#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yun s LYS 3 N 0.00 2.11 -0.46 1.61 1.02 -1.26 -4.94 119.74 117.83 1yun s LYS 3 Ca 0.00 -1.02 -0.16 0.00 0.02 0.00 0.00 55.97 54.80 1yun s LYS 3 Cb 0.00 -2.29 0.05 0.00 -0.52 0.00 0.00 37.83 35.07 1yun s LYS 3 CO 0.00 0.51 0.41 1.03 -0.92 0.00 0.00 175.35 176.38 1yun s ARG 4 N -2.15 3.02 -0.12 1.68 0.52 -1.26 -0.42 118.95 120.22 1yun s ARG 4 Ca 0.21 -1.12 0.03 0.00 -0.52 0.00 0.00 55.73 54.33 1yun s ARG 4 Cb -0.11 -4.07 0.00 0.00 0.52 0.00 0.00 34.95 31.29 1yun s ARG 4 CO 0.13 -0.97 -0.21 0.42 0.02 0.00 0.00 175.30 174.69 1yun s ILE 5 N 1.87 2.27 0.29 1.52 -1.09 -0.90 0.19 121.20 125.34 1yun s ILE 5 Ca 0.07 -0.93 0.07 0.00 -2.23 0.00 0.00 60.65 57.63 1yun s ILE 5 Cb -0.21 -1.90 -0.03 0.00 -1.58 0.00 0.00 42.46 38.73 1yun s ILE 5 CO 0.09 0.55 0.24 -0.83 -1.23 0.00 0.00 174.94 173.76 1yun s GLY 6 N 0.51 1.56 -0.05 6.18 0.00 1.00 -0.93 107.32 115.59 1yun s GLY 6 Ca -0.13 -1.51 -0.02 0.00 0.00 0.00 0.00 44.72 43.05 1yun s GLY 6 CO 0.05 -1.51 0.04 -2.27 0.00 0.00 0.00 173.10 169.42 1yun s LEU 7 N -3.91 0.28 -0.34 0.66 2.96 0.24 -2.26 118.68 116.31 1yun s LEU 7 Ca 0.36 0.04 0.03 0.00 -0.22 0.00 0.00 54.13 54.34 1yun s LEU 7 Cb -0.07 -0.21 0.10 0.00 0.50 0.00 0.00 46.19 46.51 1yun s LEU 7 CO 0.26 -0.23 0.08 0.12 -1.32 0.00 0.00 176.35 175.25 1yun s PHE 8 N 2.09 3.08 0.09 5.38 5.36 0.93 -0.72 117.98 134.18 1yun s PHE 8 Ca 0.05 -2.62 -0.23 0.00 -0.96 0.00 0.00 56.93 53.16 1yun s PHE 8 Cb -0.12 -2.53 -0.07 0.00 -0.34 0.00 0.00 43.02 39.96 1yun s PHE 8 CO -0.04 -0.91 0.70 0.20 -1.46 0.00 0.00 175.22 173.71 1yun s GLY 9 N 1.04 2.79 0.12 13.12 0.00 -1.26 -0.69 107.32 122.44 1yun s GLY 9 Ca 0.11 0.22 -0.25 0.00 0.00 0.00 0.00 44.72 44.80 1yun s GLY 9 CO -0.13 0.80 0.71 -0.32 0.00 0.00 0.00 173.10 174.16 1yun s GLY 10 N -0.78 -0.52 0.26 0.20 0.00 -1.19 -4.94 107.32 100.35 1yun s GLY 10 Ca 0.34 0.57 -0.01 0.00 0.00 0.00 0.00 44.72 45.62 1yun s GLY 10 CO 0.22 0.19 1.72 -0.84 0.00 0.00 0.00 173.10 174.39 1yun h THR 11 N 2.00 1.25 -5.76 0.90 2.02 -1.89 -2.28 112.91 109.15 1yun h THR 11 Ca -0.29 -1.17 -0.17 0.00 0.77 0.00 0.00 66.41 65.55 1yun h THR 11 Cb 1.28 1.13 0.02 0.00 -1.74 0.00 0.00 68.15 68.84 1yun h THR 11 CO 0.34 0.39 -0.40 0.49 0.37 0.00 0.00 175.52 176.72 1yun n PHE 12 N -4.16 -2.64 -3.24 3.16 3.01 -1.26 -4.63 117.46 107.71 1yun n PHE 12 Ca 0.01 0.99 -0.25 0.00 1.01 0.00 0.00 57.45 59.20 1yun n PHE 12 Cb 0.37 -3.76 -0.06 0.00 -0.01 0.00 0.00 39.48 36.02 1yun n PHE 12 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1yun n ASP 13 N -2.16 2.88 -5.00 4.37 2.03 -1.26 -3.07 116.55 114.35 1yun n ASP 13 Ca -0.09 -3.30 -0.19 0.00 0.52 0.00 0.00 54.79 51.73 1yun n ASP 13 Cb 0.56 -0.63 0.02 0.00 -0.72 0.00 0.00 41.12 40.35 1yun n ASP 13 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1yun s PRO 14 N -2.44 2.54 0.34 -0.67 0.04 -1.26 -4.78 135.00 128.77 1yun s PRO 14 Ca 0.41 -1.49 -0.29 0.00 0.04 0.00 0.00 61.00 59.67 1yun s PRO 14 Cb 0.21 -2.62 -0.11 0.00 0.04 0.00 0.00 34.50 32.02 1yun s PRO 14 CO -0.07 -0.52 1.47 0.54 0.04 0.00 0.00 177.00 178.46 1yun s VAL 15 N -2.52 2.24 0.17 -0.36 0.11 -1.17 -4.77 120.40 114.09 1yun s VAL 15 Ca 0.55 0.23 0.03 0.00 -2.93 0.00 0.00 61.98 59.87 1yun s VAL 15 Cb -0.07 -3.15 -0.01 0.00 -1.53 0.00 