#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ahq s TYR 2 N 0.00 -0.26 0.49 -1.42 5.04 -1.26 -5.18 117.35 114.76 2ahq s TYR 2 Ca 0.00 0.36 0.06 0.00 -2.44 0.00 0.00 57.07 55.05 2ahq s TYR 2 Cb 0.00 0.48 0.00 0.00 0.35 0.00 0.00 41.96 42.79 2ahq s TYR 2 CO 0.00 -0.28 0.31 0.45 -1.34 0.00 0.00 175.55 174.69 2ahq s SER 3 N -1.48 4.62 0.38 4.32 0.15 -1.26 -5.15 113.70 115.27 2ahq s SER 3 Ca 0.03 -1.14 -0.09 0.00 0.70 0.00 0.00 55.95 55.45 2ahq s SER 3 Cb -0.01 0.02 0.03 0.00 -1.71 0.00 0.00 66.02 64.35 2ahq s SER 3 CO -0.03 -0.86 0.65 -0.22 1.20 0.00 0.00 173.24 173.98 2ahq s LEU 4 N -4.13 0.52 -0.21 3.45 2.96 -1.26 -5.18 118.68 114.83 2ahq s LEU 4 Ca 0.36 -1.35 -0.28 0.00 -0.22 0.00 0.00 54.13 52.64 2ahq s LEU 4 Cb -0.01 2.22 0.12 0.00 0.50 0.00 0.00 46.19 49.02 2ahq s LEU 4 CO 0.21 -1.54 0.97 -0.60 -1.32 0.00 0.00 176.35 174.07 2ahq s ARG 5 N -2.53 0.61 -0.20 1.98 3.52 -1.26 -5.17 118.95 115.90 2ahq s ARG 5 Ca 0.23 0.39 -0.11 0.00 -0.13 0.00 0.00 55.73 56.10 2ahq s ARG 5 Cb -0.03 0.29 0.07 0.00 -1.56 0.00 0.00 34.95 33.72 2ahq s ARG 5 CO 0.16 -0.14 0.50 0.99 -0.81 0.00 0.00 175.30 176.00 2ahq s THR 6 N -0.48 -0.02 0.00 4.11 2.01 -1.26 -5.13 115.64 114.87 2ahq s THR 6 Ca -0.00 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.06 2ahq s THR 6 Cb -0.03 -0.73 0.00 0.00 0.01 0.00 0.00 72.50 71.75 2ahq s THR 6 CO -0.01 0.03 0.00 0.33 -0.69 0.00 0.00 174.62 174.28 2ahq n PHE 7 N 4.27 0.00 -3.62 4.92 -0.00 -1.26 -5.18 117.46 116.58 2ahq n PHE 7 Ca -0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 57.45 57.18 2ahq n PHE 7 Cb 0.56 0.00 -0.05 0.00 -0.00 0.00 0.00 39.48 40.00 2ahq n PHE 7 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.76 176.17 2ahq s PHE 8 N 0.00 -0.15 0.00 -5.13 -0.12 -1.26 -5.15 117.98 106.17 2ahq s PHE 8 Ca 0.00 0.26 0.00 0.00 -0.05 0.00 0.00 56.93 57.14 2ahq s PHE 8 Cb 0.00 0.48 0.00 0.00 -0.63 0.00 0.00 43.02 42.87 2ahq s PHE 8 CO 0.00 -0.13 0.00 0.28 -0.05 0.00 0.00 175.22 175.32 2ahq n VAL 9 N 0.63 0.00 0.00 -2.49 0.31 -1.26 -5.15 118.33 110.37 2ahq n VAL 9 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2ahq n VAL 9 Cb 0.58 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.51 2ahq n VAL 9 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2ahq n ARG 10 N 0.00 0.00 0.00 5.55 1.74 -1.26 -5.17 116.66 117.52 2ahq n ARG 10 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2ahq n ARG 10 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2ahq n ARG 10 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ahq n GLU 11 N -0.22 0.00 0.00 5.56 -0.58 -1.26 -4.81 120.64 119.32 2ahq n GLU 11 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2ahq n GLU 11 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2ahq n GLU 11 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2ahq n SER 12 N -2.68 0.00 -4.12 1.62 3.41 -1.26 -4.92 113.62 105.67 2ahq n SER 12 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 2ahq n SER 12 Cb 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.07 