#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhq s ARG 8 N 0.00 1.36 -0.26 5.31 1.70 -0.89 -5.01 118.95 121.15 1yhq s ARG 8 Ca 0.00 -0.69 -0.08 0.00 -0.47 0.00 0.00 55.73 54.49 1yhq s ARG 8 Cb 0.00 0.50 -0.03 0.00 -0.57 0.00 0.00 34.95 34.85 1yhq s ARG 8 CO 0.00 -0.62 0.10 0.08 -1.08 0.00 0.00 175.30 173.79 1yhq s VAL 9 N -3.55 4.56 0.15 4.99 1.01 -1.26 -2.32 120.40 123.98 1yhq s VAL 9 Ca 0.09 -0.12 0.11 0.00 0.00 0.00 0.00 61.98 62.06 1yhq s VAL 9 Cb -0.03 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1yhq s VAL 9 CO -0.00 0.30 -0.25 -0.69 0.00 0.00 0.00 175.10 174.46 1yhq s VAL 10 N 1.65 2.21 -0.31 2.92 1.01 -0.25 -4.96 120.40 122.67 1yhq s VAL 10 Ca 0.06 -1.85 -0.07 0.00 0.00 0.00 0.00 61.98 60.12 1yhq s VAL 10 Cb -0.15 -1.99 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1yhq s VAL 10 CO 0.06 -0.03 0.10 -0.89 0.00 0.00 0.00 175.10 174.34 1yhq s THR 11 N -1.37 4.07 -0.26 3.92 2.01 -1.26 -0.22 115.64 122.53 1yhq s THR 11 Ca 0.16 -0.74 -0.16 0.00 0.31 0.00 0.00 61.69 61.26 1yhq s THR 11 Cb -0.09 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.25 1yhq s THR 11 CO 0.07 0.01 0.45 -0.63 -0.69 0.00 0.00 174.62 173.83 1yhq s ILE 12 N 1.50 5.12 -0.01 1.82 -1.09 -0.49 -4.93 121.20 123.12 1yhq s ILE 12 Ca 0.02 0.74 -0.27 0.00 -2.23 0.00 0.00 60.65 58.91 1yhq s ILE 12 Cb -0.18 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 1yhq s ILE 12 CO 0.03 0.13 0.85 -2.16 -1.23 0.00 0.00 174.94 172.56 1yhq s PRO 13 N 2.14 4.52 -0.25 2.79 0.04 -1.26 -2.25 135.00 140.72 1yhq s PRO 13 Ca 0.18 1.18 0.11 0.00 0.04 0.00 0.00 61.00 62.52 1yhq s PRO 13 Cb -0.16 -3.44 0.50 0.00 0.04 0.00 0.00 34.50 31.45 1yhq s PRO 13 CO 0.09 0.06 1.43 1.28 0.04 0.00 0.00 177.00 179.90 1yhq n LEU 14 N 3.62 3.92 0.23 -3.56 4.77 0.49 -4.66 117.00 121.80 1yhq n LEU 14 Ca 0.02 -3.55 0.09 0.00 -0.03 0.00 0.00 56.01 52.54 1yhq n LEU 14 Cb 0.51 -0.60 0.56 0.00 -2.33 0.00 0.00 43.42 41.56 1yhq n LEU 14 CO 0.49 1.08 0.87 0.08 -1.33 0.00 0.00 177.39 178.59 1yhq h ARG 15 N 1.13 0.00 0.00 3.23 0.11 -1.91 -2.55 114.38 114.39 1yhq h ARG 15 Ca 0.15 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.23 1yhq h ARG 15 Cb 1.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.63 1yhq h ARG 15 CO 0.31 0.21 0.00 -0.25 0.10 0.00 0.00 179.97 180.35 1yhq n ASP 16 N -3.74 0.00 0.17 0.08 8.00 -1.26 -1.91 116.55 117.88 1yhq n ASP 16 Ca -0.01 0.09 0.13 0.00 0.71 0.00 0.00 54.79 55.70 1yhq n ASP 16 Cb 0.32 -0.30 0.42 0.00 -0.02 0.00 0.00 41.12 41.54 1yhq n ASP 16 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yhq h ALA 17 N 2.76 1.00 0.00 2.24 0.00 -1.81 -2.84 119.26 120.61 1yhq h ALA 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yhq h ALA 17 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1yhq h ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1yhq