0.00 36.38 31.62 1yun s VAL 15 CO 0.34 0.05 0.15 0.00 -3.33 0.00 0.00 175.10 172.31 1yun n HIS 16 N 1.11 -0.46 0.19 1.54 1.44 -1.26 -4.71 115.22 113.07 1yun n HIS 16 Ca 0.03 -1.40 0.06 0.00 -2.01 0.00 0.00 57.72 54.40 1yun n HIS 16 Cb 0.39 0.16 0.31 0.00 0.12 0.00 0.00 29.99 30.97 1yun n HIS 16 CO 0.00 0.00 0.00 -0.84 -2.81 0.00 0.00 176.34 172.69 1yun h ILE 17 N 1.54 0.83 -0.05 0.61 3.07 -1.76 -1.83 117.51 119.91 1yun h ILE 17 Ca -0.12 -1.57 0.00 0.00 1.55 0.00 0.00 64.86 64.73 1yun h ILE 17 Cb 0.61 1.98 -0.00 0.00 -0.27 0.00 0.00 36.82 39.13 1yun h ILE 17 CO 0.17 0.37 0.02 1.23 -1.05 0.00 0.00 178.15 178.89 1yun h GLY 18 N 2.27 0.07 0.92 0.16 0.00 -1.85 1.35 103.07 105.99 1yun h GLY 18 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 1yun h GLY 18 CO 0.05 0.02 -0.12 0.45 0.00 0.00 0.00 176.54 176.93 1yun h HIS 19 N 0.06 -0.32 -0.50 5.60 3.86 -1.87 -0.31 115.15 121.67 1yun h HIS 19 Ca 0.02 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 1yun h HIS 19 Cb 0.00 0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.57 1yun h HIS 19 CO -0.09 -0.19 0.19 0.52 0.86 0.00 0.00 177.93 179.22 1yun h MET 20 N -0.30 0.75 -0.05 2.45 2.07 -1.06 0.39 114.93 119.18 1yun h MET 20 Ca -0.01 -0.14 -0.08 0.00 -2.07 0.00 0.00 59.70 57.40 1yun h MET 20 Cb 0.26 -0.12 -0.01 0.00 -1.87 0.00 0.00 31.60 29.86 1yun h MET 20 CO 0.01 0.68 -0.33 0.00 1.07 0.00 0.00 176.91 178.34 1yun h ARG 21 N 0.66 0.09 -0.13 1.72 2.47 0.18 -0.02 114.38 119.35 1yun h ARG 21 Ca 0.16 -0.03 -0.15 0.00 -1.26 0.00 0.00 59.98 58.71 1yun h ARG 21 Cb 0.21 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.52 1yun h ARG 21 CO -0.01 0.41 -0.55 0.77 0.56 0.00 0.00 179.97 181.15 1yun h SER 22 N 0.08 0.43 0.30 7.04 0.02 -0.07 -2.51 113.55 118.84 1yun h SER 22 Ca 0.01 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1yun h SER 22 Cb 0.62 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 1yun h SER 22 CO 0.05 0.90 -0.28 0.00 -1.14 0.00 0.00 176.83 176.36 1yun h ALA 23 N 1.11 -0.59 -0.28 3.77 0.00 0.53 -0.02 119.26 123.79 1yun h ALA 23 Ca 0.01 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1yun h ALA 23 Cb 1.06 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 19.17 1yun h ALA 23 CO 0.09 -0.86 -0.47 0.28 0.00 0.00 0.00 179.25 178.29 1yun h VAL 24 N -0.60 0.00 -0.58 0.00 2.07 -0.96 -1.28 116.25 114.90 1yun h VAL 24 Ca -0.02 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.60 1yun h VAL 24 Cb 0.54 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.24 1yun h VAL 24 CO -0.04 0.00 0.19 -0.33 0.02 0.00 0.00 177.57 177.41 1yun h GLU 25 N -0.38 0.34 -0.59 1.57 5.08 -1.34 -2.31 114.58 116.96 1yun h GLU 25 Ca 0.05 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.49 1yun h GLU 25 Cb 0.52 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.62 1yun h GLU 25 CO -0.46 0.23 0.18 1.98 -1.00 0.00 0.00 179.01 179.93 1yun h MET 26 N 0.35 0.33 0.49 2.33 4.05 0.10 -0.42 114.93 122.16 1yun h MET 26 Ca 0.29 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.67 1yun h MET 26 Cb 0.37 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 1yun h MET 26 CO -0.32 0.22 -0.23 0.00 0.23 0.00 0.00 176.91 176.81 1yun h ALA 27 N 1.43 -0.66 -0.91 0.39 0.00 -0.81 -0.82 119.26 117.87 1yun h ALA 27 Ca 0.30 