#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 2.10 -0.29 -1.42 2.02 -1.26 -5.12 117.35 113.38 2ahq s TYR 2 Ca 0.00 -0.69 -0.03 0.00 -0.37 0.00 0.00 57.07 55.98 2ahq s TYR 2 Cb 0.00 -2.02 0.10 0.00 -0.40 0.00 0.00 41.96 39.64 2ahq s TYR 2 CO 0.00 -0.31 0.12 -1.12 -1.57 0.00 0.00 175.55 172.67 2ahq s SER 3 N -4.20 3.61 -0.29 2.29 0.01 -1.26 -5.09 113.70 108.77 2ahq s SER 3 Ca 0.41 -1.35 -0.15 0.00 1.31 0.00 0.00 55.95 56.17 2ahq s SER 3 Cb -0.02 -0.46 0.13 0.00 0.21 0.00 0.00 66.02 65.88 2ahq s SER 3 CO 0.24 -0.43 0.87 -0.22 0.41 0.00 0.00 173.24 174.12 2ahq s LEU 4 N 1.99 -0.69 0.00 2.44 1.98 -1.26 -5.10 118.68 118.05 2ahq s LEU 4 Ca 0.09 1.06 0.00 0.00 -2.89 0.00 0.00 54.13 52.39 2ahq s LEU 4 Cb -0.16 1.96 0.00 0.00 0.66 0.00 0.00 46.19 48.64 2ahq s LEU 4 CO -0.34 -0.16 0.00 0.54 -1.89 0.00 0.00 176.35 174.50 2ahq n ARG 5 N 4.14 0.00 -3.66 1.98 1.74 -1.26 -5.16 116.66 114.44 2ahq n ARG 5 Ca -0.18 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.84 2ahq n ARG 5 Cb 0.57 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.93 2ahq n ARG 5 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2ahq s THR 6 N 0.00 -0.36 0.00 0.55 -4.23 -1.26 -5.13 115.64 105.21 2ahq s THR 6 Ca 0.00 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.57 2ahq s THR 6 Cb 0.00 -0.83 0.00 0.00 1.34 0.00 0.00 72.50 73.01 2ahq s THR 6 CO 0.00 0.02 0.00 0.33 -0.54 0.00 0.00 174.62 174.43 2ahq n PHE 7 N 4.77 0.00 -3.81 3.99 -0.00 -1.26 -5.19 117.46 115.97 2ahq n PHE 7 Ca -0.17 0.00 0.02 0.00 -0.00 0.00 0.00 57.45 57.31 2ahq n PHE 7 Cb 0.54 0.00 0.01 0.00 -0.00 0.00 0.00 39.48 40.02 2ahq n PHE 7 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.76 176.88 2ahq s PHE 8 N 0.00 -0.00 0.00 -5.13 5.36 -1.26 -5.16 117.98 111.79 2ahq s PHE 8 Ca 0.00 -0.10 0.00 0.00 -0.96 0.00 0.00 56.93 55.87 2ahq s PHE 8 Cb 0.00 0.55 0.00 0.00 -0.34 0.00 0.00 43.02 43.23 2ahq s PHE 8 CO 0.00 -0.24 0.00 0.28 -1.46 0.00 0.00 175.22 173.80 2ahq n VAL 9 N -0.71 0.00 0.00 3.12 0.31 -1.26 -5.13 118.33 114.66 2ahq n VAL 9 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2ahq n VAL 9 Cb 0.61 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 2ahq n VAL 9 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2ahq n ARG 10 N 0.00 0.00 -1.42 5.55 0.63 -1.26 -5.17 116.66 114.99 2ahq n ARG 10 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2ahq n ARG 10 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2ahq n ARG 10 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 2ahq n GLU 11 N -1.75 0.00 -1.55 -0.14 0.28 -1.26 -5.17 120.64 111.05 2ahq n GLU 11 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.16 57.07 2ahq n GLU 11 Cb 0.00 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 32.83 2ahq n GLU 11 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2ahq n SER 12 N -0.09 -8.21 0.00 -1.84 7.64 -1.26 -5.03 113.62 104.82 2ahq n SER 12 Ca 0.00 1.73 0.00 0.00 1.01 0.00 0.00 58.87 61.61 2ahq n SER 12 Cb 0.00 -5.10 0.00 