h ARG 18 N 0.00 0.00 0.00 0.00 3.08 -1.58 -2.38 114.38 113.50 1yhq h ARG 18 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 1yhq h ARG 18 Cb 0.67 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 1yhq h ARG 18 CO 0.00 0.00 -0.56 0.00 -1.07 0.00 0.00 179.97 178.34 1yhq h ALA 19 N 2.26 0.92 -2.21 0.04 0.00 -1.71 -3.44 119.26 115.11 1yhq h ALA 19 Ca 0.00 -0.51 -0.47 0.00 0.00 0.00 0.00 54.91 53.93 1yhq h ALA 19 Cb 0.39 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1yhq h ALA 19 CO 0.00 0.70 0.27 -2.00 0.00 0.00 0.00 179.25 178.21 1yhq s GLU 20 N -3.51 3.97 0.35 0.00 2.56 -0.90 -4.99 118.70 116.18 1yhq s GLU 20 Ca -0.00 0.83 -0.28 0.00 0.00 0.00 0.00 54.97 55.52 1yhq s GLU 20 Cb 0.12 -2.25 -0.12 0.00 2.00 0.00 0.00 34.13 33.88 1yhq s GLU 20 CO 0.74 -0.11 1.36 -0.35 -0.56 0.00 0.00 175.26 176.34 1yhq n PRO 21 N -1.16 2.32 -0.33 4.30 -0.04 -1.26 -4.82 135.00 134.01 1yhq n PRO 21 Ca 0.05 0.81 0.18 0.00 -0.04 0.00 0.00 63.50 64.51 1yhq n PRO 21 Cb 0.54 -2.45 0.43 0.00 -0.04 0.00 0.00 33.50 31.98 1yhq n PRO 21 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1yhq h ASN 22 N 2.72 0.59 0.00 3.54 2.35 -1.91 -0.99 115.58 121.89 1yhq h ASN 22 Ca -0.48 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.36 1yhq h ASN 22 Cb 1.27 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.63 1yhq h ASN 22 CO 0.63 0.16 0.00 0.00 -1.65 0.00 0.00 177.43 176.58 1yhq n HIS 23 N -4.70 0.00 -1.58 1.19 1.44 -1.26 -3.14 115.22 107.17 1yhq n HIS 23 Ca 0.24 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.98 1yhq n HIS 23 Cb 0.73 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.88 1yhq n HIS 23 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1yhq n LYS 24 N -0.85 0.48 -0.16 -1.40 5.02 -0.38 -4.53 118.16 116.35 1yhq n LYS 24 Ca 0.11 -1.45 -0.04 0.00 -2.02 0.00 0.00 58.31 54.91 1yhq n LYS 24 Cb 0.05 -0.81 0.05 0.00 -0.02 0.00 0.00 35.03 34.30 1yhq n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yhq h ARG 25 N 0.00 0.44 -0.73 1.97 3.08 -1.42 -2.92 114.38 114.80 1yhq h ARG 25 Ca 0.00 -0.03 0.16 0.00 0.07 0.00 0.00 59.98 60.19 1yhq h ARG 25 Cb 1.22 -0.10 -0.12 0.00 0.08 0.00 0.00 29.97 31.05 1yhq h ARG 25 CO 0.00 0.29 0.04 0.00 -1.07 0.00 0.00 179.97 179.23 1yhq h ALA 26 N 1.28 0.79 -0.11 0.04 0.00 -1.51 0.37 119.26 120.11 1yhq h ALA 26 Ca 0.22 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 1yhq h ALA 26 Cb 0.16 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1yhq h ALA 26 CO -0.17 -0.41 0.06 -0.44 0.00 0.00 0.00 179.25 178.29 1yhq h ASP 27 N 0.13 0.14 -0.31 0.00 3.45 -1.79 -1.76 116.42 116.28 1yhq h ASP 27 Ca 0.40 -0.07 -0.04 0.00 0.43 0.00 0.00 57.03 57.75 1yhq h ASP 27 Cb 0.69 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 39.41 1yhq h ASP 27 CO -0.61 0.17 0.09 