13 32.02 2c7m s GLU 18 CO 0.10 0.44 1.78 -1.35 -0.49 0.00 0.00 175.26 175.74 2c7m h PRO 19 N 4.41 0.00 0.00 0.39 0.11 -1.97 0.19 132.00 135.13 2c7m h PRO 19 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2c7m h PRO 19 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2c7m h PRO 19 CO 0.42 0.00 -0.04 -1.13 -0.21 0.00 0.00 178.00 177.04 2c7m n SER 20 N -3.61 0.50 -4.72 -2.05 3.41 -1.26 -0.78 113.62 105.10 2c7m n SER 20 Ca 0.12 0.51 -0.43 0.00 -0.26 0.00 0.00 58.87 58.81 2c7m n SER 20 Cb 0.85 -0.62 -0.02 0.00 -0.26 0.00 0.00 64.21 64.16 2c7m n SER 20 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2c7m n ASP 21 N -1.95 3.36 -4.79 4.04 9.92 0.66 -4.75 116.55 123.03 2c7m n ASP 21 Ca 0.06 1.17 -0.32 0.00 -0.53 0.00 0.00 54.79 55.16 2c7m n ASP 21 Cb 0.39 -1.53 0.04 0.00 -0.64 0.00 0.00 41.12 39.38 2c7m n ASP 21 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2c7m s THR 22 N -0.33 3.64 0.31 -3.53 -4.23 -1.26 -1.22 115.64 109.02 2c7m s THR 22 Ca 0.62 0.68 0.03 0.00 -1.18 0.00 0.00 61.69 61.84 2c7m s THR 22 Cb -0.55 -3.24 0.29 0.00 1.34 0.00 0.00 72.50 70.34 2c7m s THR 22 CO 0.53 -0.55 1.89 0.40 -0.54 0.00 0.00 174.62 176.35 2c7m h ILE 23 N -0.16 0.99 -0.69 2.99 1.08 -1.17 -1.23 117.51 119.33 2c7m h ILE 23 Ca -0.46 -0.32 0.01 0.00 -0.39 0.00 0.00 64.86 63.70 2c7m h ILE 23 Cb 1.23 -0.03 -0.03 0.00 -3.07 0.00 0.00 36.82 34.91 2c7m h ILE 23 CO 0.55 0.17 0.46 -0.08 -0.69 0.00 0.00 178.15 178.56 2c7m h GLU 24 N 0.94 0.89 0.01 2.37 4.81 -1.77 -1.72 114.58 120.11 2c7m h GLU 24 Ca 0.41 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.59 2c7m h GLU 24 Cb 0.36 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.54 2c7m h GLU 24 CO -0.18 0.59 -0.01 -0.91 -0.73 0.00 0.00 179.01 177.78 2c7m h ASN 25 N 0.92 -0.02 -0.52 1.04 2.35 -1.77 -1.39 115.58 116.20 2c7m h ASN 25 Ca 0.25 -0.45 0.02 0.00 -0.55 0.00 0.00 56.30 55.57 2c7m h ASN 25 Cb -0.09 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 2c7m h ASN 25 CO -0.06 0.45 0.32 0.58 -1.65 0.00 0.00 177.43 177.07 2c7m h VAL 26 N -0.49 1.08 -0.95 2.81 2.07 -0.96 -1.10 116.25 118.72 2c7m h VAL 26 Ca -0.00 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.31 2c7m h VAL 26 Cb 0.47 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 2c7m h VAL 26 CO 0.00 0.12 0.62 0.11 0.02 0.00 0.00 177.57 178.45 2c7m h LYS 27 N 0.65 1.22 -0.71 1.57 1.57 -1.32 -1.62 116.57 117.93 2c7m h LYS 27 Ca 0.20 -0.07 0.10 0.00 -1.87 0.00 0.00 60.65 59.01 2c7m h LYS 27 Cb -0.01 -0.27 -0.07 0.00 0.08 0.00 0.00 32.23 31.95 2c7m h