#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 -0.02 0.15 1.09 -0.85 -1.26 -5.19 117.35 111.27 2ahq s TYR 2 Ca 0.00 -0.51 0.01 0.00 -0.52 0.00 0.00 57.07 56.05 2ahq s TYR 2 Cb 0.00 0.76 -0.00 0.00 0.38 0.00 0.00 41.96 43.09 2ahq s TYR 2 CO 0.00 -1.29 0.03 -1.13 -1.52 0.00 0.00 175.55 171.64 2ahq n SER 3 N -0.97 1.61 0.00 -0.18 3.41 -1.26 -5.16 113.62 111.07 2ahq n SER 3 Ca -0.06 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 56.83 2ahq n SER 3 Cb 0.60 0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.79 2ahq n SER 3 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2ahq n LEU 4 N 0.00 0.00 0.00 1.04 4.77 -1.26 -5.18 117.00 116.37 2ahq n LEU 4 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 2ahq n LEU 4 Cb 0.20 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2ahq n LEU 4 CO 0.11 0.00 0.00 -2.11 -1.33 0.00 0.00 177.39 174.06 2ahq n ARG 5 N -0.01 0.00 -3.73 3.23 1.85 -1.26 -5.06 116.66 111.69 2ahq n ARG 5 Ca 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.72 2ahq n ARG 5 Cb 0.00 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.31 2ahq n ARG 5 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2ahq s THR 6 N -2.83 0.00 1.19 8.89 2.01 -1.26 -5.17 115.64 118.48 2ahq s THR 6 Ca 0.00 -0.03 -0.17 0.00 0.31 0.00 0.00 61.69 61.80 2ahq s THR 6 Cb 0.00 -0.60 0.28 0.00 0.01 0.00 0.00 72.50 72.19 2ahq s THR 6 CO 0.00 -0.02 1.07 0.12 -0.69 0.00 0.00 174.62 175.10 2ahq s PHE 7 N 0.10 0.81 0.23 4.92 5.36 -1.26 -5.08 117.98 123.07 2ahq s PHE 7 Ca -0.01 0.69 -0.08 0.00 -0.96 0.00 0.00 56.93 56.57 2ahq s PHE 7 Cb -0.03 -3.29 0.03 0.00 -0.34 0.00 0.00 43.02 39.40 2ahq s PHE 7 CO 0.01 -3.82 0.44 1.19 -1.46 0.00 0.00 175.22 171.58 2ahq n PHE 8 N -4.78 -1.74 0.00 10.12 3.72 -1.26 -5.15 117.46 118.38 2ahq n PHE 8 Ca 0.10 -1.09 0.00 0.00 -0.05 0.00 0.00 57.45 56.40 2ahq n PHE 8 Cb 0.58 0.52 0.00 0.00 -0.94 0.00 0.00 39.48 39.65 2ahq n PHE 8 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2ahq n VAL 9 N -0.31 0.00 0.00 -4.37 3.14 -1.26 -5.13 118.33 110.40 2ahq n VAL 9 Ca -0.05 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 2ahq n VAL 9 Cb 0.34 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.12 2ahq n VAL 9 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 2ahq n ARG 10 N 0.00 0.00 -2.90 1.45 0.00 -1.26 -5.11 116.66 108.85 2ahq n ARG 10 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.85 57.89 2ahq n ARG 10 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2ahq n ARG 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 2ahq s GLU 11 N -0.68 0.06 0.12 -0.14 2.56 -1.26 -5.18 118.70 114.18 2ahq s GLU 11 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.97 54.98 2ahq s GLU 11 Cb 0.00 0.01 0.02 0.00 2.00 0.00 0.00 34.13 36.17 2ahq s GLU 11 CO 0.00 -0.10 0.16 -1.13 -0.56 0.00 0.00 175.26 173.63 2ahq n SER 12 N 4.23 0.22 0.00 -1.70 3.41 -1.26 -5.01 113.62 113.51 2ahq n SER 12 Ca 0.07 -1.19 0.00 0.00 -0.26 0.00 0.00 58.87 57.50 