0.50 -1.57 0.00 0.00 179.24 177.82 1yhq h LYS 28 N 0.09 0.57 -0.17 3.56 1.63 -1.07 -2.37 116.57 118.81 1yhq h LYS 28 Ca 0.04 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1yhq h LYS 28 Cb 0.06 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.59 1yhq h LYS 28 CO -0.01 0.53 0.09 0.00 -3.45 0.00 0.00 179.45 176.61 1yhq h ALA 29 N 1.54 0.22 -0.08 5.00 0.00 0.05 -0.86 119.26 125.13 1yhq h ALA 29 Ca 0.13 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1yhq h ALA 29 Cb 0.22 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1yhq h ALA 29 CO -0.00 -0.24 0.06 1.98 0.00 0.00 0.00 179.25 181.05 1yhq h MET 30 N 0.17 0.00 0.05 0.00 1.85 -0.83 -1.27 114.93 114.91 1yhq h MET 30 Ca 0.06 0.00 -0.23 0.00 -0.61 0.00 0.00 59.70 58.92 1yhq h MET 30 Cb 0.07 0.00 0.02 0.00 0.43 0.00 0.00 31.60 32.13 1yhq h MET 30 CO -0.01 0.00 -0.92 0.82 -0.40 0.00 0.00 176.91 176.40 1yhq h ILE 31 N 0.00 1.36 -0.74 1.77 2.04 -0.97 -3.07 117.51 117.90 1yhq h ILE 31 Ca 0.04 -2.28 0.05 0.00 1.00 0.00 0.00 64.86 63.66 1yhq h ILE 31 Cb 0.16 2.65 -0.05 0.00 -0.74 0.00 0.00 36.82 38.83 1yhq h ILE 31 CO -0.00 0.68 0.44 -0.07 0.00 0.00 0.00 178.15 179.20 1yhq h LEU 32 N 0.09 0.69 -0.53 1.44 3.38 -0.13 -1.07 115.31 119.19 1yhq h LEU 32 Ca -0.13 0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1yhq h LEU 32 Cb 1.62 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 42.21 1yhq h LEU 32 CO 0.18 0.46 0.31 0.40 0.09 0.00 0.00 178.44 179.87 1yhq h ILE 33 N 0.83 1.03 -0.43 1.22 2.04 -1.32 0.54 117.51 121.42 1yhq h ILE 33 Ca 0.32 -0.21 -0.09 0.00 1.00 0.00 0.00 64.86 65.88 1yhq h ILE 33 Cb 0.13 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1yhq h ILE 33 CO -0.16 0.11 -0.11 -0.09 0.00 0.00 0.00 178.15 177.90 1yhq h ARG 34 N 0.60 0.77 -0.07 2.37 2.43 -1.30 -1.96 114.38 117.23 1yhq h ARG 34 Ca 0.22 -0.25 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 1yhq h ARG 34 Cb 0.06 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1yhq h ARG 34 CO -0.11 0.85 -0.64 0.93 -1.51 0.00 0.00 179.97 179.49 1yhq h GLU 35 N 0.69 0.26 -0.07 0.20 5.08 -0.70 -1.99 114.58 118.06 1yhq h GLU 35 Ca 0.12 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1yhq h GLU 35 Cb 0.59 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1yhq h GLU 35 CO 0.04 0.81 -0.02 1.25 -1.00 0.00 0.00 179.01 180.09 1yhq h HIS 36 N 0.19 0.14 -0.46 4.33 2.76 -0.67 -2.18 115.15 119.27 1yhq h HIS 36 Ca -0.01 -0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.05 1yhq h HIS 36 Cb 1.16 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 30.07 1yhq h HIS 36 CO 0.02 0.46 -0.02 -0.07 -1.30 0.00 0.00 177.93 177.03 1yhq h LEU 37 N -0.21 0.73 -0.62 0.26 3.38 -1.37 -1.16 115.31 116.32 1yhq h LEU 37 Ca 0.02 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 1yhq h LEU 37 Cb 0.41 