LYS 27 CO -0.07 0.81 0.34 0.00 -0.57 0.00 0.00 179.45 179.95 2c7m h ALA 28 N 1.36 0.98 -0.38 3.86 0.00 -0.85 -0.75 119.26 123.48 2c7m h ALA 28 Ca 0.36 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.34 2c7m h ALA 28 Cb -0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2c7m h ALA 28 CO -0.09 -0.07 0.23 0.87 0.00 0.00 0.00 179.25 180.19 2c7m h LYS 29 N 0.57 0.45 -0.98 0.00 1.57 -0.68 -0.06 116.57 117.45 2c7m h LYS 29 Ca 0.35 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 59.16 2c7m h LYS 29 Cb 0.40 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 2c7m h LYS 29 CO -0.29 0.30 0.64 0.82 -0.57 0.00 0.00 179.45 180.35 2c7m h ILE 30 N 0.47 1.11 -0.94 1.86 2.04 -1.04 -1.57 117.51 119.43 2c7m h ILE 30 Ca 0.15 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 65.62 2c7m h ILE 30 Cb -0.01 -0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 35.87 2c7m h ILE 30 CO -0.06 0.21 0.62 -0.61 0.00 0.00 0.00 178.15 178.31 2c7m h GLN 31 N 1.16 1.23 -0.65 2.37 4.15 -0.35 0.17 115.11 123.19 2c7m h GLN 31 Ca 0.41 -0.07 0.03 0.00 0.77 0.00 0.00 58.65 59.79 2c7m h GLN 31 Cb 0.13 -0.28 -0.04 0.00 0.21 0.00 0.00 27.48 27.50 2c7m h GLN 31 CO -0.15 0.81 0.41 -0.44 -1.93 0.00 0.00 178.83 177.52 2c7m h ASP 32 N 1.26 0.67 0.14 -0.69 3.45 -0.06 0.24 116.42 121.43 2c7m h ASP 32 Ca 0.35 -0.00 -0.30 0.00 0.43 0.00 0.00 57.03 57.51 2c7m h ASP 32 Cb -0.13 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 38.50 2c7m h ASP 32 CO -0.08 0.46 -1.52 0.11 -1.57 0.00 0.00 179.24 176.64 2c7m h LYS 33 N 0.80 0.31 -0.01 3.56 1.57 -1.27 -3.40 116.57 118.13 2c7m h LYS 33 Ca 0.26 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 2c7m h LYS 33 Cb 0.01 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2c7m h LYS 33 CO -0.10 1.25 -0.28 0.39 -0.57 0.00 0.00 179.45 180.14 2c7m n GLU 34 N -3.80 2.41 -1.41 3.15 -0.58 0.03 -4.99 120.64 115.45 2c7m n GLU 34 Ca -0.25 -0.48 -0.15 0.00 -0.42 0.00 0.00 57.16 55.86 2c7m n GLU 34 Cb 0.97 -1.07 -0.06 0.00 -0.57 0.00 0.00 31.44 30.70 2c7m n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2c7m n GLY 35 N 0.99 1.42 3.64 0.62 0.00 0.83 -4.98 105.19 107.70 2c7m n GLY 35 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2c7m n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c7m s ILE 36 N -2.24 4.86 0.31 -0.61 1.01 -1.26 -4.98 121.20 118.29 2c7m s ILE 36 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 60.65 61.83 2c7m s ILE 36 Cb 0.00 -4.08 -0.11 0.00 0.01 0.00 0.00 42.46 38.28 2c7m s ILE 36 CO 0.00 -0.06 1.49 -2.16 0.00 