0.00 -1.01 0.00 0.00 64.21 58.10 2ahq n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ahq n ALA 13 N -3.28 0.00 -2.54 -0.43 0.00 -1.26 -4.84 120.51 108.16 2ahq n ALA 13 Ca -0.04 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.17 2ahq n ALA 13 Cb 0.56 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.03 2ahq n ALA 13 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2ahq n GLU 14 N 0.00 -1.13 0.00 0.00 2.13 -1.26 -3.98 120.64 116.40 2ahq n GLU 14 Ca 0.00 0.82 0.00 0.00 0.66 0.00 0.00 57.16 58.64 2ahq n GLU 14 Cb 0.00 -1.19 0.00 0.00 0.27 0.00 0.00 31.44 30.52 2ahq n GLU 14 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ahq n GLY 15 N -0.17 0.40 3.82 8.31 0.00 -1.26 -5.13 105.19 111.16 2ahq n GLY 15 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 3.19 0.54 0.99 0.05 -1.26 -5.04 118.68 117.16 2ahq s LEU 16 Ca 0.00 1.62 -0.13 0.00 0.05 0.00 0.00 54.13 55.67 2ahq s LEU 16 Cb 0.00 -4.50 -0.06 0.00 -2.05 0.00 0.00 46.19 39.58 2ahq s LEU 16 CO 0.00 -1.36 0.97 0.42 -0.55 0.00 0.00 176.35 175.84 2ahq s THR 17 N -2.99 4.64 0.46 5.48 -4.23 -1.26 -4.92 115.64 112.83 2ahq s THR 17 Ca 0.58 0.98 0.17 0.00 -1.18 0.00 0.00 61.69 62.24 2ahq s THR 17 Cb -0.14 -3.79 0.34 0.00 1.34 0.00 0.00 72.50 70.26 2ahq s THR 17 CO 0.53 -0.86 1.99 0.06 -0.54 0.00 0.00 174.62 175.79 2ahq h GLN 18 N 0.43 0.27 -0.26 3.99 -0.00 -2.00 -0.30 115.11 117.24 2ahq h GLN 18 Ca -0.46 -0.02 -0.18 0.00 -0.00 0.00 0.00 58.65 57.99 2ahq h GLN 18 Cb 1.19 -0.06 0.00 0.00 -0.00 0.00 0.00 27.48 28.61 2ahq h GLN 18 CO 0.62 0.18 -0.56 0.78 -0.00 0.00 0.00 178.83 179.85 2ahq h GLY 19 N 0.28 0.91 0.99 0.06 0.00 -2.01 -3.05 103.07 100.25 2ahq h GLY 19 Ca 0.27 -1.10 0.02 0.00 0.00 0.00 0.00 47.33 46.51 2ahq h GLY 19 CO -0.06 0.99 0.66 -2.09 0.00 0.00 0.00 176.54 176.04 2ahq h GLU 20 N 0.60 1.30 -1.00 4.80 4.22 -1.45 -1.38 114.58 121.66 2ahq h GLU 20 Ca 0.00 -0.08 0.03 0.00 0.08 0.00 0.00 59.36 59.40 2ahq h GLU 20 Cb 1.17 -0.29 -0.06 0.00 0.50 0.00 0.00 28.75 30.08 2ahq h GLU 20 CO 0.12 0.86 0.66 1.25 -2.18 0.00 0.00 179.01 179.72 2ahq h LEU 21 N 1.34 1.11 0.04 1.64 7.12 -1.30 -1.22 115.31 124.04 2ahq h LEU 21 Ca 0.37 -0.01 0.03 0.00 0.13 0.00 0.00 57.88 58.40 2ahq h LEU 21 Cb -0.12 -0.26 -0.05 0.00 -0.53 0.00 0.00 40.66 39.70 2ahq h LEU 21 CO -0.09 0.77 -0.35 0.24 -0.13 0.00 0.00 178.44 178.87 2ahq h MET 22 N 1.29 -0.51 -0.06 1.25 2.86 -1.15 0.46 114.93 119.07 2ahq h MET 22 Ca 0.39 0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 58.07 2ahq h MET 22 Cb -0.03 0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 2ahq h MET 22 CO -0.12 -0.34 0.02 -0.22 1.06 0.00 0.00 176.91 177.32 2ahq h LYS 23 N -0.53 0.09 -0.25 1.72 3.64 -1.31 0.45 116.57 120.39 2ahq h LYS 23 Ca 0.05 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2ahq h LYS 23 Cb 0.60 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 2ahq h LYS 23 CO -0.26 0.07 -0.02 -0.07 -2.27 0.00 0.00 179.45 176.91 2ahq h LEU 24 N 0.09 0.44 -0.15 5.20 3.38 0.26 