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1yun h ALA 27 Cb 0.40 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.37 1yun h ALA 27 CO -0.33 -0.82 0.59 0.93 0.00 0.00 0.00 179.25 179.62 1yun h GLU 28 N -0.76 0.88 -0.31 0.00 5.08 -1.18 1.02 114.58 119.31 1yun h GLU 28 Ca -0.07 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 1yun h GLU 28 Cb 0.55 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1yun h GLU 28 CO 0.11 0.58 -0.07 0.37 -1.00 0.00 0.00 179.01 179.01 1yun h GLN 29 N 0.91 0.59 -0.35 2.33 4.15 -0.89 -3.21 115.11 118.63 1yun h GLN 29 Ca 0.43 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.63 1yun h GLN 29 Cb 0.42 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1yun h GLN 29 CO -0.19 0.77 0.00 1.19 -1.93 0.00 0.00 178.83 178.67 1yun n PHE 30 N -4.48 0.45 -2.64 3.99 3.01 -0.16 -4.91 117.46 112.73 1yun n PHE 30 Ca -0.03 -0.22 -0.20 0.00 1.01 0.00 0.00 57.45 58.01 1yun n PHE 30 Cb 0.32 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.79 1yun n PHE 30 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1yun n ALA 31 N 1.12 -0.77 -1.66 4.37 0.00 0.34 -4.86 120.51 119.04 1yun n ALA 31 Ca 0.18 0.19 -0.44 0.00 0.00 0.00 0.00 53.44 53.37 1yun n ALA 31 Cb 0.51 -2.62 -0.02 0.00 0.00 0.00 0.00 19.45 17.33 1yun n ALA 31 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1yun n LEU 32 N -3.32 2.93 -0.29 0.00 4.77 -1.00 -4.78 117.00 115.32 1yun n LEU 32 Ca -0.18 1.17 -0.04 0.00 -0.03 0.00 0.00 56.01 56.93 1yun n LEU 32 Cb 0.65 -1.41 0.10 0.00 -2.33 0.00 0.00 43.42 40.43 1yun n LEU 32 CO 0.34 -0.70 1.10 0.44 -1.33 0.00 0.00 177.39 177.24 1yun h ASP 33 N 3.17 1.07 -3.41 -1.43 3.32 0.17 -3.45 116.42 115.85 1yun h ASP 33 Ca -0.44 -0.13 -0.09 0.00 0.02 0.00 0.00 57.03 56.39 1yun h ASP 33 Cb 1.29 -0.28 -0.24 0.00 0.22 0.00 0.00 39.33 40.32 1yun h ASP 33 CO 0.68 0.91 -0.19 -0.70 -1.72 0.00 0.00 179.24 178.23 1yun s GLU 34 N -5.64 0.51 -0.19 3.56 2.12 -0.86 -4.62 118.70 113.58 1yun s GLU 34 Ca -0.12 0.84 -0.04 0.00 0.36 0.00 0.00 54.97 56.00 1yun s GLU 34 Cb 0.16 0.11 -0.02 0.00 0.26 0.00 0.00 34.13 34.64 1yun s GLU 34 CO 0.83 -0.13 -0.03 -1.17 -0.54 0.00 0.00 175.26 174.22 1yun s LEU 35 N 1.07 3.08 -0.36 2.70 0.20 0.57 -0.00 118.68 125.93 1yun s LEU 35 Ca -0.06 -0.27 -0.11 0.00 0.69 0.00 0.00 54.13 54.38 1yun s LEU 35 Cb -0.06 -1.77 0.01 0.00 -0.43 0.00 0.00 46.19 43.94 1yun s LEU 35 CO -0.10 0.06 0.21 -0.13 -0.29 0.00 0.00 176.35 176.10 1yun s ARG 36 N 1.00 3.05 0.15 1.98 0.52 -0.96 -1.17 118.95 123.51 1yun s ARG 36 Ca 0.01 -0.93 -0.30 0.00 -0.52 0.00 0.00 55.73 53.99 1yun s ARG 36 Cb -0.15 -3.72 -0.07 0.00 0.52 0.00 0.00 34.95 31.53 1yun s ARG 36 CO 0.01 -0.60 1.12 -0.51 0.02 0.00 0.00 175.30 175.34 1yun s LEU 37 N 1.60 4.45 -0.53 2.53 1.02 -0.61 -0.05 118.68 127.10 1yun s LEU 37 Ca 0.03 2.07 0.04 0.00 0.02 0.00 0.00 54.13 56.29 1yun s LEU 37 Cb -0.18 -3.60 0.14 0.00 0.02 0.00 0.00 46.19 42.57 1yun s LEU 37 CO 0.07 -0.29 0.31 -0.22 0.02 0.00 0.00 176.35 176.25 1yun s LEU 38 N 0.00 3.66 0.16 1.79 2.96 0.13 -0.41 118.68 126.97 1yun s LEU 38 Ca 0.52 -3.08 -0.31 0.00 -0.22 0.00 0.00 54.13 51.03 1yun s LEU 38 Cb -0.29 -1.34 -0.11 0.00 0.50 0.00 0.00 46.19 44.95 1yun s LEU 38 CO 0.34 -0.20 1.69 -2.84 -1.32 0.00 0.00 176.35 174.01 1yun s PRO 39 N -0.32 4.16 0.50 0.98 0.02 -1.26 -3.18 135.00 135.90 1yun s PRO 39 Ca 0.20 2.49 -0.18 0.00 0.02 0.00 0.00 61.00 63.53 1yun s PRO 39 Cb -0.18 -3.28 -0.08 0.00 0.02 0.00 0.00 34.50 30.98 1yun s PRO 39 CO -0.05 -0.72 0.99 -0.80 -0.33 0.00 0.00 177.00 176.08 1yun s ASN 40 N 1.65 6.59 0.26 2.53 0.02 -0.86 -4.27 114.94 120.87 1yun s ASN 40 Ca 0.74 1.67 -0.21 0.00 -1.02 0.00 0.00 52.86 54.05 1yun s ASN 40 Cb -0.46 -2.53 -0.09 0.00 0.02 0.00 0.00 41.25 38.20 1yun s ASN 40 CO 0.33 -0.61 0.79 0.00 0.02 0.00 0.00 177.10 177.62 1yun s ALA 41 N -2.41 3.34 0.12 0.60 0.00 -1.26 -4.88 121.76 117.27 1yun s ALA 41 Ca 0.61 0.25 -0.10 0.00 0.00 0.00 0.00 51.96 52.72 1yun s ALA 41 Cb -0.11 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.10 1yun s ALA 41 CO 0.26 0.28 0.26 -0.98 0.00 0.00 0.00 175.76 175.58 1yun s ARG 42 N -2.13 0.98 0.30 0.00 1.70 -1.26 -4.56 118.95 113.99 1yun s ARG 42 Ca 0.46 -0.99 -0.28 0.00 -0.47 0.00 0.00 55.73 54.45 1yun s ARG 42 Cb -0.16 0.38 -0.13 0.00 -0.57 0.00 0.00 34.95 34.46 1yun s ARG 42 CO 0.21 -0.34 1.16 -2.30 -1.08 0.00 0.00 175.30 172.95 1yun n PRO 43 N -0.14 1.72 -0.37 3.89 -0.02 -1.26 -4.83 135.00 133.99 1yun n PRO 43 Ca -0.13 0.60 0.29 0.00 -2.02 0.00 0.00 63.50 62.24 1yun n PRO 43 Cb 0.63 -2.09 0.56 0.00 -0.02 0.00 0.00 33.50 32.59 1yun n PRO 43 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1yun h PRO 44 N 2.43 0.25 -0.00 0.52 0.11 -2.00 0.11 132.00 133.42 1yun h PRO 44 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1yun h PRO 44 Cb 1.31 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1yun h PRO 44 CO 0.63 0.16 -0.03 -2.39 -0.21 0.00 0.00 178.00 176.17 1yun n HIS 45 N -4.69 0.00 0.07 0.65 1.44 -1.26 -2.34 115.22 109.09 1yun n HIS 45 Ca 0.31 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 56.10 1yun n HIS 45 Cb 1.12 -0.09 0.17 0.00 0.12 0.00 0.00 29.99 31.30 1yun n HIS 45 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1yun n ARG 46 N -0.89 2.28 -2.15 -1.40 5.12 0.37 -4.96 116.66 115.03 1yun n ARG 46 Ca 0.19 -2.03 -0.31 0.00 -1.93 0.00 0.00 57.85 53.77 1yun n ARG 46 Cb 0.20 -1.37 -0.01 0.00 -1.16 0.00 0.00 32.46 30.12 1yun n ARG 46 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1yun s GLU 47 N -1.13 3.74 0.21 5.56 0.41 -0.99 -4.97 118.70 121.52 1yun s GLU 47 Ca 0.29 0.79 -0.31 0.00 -0.41 0.00 0.00 54.97 55.33 1yun s GLU 47 Cb 0.16 -2.13 -0.11 0.00 -1.78 0.00 0.00 34.13 30.28 1yun s GLU 47 CO 0.22 -0.42 1.62 0.99 -0.49 0.00 0.00 175.26 177.19 1yun s THR 48 N -2.92 2.30 0.20 3.63 2.01 -1.25 -4.90 115.64 114.70 1yun s THR 48 Ca 0.56 0.22 -0.32 0.00 0.31 0.00 0.00 61.69 62.46 1yun s THR 48 Cb -0.11 -3.14 -0.14 0.00 0.01 0.00 0.00 72.50 69.12 1yun s THR 48 CO 0.44 0.02 1.33 -2.65 -0.69 0.00 0.00 174.62 173.08 1yun n PRO 49 N 3.58 1.67 -1.81 4.92 -0.02 -1.26 -0.91 135.00 141.17 1yun n PRO 49 Ca 0.13 0.60 -0.17 0.00 -2.02 0.00 0.00 63.50 62.04 1yun n PRO 49 Cb 0.37 -2.21 -0.05 0.00 -0.02 0.00 0.00 33.50 31.59 1yun n PRO 49 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1yun n GLN 50 N 2.12 -1.26 -3.61 -0.52 1.13 -1.26 -4.81 117.38 109.17 1yun n GLN 50 Ca 0.14 1.00 -0.28 0.00 -1.94 0.00 0.00 57.00 55.92 1yun n GLN 50 Cb 0.28 -5.31 -0.16 0.00 0.11 0.00 0.00 30.24 25.16 1yun n GLN 50 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1yun s VAL 51 N -2.72 0.15 0.72 5.09 1.01 -0.08 -4.54 120.40 120.02 1yun s VAL 51 Ca 0.00 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.19 1yun s VAL 51 Cb 0.00 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.43 1yun s VAL 51 CO 0.00 -0.56 1.07 -0.94 0.00 0.00 0.00 175.10 174.67 1yun s SER 52 N 2.00 4.94 0.17 3.32 1.04 -1.26 -3.85 113.70 120.07 1yun s SER 52 Ca 0.06 0.72 -0.14 0.00 0.48 0.00 0.00 55.95 57.07 1yun s SER 52 Cb -0.16 -1.39 0.10 0.00 0.10 0.00 0.00 66.02 64.66 1yun s SER 52 CO -0.25 -1.57 1.80 0.00 0.98 0.00 0.00 173.24 174.20 1yun h ALA 53 N -0.69 0.62 0.00 5.32 0.00 -1.97 -1.27 119.26 121.28 1yun h ALA 53 Ca -0.45 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1yun h ALA 53 Cb 1.30 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1yun h ALA 53 CO 0.63 -0.04 -0.13 0.00 0.00 0.00 0.00 179.25 179.71 1yun h ALA 54 N 1.23 1.05 0.17 0.00 0.00 -1.94 0.14 119.26 119.91 1yun h ALA 54 Ca 0.20 -0.11 -0.30 0.00 0.00 0.00 0.00 54.91 54.69 1yun h ALA 54 Cb 0.05 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1yun h ALA 54 CO -0.11 0.16 -1.39 1.96 0.00 0.00 0.00 179.25 179.87 1yun h GLN 55 N 0.00 0.36 -0.75 0.00 4.20 -1.76 -2.07 115.11 115.10 1yun h GLN 55 Ca -0.00 -0.62 0.09 0.00 0.06 0.00 0.00 58.65 58.19 1yun h GLN 55 Cb 0.59 0.23 -0.07 0.00 0.30 0.00 0.00 27.48 28.53 1yun h GLN 55 CO 0.02 1.28 0.39 0.00 -0.67 0.00 0.00 178.83 179.85 1yun h ARG 56 N 0.10 0.64 -0.61 1.46 3.08 -0.66 -1.31 114.38 117.08 1yun h ARG 56 Ca -0.20 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.71 1yun h ARG 56 Cb 2.05 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.93 1yun h ARG 56 CO 0.22 0.43 -0.00 1.25 -1.07 0.00 0.00 179.97 180.79 1yun h LEU 57 N 0.66 1.06 -0.41 3.04 5.85 -0.69 -1.98 115.31 122.85 1yun h LEU 57 Ca 0.36 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1yun h LEU 57 Cb 0.36 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1yun h LEU 57 CO -0.26 1.11 0.27 0.00 -0.34 0.00 0.00 178.44 179.22 1yun h ALA 58 N 0.99 0.52 -0.64 1.25 0.00 -1.02 -1.13 119.26 119.22 1yun h ALA 58 Ca 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1yun h ALA 58 Cb 0.57 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1yun h ALA 58 CO 0.03 -0.03 0.35 0.52 0.00 0.00 0.00 179.25 180.12 1yun h MET 59 N 0.55 0.88 -0.23 0.00 2.86 -1.05 0.31 114.93 118.25 1yun h MET 59 Ca 0.15 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.60 1yun h MET 59 Cb -0.06 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.41 1yun h MET 59 CO -0.04 0.65 -0.28 0.28 1.06 0.00 0.00 176.91 178.59 1yun h VAL 60 N 0.89 1.27 -0.49 -2.22 2.07 -0.83 -0.21 116.25 116.74 1yun h VAL 60 Ca 0.23 -1.30 -0.12 0.00 0.82 0.00 0.00 66.70 66.33 1yun h VAL 60 Cb 0.03 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1yun h VAL 60 CO -0.04 0.41 -0.17 -0.33 0.02 0.00 0.00 177.57 177.46 1yun h GLU 61 N 0.39 0.98 -0.75 1.57 5.08 -0.01 -2.55 114.58 119.29 1yun h GLU 61 Ca 0.06 -0.40 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 1yun h GLU 61 Cb 0.69 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.86 1yun h GLU 61 CO 0.05 1.07 0.41 0.00 -1.00 0.00 0.00 179.01 179.55 1yun h ARG 62 N 0.83 1.04 -0.13 2.33 2.47 -0.03 -1.10 114.38 119.80 1yun h ARG 62 Ca 0.12 -0.11 -0.11 0.00 -1.26 0.00 0.00 59.98 58.61 