2ahq n SER 12 Cb 0.62 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 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 -2.98 0.00 -2.09 7.33 0.00 -1.26 -4.75 120.51 116.76 2ahq n ALA 13 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.36 2ahq n ALA 13 Cb 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.49 2ahq n ALA 13 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ahq n GLU 14 N 0.00 0.00 -0.85 0.00 1.02 -1.26 -4.71 120.64 114.84 2ahq n GLU 14 Ca 0.00 -1.18 0.00 0.00 -0.02 0.00 0.00 57.16 55.96 2ahq n GLU 14 Cb 0.00 0.41 0.00 0.00 -0.02 0.00 0.00 31.44 31.83 2ahq n GLU 14 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ahq n GLY 15 N 0.09 0.64 3.73 0.62 0.00 -1.26 -4.97 105.19 104.03 2ahq n GLY 15 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 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 3.39 0.39 0.99 0.05 -1.26 -5.00 118.68 117.24 2ahq s LEU 16 Ca 0.00 2.39 -0.09 0.00 0.05 0.00 0.00 54.13 56.48 2ahq s LEU 16 Cb 0.00 -4.59 -0.06 0.00 -2.05 0.00 0.00 46.19 39.49 2ahq s LEU 16 CO 0.00 -2.14 0.73 0.42 -0.55 0.00 0.00 176.35 174.81 2ahq s THR 17 N -1.87 4.85 0.47 5.48 -4.23 -1.26 -4.92 115.64 114.16 2ahq s THR 17 Ca 0.76 0.45 0.27 0.00 -1.18 0.00 0.00 61.69 61.99 2ahq s THR 17 Cb -0.30 -3.75 0.47 0.00 1.34 0.00 0.00 72.50 70.26 2ahq s THR 17 CO 0.43 -0.52 1.80 -0.61 -0.54 0.00 0.00 174.62 175.17 2ahq h GLN 18 N 1.21 0.18 -0.17 3.99 5.75 -2.00 0.44 115.11 124.50 2ahq h GLN 18 Ca -0.47 -0.01 -0.18 0.00 -0.15 0.00 0.00 58.65 57.84 2ahq h GLN 18 Cb 1.19 -0.04 0.01 0.00 1.07 0.00 0.00 27.48 29.71 2ahq h GLN 18 CO 0.64 0.12 -0.58 0.78 -2.65 0.00 0.00 178.83 177.14 2ahq h GLY 19 N 0.19 0.77 0.72 2.39 0.00 -2.00 -3.06 103.07 102.07 2ahq h GLY 19 Ca 0.56 -1.01 0.07 0.00 0.00 0.00 0.00 47.33 46.95 2ahq h GLY 19 CO -0.15 0.90 0.62 0.83 0.00 0.00 0.00 176.54 178.75 2ahq h GLU 20 N 0.40 1.09 -0.96 4.80 4.39 -0.52 -0.51 114.58 123.27 2ahq h GLU 20 Ca -0.02 -0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.62 2ahq h GLU 20 Cb 1.20 -0.25 -0.05 0.00 -0.10 0.00 0.00 28.75 29.56 2ahq h GLU 20 CO 0.12 0.72 0.63 1.25 -1.16 0.00 0.00 179.01 180.58 2ahq h LEU 21 N 1.12 1.09 0.63 1.33 7.12 -1.29 0.17 115.31 125.49 2ahq h LEU 21 Ca 0.42 -0.03 -0.02 0.00 0.13 0.00 0.00 57.88 58.38 2ahq h LEU 21 Cb 0.19 -0.27 -0.01 0.00 -0.53 0.00 0.00 40.66 40.03 2ahq h LEU 21 CO -0.18 0.79 -0.48 0.24 -0.13 0.00 0.00 178.44 178.68 2ahq h MET 22 N 1.29 -1.03 0.00 1.25 2.86 -1.01 0.15 114.93 118.45 2ahq h MET 22 Ca 0.35 0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 58.06 2ahq h MET 22 Cb -0.14 0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 2ahq h MET 22 CO -0.08 -0.68 -0.01 -0.22 1.06 0.00 0.00 176.91 176.98 2ahq h LYS 23 N -1.06 0.00 -0.38 1.72 3.64 -1.27 -0.45 116.57 118.77 2ahq h LYS 23 Ca -0.08 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.23 2ahq h LYS 23 Cb 0.88 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.69 2ahq h LYS 23 CO 