0.88 115.31 125.41 2ahq h LEU 24 Ca 0.02 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.61 2ahq h LEU 24 Cb 0.02 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2ahq h LEU 24 CO -0.00 0.67 -0.10 0.40 0.09 0.00 0.00 178.44 179.50 2ahq h ILE 25 N 0.21 1.33 -0.02 1.22 2.04 0.93 -2.15 117.51 121.08 2ahq h ILE 25 Ca 0.07 -1.18 -0.05 0.00 1.00 0.00 0.00 64.86 64.70 2ahq h ILE 25 Cb 0.45 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 2ahq h ILE 25 CO 0.02 0.35 -0.22 0.50 0.00 0.00 0.00 178.15 178.80 2ahq h LYS 26 N -0.02 0.02 -0.22 2.37 1.63 -0.09 -1.59 116.57 118.66 2ahq h LYS 26 Ca 0.03 -0.01 -0.09 0.00 -0.85 0.00 0.00 60.65 59.73 2ahq h LYS 26 Cb 0.59 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.20 2ahq h LYS 26 CO 0.03 0.24 -0.25 0.93 -3.45 0.00 0.00 179.45 176.95 2ahq h GLU 27 N 0.02 0.42 -0.38 1.90 5.08 0.11 0.27 114.58 122.00 2ahq h GLU 27 Ca 0.00 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.12 2ahq h GLU 27 Cb 0.40 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2ahq h GLU 27 CO 0.03 0.64 -0.12 0.82 -1.00 0.00 0.00 179.01 179.38 2ahq h ILE 28 N 0.37 1.28 -0.40 3.13 5.03 -0.64 -2.29 117.51 123.99 2ahq h ILE 28 Ca 0.06 -1.22 0.00 0.00 -0.12 0.00 0.00 64.86 63.58 2ahq h ILE 28 Cb 0.64 1.28 0.00 0.00 -3.03 0.00 0.00 36.82 35.72 2ahq h ILE 28 CO 0.05 0.40 0.00 0.55 -0.68 0.00 0.00 178.15 178.47 2ahq n VAL 29 N -4.33 0.78 0.13 1.67 3.14 -1.00 -4.15 118.33 114.57 2ahq n VAL 29 Ca -0.02 -0.61 0.17 0.00 -2.96 0.00 0.00 64.34 60.92 2ahq n VAL 29 Cb 0.37 0.13 0.74 0.00 -1.06 0.00 0.00 33.84 34.02 2ahq n VAL 29 CO 0.00 0.00 0.00 1.05 -6.46 0.00 0.00 176.83 171.42 2ahq h GLU 30 N 2.40 0.00 -1.18 1.45 4.11 0.14 -3.04 114.58 118.47 2ahq h GLU 30 Ca 0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 59.05 2ahq h GLU 30 Cb 0.73 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.66 2ahq h GLU 30 CO 0.06 0.00 -0.94 0.27 0.07 0.00 0.00 179.01 178.47 2ahq n ASN 31 N -4.16 -0.08 -3.46 3.06 6.94 -1.26 -5.07 115.26 111.23 2ahq n ASN 31 Ca 0.04 -3.09 0.00 0.00 -0.02 0.00 0.00 54.58 51.51 2ahq n ASN 31 Cb 0.40 0.16 0.00 0.00 -2.36 0.00 0.00 39.78 37.98 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 0.17 0.99 -3.84 -3.83 0.28 -1.15 -5.07 120.64 108.19 2ahq n GLU 32 Ca 0.15 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 57.08 2ahq n GLU 32 Cb 0.71 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.56 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 -2.14 -0.27 -0.05 -1.84 2.15 0.20 -4.97 116.67 109.76 2ahq s ASP 33 Ca 0.00 -0.59 -0.10 0.00 0.43 0.00 0.00 52.55 52.29 2ahq s ASP 33 Cb 0.00 0.71 -0.05 0.00 -0.30 0.00 0.00 42.92 43.28 2ahq s ASP 33 CO 0.00 -1.31 0.44 0.11 -0.17 0.00 0.00 175.17 174.25 2ahq h LYS 34 N 2.02 -0.34 0.00 4.34 1.79 -1.97 -2.49 116.57 119.92 2ahq h LYS 34 Ca -0.21 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 2ahq h LYS 34 Cb 1.25 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 2ahq h LYS 34 CO 0.25 -0.23 