1yun h ARG 62 Cb 0.74 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.84 1yun h ARG 62 CO 0.06 0.76 -0.42 0.00 0.56 0.00 0.00 179.97 180.92 1yun h ALA 63 N 1.41 1.05 -0.02 0.04 0.00 -0.90 -3.21 119.26 117.64 1yun h ALA 63 Ca 0.27 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1yun h ALA 63 Cb 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1yun h ALA 63 CO -0.04 0.61 -0.28 1.33 0.00 0.00 0.00 179.25 180.87 1yun n VAL 64 N -4.01 0.00 -2.01 0.00 0.24 -0.97 -4.82 118.33 106.75 1yun n VAL 64 Ca -0.02 -0.36 -0.42 0.00 -2.04 0.00 0.00 64.34 61.50 1yun n VAL 64 Cb 0.49 1.28 -0.03 0.00 -1.47 0.00 0.00 33.84 34.12 1yun n VAL 64 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yun s ALA 65 N -2.01 3.65 0.00 2.33 0.00 -0.43 -0.76 121.76 124.54 1yun s ALA 65 Ca 0.18 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.23 1yun s ALA 65 Cb 0.16 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1yun s ALA 65 CO 0.41 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.48 1yun n GLY 66 N 3.93 0.79 3.46 0.00 0.00 -1.26 -5.00 105.19 107.11 1yun n GLY 66 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1yun n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yun s VAL 67 N -3.04 5.07 -0.06 1.61 1.01 0.06 -5.03 120.40 120.01 1yun s VAL 67 Ca 0.00 -0.56 -0.36 0.00 0.00 0.00 0.00 61.98 61.06 1yun s VAL 67 Cb 0.00 -3.74 -0.14 0.00 0.00 0.00 0.00 36.38 32.50 1yun s VAL 67 CO 0.00 -0.18 1.68 -1.84 0.00 0.00 0.00 175.10 174.76 1yun n GLU 68 N 5.10 1.69 -0.96 2.72 0.00 -1.26 -2.46 120.64 125.46 1yun n GLU 68 Ca -0.12 0.62 0.00 0.00 0.00 0.00 0.00 57.16 57.66 1yun n GLU 68 Cb 0.48 -2.36 0.00 0.00 0.00 0.00 0.00 31.44 29.56 1yun n GLU 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1yun n ARG 69 N 4.86 -0.63 -4.28 3.44 1.74 -1.26 -4.96 116.66 115.57 1yun n ARG 69 Ca 0.22 0.16 -0.33 0.00 -0.77 0.00 0.00 57.85 57.12 1yun n ARG 69 Cb 0.23 -3.68 -0.16 0.00 -1.02 0.00 0.00 32.46 27.82 1yun n ARG 69 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1yun s LEU 70 N 0.00 2.22 0.00 0.55 1.02 -1.03 -0.32 118.68 121.12 1yun s LEU 70 Ca 0.00 -0.60 0.03 0.00 0.02 0.00 0.00 54.13 53.57 1yun s LEU 70 Cb 0.00 -1.50 -0.01 0.00 0.02 0.00 0.00 46.19 44.70 1yun s LEU 70 CO 0.00 0.03 0.09 0.35 0.02 0.00 0.00 176.35 176.84 1yun n THR 71 N 4.44 0.00 -4.77 5.49 -2.24 -0.32 -4.74 114.28 112.14 1yun n THR 71 Ca -0.20 -2.15 -0.24 0.00 -2.27 0.00 0.00 64.05 59.19 1yun n THR 71 Cb 0.51 0.67 -0.15 0.00 -2.10 0.00 0.00 70.33 69.26 1yun n THR 71 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1yun s VAL 72 N -2.85 1.31 -0.39 2.28 0.11 -1.26 -1.57 120.40 118.02 1yun s VAL 72 Ca 0.13 -0.73 -0.08 0.00 -2.93 0.00 0.00 61.98 58.38 1yun s VAL 72 Cb 0.01 -1.09 0.06 0.00 -1.53 0.00 0.00 36.38 33.83 1yun s VAL 72 CO 0.09 0.36 0.21 -0.62 -3.33 0.00 0.00 175.10 171.81 1yun s ASP 73 N -0.42 5.54 -0.06 3.54 3.68 0.45 -4.90 116.67 124.50 1yun s ASP 73 Ca 0.06 -1.37 0.08 0.00 2.13 0.00 0.00 52.55 53.46 1yun s ASP 73 Cb -0.06 -1.95 0.35 0.00 -1.45 0.00 0.00 42.92 39.81 1yun s ASP 73 CO -0.01 -0.46 1.16 -0.81 0.13 0.00 0.00 175.17 175.18 1yun n PRO 74 N 4.88 2.38 0.10 4.34 -0.04 -1.26 -4.12 135.00 141.29 1yun n PRO 74 Ca -0.10 -1.38 0.01 0.00 -0.04 0.00 0.00 63.50 61.99 1yun n PRO 74 Cb 0.44 -1.60 0.34 0.00 -0.04 0.00 0.00 33.50 32.63 1yun n PRO 74 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 1yun h ARG 75 N 1.94 0.26 -0.29 0.54 0.11 -1.94 -0.17 114.38 114.84 1yun h ARG 75 Ca 0.00 -0.07 -0.10 0.00 0.10 0.00 0.00 59.98 59.90 1yun h ARG 75 Cb 0.88 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.91 1yun h ARG 75 CO 0.13 0.45 -0.26 0.93 0.10 0.00 0.00 179.97 181.32 1yun h GLU 76 N 0.24 0.57 0.00 0.08 5.08 -1.81 -2.84 114.58 115.89 1yun h GLU 76 Ca 0.04 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1yun h GLU 76 Cb 0.48 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1yun h GLU 76 CO 0.03 0.78 0.00 1.28 -1.00 0.00 0.00 179.01 180.10 1yun n LEU 77 N -4.11 0.00 -0.89 1.33 4.77 -0.11 -2.48 117.00 115.51 1yun n LEU 77 Ca -0.00 0.04 0.05 0.00 -0.03 0.00 0.00 56.01 56.07 1yun n LEU 77 Cb 0.43 -0.04 0.15 0.00 -2.33 0.00 0.00 43.42 41.63 1yun n LEU 77 CO 0.43 -0.02 0.27 0.00 -1.33 0.00 0.00 177.39 176.74 1yun n GLN 78 N -1.04 1.23 -2.79 3.23 10.64 -0.97 -4.98 117.38 122.70 1yun n GLN 78 Ca 0.13 -3.00 -0.17 0.00 -1.83 0.00 0.00 57.00 52.14 1yun n GLN 78 Cb 0.07 -1.22 0.03 0.00 -0.86 0.00 0.00 30.24 28.27 1yun n GLN 78 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 1yun n ARG 79 N -0.68 0.76 0.21 2.61 1.74 -1.04 -5.01 116.66 115.25 1yun n ARG 79 Ca 0.16 -2.48 0.10 0.00 -0.77 0.00 0.00 57.85 54.86 1yun n ARG 79 Cb 0.82 -0.02 0.33 0.00 -1.02 0.00 0.00 32.46 32.57 1yun n ARG 79 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1yun h ASP 80 N 0.23 0.00 -5.52 0.55 3.45 -1.96 -3.47 116.42 109.69 1yun h ASP 80 Ca -0.23 0.00 0.23 0.00 0.43 0.00 0.00 57.03 57.46 1yun h ASP 80 Cb 0.96 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 39.66 1yun h ASP 80 CO 0.34 0.19 0.65 -0.54 -1.57 0.00 0.00 179.24 178.31 1yun s LYS 81 N -3.40 0.96 1.09 3.56 -0.14 -1.26 -5.17 119.74 115.38 1yun s LYS 81 Ca 0.03 -0.58 -0.17 0.00 -1.36 0.00 0.00 55.97 53.89 1yun s LYS 81 Cb 0.08 0.30 0.10 0.00 -1.68 0.00 0.00 37.83 36.63 1yun s LYS 81 CO 0.65 -0.45 0.17 -2.30 -0.76 0.00 0.00 175.35 172.66 1yun n PRO 82 N -0.61 -1.38 -4.35 -1.68 -0.02 -1.26 -5.01 135.00 120.69 1yun n PRO 82 Ca -0.04 -0.38 -0.18 0.00 -2.02 0.00 0.00 63.50 60.88 1yun n PRO 82 Cb 0.60 -1.77 -0.10 0.00 -0.02 0.00 0.00 33.50 32.21 1yun n PRO 82 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1yun s SER 83 N -1.92 1.56 0.63 2.55 1.04 -1.26 -5.10 113.70 111.20 1yun s SER 83 Ca 0.57 -1.36 -0.11 0.00 0.48 0.00 0.00 55.95 55.53 1yun s SER 83 Cb -0.15 0.08 -0.03 0.00 0.10 0.00 0.00 66.02 66.02 1yun s SER 83 CO 0.66 -0.67 1.04 -0.31 0.98 0.00 0.00 173.24 174.94 1yun s TYR 84 N -3.60 3.55 0.17 5.02 1.51 -1.26 -4.97 117.35 117.78 1yun s TYR 84 Ca 0.36 1.29 -0.09 0.00 -1.01 0.00 0.00 57.07 57.61 1yun s TYR 84 Cb 0.08 -2.76 0.03 0.00 -0.11 0.00 0.00 41.96 39.20 1yun s TYR 84 CO 0.13 -0.78 1.57 1.15 -1.11 0.00 0.00 175.55 176.51 1yun h THR 85 N -0.39 1.27 -0.91 -0.71 2.02 -2.00 -2.39 112.91 109.80 1yun h THR 85 Ca -0.44 -1.35 0.21 0.00 0.77 0.00 0.00 66.41 65.60 1yun h THR 85 Cb 1.20 1.08 -0.07 0.00 -1.74 0.00 0.00 68.15 68.62 1yun h THR 85 CO 0.62 0.47 0.60 -0.29 0.37 0.00 0.00 175.52 177.29 1yun h ILE 86 N 0.87 0.66 -0.28 3.11 6.09 -1.93 0.23 117.51 126.25 1yun h ILE 86 Ca 0.12 -0.13 -0.19 0.00 -1.37 0.00 0.00 64.86 63.29 