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1yhq h LEU 37 CO 0.01 0.81 0.14 0.00 0.09 0.00 0.00 178.44 179.49 1yhq h ALA 38 N 1.27 0.82 0.20 1.53 0.00 -1.32 -1.44 119.26 120.33 1yhq h ALA 38 Ca 0.14 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1yhq h ALA 38 Cb 0.46 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1yhq h ALA 38 CO 0.02 0.55 -0.10 -0.22 0.00 0.00 0.00 179.25 179.50 1yhq h LYS 39 N 0.92 -0.26 0.00 0.00 3.64 -1.15 -0.32 116.57 119.40 1yhq h LYS 39 Ca 0.19 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1yhq h LYS 39 Cb 0.37 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1yhq h LYS 39 CO 0.00 0.12 0.00 0.72 -2.27 0.00 0.00 179.45 178.03 1yhq n HIS 40 N -4.97 0.00 0.01 1.91 8.25 -0.46 -2.17 115.22 117.79 1yhq n HIS 40 Ca -0.08 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.39 1yhq n HIS 40 Cb 0.26 -0.43 0.01 0.00 1.12 0.00 0.00 29.99 30.95 1yhq n HIS 40 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1yhq n PHE 41 N -1.43 0.03 -3.55 4.41 3.01 -0.54 -5.03 117.46 114.36 1yhq n PHE 41 Ca 0.04 -0.31 -0.21 0.00 1.01 0.00 0.00 57.45 57.97 1yhq n PHE 41 Cb 0.14 -0.03 0.02 0.00 -0.01 0.00 0.00 39.48 39.60 1yhq n PHE 41 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1yhq n SER 42 N -0.22 -5.85 -3.91 4.37 7.64 -0.92 -5.01 113.62 109.71 1yhq n SER 42 Ca 0.01 -0.76 -0.09 0.00 1.01 0.00 0.00 58.87 59.04 1yhq n SER 42 Cb 0.18 -3.39 -0.06 0.00 -1.01 0.00 0.00 64.21 59.93 1yhq n SER 42 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1yhq s VAL 43 N -3.20 0.06 0.30 0.44 1.01 -0.17 -5.04 120.40 113.80 1yhq s VAL 43 Ca 0.22 -1.25 -0.28 0.00 0.00 0.00 0.00 61.98 60.67 1yhq s VAL 43 Cb -0.08 -1.76 -0.09 0.00 0.00 0.00 0.00 36.38 34.45 1yhq s VAL 43 CO 0.84 -0.28 0.99 -1.81 0.00 0.00 0.00 175.10 174.84 1yhq s ASP 44 N -2.94 7.31 0.56 3.32 1.11 -1.26 -4.46 116.67 120.30 1yhq s ASP 44 Ca 0.15 2.00 0.25 0.00 0.18 0.00 0.00 52.55 55.13 1yhq s ASP 44 Cb 0.03 -2.60 1.49 0.00 1.07 0.00 0.00 42.92 42.90 1yhq s ASP 44 CO -0.01 -0.10 2.06 -0.33 1.18 0.00 0.00 175.17 177.97 1yhq h GLU 45 N 3.46 0.00 0.00 8.23 5.08 -1.91 0.29 114.58 129.74 1yhq h GLU 45 Ca -0.47 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.84 1yhq h GLU 45 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1yhq h GLU 45 CO 0.66 0.00 -0.26 -0.44 -1.00 0.00 0.00 179.01 177.97 1yhq h ASP 46 N 0.00 0.00 0.01 1.42 3.32 -1.96 -2.89 116.42 116.32 1yhq h ASP 46 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1yhq h ASP 46 Cb 0.63 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1yhq h ASP 46 CO -0.00 0.26 -0.03 0.00 -1.72 0.00 0.00 179.24 177.74 1yhq n ALA 47 N -2.26 2.63 -2.62 3.45 0.00 0.10 -4.84 120.51 116.96 1yhq n ALA 47 Ca -0.00 -0.47 -0.40 0.00 0.00 0.00 0.00 53.44 52.56 1yhq n ALA 47 Cb 0.42 -1.12 -0.07 0.00 0.00 0.00 0.00 19.45 18.69 1yhq n ALA 47 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yhq s VAL 48 N -2.06 5.00 -0.23 0.00 1.01 -1.09 -1.96 120.40 121.07 1yhq s VAL 48 Ca 0.35 1.07 -0.07 0.00 0.00 0.00 0.00 61.98 63.34 1yhq s VAL 48 Cb 0.21 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1yhq s VAL 48 CO 0.35 0.04 0.05 -0.60 0.00 0.00 0.00 175.10 174.94 1yhq s ARG 49 N 2.46 3.68 -0.27 2.72 3.52 0.31 -4.98 118.95 126.39 1yhq s ARG 49 Ca 0.25 -0.48 -0.10 0.00 -0.13 0.00 0.00 55.73 55.27 1yhq s ARG 49 Cb -0.16 -3.24 -0.05 0.00 -1.56 0.00 0.00 34.95 29.95 1yhq s ARG 49 CO 0.09 -0.08 0.16 -0.51 -0.81 0.00 0.00 175.30 174.15 1yhq s LEU 50 N 1.30 3.91 0.26 -0.88 1.43 -1.26 -0.91 118.68 122.53 1yhq s LEU 50 Ca 0.05 -0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 52.81 1yhq s LEU 50 Cb -0.15 -2.08 -0.10 0.00 0.03 0.00 0.00 46.19 43.90 1yhq s LEU 50 CO 0.03 -0.04 1.31 -0.62 0.23 0.00 0.00 176.35 177.26 1yhq s ASP 51 N 1.70 6.84 0.61 2.29 -1.08 0.70 -4.85 116.67 122.88 1yhq s ASP 51 Ca 0.07 2.53 0.27 0.00 -0.52 0.00 0.00 52.55 54.90 1yhq s ASP 51 Cb -0.16 -2.63 0.97 0.00 -1.46 0.00 0.00 42.92 39.65 1yhq s ASP 51 CO 0.09 -0.53 1.36 -0.65 0.52 0.00 0.00 175.17 175.97 1yhq h PRO 52 N 4.53 0.00 -0.53 4.34 0.11 -1.97 0.32 132.00 138.80 1yhq h PRO 52 Ca -0.46 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.71 1yhq h PRO 52 Cb 1.22 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 1yhq h PRO 52 CO 0.73 0.00 0.23 0.66 -0.21 0.00 0.00 178.00 179.41 1yhq h SER 53 N 0.00 0.29 -0.82 -2.05 4.64 -1.93 0.25 113.55 113.93 1yhq h SER 53 Ca 0.46 0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.79 1yhq h SER 53 Cb 2.73 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 64.78 1yhq h SER 53 CO -0.00 0.20 0.39 0.40 -0.87 0.00 0.00 176.83 176.94 1yhq h ILE 54 N 0.44 1.26 0.12 0.95 2.04 -0.69 -1.23 117.51 120.40 1yhq h ILE 54 Ca 0.25 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1yhq h ILE 54 Cb 0.22 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1yhq h ILE 54 CO -0.21 0.31 -0.06 -1.13 0.00 0.00 0.00 178.15 177.06 1yhq h ASN 55 N 1.18 -0.14 -0.09 1.72 -1.24 -1.27 -2.03 115.58 113.71 1yhq h ASN 55 Ca 0.28 -0.09 -0.03 0.00 0.71 0.00 0.00 56.30 57.17 1yhq h ASN 55 Cb 0.12 0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.20 1yhq h ASN 55 CO -0.03 -0.00 -0.02 -0.33 -1.29 0.00 0.00 177.43 175.75 1yhq h GLU 56 N -0.27 0.29 0.11 6.67 5.08 -0.86 -1.40 114.58 124.20 1yhq h GLU 56 Ca -0.02 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1yhq h GLU 56 Cb 0.22 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1yhq h GLU 56 CO 0.03 0.34 -0.05 0.00 -1.00 0.00 0.00 179.01 178.32 1yhq h ALA 57 N 1.70 -0.15 0.00 3.43 0.00 -0.86 -0.18 119.26 123.21 1yhq h ALA 57 Ca 0.07 