0.00 0.54 -1.08 0.00 0.00 179.45 178.93 2ahq n ARG 35 N -4.66 0.98 -3.05 3.15 1.74 -1.26 -4.02 116.66 109.54 2ahq n ARG 35 Ca -0.04 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.87 2ahq n ARG 35 Cb 0.14 -1.39 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 2ahq n ARG 35 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2ahq n LYS 36 N -0.89 0.53 0.00 5.56 5.02 -1.23 -5.14 118.16 122.02 2ahq n LYS 36 Ca 0.18 -2.59 0.00 0.00 -2.02 0.00 0.00 58.31 53.88 2ahq n LYS 36 Cb 0.08 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 2ahq n LYS 36 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2ahq n PRO 37 N 2.26 1.06 -2.70 1.97 -0.04 -0.94 -0.62 135.00 135.98 2ahq n PRO 37 Ca 0.20 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.60 2ahq n PRO 37 Cb 0.54 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.10 2ahq n PRO 37 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ahq n TYR 38 N -0.24 -1.19 -0.90 0.54 4.01 -1.26 -4.64 117.16 113.48 2ahq n TYR 38 Ca 0.00 -2.12 -0.29 0.00 -0.16 0.00 0.00 57.90 55.33 2ahq n TYR 38 Cb 0.00 0.95 0.21 0.00 -0.31 0.00 0.00 39.34 40.19 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 -1.89 1.98 0.47 7.72 1.04 -1.26 -4.15 113.70 117.61 2ahq s SER 39 Ca 0.21 1.37 0.31 0.00 0.48 0.00 0.00 55.95 58.32 2ahq s SER 39 Cb 0.42 -2.08 1.41 0.00 0.10 0.00 0.00 66.02 65.87 2ahq s SER 39 CO -0.06 -3.56 1.71 -2.24 0.98 0.00 0.00 173.24 170.07 2ahq h ASP 40 N -2.18 0.20 0.53 7.02 2.03 -1.96 0.34 116.42 122.40 2ahq h ASP 40 Ca -0.57 0.06 -0.03 0.00 -0.73 0.00 0.00 57.03 55.77 2ahq h ASP 40 Cb 1.33 0.04 0.01 0.00 -0.83 0.00 0.00 39.33 39.87 2ahq h ASP 40 CO 0.54 -0.03 -0.26 -0.61 -1.03 0.00 0.00 179.24 177.86 2ahq h GLN 41 N 0.14 -0.69 0.29 4.15 5.75 -1.93 0.08 115.11 122.90 2ahq h GLN 41 Ca 0.69 0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 59.23 2ahq h GLN 41 Cb 2.32 0.16 0.00 0.00 1.07 0.00 0.00 27.48 31.03 2ahq h GLN 41 CO -0.21 -0.39 -0.14 1.49 -2.65 0.00 0.00 178.83 176.93 2ahq h GLU 42 N -0.92 -0.37 -0.96 1.69 4.57 -0.76 0.18 114.58 118.01 2ahq h GLU 42 Ca -0.07 0.03 0.21 0.00 -1.18 0.00 0.00 59.36 58.35 2ahq h GLU 42 Cb 0.62 0.08 -0.18 0.00 -0.16 0.00 0.00 28.75 29.11 2ahq h GLU 42 CO 0.12 -0.25 -0.15 0.82 -1.18 0.00 0.00 179.01 178.38 2ahq h ILE 43 N -0.39 0.05 -0.58 2.32 2.04 -0.93 1.75 117.51 121.76 2ahq h ILE 43 Ca -0.04 -0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.85 2ahq h ILE 43 Cb 0.30 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.38 2ahq h ILE 43 CO 0.06 0.00 0.34 0.00 0.00 0.00 0.00 178.15 178.56 2ahq h ALA 44 N 1.95 0.76 -0.36 1.87 0.00 -0.83 0.15 119.26 122.81 2ahq h ALA 44 Ca 0.50 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.38 2ahq h ALA 44 Cb 0.86 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2ahq h ALA 44 CO -0.95 0.04 0.11 -0.91 0.00 0.00 0.00 179.25 177.54 2ahq h ASN 45 N 0.66 0.47 0.08 0.00 2.35 0.55 -1.06 115.58 118.62 2ahq h ASN 45 Ca 0.24 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2ahq