2ahq n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ahq n ALA 13 N -3.00 -4.31 -0.65 7.33 0.00 0.10 -4.91 120.51 115.07 2ahq n ALA 13 Ca 0.00 -1.30 -0.28 0.00 0.00 0.00 0.00 53.44 51.86 2ahq n ALA 13 Cb 0.00 -1.20 0.24 0.00 0.00 0.00 0.00 19.45 18.50 2ahq n ALA 13 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2ahq s GLU 14 N -2.95 -0.82 -0.67 0.00 -1.05 -1.26 -4.76 118.70 107.20 2ahq s GLU 14 Ca 0.47 0.74 -0.04 0.00 -0.15 0.00 0.00 54.97 55.98 2ahq s GLU 14 Cb -0.03 -1.57 -0.04 0.00 -0.44 0.00 0.00 34.13 32.04 2ahq s GLU 14 CO 0.62 -3.63 1.83 0.41 0.95 0.00 0.00 175.26 175.44 2ahq n GLY 15 N 0.47 2.72 3.83 -3.83 0.00 -1.26 -4.87 105.19 102.26 2ahq n GLY 15 Ca 0.03 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.09 2ahq n GLY 15 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ahq s LEU 16 N 0.07 3.83 0.41 0.99 0.05 -1.26 -5.05 118.68 117.71 2ahq s LEU 16 Ca 0.29 1.61 -0.08 0.00 0.05 0.00 0.00 54.13 56.01 2ahq s LEU 16 Cb 0.08 -4.49 -0.05 0.00 -2.05 0.00 0.00 46.19 39.67 2ahq s LEU 16 CO -0.02 -0.44 0.74 0.42 -0.55 0.00 0.00 176.35 176.50 2ahq s THR 17 N -2.34 4.86 0.43 5.48 -4.23 -1.26 -4.91 115.64 113.68 2ahq s THR 17 Ca 0.60 0.39 0.19 0.00 -1.18 0.00 0.00 61.69 61.69 2ahq s THR 17 Cb -0.09 -3.78 0.39 0.00 1.34 0.00 0.00 72.50 70.36 2ahq s THR 17 CO 0.20 -0.60 1.87 0.06 -0.54 0.00 0.00 174.62 175.61 2ahq h GLN 18 N 0.99 0.35 -0.07 3.99 3.07 -2.00 0.40 115.11 121.84 2ahq h GLN 18 Ca -0.47 -0.02 -0.16 0.00 0.09 0.00 0.00 58.65 58.09 2ahq h GLN 18 Cb 1.19 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 28.66 2ahq h GLN 18 CO 0.63 0.23 -0.66 0.78 0.09 0.00 0.00 178.83 179.91 2ahq h GLY 19 N 0.36 0.32 1.16 0.06 0.00 -2.01 -2.97 103.07 100.00 2ahq h GLY 19 Ca 0.45 -0.42 -0.13 0.00 0.00 0.00 0.00 47.33 47.24 2ahq h GLY 19 CO -0.15 0.38 -0.20 0.83 0.00 0.00 0.00 176.54 177.40 2ahq h GLU 20 N 0.21 0.96 -0.92 4.80 5.08 -0.64 -2.81 114.58 121.26 2ahq h GLU 20 Ca -0.01 -0.39 0.01 0.00 -1.00 0.00 0.00 59.36 57.96 2ahq h GLU 20 Cb 1.19 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.36 2ahq h GLU 20 CO 0.11 1.06 0.61 1.25 -1.00 0.00 0.00 179.01 181.03 2ahq h LEU 21 N 0.83 1.05 0.32 1.33 7.12 -1.11 0.47 115.31 125.34 2ahq h LEU 21 Ca 0.11 -0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.10 2ahq h LEU 21 Cb 0.76 -0.26 -0.03 0.00 -0.53 0.00 0.00 40.66 40.60 2ahq h LEU 21 CO 0.06 0.76 -0.40 -0.03 -0.13 0.00 0.00 178.44 178.70 2ahq h MET 22 N 1.25 -0.75 0.00 1.25 4.05 -1.34 0.39 114.93 119.78 2ahq h MET 22 Ca 0.34 0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.80 2ahq h MET 22 Cb -0.15 0.17 -0.00 0.00 -0.80 0.00 0.00 31.60 30.82 2ahq h MET 22 CO -0.07 -0.50 -0.06 0.87 0.23 0.00 0.00 176.91 177.38 2ahq h LYS 23 N -0.77 0.00 -0.31 0.39 1.57 -1.32 0.14 116.57 116.27 2ahq h LYS 23 Ca -0.02 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 2ahq h LYS 23 Cb 0.72 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2ahq h LYS 23 CO -0.11 0.06 -0.03 -0.07 -0.57 0.00 