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1yhq h ALA 57 Cb 0.23 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1yhq h ALA 57 CO 0.01 -0.55 -0.33 0.00 0.00 0.00 0.00 179.25 178.38 1yhq h ALA 58 N 0.66 1.40 -0.20 0.00 0.00 -0.96 -2.83 119.26 117.33 1yhq h ALA 58 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1yhq h ALA 58 Cb 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1yhq h ALA 58 CO 0.02 0.42 0.00 0.91 0.00 0.00 0.00 179.25 180.60 1yhq n TRP 59 N -4.07 0.24 -0.28 0.00 7.02 -0.57 -4.55 117.44 115.23 1yhq n TRP 59 Ca -0.02 -0.12 0.03 0.00 -1.02 0.00 0.00 57.50 56.37 1yhq n TRP 59 Cb 0.38 0.00 0.11 0.00 -2.42 0.00 0.00 31.31 29.39 1yhq n TRP 59 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1yhq h ALA 60 N 4.39 0.59 -0.70 6.99 0.00 -0.77 0.01 119.26 129.77 1yhq h ALA 60 Ca 0.00 0.31 -0.20 0.00 0.00 0.00 0.00 54.91 55.02 1yhq h ALA 60 Cb 0.77 0.59 -0.12 0.00 0.00 0.00 0.00 17.79 19.03 1yhq h ALA 60 CO 0.00 -0.41 0.25 0.54 0.00 0.00 0.00 179.25 179.63 1yhq n ARG 61 N -5.50 3.60 0.00 0.00 1.74 -1.26 -5.05 116.66 110.19 1yhq n ARG 61 Ca 0.12 -2.86 0.00 0.00 -0.77 0.00 0.00 57.85 54.34 1yhq n ARG 61 Cb 0.43 -2.16 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 1yhq n ARG 61 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yhq n GLY 62 N -0.09 -3.22 0.21 -0.13 0.00 -0.01 -4.17 105.19 97.77 1yhq n GLY 62 Ca 0.38 -2.00 0.13 0.00 0.00 0.00 0.00 46.02 44.53 1yhq n GLY 62 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1yhq h ARG 63 N 0.00 0.00 0.00 1.61 2.43 -1.90 -3.33 114.38 113.19 1yhq h ARG 63 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1yhq h ARG 63 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1yhq h ARG 63 CO 0.00 0.00 -1.19 0.00 -1.51 0.00 0.00 179.97 177.27 1yhq n ALA 64 N -2.02 3.65 -3.39 2.80 0.00 -1.26 -1.34 120.51 118.94 1yhq n ALA 64 Ca 0.03 -0.46 -0.31 0.00 0.00 0.00 0.00 53.44 52.70 1yhq n ALA 64 Cb 0.44 -0.62 -0.06 0.00 0.00 0.00 0.00 19.45 19.21 1yhq n ALA 64 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1yhq n ASN 65 N -1.68 4.27 -4.83 0.00 3.02 -1.25 -4.76 115.26 110.03 1yhq n ASN 65 Ca 0.01 -3.41 -0.33 0.00 -0.03 0.00 0.00 54.58 50.82 1yhq n ASN 65 Cb 0.34 -0.82 -0.07 0.00 -0.61 0.00 0.00 39.78 38.63 1yhq n ASN 65 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1yhq s THR 66 N -2.41 4.46 0.52 3.41 2.01 -1.26 -4.29 115.64 118.08 1yhq s THR 66 Ca 0.36 1.35 -0.20 0.00 0.31 0.00 0.00 61.69 63.52 1yhq s THR 66 Cb 0.10 -3.61 -0.07 0.00 0.01 0.00 0.00 72.50 68.93 1yhq s THR 66 CO -0.01 -0.28 1.09 -2.16 -0.69 0.00 0.00 174.62 172.57 1yhq s PRO 67 N -3.11 3.57 0.43 4.92 0.04 -1.26 -4.94 135.00 134.65 1yhq s PRO 67 Ca 0.60 1.49 0.29 0.00 0.04 0.00 0.00 61.00 63.42 1yhq s PRO 67 Cb -0.09 -2.05 1.18 0.00 0.04 0.00 0.00 34.50 33.57 1yhq s PRO 67 CO 0.14 -0.65 1.86 0.66 0.04 0.00 0.00 177.00 179.06 1yhq h SER 68 N 1.37 0.00 -5.45 6.66 4.64 -1.95 -3.43 113.55 115.38 1yhq h SER 68 Ca -0.50 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.63 1yhq h SER 68 Cb 1.24 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.23 1yhq h SER 68 CO 0.58 0.00 -0.29 -0.54 -0.87 0.00 0.00 176.83 175.71 1yhq s LYS 69 N -3.50 1.58 -0.29 4.77 1.02 -1.26 -0.38 119.74 121.67 1yhq s LYS 69 Ca 0.03 -1.54 -0.14 0.00 0.02 0.00 0.00 55.97 54.33 1yhq s LYS 69 Cb 0.09 0.40 0.14 0.00 -0.52 0.00 0.00 37.83 37.94 1yhq s LYS 69 CO 0.49 -0.62 0.87 -1.50 -0.92 0.00 0.00 175.35 173.67 1yhq s ILE 70 N -3.73 -0.36 0.01 2.17 2.07 -0.95 -4.92 121.20 115.48 1yhq s ILE 70 Ca 0.30 0.00 -0.26 0.00 -1.41 0.00 0.00 60.65 59.28 1yhq s ILE 70 Cb 0.02 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.56 1yhq s ILE 70 CO 0.14 0.00 0.81 -0.13 -1.91 0.00 0.00 174.94 173.86 1yhq s ARG 71 N 2.05 4.51 -0.01 3.50 0.52 -1.26 -1.40 118.95 126.86 1yhq s ARG 71 Ca -0.06 1.13 0.02 0.00 -0.52 0.00 0.00 55.73 56.29 1yhq s ARG 71 Cb -0.06 -3.41 0.00 0.00 0.52 0.00 0.00 34.95 32.00 1yhq s ARG 71 CO -0.17 0.13 -0.06 0.54 0.02 0.00 0.00 175.30 175.75 1yhq s VAL 72 N 0.46 0.55 -0.38 3.52 0.11 0.69 -3.65 120.40 121.70 1yhq s VAL 72 Ca 0.42 -0.25 -0.13 0.00 -2.93 0.00 0.00 61.98 59.09 1yhq s VAL 72 Cb -0.20 -0.49 0.02 0.00 -1.53 0.00 0.00 36.38 34.18 1yhq s VAL 72 CO 0.23 0.17 0.24 -0.60 -3.33 0.00 0.00 175.10 171.82 1yhq s ARG 73 N 0.10 2.98 0.08 1.54 3.52 0.20 -1.09 118.95 126.28 1yhq s ARG 73 Ca -0.01 -0.99 0.09 0.00 -0.13 0.00 0.00 55.73 54.69 1yhq s ARG 73 Cb -0.06 -3.83 -0.03 0.00 -1.56 0.00 0.00 34.95 29.47 1yhq s ARG 73 CO -0.00 -0.68 -0.25 0.00 -0.81 0.00 0.00 175.30 173.56 1yhq s ALA 74 N 1.62 2.17 0.18 6.12 0.00 -0.98 -1.78 121.76 129.09 1yhq s ALA 74 Ca 0.04 -1.31 0.11 0.00 0.00 0.00 0.00 51.96 50.80 1yhq s ALA 74 Cb -0.19 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 1yhq s ALA 74 CO 0.08 0.49 -0.25 0.00 0.00 0.00 0.00 175.76 176.09 1yhq s ALA 75 N -0.94 2.51 -0.03 0.00 0.00 0.06 -2.10 121.76 121.27 1yhq s ALA 75 Ca 0.11 -1.60 0.04 0.00 0.00 0.00 0.00 51.96 50.52 1yhq s ALA 75 Cb -0.10 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 1yhq s ALA 75 CO 0.04 0.46 -0.16 0.50 0.00 0.00 0.00 175.76 176.60 1yhq s ARG 76 N -2.53 1.45 0.00 0.00 3.52 -1.26 -1.52 118.95 118.61 1yhq s ARG 76 Ca 0.19 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 55.24 1yhq s ARG 76 Cb -0.08 -1.33 0.00 0.00 -1.56 0.00 0.00 34.95 31.97 1yhq s ARG 76 CO 0.09 0.27 0.00 1.97 -0.81 0.00 0.00 175.30 176.82 1yhq n PHE 77 N 2.96 0.00 0.00 5.12 1.16 -0.73 -4.80 117.46 121.18 1yhq n PHE 77 Ca -0.17 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.41 1yhq n PHE 77 Cb 0.54 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.41 