0.03 0.01 -0.01 -0.07 -2.27 0.00 0.00 179.45 177.14 2ahq h LEU 24 N 0.00 0.66 -0.28 5.20 3.38 0.32 0.33 115.31 124.92 2ahq h LEU 24 Ca -0.00 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 2ahq h LEU 24 Cb 0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2ahq h LEU 24 CO 0.00 0.81 -0.08 0.40 0.09 0.00 0.00 178.44 179.67 2ahq h ILE 25 N 0.49 1.28 -0.08 1.22 2.04 0.78 -2.61 117.51 120.63 2ahq h ILE 25 Ca 0.11 -1.11 -0.04 0.00 1.00 0.00 0.00 64.86 64.82 2ahq h ILE 25 Cb 0.48 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2ahq h ILE 25 CO 0.02 0.35 -0.12 0.50 0.00 0.00 0.00 178.15 178.90 2ahq h LYS 26 N 0.30 0.12 -0.96 2.37 1.63 -1.03 -1.86 116.57 117.14 2ahq h LYS 26 Ca 0.07 -0.02 0.07 0.00 -0.85 0.00 0.00 60.65 59.92 2ahq h LYS 26 Cb 0.56 -0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.10 2ahq h LYS 26 CO 0.03 0.25 0.62 1.49 -3.45 0.00 0.00 179.45 178.39 2ahq h GLU 27 N 0.12 1.06 -0.40 1.90 4.81 0.05 0.24 114.58 122.36 2ahq h GLU 27 Ca 0.03 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 2ahq h GLU 27 Cb 0.29 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2ahq h GLU 27 CO 0.02 0.70 -0.13 0.82 -0.73 0.00 0.00 179.01 179.69 2ahq h ILE 28 N 1.09 1.28 0.00 2.32 5.03 -1.24 -1.73 117.51 124.25 2ahq h ILE 28 Ca 0.42 -1.23 0.00 0.00 -0.12 0.00 0.00 64.86 63.92 2ahq h ILE 28 Cb 0.21 1.25 0.00 0.00 -3.03 0.00 0.00 36.82 35.25 2ahq h ILE 28 CO -0.17 0.41 0.00 0.52 -0.68 0.00 0.00 178.15 178.24 2ahq n VAL 29 N -4.31 0.00 0.26 1.67 0.31 -0.47 -3.07 118.33 112.73 2ahq n VAL 29 Ca -0.01 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.46 2ahq n VAL 29 Cb 0.38 -0.39 0.65 0.00 -0.91 0.00 0.00 33.84 33.57 2ahq n VAL 29 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2ahq h GLU 30 N 0.00 0.00 -0.28 5.55 4.81 0.39 -3.32 114.58 121.72 2ahq h GLU 30 Ca 0.00 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.96 2ahq h GLU 30 Cb 0.00 0.00 -0.19 0.00 0.63 0.00 0.00 28.75 29.19 2ahq h GLU 30 CO 0.00 0.09 -0.54 0.27 -0.73 0.00 0.00 179.01 178.10 2ahq n ASN 31 N -3.27 -1.78 -3.89 1.04 0.23 -1.17 -5.09 115.26 101.32 2ahq n ASN 31 Ca -0.00 -3.41 0.00 0.00 -0.53 0.00 0.00 54.58 50.63 2ahq n ASN 31 Cb 0.32 1.42 0.00 0.00 -2.08 0.00 0.00 39.78 39.44 2ahq n ASN 31 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 2ahq n GLU 32 N 0.20 1.19 -3.65 -3.83 0.28 -1.24 -5.09 120.64 108.50 2ahq n GLU 32 Ca 0.07 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.97 2ahq n GLU 32 Cb 0.72 0.00 -0.03 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 -1.89 -0.37 -0.00 -1.84 2.15 0.57 -4.97 116.67 110.31 2ahq s ASP 33 Ca 0.00 -0.34 -0.05 0.00 0.43 0.00 0.00 52.55 52.59 2ahq s ASP 33 Cb 0.00 0.62 -0.03 0.00 -0.30 0.00 0.00 42.92 43.21 2ahq s ASP 33 CO 0.00 -1.09 0.58 0.11 -0.17 0.00 0.00 175.17 174.60 2ahq h LYS 34 N 2.08 -0.17 0.00 4.34 6.56 -1.98 -2.08 116.57 125.32 2ahq h LYS 34 Ca -0.28 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.32 2ahq h LYS 34 Cb 1.28 