0.00 0.00 174.94 174.21 2c7m s PRO 37 N 2.79 4.18 0.44 2.79 0.04 -1.26 -3.67 135.00 140.30 2c7m s PRO 37 Ca 0.33 2.46 0.33 0.00 0.04 0.00 0.00 61.00 64.17 2c7m s PRO 37 Cb -0.15 -3.04 1.47 0.00 0.04 0.00 0.00 34.50 32.82 2c7m s PRO 37 CO 0.08 -0.50 1.50 -2.30 0.04 0.00 0.00 177.00 175.82 2c7m n PRO 38 N 1.64 -0.03 -0.04 0.56 -0.02 -1.26 0.27 135.00 136.11 2c7m n PRO 38 Ca 0.05 1.19 0.07 0.00 -2.02 0.00 0.00 63.50 62.79 2c7m n PRO 38 Cb 0.39 -2.38 0.35 0.00 -0.02 0.00 0.00 33.50 31.83 2c7m n PRO 38 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2c7m n ASP 39 N -4.54 0.64 -0.85 2.55 5.68 -1.26 -2.48 116.55 116.27 2c7m n ASP 39 Ca 0.39 -1.68 0.07 0.00 -0.50 0.00 0.00 54.79 53.08 2c7m n ASP 39 Cb 1.56 -0.05 0.22 0.00 -1.14 0.00 0.00 41.12 41.71 2c7m n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2c7m n GLN 40 N -0.30 3.01 -5.22 0.11 6.02 0.14 -4.76 117.38 116.39 2c7m n GLN 40 Ca 0.11 -2.48 -0.32 0.00 -0.01 0.00 0.00 57.00 54.30 2c7m n GLN 40 Cb 0.14 -1.59 -0.17 0.00 1.02 0.00 0.00 30.24 29.65 2c7m n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2c7m s GLN 41 N -1.87 3.05 -0.13 -1.09 -0.21 -1.04 -0.70 119.66 117.67 2c7m s GLN 41 Ca 0.34 -0.88 0.02 0.00 0.02 0.00 0.00 55.36 54.87 2c7m s GLN 41 Cb 0.24 -2.30 0.00 0.00 1.00 0.00 0.00 33.01 31.95 2c7m s GLN 41 CO 0.14 0.18 -0.20 1.03 -2.12 0.00 0.00 175.29 174.31 2c7m s ARG 42 N 0.34 3.11 0.07 2.91 0.52 0.23 -4.83 118.95 121.31 2c7m s ARG 42 Ca -0.19 -0.82 0.05 0.00 -0.52 0.00 0.00 55.73 54.25 2c7m s ARG 42 Cb -0.18 -2.45 -0.04 0.00 0.52 0.00 0.00 34.95 32.81 2c7m s ARG 42 CO 0.09 0.09 -0.05 -0.51 0.02 0.00 0.00 175.30 174.94 2c7m s LEU 43 N 0.58 3.24 -0.02 2.53 1.43 -1.26 -0.59 118.68 124.60 2c7m s LEU 43 Ca -0.12 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.77 2c7m s LEU 43 Cb -0.16 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.09 2c7m s LEU 43 CO 0.03 0.21 -0.07 -0.63 0.23 0.00 0.00 176.35 176.13 2c7m s ILE 44 N -1.19 0.56 -0.13 -0.59 1.01 -0.63 -0.75 121.20 119.48 2c7m s ILE 44 Ca 0.22 -0.26 -0.08 0.00 0.00 0.00 0.00 60.65 60.52 2c7m s ILE 44 Cb -0.11 -0.50 0.04 0.00 0.01 0.00 0.00 42.46 41.90 2c7m s ILE 44 CO 0.14 0.18 0.31 0.12 0.00 0.00 0.00 174.94 175.69 2c7m s PHE 45 N 0.10 -0.40 -1.38 3.97 5.36 -0.49 -1.60 117.98 123.54 2c7m s PHE 45 Ca -0.01 0.93 -0.07 0.00 -0.96 0.00 0.00 56.93 56.82 2c7m s PHE 45 Cb -0.06 0.13 0.03 0.00 -0.34 0.00 0.00 43.02 42.78 2c7m s PHE 45 CO -0.00 -0.24 0.99 0.00 -1.46 0.00 0.00 175.22 174.52 2c7m n ALA 46 N 3.73 -1.56 -0.90 11.12 0.00 -1.26 -2.08 120.51 129.56 2c7m n ALA 46 Ca -0.20 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2c7m n ALA 46 Cb 0.55 -3.98 0.00 0.00 0.00 0.00 0.00 19.45 16.03 2c7m n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c7m n GLY 47 N -1.68 0.51 2.92 0.00 0.00 -1.26 -5.01 105.19 100.66 2c7m n GLY 47 Ca -0.09 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.44 2c7m n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c7m s LYS 48 N -0.75 0.13 0.08 1.61 1.02 -0.89 -5.13 119.74 115.82 2c7m s LYS 48 Ca 0.00 -0.25 -0.30 0.00 0.02 0.00 0.00 55.97 55.43 2c7m s LYS 48 Cb 0.00 0.04 -0.06 0.00 -0.52 0.00 0.00 37.83 37.29 2c7m s LYS 48 CO 0.00 -0.02 1.12 -0.65 -0.92 0.00 0.00 175.35 174.89 2c7m s GLN 49 N -0.60 4.50 0.09 1.68 -0.21 -1.26 -1.40 119.66 122.47 2c7m s GLN 49 Ca -0.06 1.68 -0.26 0.00 0.02 0.00 0.00 55.36 56.73 2c7m s GLN 49 Cb -0.04 -3.35 -0.06 0.00 1.00 0.00 0.00 33.01 30.55 2c7m s GLN 49 CO -0.00 -0.12 0.80 -0.51 -2.12 0.00 0.00 175.29 173.33 2c7m s LEU 50 N 0.68 4.50 -0.00 2.90 1.43 0.07 -4.96 118.68 123.29 2c7m s LEU 50 Ca 0.55 1.56 -0.16 0.00 -1.03 0.00 0.00 54.13 55.05 2c7m s LEU 50 Cb -0.28 -3.31 -0.06 0.00 0.03 0.00 0.00 46.19 42.58 2c7m s LEU 50 CO 0.30 0.06 0.44 -1.61 0.23 0.00 0.00 176.35 175.77 2c7m s GLU 51 N -0.36 4.01 0.40 1.70 2.02 -1.26 -4.71 118.70 120.49 2c7m s GLU 51 Ca 0.39 0.46 0.19 0.00 0.02 0.00 0.00 54.97 56.03 2c7m s GLU 51 Cb -0.22 -3.25 1.14 0.00 0.10 0.00 0.00 34.13 31.90 2c7m s GLU 51 CO 0.25 0.62 1.75 -0.44 0.02 0.00 0.00 175.26 177.46 2c7m h ASP 52 N 4.91 0.43 -0.03 -0.19 5.19 -1.96 -2.23 116.42 122.53 2c7m h ASP 52 Ca -0.50 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.00 2c7m h ASP 52 Cb 1.21 0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2c7m h ASP 52 CO 0.63 0.05 0.00 0.61 -3.12 0.00 0.00 179.24 177.41 2c7m n GLY 53 N -1.47 -0.04 4.01 2.75 0.00 -1.26 -2.59 105.19 106.59 2c7m n GLY 53 Ca 0.27 -0.42 -0.18 0.00 0.00 0.00 0.00 46.02 45.68 2c7m n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c7m s ARG 54 N -1.98 2.65 0.28 1.61 1.81 -0.84 -4.92 118.95 117.56 2c7m s ARG 54 Ca 0.38 -1.39 0.12 0.00 -1.72 0.00 0.00 55.73 53.12 2c7m s ARG 54 Cb 0.21 -2.69 -0.05 0.00 -0.45 0.00 0.00 34.95 31.96 2c7m s ARG 54 CO 0.33 -0.44 -0.18 0.95 -0.68 0.00 0.00 175.30 175.27 2c7m s THR 55 N -2.46 2.55 0.17 0.02 -4.23 -1.26 -1.03 115.64 109.40 2c7m s THR 55 Ca 0.56 -2.37 -0.18 0.00 -1.18 0.00 0.00 61.69 58.53 2c7m s THR 55 Cb -0.08 -2.35 0.10 0.00 1.34 0.00 0.00 72.50 71.51 2c7m s THR 55 CO 0.34 -0.39 1.65 -0.07 -0.54 