0.00 179.45 178.72 2ahq h LEU 24 N 0.00 0.56 -0.25 2.94 3.38 0.46 1.12 115.31 123.52 2ahq h LEU 24 Ca -0.00 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.57 2ahq h LEU 24 Cb 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2ahq h LEU 24 CO 0.01 0.76 -0.09 0.40 0.09 0.00 0.00 178.44 179.60 2ahq h ILE 25 N 0.34 1.29 -0.65 1.22 2.04 0.82 -2.62 117.51 119.96 2ahq h ILE 25 Ca 0.08 -1.14 -0.08 0.00 1.00 0.00 0.00 64.86 64.72 2ahq h ILE 25 Cb 0.49 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 2ahq h ILE 25 CO 0.02 0.36 0.09 0.50 0.00 0.00 0.00 178.15 179.12 2ahq h LYS 26 N 0.23 1.08 -0.89 2.37 3.11 -0.68 -2.36 116.57 119.42 2ahq h LYS 26 Ca 0.06 -0.30 0.16 0.00 -2.81 0.00 0.00 60.65 57.76 2ahq h LYS 26 Cb 0.58 -0.12 -0.07 0.00 -1.00 0.00 0.00 32.23 31.62 2ahq h LYS 26 CO 0.03 1.00 0.58 0.93 -2.81 0.00 0.00 179.45 179.18 2ahq h GLU 27 N 1.00 0.61 -0.48 1.90 5.08 0.14 0.22 114.58 123.05 2ahq h GLU 27 Ca 0.19 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.40 2ahq h GLU 27 Cb 0.46 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 2ahq h GLU 27 CO 0.02 0.40 -0.16 0.82 -1.00 0.00 0.00 179.01 179.09 2ahq h ILE 28 N 0.63 1.27 0.00 3.13 2.04 -1.05 -1.74 117.51 121.78 2ahq h ILE 28 Ca 0.46 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2ahq h ILE 28 Cb 0.83 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 2ahq h ILE 28 CO -0.21 0.45 0.00 0.52 0.00 0.00 0.00 178.15 178.91 2ahq n VAL 29 N -4.13 0.00 0.22 1.67 0.31 0.74 -3.68 118.33 113.46 2ahq n VAL 29 Ca 0.01 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.40 2ahq n VAL 29 Cb 0.42 -0.43 0.50 0.00 -0.91 0.00 0.00 33.84 33.42 2ahq n VAL 29 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2ahq h GLU 30 N 0.03 0.00 -0.63 5.55 4.39 -0.77 -3.30 114.58 119.85 2ahq h GLU 30 Ca 0.00 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.39 2ahq h GLU 30 Cb 0.43 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 28.81 2ahq h GLU 30 CO 0.00 0.26 -0.76 0.27 -1.16 0.00 0.00 179.01 177.61 2ahq n ASN 31 N -3.92 -0.54 -3.82 1.42 6.94 -1.24 -5.12 115.26 108.97 2ahq n ASN 31 Ca -0.02 -2.87 0.00 0.00 -0.02 0.00 0.00 54.58 51.68 2ahq n ASN 31 Cb 0.33 0.46 0.00 0.00 -2.36 0.00 0.00 39.78 38.21 2ahq n ASN 31 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 2ahq n GLU 32 N -0.11 1.87 -3.57 -3.83 0.28 -1.25 -5.06 120.64 108.98 2ahq n GLU 32 Ca 0.07 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.91 2ahq n GLU 32 Cb 0.78 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.59 2ahq n GLU 32 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2ahq s ASP 33 N -2.03 -0.54 -0.11 -1.84 2.15 -1.20 -4.96 116.67 108.14 2ahq s ASP 33 Ca 0.00 0.52 -0.27 0.00 0.43 0.00 0.00 52.55 53.23 2ahq s ASP 33 Cb 0.00 0.49 -0.23 0.00 -0.30 0.00 0.00 42.92 42.88 2ahq s ASP 33 CO 0.00 -0.60 0.85 0.11 -0.17 0.00 0.00 175.17 175.37 2ahq h LYS 34 N 3.12 -0.01 0.00 4.34 1.79 -1.97 0.92 116.57 124.75 2ahq h LYS 34 Ca -0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.19 2ahq h LYS 34 Cb 1.