h ASN 45 Cb 0.07 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2ahq h ASN 45 CO -0.13 0.46 -0.04 0.40 -1.65 0.00 0.00 177.43 176.47 2ahq h ILE 46 N 0.51 1.04 -0.48 2.81 2.04 0.20 -2.41 117.51 121.22 2ahq h ILE 46 Ca 0.12 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.61 2ahq h ILE 46 Cb 0.17 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 2ahq h ILE 46 CO -0.01 0.11 0.32 -0.07 0.00 0.00 0.00 178.15 178.50 2ahq h LEU 47 N -0.31 0.34 -2.19 1.44 4.07 -0.58 0.37 115.31 118.45 2ahq h LEU 47 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 2ahq h LEU 47 Cb 0.26 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.93 2ahq h LEU 47 CO 0.02 0.22 0.14 0.50 -1.08 0.00 0.00 178.44 178.24 2ahq h LYS 48 N 0.39 0.00 0.00 1.13 1.63 -0.68 -0.15 116.57 118.89 2ahq h LYS 48 Ca 0.21 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 2ahq h LYS 48 Cb 0.34 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 2ahq h LYS 48 CO -0.05 0.00 0.00 -0.85 -3.45 0.00 0.00 179.45 175.10 2ahq n GLU 49 N -2.77 0.22 -2.84 1.90 0.28 0.13 -4.71 120.64 112.86 2ahq n GLU 49 Ca -0.02 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.88 2ahq n GLU 49 Cb 0.19 -1.07 0.04 0.00 1.43 0.00 0.00 31.44 32.03 2ahq n GLU 49 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2ahq n LYS 50 N -0.57 -3.48 -0.00 3.44 0.00 -0.12 -4.94 118.16 112.49 2ahq n LYS 50 Ca 0.01 0.41 0.01 0.00 0.00 0.00 0.00 58.31 58.74 2ahq n LYS 50 Cb 0.00 -4.13 -0.02 0.00 0.00 0.00 0.00 35.03 30.89 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 -1.14 0.11 3.47 3.14 0.00 -0.91 -5.07 105.19 104.80 2ahq n GLY 51 Ca -0.08 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 2ahq n GLY 51 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ahq s PHE 52 N -1.93 -0.45 -0.92 1.61 0.08 -1.23 -4.29 117.98 110.85 2ahq s PHE 52 Ca -0.00 0.34 -0.15 0.00 0.12 0.00 0.00 56.93 57.23 2ahq s PHE 52 Cb 0.02 0.54 0.19 0.00 -0.57 0.00 0.00 43.02 43.19 2ahq s PHE 52 CO 0.10 -0.67 0.98 0.21 -0.10 0.00 0.00 175.22 175.74 2ahq s LYS 53 N -3.17 3.71 0.34 0.44 2.36 -1.26 -4.65 119.74 117.51 2ahq s LYS 53 Ca 0.02 -2.32 0.03 0.00 -2.55 0.00 0.00 55.97 51.16 2ahq s LYS 53 Cb -0.01 -4.66 -0.01 0.00 -1.05 0.00 0.00 37.83 32.10 2ahq s LYS 53 CO -0.09 -1.49 0.11 0.28 1.55 0.00 0.00 175.35 175.72 2ahq n VAL 54 N 4.40 0.00 -3.60 4.02 0.31 -1.26 -5.10 118.33 117.10 2ahq n VAL 54 Ca 0.20 -1.95 -0.10 0.00 -0.01 0.00 0.00 64.34 62.49 2ahq n VAL 54 Cb 0.47 0.68 -0.06 0.00 -0.91 0.00 0.00 33.84 34.02 2ahq n VAL 54 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ahq s ALA 55 N -2.89 -1.96 0.19 3.52 0.00 -1.26 -4.96 121.76 114.39 2ahq s ALA 55 Ca 0.16 1.69 0.05 0.00 0.00 0.00 0.00 51.96 53.86 2ahq s ALA 55 Cb 0.01 -1.01 0.55 0.00 0.00 0.00 0.00 23.12 22.67 2ahq s ALA 55 CO 0.11 -0.28 0.91 0.54 0.00 0.00 0.00 175.76 177.04 2ahq n ARG 56 N 1.24 -0.04 0.36 0.00 1.74 -1.26 0.23 116.66 118.92 2ahq n ARG 56 Ca -0.11 0.84 -0.18 0.00 -0.77 0.00 