0.00 0.00 174.62 175.61 2c7m h LEU 56 N 2.24 -0.52 -2.00 4.79 3.38 -1.19 -0.41 115.31 121.60 2c7m h LEU 56 Ca -0.40 0.14 0.20 0.00 0.09 0.00 0.00 57.88 57.91 2c7m h LEU 56 Cb 1.26 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 42.29 2c7m h LEU 56 CO 0.60 -0.18 0.50 0.77 0.09 0.00 0.00 178.44 180.22 2c7m h SER 57 N -0.06 0.00 0.03 -0.43 4.64 -1.17 0.25 113.55 116.81 2c7m h SER 57 Ca 0.20 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2c7m h SER 57 Cb 0.37 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2c7m h SER 57 CO -0.45 0.00 -0.01 0.44 -0.87 0.00 0.00 176.83 175.94 2c7m h ASP 58 N 0.00 0.00 -0.28 4.97 3.45 -1.34 -1.04 116.42 122.19 2c7m h ASP 58 Ca 0.33 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.79 2c7m h ASP 58 Cb 1.34 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.11 2c7m h ASP 58 CO -0.00 0.01 0.00 -1.22 -1.57 0.00 0.00 179.24 176.45 2c7m n TYR 59 N -3.52 0.36 -3.03 4.55 4.01 0.06 -4.94 117.16 114.65 2c7m n TYR 59 Ca -0.03 -0.26 -0.22 0.00 -0.16 0.00 0.00 57.90 57.22 2c7m n TYR 59 Cb 0.09 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 39.14 2c7m n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2c7m n ASN 60 N 0.95 -5.74 -4.59 7.72 5.15 -0.39 -4.94 115.26 113.40 2c7m n ASN 60 Ca 0.13 -0.28 -0.43 0.00 -0.60 0.00 0.00 54.58 53.41 2c7m n ASN 60 Cb 0.46 -4.66 -0.02 0.00 -0.53 0.00 0.00 39.78 35.03 2c7m n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2c7m s ILE 61 N -3.13 4.13 0.17 -1.44 1.01 -1.11 -5.02 121.20 115.81 2c7m s ILE 61 Ca 0.30 1.12 0.02 0.00 0.00 0.00 0.00 60.65 62.08 2c7m s ILE 61 Cb -0.14 -4.61 0.02 0.00 0.01 0.00 0.00 42.46 37.74 2c7m s ILE 61 CO 0.37 -1.08 0.16 0.00 0.00 0.00 0.00 174.94 174.38 2c7m n GLN 62 N 8.03 1.16 -1.69 2.79 6.02 -1.26 -4.40 117.38 128.03 2c7m n GLN 62 Ca 0.11 -1.05 -0.44 0.00 -0.01 0.00 0.00 57.00 55.61 2c7m n GLN 62 Cb 0.49 0.07 -0.03 0.00 1.02 0.00 0.00 30.24 31.80 2c7m n GLN 62 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2c7m n LYS 63 N -1.02 2.19 -1.13 -1.09 0.00 -1.26 -2.07 118.16 113.78 2c7m n LYS 63 Ca 0.01 0.78 -0.04 0.00 -0.00 0.00 0.00 58.31 59.05 2c7m n LYS 63 Cb 0.19 -2.47 -0.02 0.00 -0.00 0.00 0.00 35.03 32.73 2c7m n LYS 63 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2c7m n GLU 64 N 2.16 -0.76 -2.31 -1.58 4.71 0.26 -5.01 120.64 118.11 2c7m n GLU 64 Ca 0.11 0.51 -0.34 0.00 -0.01 0.00 0.00 57.16 57.43 2c7m n GLU 64 Cb 0.32 -4.28 -0.01 0.00 -1.01 0.00 0.00 31.44 26.47 2c7m n GLU 64 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2c7m