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.97 2ahq h LYS 34 CO 0.34 -0.11 0.00 0.54 -2.06 0.00 0.00 179.45 178.16 2ahq n ARG 35 N -2.81 0.44 -3.26 3.15 5.12 -1.26 -3.85 116.66 114.19 2ahq n ARG 35 Ca -0.02 0.06 -0.23 0.00 -1.93 0.00 0.00 57.85 55.72 2ahq n ARG 35 Cb 0.07 -1.50 -0.08 0.00 -1.16 0.00 0.00 32.46 29.79 2ahq n ARG 35 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2ahq n LYS 36 N -1.18 0.32 0.00 5.56 4.76 -1.21 -5.13 118.16 121.28 2ahq n LYS 36 Ca 0.12 -2.99 0.00 0.00 -2.87 0.00 0.00 58.31 52.57 2ahq n LYS 36 Cb 0.13 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 31.75 2ahq n LYS 36 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2ahq n PRO 37 N 2.62 0.91 -2.75 1.97 -0.04 -0.79 -0.32 135.00 136.61 2ahq n PRO 37 Ca 0.27 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.63 2ahq n PRO 37 Cb 0.50 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.04 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 -0.37 -1.44 -1.53 0.54 4.01 -1.26 -4.60 117.16 112.51 2ahq n TYR 38 Ca 0.00 -2.37 -0.29 0.00 -0.16 0.00 0.00 57.90 55.08 2ahq n TYR 38 Cb 0.00 0.94 0.13 0.00 -0.31 0.00 0.00 39.34 40.09 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 -1.79 3.72 0.57 7.72 1.04 -1.26 -4.49 113.70 119.21 2ahq s SER 39 Ca 0.25 1.05 0.32 0.00 0.48 0.00 0.00 55.95 58.05 2ahq s SER 39 Cb 0.38 -1.66 1.43 0.00 0.10 0.00 0.00 66.02 66.28 2ahq s SER 39 CO -0.05 -2.43 1.76 -2.24 0.98 0.00 0.00 173.24 171.26 2ahq h ASP 40 N -1.41 0.00 0.41 7.02 2.03 -1.94 -0.09 116.42 122.44 2ahq h ASP 40 Ca -0.50 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 55.78 2ahq h ASP 40 Cb 1.32 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.82 2ahq h ASP 40 CO 0.61 0.00 -0.20 -0.61 -1.03 0.00 0.00 179.24 178.01 2ahq h GLN 41 N 0.00 -0.53 0.04 4.15 5.75 -1.89 -2.67 115.11 119.96 2ahq h GLN 41 Ca 0.42 0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.96 2ahq h GLN 41 Cb 1.96 0.12 -0.00 0.00 1.07 0.00 0.00 27.48 30.63 2ahq h GLN 41 CO -0.00 -0.36 -0.04 1.49 -2.65 0.00 0.00 178.83 177.27 2ahq h GLU 42 N -0.82 -0.08 -0.89 1.69 4.81 -1.42 -1.75 114.58 116.13 2ahq h GLU 42 Ca -0.06 0.01 0.33 0.00 -0.13 0.00 0.00 59.36 59.51 2ahq h GLU 42 Cb 0.42 0.02 -0.11 0.00 0.63 0.00 0.00 28.75 29.71 2ahq h GLU 42 CO 0.09 -0.05 0.54 -0.89 -0.73 0.00 0.00 179.01 177.97 2ahq n ILE 43 N -2.48 -0.23 0.17 2.32 5.41 -0.22 0.31 119.36 124.64 2ahq n ILE 43 Ca -0.01 1.37 -0.14 0.00 1.00 0.00 0.00 62.75 64.97 2ahq n ILE 43 Cb 0.04 -2.24 -0.07 0.00 -0.71 0.00 0.00 39.64 36.66 2ahq n ILE 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ahq h ALA 44 N 1.27 -0.46 0.00 -1.39 0.00 -0.95 0.45 119.26 118.18 2ahq h ALA 44 Ca 0.63 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.46 2ahq h ALA 44 Cb 1.89 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.97 2ahq h ALA 44 CO -0.43 -0.78 0.00 0.27 0.00 0.00 0.00 179.25 178.32 2ahq n ASN 45 N -5.34 0.34 -0.02 0.00 0.23 0.91 -2.33 115.26 109.06 