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 2ahq h LYS 34 CO 0.39 0.79 0.00 -2.13 -1.08 0.00 0.00 179.45 177.43 2ahq n ARG 35 N -4.69 0.43 -2.72 3.15 0.63 -1.26 -3.95 116.66 108.25 2ahq n ARG 35 Ca -0.09 0.06 -0.07 0.00 -0.92 0.00 0.00 57.85 56.83 2ahq n ARG 35 Cb 0.39 -1.50 0.06 0.00 0.45 0.00 0.00 32.46 31.86 2ahq n ARG 35 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2ahq n LYS 36 N -1.19 0.52 -1.89 -0.14 4.76 -1.20 -5.16 118.16 113.86 2ahq n LYS 36 Ca 0.12 -1.33 -0.32 0.00 -2.87 0.00 0.00 58.31 53.91 2ahq n LYS 36 Cb 0.14 -0.98 0.02 0.00 -1.84 0.00 0.00 35.03 32.37 2ahq n LYS 36 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2ahq s PRO 37 N 0.48 3.22 -1.43 1.97 0.04 0.32 -3.22 135.00 136.38 2ahq s PRO 37 Ca 0.30 1.09 -0.08 0.00 0.04 0.00 0.00 61.00 62.34 2ahq s PRO 37 Cb 0.22 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.78 2ahq s PRO 37 CO -0.18 -0.88 2.52 0.66 0.04 0.00 0.00 177.00 179.16 2ahq n TYR 38 N -2.42 2.64 -0.86 0.56 4.01 -1.26 -4.75 117.16 115.09 2ahq n TYR 38 Ca 0.08 -2.92 -0.28 0.00 -0.16 0.00 0.00 57.90 54.61 2ahq n TYR 38 Cb 0.53 -2.13 0.21 0.00 -0.31 0.00 0.00 39.34 37.65 2ahq n TYR 38 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2ahq s SER 39 N 1.25 1.78 0.49 7.72 1.04 -1.26 -4.15 113.70 120.57 2ahq s SER 39 Ca 0.57 1.36 0.37 0.00 0.48 0.00 0.00 55.95 58.73 2ahq s SER 39 Cb 0.17 -2.08 1.53 0.00 0.10 0.00 0.00 66.02 65.74 2ahq s SER 39 CO -0.07 -3.68 1.64 -2.24 0.98 0.00 0.00 173.24 169.87 2ahq h ASP 40 N -2.27 0.14 -0.23 7.02 2.03 -1.89 1.47 116.42 122.69 2ahq h ASP 40 Ca -0.58 0.07 -0.02 0.00 -0.73 0.00 0.00 57.03 55.77 2ahq h ASP 40 Cb 1.33 0.06 -0.01 0.00 -0.83 0.00 0.00 39.33 39.88 2ahq h ASP 40 CO 0.54 -0.08 0.06 -0.61 -1.03 0.00 0.00 179.24 178.11 2ahq h GLN 41 N 0.06 0.36 0.00 4.15 5.75 -1.95 -0.10 115.11 123.38 2ahq h GLN 41 Ca 0.81 -0.09 -0.00 0.00 -0.15 0.00 0.00 58.65 59.22 2ahq h GLN 41 Cb 2.86 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 31.36 2ahq h GLN 41 CO -0.22 0.47 -0.00 1.49 -2.65 0.00 0.00 178.83 177.92 2ahq h GLU 42 N 0.18 -0.01 -0.96 1.69 4.57 0.17 -0.33 114.58 119.91 2ahq h GLU 42 Ca 0.07 0.00 0.27 0.00 -1.18 0.00 0.00 59.36 58.52 2ahq h GLU 42 Cb 0.27 0.00 -0.17 0.00 -0.16 0.00 0.00 28.75 28.69 2ahq h GLU 42 CO 0.00 -0.00 0.10 0.82 -1.18 0.00 0.00 179.01 178.75 2ahq h ILE 43 N -0.01 0.08 -0.63 2.32 5.03 -1.37 1.98 117.51 124.92 2ahq h ILE 43 Ca -0.00 -0.02 0.05 0.00 -0.12 0.00 0.00 64.86 64.78 2ahq h ILE 43 Cb 0.00 0.04 -0.05 0.00 -3.03 0.00 0.00 36.82 33.78 2ahq h ILE 43 CO 0.00 0.01 0.35 0.00 -0.68 0.00 0.00 178.15 177.83 2ahq h ALA 44 N 1.94 0.83 -0.32 1.87 0.00 -0.97 -0.05 119.26 122.56 2ahq h ALA 44 Ca 0.60 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.41 2ahq h ALA 44 Cb 1.27 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2ahq h ALA 44 CO -0.85 0.03 -0.26 -0.91 0.00 0.00 0.00 179.25 177.26 2ahq h ASN 45 N 0.66 0.64 -0.59 0.00 2.35 0.46 -2.80 115.58 116.30 2ahq