s SER 65 N -2.44 5.91 -0.15 1.62 0.01 -0.88 -4.74 113.70 113.04 2c7m s SER 65 Ca 0.00 2.04 0.00 0.00 1.31 0.00 0.00 55.95 59.31 2c7m s SER 65 Cb 0.00 -2.57 -0.00 0.00 0.21 0.00 0.00 66.02 63.66 2c7m s SER 65 CO 0.00 -1.08 -0.16 -0.89 0.41 0.00 0.00 173.24 171.52 2c7m s THR 66 N -1.94 2.68 0.38 1.44 2.01 -1.26 -0.47 115.64 118.48 2c7m s THR 66 Ca 0.70 -0.77 0.08 0.00 0.31 0.00 0.00 61.69 62.00 2c7m s THR 66 Cb -0.20 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.15 2c7m s THR 66 CO 0.26 0.52 0.27 -0.76 -0.69 0.00 0.00 174.62 174.22 2c7m s LEU 67 N 0.71 3.35 0.03 4.42 1.02 0.13 -4.87 118.68 123.46 2c7m s LEU 67 Ca -0.07 -0.76 0.07 0.00 0.02 0.00 0.00 54.13 53.39 2c7m s LEU 67 Cb -0.16 -1.90 -0.03 0.00 0.02 0.00 0.00 46.19 44.13 2c7m s LEU 67 CO 0.01 -0.49 -0.21 -1.00 0.02 0.00 0.00 176.35 174.69 2c7m s HIS 68 N -2.45 2.48 -0.12 0.29 3.76 -0.63 -1.58 115.29 117.04 2c7m s HIS 68 Ca 0.43 -0.31 -0.01 0.00 -0.15 0.00 0.00 55.06 55.01 2c7m s HIS 68 Cb -0.02 -1.46 -0.03 0.00 1.11 0.00 0.00 32.58 32.18 2c7m s HIS 68 CO 0.25 0.17 -0.07 -1.17 -0.85 0.00 0.00 174.74 173.08 2c7m s LEU 69 N -1.21 3.09 0.08 0.89 2.96 0.34 -1.61 118.68 123.23 2c7m s LEU 69 Ca 0.13 -0.15 0.08 0.00 -0.22 0.00 0.00 54.13 53.98 2c7m s LEU 69 Cb -0.10 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 2c7m s LEU 69 CO 0.03 0.23 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.38 2c7m s VAL 70 N -0.01 1.77 -0.03 1.68 1.01 0.24 -4.29 120.40 120.77 2c7m s VAL 70 Ca -0.01 -1.45 -0.23 0.00 0.00 0.00 0.00 61.98 60.30 2c7m s VAL 70 Cb -0.14 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2c7m s VAL 70 CO 0.03 0.06 0.68 -0.22 0.00 0.00 0.00 175.10 175.65 2c7m s LEU 71 N -1.66 4.36 0.06 3.92 2.96 -1.26 -0.60 118.68 126.47 2c7m s LEU 71 Ca 0.08 1.22 -0.26 0.00 -0.22 0.00 0.00 54.13 54.95 2c7m s LEU 71 Cb -0.10 -3.07 -0.06 0.00 0.50 0.00 0.00 46.19 43.47 2c7m s LEU 71 CO 0.04 -0.04 0.79 -0.13 -1.32 0.00 0.00 176.35 175.69 2c7m s ARG 72 N 0.42 4.53 0.47 1.98 0.52 0.13 -4.89 118.95 122.11 2c7m s ARG 72 Ca 0.36 1.13 0.05 0.00 -0.52 0.00 0.00 55.73 56.75 2c7m s ARG 72 Cb -0.18 -3.36 -0.02 0.00 0.52 0.00 0.00 34.95 31.91 2c7m s ARG 72 CO 0.19 0.30 0.20 -0.51 0.02 0.00 0.00 175.30 175.50 2c7m s LEU 73 N -0.15 2.82 0.00 2.53 1.43 -1.26 -4.70 118.68 119.35 2c7m s LEU 73 Ca 0.39 -1.25 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 2c7m s LEU 73 Cb -0.21 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 44.80 2c7m s LEU 73 CO 0.24 -0.76 0.00 -1.14 0.23 0.00 0.00 176.35 174.92