0.00 57.85 57.64 2ahq n ARG 56 Cb 0.57 -1.39 -0.09 0.00 -1.02 0.00 0.00 32.46 30.53 2ahq n ARG 56 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2ahq h ARG 57 N 0.00 -0.85 -0.53 5.56 1.12 -1.96 0.89 114.38 118.62 2ahq h ARG 57 Ca 0.40 0.06 0.00 0.00 -1.11 0.00 0.00 59.98 59.33 2ahq h ARG 57 Cb 0.91 0.19 -0.03 0.00 -0.01 0.00 0.00 29.97 31.04 2ahq h ARG 57 CO -0.51 -0.56 0.34 1.15 -3.11 0.00 0.00 179.97 177.28 2ahq h THR 58 N -0.90 1.14 -0.62 0.20 2.02 0.24 -1.12 112.91 113.88 2ahq h THR 58 Ca -0.09 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 2ahq h THR 58 Cb 0.68 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 2ahq h THR 58 CO 0.15 0.14 0.35 0.58 0.37 0.00 0.00 175.52 177.11 2ahq h VAL 59 N 0.72 1.19 -0.90 3.16 2.07 0.37 -1.11 116.25 121.75 2ahq h VAL 59 Ca 0.19 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 67.32 2ahq h VAL 59 Cb -0.06 0.37 -0.07 0.00 -1.52 0.00 0.00 31.29 30.01 2ahq h VAL 59 CO -0.04 0.21 0.55 0.00 0.02 0.00 0.00 177.57 178.31 2ahq h ALA 60 N 1.17 1.26 -0.39 1.67 0.00 0.14 1.00 119.26 124.11 2ahq h ALA 60 Ca 0.22 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2ahq h ALA 60 Cb 0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2ahq h ALA 60 CO -0.04 0.27 0.19 -0.22 0.00 0.00 0.00 179.25 179.45 2ahq h LYS 61 N 0.98 0.56 -0.43 0.00 3.64 -0.40 -2.83 116.57 118.09 2ahq h LYS 61 Ca 0.40 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.61 2ahq h LYS 61 Cb 0.24 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 2ahq h LYS 61 CO -0.20 0.50 -0.09 1.88 -2.27 0.00 0.00 179.45 179.27 2ahq h TYR 62 N 0.49 0.93 -1.00 1.91 -1.99 0.02 -2.96 116.97 114.38 2ahq h TYR 62 Ca 0.13 -0.20 0.37 0.00 2.00 0.00 0.00 58.73 61.04 2ahq h TYR 62 Cb 0.12 -0.23 -0.17 0.00 2.00 0.00 0.00 36.73 38.46 2ahq h TYR 62 CO -0.01 0.93 0.50 -0.09 -0.00 0.00 0.00 178.16 179.49 2ahq h ARG 63 N 0.66 0.11 -0.47 4.88 2.43 0.12 1.81 114.38 123.93 2ahq h ARG 63 Ca 0.11 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.15 2ahq h ARG 63 Cb 0.63 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2ahq h ARG 63 CO 0.04 0.07 -0.18 1.49 -1.51 0.00 0.00 179.97 179.89 2ahq h GLU 64 N 0.11 0.95 -0.30 0.20 4.81 -1.46 -0.48 114.58 118.42 2ahq h GLU 64 Ca 0.78 -0.39 -0.16 0.00 -0.13 0.00 0.00 59.36 59.46 2ahq h GLU 64 Cb 1.95 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 31.28 2ahq h GLU 64 CO -0.72 1.06 -0.45 0.52 -0.73 0.00 0.00 179.01 178.69 2ahq h MET 65 N 0.80 0.77 -1.32 1.92 2.86 0.23 -3.41 114.93 116.77 2ahq h MET 65 Ca 0.11 -0.43 -0.09 0.00 -2.06 0.00 0.00 59.70 57.24 2ahq h MET 65 Cb 0.74 0.03 -0.24 0.00 0.06 0.00 0.00 31.60 32.19 2ahq h MET 65 CO 0.06 1.05 -0.47 -0.48 1.06 0.00 0.00 176.91 178.14 2ahq s LEU 66 N -8.67 -1.21 0.00 1.22 -0.00 0.29 -5.11 118.68 105.20 2ahq s LEU 66 Ca -0.09 -0.25 0.30 0.00 -0.00 0.00 0.00 54.13 54.08 2ahq s LEU 66 Cb 0.11 1.59 1.51 0.00 -0.00 0.00 0.00 46.19 49.40 2ahq s LEU 66 CO 0.86 -0.30 2.00 0.61 -0.00 0.00 0.00 176.35 179.52