2ahq n ASN 45 Ca -0.09 0.59 -0.18 0.00 -0.53 0.00 0.00 54.58 54.38 2ahq n ASN 45 Cb 0.25 -0.66 -0.14 0.00 -2.08 0.00 0.00 39.78 37.15 2ahq n ASN 45 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 2ahq h ILE 46 N 0.00 1.53 -0.70 1.53 2.04 0.15 -3.28 117.51 118.78 2ahq h ILE 46 Ca 0.00 -2.41 0.08 0.00 1.00 0.00 0.00 64.86 63.54 2ahq h ILE 46 Cb 0.27 3.15 -0.05 0.00 -0.74 0.00 0.00 36.82 39.45 2ahq h ILE 46 CO 0.00 0.63 0.46 -0.07 0.00 0.00 0.00 178.15 179.18 2ahq h LEU 47 N -0.70 0.57 -1.15 1.44 4.07 0.19 0.11 115.31 119.84 2ahq h LEU 47 Ca -0.12 0.01 0.08 0.00 0.08 0.00 0.00 57.88 57.94 2ahq h LEU 47 Cb 1.34 -0.11 -0.06 0.00 1.08 0.00 0.00 40.66 42.91 2ahq h LEU 47 CO 0.04 0.35 0.59 0.50 -1.08 0.00 0.00 178.44 178.85 2ahq h LYS 48 N 0.64 0.95 0.00 1.13 3.64 -1.58 0.69 116.57 122.04 2ahq h LYS 48 Ca 0.32 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.62 2ahq h LYS 48 Cb 0.40 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2ahq h LYS 48 CO -0.11 0.63 -0.11 1.05 -2.27 0.00 0.00 179.45 178.64 2ahq h GLU 49 N 0.97 0.00 0.02 1.90 -0.00 -0.85 -2.90 114.58 113.73 2ahq h GLU 49 Ca 0.41 0.00 -0.21 0.00 -0.00 0.00 0.00 59.36 59.56 2ahq h GLU 49 Cb 0.31 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 29.03 2ahq h GLU 49 CO -0.17 0.11 -1.14 0.87 -0.00 0.00 0.00 179.01 178.68 2ahq h LYS 50 N 0.00 0.04 0.00 1.06 6.56 -0.24 -3.49 116.57 120.51 2ahq h LYS 50 Ca -0.00 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 2ahq h LYS 50 Cb 0.29 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 31.98 2ahq h LYS 50 CO 0.01 1.03 0.00 0.41 -2.06 0.00 0.00 179.45 178.85 2ahq n GLY 51 N 1.53 1.12 3.57 3.86 0.00 0.20 -5.06 105.19 110.40 2ahq n GLY 51 Ca -0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.04 -0.07 -3.10 1.61 3.72 -1.14 -4.24 117.46 114.20 2ahq n PHE 52 Ca 0.00 0.33 -0.45 0.00 -0.05 0.00 0.00 57.45 57.29 2ahq n PHE 52 Cb 0.00 -1.92 -0.00 0.00 -0.94 0.00 0.00 39.48 36.62 2ahq n PHE 52 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2ahq s LYS 53 N -4.15 4.04 0.00 -1.08 2.47 -1.26 -4.70 119.74 115.06 2ahq s LYS 53 Ca 0.63 -2.71 0.00 0.00 -1.56 0.00 0.00 55.97 52.34 2ahq s LYS 53 Cb -0.23 -4.83 0.00 0.00 -1.46 0.00 0.00 37.83 31.31 2ahq s LYS 53 CO 0.61 -1.56 0.00 0.28 0.16 0.00 0.00 175.35 174.85 2ahq n VAL 54 N 4.01 0.00 0.00 4.02 0.31 -1.26 -5.07 118.33 120.35 2ahq n VAL 54 Ca 0.29 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.62 2ahq n VAL 54 Cb 0.43 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 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 -0.21 3.52 0.00 -1.26 -4.86 120.51 114.70 2ahq n ALA 55 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 2ahq n ALA 55 Cb 0.00 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.68 2ahq n ALA 55 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2ahq n ARG 56 N -1.04 -0.05 0.29 0.00 1.85 -1.26 0.22 116.66 116.68 2ahq n ARG 56 Ca 0.00 0.91 -0.16 0.00 -1.00 0.00 0.00 57.85 57.60 