1yhq n PHE 77 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 1yhq n GLU 78 N -0.02 0.00 0.19 3.97 2.13 -1.26 -1.68 120.64 123.98 1yhq n GLU 78 Ca 0.00 0.00 0.14 0.00 0.66 0.00 0.00 57.16 57.96 1yhq n GLU 78 Cb 0.00 0.00 0.58 0.00 0.27 0.00 0.00 31.44 32.29 1yhq n GLU 78 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 1yhq h GLU 79 N 0.00 0.00 0.00 5.31 -0.00 -2.03 -3.13 114.58 114.73 1yhq h GLU 79 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 59.36 59.14 1yhq h GLU 79 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 28.75 28.71 1yhq h GLU 79 CO 0.00 0.00 -1.92 -1.91 -0.00 0.00 0.00 179.01 175.18 1yhq n GLU 80 N -2.61 1.55 -0.40 1.06 2.13 -1.26 -5.08 120.64 116.02 1yhq n GLU 80 Ca 0.01 -0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1yhq n GLU 80 Cb 0.27 -1.36 0.00 0.00 0.27 0.00 0.00 31.44 30.62 1yhq n GLU 80 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1yhq n GLY 81 N 2.07 -0.61 3.16 8.31 0.00 -1.19 -5.03 105.19 111.91 1yhq n GLY 81 Ca -0.20 -0.72 -0.08 0.00 0.00 0.00 0.00 46.02 45.01 1yhq n GLY 81 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1yhq s GLU 82 N -0.35 0.77 -0.03 1.61 4.04 -0.68 -4.67 118.70 119.39 1yhq s GLU 82 Ca 0.00 -1.08 0.05 0.00 0.04 0.00 0.00 54.97 53.97 1yhq s GLU 82 Cb 0.00 0.29 -0.01 0.00 0.02 0.00 0.00 34.13 34.43 1yhq s GLU 82 CO 0.00 -0.21 -0.17 0.00 -1.84 0.00 0.00 175.26 173.04 1yhq s ALA 83 N -3.89 1.46 -0.12 -0.84 0.00 -0.83 -1.77 121.76 115.77 1yhq s ALA 83 Ca 0.07 -0.70 -0.02 0.00 0.00 0.00 0.00 51.96 51.31 1yhq s ALA 83 Cb 0.06 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1yhq s ALA 83 CO -0.10 0.30 -0.05 0.42 0.00 0.00 0.00 175.76 176.33 1yhq s ILE 84 N -0.12 3.81 0.08 0.00 1.01 -0.58 -0.53 121.20 124.87 1yhq s ILE 84 Ca 0.00 -0.41 0.04 0.00 0.00 0.00 0.00 60.65 60.29 1yhq s ILE 84 Cb -0.10 -2.62 -0.03 0.00 0.01 0.00 0.00 42.46 39.72 1yhq s ILE 84 CO 0.01 0.54 -0.12 -0.69 0.00 0.00 0.00 174.94 174.68 1yhq s VAL 85 N -0.10 1.00 0.27 2.92 1.01 -0.08 -0.76 120.40 124.65 1yhq s VAL 85 Ca 0.02 -1.41 -0.13 0.00 0.00 0.00 0.00 61.98 60.46 1yhq s VAL 85 Cb -0.13 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.12 1yhq s VAL 85 CO 0.03 -0.37 0.52 -1.83 0.00 0.00 0.00 175.10 173.45 1yhq s GLU 86 N -2.11 1.64 1.20 2.72 -1.05 -0.73 -0.21 118.70 120.15 1yhq s GLU 86 Ca -0.00 -1.28 -0.19 0.00 -0.15 0.00 0.00 54.97 53.35 1yhq s GLU 86 Cb -0.07 0.49 0.28 0.00 -0.44 0.00 0.00 34.13 34.39 1yhq s GLU 86 CO 0.01 -0.70 1.10 0.00 0.95 0.00 0.00 175.26 176.63 1yhq s ALA 87 N -3.83 0.54 0.00 -0.84 0.00 -1.26 -0.62 121.76 115.74 1yhq s ALA 87 Ca 0.22 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1yhq s ALA 87 Cb -0.01 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1yhq s ALA 87 CO 0.10 -3.59 0.05 0.39 0.00 0.00 0.00 175.76 172.72