h ASN 45 Ca 0.28 -0.23 0.04 0.00 -0.55 0.00 0.00 56.30 55.84 2ahq h ASN 45 Cb 0.15 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.30 2ahq h ASN 45 CO -0.16 0.88 0.33 0.40 -1.65 0.00 0.00 177.43 177.22 2ahq h ILE 46 N 0.55 1.00 -0.90 2.81 2.04 0.20 0.17 117.51 123.38 2ahq h ILE 46 Ca 0.07 -0.22 0.21 0.00 1.00 0.00 0.00 64.86 65.92 2ahq h ILE 46 Cb 0.73 0.31 -0.07 0.00 -0.74 0.00 0.00 36.82 37.06 2ahq h ILE 46 CO 0.06 0.12 0.60 0.17 0.00 0.00 0.00 178.15 179.09 2ahq h LEU 47 N 0.64 0.39 -2.08 1.44 8.10 -0.79 0.97 115.31 123.98 2ahq h LEU 47 Ca 0.25 0.04 0.09 0.00 0.11 0.00 0.00 57.88 58.37 2ahq h LEU 47 Cb 0.10 -0.03 -0.01 0.00 -0.44 0.00 0.00 40.66 40.28 2ahq h LEU 47 CO -0.14 0.15 0.25 0.50 -4.11 0.00 0.00 178.44 175.10 2ahq h LYS 48 N 0.39 0.00 -1.87 0.17 3.64 -0.94 2.07 116.57 120.02 2ahq h LYS 48 Ca 0.47 0.00 0.56 0.00 -1.27 0.00 0.00 60.65 60.40 2ahq h LYS 48 Cb 1.19 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.92 2ahq h LYS 48 CO -0.17 0.00 1.33 0.39 -2.27 0.00 0.00 179.45 178.73 2ahq n GLU 49 N -4.17 -0.01 0.00 1.90 -0.58 0.34 -4.14 120.64 113.99 2ahq n GLU 49 Ca 0.04 1.12 0.00 0.00 -0.42 0.00 0.00 57.16 57.90 2ahq n GLU 49 Cb 0.42 -2.50 0.00 0.00 -0.57 0.00 0.00 31.44 28.79 2ahq n GLU 49 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2ahq n LYS 50 N -4.07 0.00 0.00 3.49 0.00 -0.54 -5.10 118.16 111.94 2ahq n LYS 50 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.75 2ahq n LYS 50 Cb 1.94 0.00 0.00 0.00 0.00 0.00 0.00 35.03 36.97 2ahq n LYS 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ahq n GLY 51 N -1.00 1.41 1.45 3.14 0.00 0.69 -4.81 105.19 106.07 2ahq n GLY 51 Ca 0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.50 2ahq n GLY 51 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ahq n PHE 52 N 0.00 1.08 -3.85 1.61 3.72 -1.18 0.01 117.46 118.85 2ahq n PHE 52 Ca 0.00 -1.01 -0.25 0.00 -0.05 0.00 0.00 57.45 56.14 2ahq n PHE 52 Cb 0.00 -0.51 0.01 0.00 -0.94 0.00 0.00 39.48 38.03 2ahq n PHE 52 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 2ahq n LYS 53 N -0.04 -4.26 0.00 -1.08 4.81 -1.26 -4.86 118.16 111.48 2ahq n LYS 53 Ca 0.21 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 58.17 2ahq n LYS 53 Cb 0.89 -4.96 0.00 0.00 0.02 0.00 0.00 35.03 30.99 2ahq n LYS 53 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2ahq n VAL 54 N -4.38 0.00 0.00 3.15 0.31 -1.26 -5.05 118.33 111.10 2ahq n VAL 54 Ca -0.24 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2ahq n VAL 54 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 2ahq n VAL 54 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ahq n ALA 55 N -3.00 0.00 -0.36 3.52 0.00 -1.26 -4.86 120.51 114.55 2ahq n ALA 55 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2ahq n ALA 55 Cb 0.00 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.57 2ahq n ALA 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ahq n ARG 56 N -0.99 -0.11 -0.20 0.00 1.74 -1.26 0.23 116.66 116.06 2ahq n ARG 56 Ca 0.00 