2ahq n ARG 56 Cb 0.00 -1.49 -0.08 0.00 -1.05 0.00 0.00 32.46 29.83 2ahq n ARG 56 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 2ahq h ARG 57 N 0.00 -0.67 -0.19 2.89 2.43 -1.93 0.51 114.38 117.41 2ahq h ARG 57 Ca 0.41 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 2ahq h ARG 57 Cb 0.93 0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 2ahq h ARG 57 CO -0.56 -0.43 0.12 1.15 -1.51 0.00 0.00 179.97 178.74 2ahq h THR 58 N -0.74 1.06 -0.71 0.20 2.02 0.23 -2.33 112.91 112.66 2ahq h THR 58 Ca -0.07 -0.14 0.06 0.00 0.77 0.00 0.00 66.41 67.03 2ahq h THR 58 Cb 0.55 0.81 -0.05 0.00 -1.74 0.00 0.00 68.15 67.72 2ahq h THR 58 CO 0.12 0.06 0.41 0.58 0.37 0.00 0.00 175.52 177.06 2ahq h VAL 59 N 0.24 1.00 -0.89 3.16 2.07 0.43 -0.45 116.25 121.82 2ahq h VAL 59 Ca 0.07 -0.26 0.17 0.00 0.82 0.00 0.00 66.70 67.50 2ahq h VAL 59 Cb -0.01 0.17 -0.10 0.00 -1.52 0.00 0.00 31.29 29.83 2ahq h VAL 59 CO -0.01 0.14 0.46 0.00 0.02 0.00 0.00 177.57 178.17 2ahq h ALA 60 N 1.35 1.39 -0.51 1.67 0.00 0.55 0.83 119.26 124.55 2ahq h ALA 60 Ca 0.31 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.29 2ahq h ALA 60 Cb 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2ahq h ALA 60 CO -0.17 -0.15 0.20 0.87 0.00 0.00 0.00 179.25 180.00 2ahq h LYS 61 N 0.59 0.76 -0.64 0.00 1.57 -0.67 -2.69 116.57 115.48 2ahq h LYS 61 Ca 0.51 -0.14 -0.08 0.00 -1.87 0.00 0.00 60.65 59.07 2ahq h LYS 61 Cb 0.81 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 2ahq h LYS 61 CO -0.41 0.67 0.07 1.88 -0.57 0.00 0.00 179.45 181.10 2ahq h TYR 62 N 0.68 1.16 -0.95 -1.35 -1.99 0.21 -2.71 116.97 112.02 2ahq h TYR 62 Ca 0.17 -0.17 0.20 0.00 2.00 0.00 0.00 58.73 60.92 2ahq h TYR 62 Cb 0.20 -0.31 -0.11 0.00 2.00 0.00 0.00 36.73 38.51 2ahq h TYR 62 CO 0.01 0.99 0.53 -0.09 -0.00 0.00 0.00 178.16 179.60 2ahq h ARG 63 N 0.99 0.61 -0.38 4.88 2.43 0.81 0.64 114.38 124.36 2ahq h ARG 63 Ca 0.19 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.18 2ahq h ARG 63 Cb 0.48 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2ahq h ARG 63 CO 0.02 0.40 -0.33 0.93 -1.51 0.00 0.00 179.97 179.48 2ahq h GLU 64 N 0.63 0.85 -0.39 0.20 3.07 -1.29 1.03 114.58 118.69 2ahq h GLU 64 Ca 0.57 -0.41 -0.11 0.00 -0.50 0.00 0.00 59.36 58.90 2ahq h GLU 64 Cb 0.95 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.84 2ahq h GLU 64 CO -0.43 1.05 -0.22 0.52 -1.40 0.00 0.00 179.01 178.54 2ahq h MET 65 N 0.71 0.78 0.00 2.33 2.86 -0.23 -3.33 114.93 118.05 2ahq h MET 65 Ca 0.07 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 2ahq h MET 65 Cb 0.89 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.52 2ahq h MET 65 CO 0.08 0.93 -0.08 -0.07 1.06 0.00 0.00 176.91 178.82 2ahq h LEU 66 N 0.68 0.00 0.00 1.22 -0.00 0.21 -3.51 115.31 113.90 2ahq h LEU 66 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2ahq h LEU 66 Cb 0.73 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.39 2ahq h LEU 66 CO 0.06 0.33 0.00 0.61 -0.00 0.00 0.00 178.44 179.43