1.55 -0.01 0.00 -0.77 0.00 0.00 57.85 58.61 2ahq n ARG 56 Cb 0.00 -2.31 0.20 0.00 -1.02 0.00 0.00 32.46 29.33 2ahq n ARG 56 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 2ahq h ARG 57 N 0.00 0.97 0.11 5.56 -0.00 -1.99 0.12 114.38 119.15 2ahq h ARG 57 Ca 0.46 -0.12 -0.01 0.00 -0.00 0.00 0.00 59.98 60.31 2ahq h ARG 57 Cb 0.70 -0.19 0.00 0.00 -0.00 0.00 0.00 29.97 30.49 2ahq h ARG 57 CO -1.02 0.73 -0.05 1.15 -0.00 0.00 0.00 179.97 180.78 2ahq h THR 58 N 0.97 1.10 -0.89 0.08 2.02 0.25 -2.94 112.91 113.51 2ahq h THR 58 Ca 0.24 -1.19 0.13 0.00 0.77 0.00 0.00 66.41 66.37 2ahq h THR 58 Cb 0.06 1.81 -0.07 0.00 -1.74 0.00 0.00 68.15 68.21 2ahq h THR 58 CO -0.04 0.27 0.57 0.58 0.37 0.00 0.00 175.52 177.28 2ahq h VAL 59 N -0.73 0.86 -0.63 3.16 2.07 0.24 0.14 116.25 121.35 2ahq h VAL 59 Ca -0.01 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 67.31 2ahq h VAL 59 Cb 0.55 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 2ahq h VAL 59 CO 0.02 0.13 0.35 0.00 0.02 0.00 0.00 177.57 178.09 2ahq h ALA 60 N 1.59 0.84 -0.39 1.67 0.00 -0.74 1.80 119.26 124.03 2ahq h ALA 60 Ca 0.44 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.33 2ahq h ALA 60 Cb 0.66 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2ahq h ALA 60 CO -0.20 0.03 0.11 -0.22 0.00 0.00 0.00 179.25 178.97 2ahq h LYS 61 N 0.65 0.61 -0.53 0.00 3.64 -0.60 -2.90 116.57 117.44 2ahq h LYS 61 Ca 0.28 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.41 2ahq h LYS 61 Cb 0.16 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2ahq h LYS 61 CO -0.17 0.62 -0.11 1.88 -2.27 0.00 0.00 179.45 179.41 2ahq h TYR 62 N 0.48 1.12 -0.97 1.91 -1.99 -0.20 -2.96 116.97 114.37 2ahq h TYR 62 Ca 0.12 -0.24 0.31 0.00 2.00 0.00 0.00 58.73 60.93 2ahq h TYR 62 Cb 0.28 -0.28 -0.16 0.00 2.00 0.00 0.00 36.73 38.57 2ahq h TYR 62 CO 0.01 1.05 0.38 -0.09 -0.00 0.00 0.00 178.16 179.51 2ahq h ARG 63 N 0.87 0.15 -0.08 4.88 1.12 0.29 1.90 114.38 123.52 2ahq h ARG 63 Ca 0.14 -0.01 -0.14 0.00 -1.11 0.00 0.00 59.98 58.85 2ahq h ARG 63 Cb 0.67 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 30.59 2ahq h ARG 63 CO 0.05 0.10 -0.58 1.49 -3.11 0.00 0.00 179.97 177.92 2ahq h GLU 64 N 0.16 0.26 0.00 0.20 4.81 -1.49 1.77 114.58 120.29 2ahq h GLU 64 Ca 0.69 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.68 2ahq h GLU 64 Cb 1.59 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.98 2ahq h GLU 64 CO -0.72 0.77 -0.34 0.52 -0.73 0.00 0.00 179.01 178.51 2ahq h MET 65 N 0.19 0.00 0.00 1.92 2.86 0.29 -3.42 114.93 116.77 2ahq h MET 65 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2ahq h MET 65 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 2ahq h MET 65 CO 0.09 0.34 0.00 1.47 1.06 0.00 0.00 176.91 179.87 2ahq n LEU 66 N -3.99 -0.94 0.00 1.22 -0.00 0.46 -5.10 117.00 108.65 2ahq n LEU 66 Ca -0.02 0.27 0.00 0.00 -0.00 0.00 0.00 56.01 56.27 2ahq n LEU 66 Cb 0.40 1.09 0.00 0.00 -0.00 0.00 0.00 43.42 44.91 2ahq n LEU 66 CO 0.38 -0.37 0.00 0.61 -0.00 0.00 0.00 177.39 178.00