1yun h ILE 86 Cb 0.76 0.25 0.00 0.00 0.47 0.00 0.00 36.82 38.30 1yun h ILE 86 CO 0.06 0.07 -0.56 0.44 -3.07 0.00 0.00 178.15 175.09 1yun h ASP 87 N 0.37 0.98 -0.93 2.19 3.32 -1.80 -1.38 116.42 119.16 1yun h ASP 87 Ca 0.47 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1yun h ASP 87 Cb 1.23 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 40.45 1yun h ASP 87 CO -0.17 1.33 0.60 0.74 -1.72 0.00 0.00 179.24 180.02 1yun h THR 88 N 0.67 1.25 0.24 0.35 2.02 -0.93 -2.24 112.91 114.26 1yun h THR 88 Ca 0.01 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 1yun h THR 88 Cb 1.17 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1yun h THR 88 CO 0.12 0.24 -0.11 0.25 0.37 0.00 0.00 175.52 176.40 1yun h LEU 89 N 1.27 -0.27 -1.38 2.58 5.85 -0.27 0.97 115.31 124.06 1yun h LEU 89 Ca 0.34 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.98 1yun h LEU 89 Cb -0.12 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1yun h LEU 89 CO -0.07 -0.04 0.45 -0.33 -0.34 0.00 0.00 178.44 178.11 1yun h GLU 90 N -0.49 0.78 -0.11 1.25 5.08 -1.22 0.70 114.58 120.56 1yun h GLU 90 Ca -0.03 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1yun h GLU 90 Cb 0.37 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1yun h GLU 90 CO 0.05 0.51 -0.00 1.03 -1.00 0.00 0.00 179.01 179.61 1yun h SER 91 N 0.80 0.19 -0.37 1.42 0.87 -0.92 0.43 113.55 115.96 1yun h SER 91 Ca 0.27 -0.31 0.08 0.00 -1.23 0.00 0.00 61.79 60.60 1yun h SER 91 Cb 0.10 -0.05 -0.09 0.00 -0.44 0.00 0.00 62.40 61.92 1yun h SER 91 CO -0.08 0.45 -0.23 0.58 -0.53 0.00 0.00 176.83 177.02 1yun h VAL 92 N -0.08 0.37 -0.22 2.23 2.07 -0.49 -2.83 116.25 117.29 1yun h VAL 92 Ca 0.03 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.47 1yun h VAL 92 Cb 0.36 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1yun h VAL 92 CO 0.01 0.00 -0.19 -0.09 0.02 0.00 0.00 177.57 177.31 1yun h ARG 93 N -0.18 0.40 -0.35 1.57 9.65 -0.38 -1.82 114.38 123.27 1yun h ARG 93 Ca 0.18 -0.12 0.10 0.00 -1.10 0.00 0.00 59.98 59.04 1yun h ARG 93 Cb 0.46 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.99 1yun h ARG 93 CO -0.48 0.58 0.29 0.00 2.80 0.00 0.00 179.97 183.16 1yun h ALA 94 N 1.44 2.18 -0.69 2.80 0.00 0.10 0.10 119.26 125.19 1yun h ALA 94 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1yun h ALA 94 Cb 0.55 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1yun h ALA 94 CO 0.04 -0.47 0.00 0.39 0.00 0.00 0.00 179.25 179.20 1yun n GLU 95 N -4.12 2.77 -3.43 0.00 1.02 -0.69 -4.98 120.64 111.22 1yun n GLU 95 Ca 0.05 -2.61 -0.19 0.00 -0.02 0.00 0.00 57.16 54.39 1yun n GLU 95 Cb 0.47 -1.55 -0.01 0.00 -0.02 0.00 0.00 31.44 30.33 1yun n GLU 95 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1yun s LEU 96 N -1.02 3.73 0.43 -4.62 1.43 0.36 -5.10 118.68 113.88 1yun s LEU 96 Ca 0.47 -0.39 -0.14 0.00 -1.03 0.00 0.00 54.13 53.03 1yun s LEU 96 Cb 0.24 -2.52 -0.08 0.00 0.03 0.00 0.00 46.19 43.87 1yun s LEU 96 CO 0.31 -0.54 0.85 0.00 0.23 0.00 0.00 176.35 177.21 1yun s ALA 97 N -2.29 3.23 0.10 4.21 0.00 -1.26 -4.98 121.76 120.77 1yun s ALA 97 Ca 0.47 0.01 0.27 0.00 0.00 0.00 0.00 51.96 52.71 1yun s ALA 97 Cb -0.08 -2.88 1.04 0.00 0.00 0.00 0.00 23.12 21.20 1yun s ALA 97 CO 0.30 -0.02 1.87 0.00 0.00 0.00 0.00 175.76 177.91 1yun h ALA 98 N 1.36 1.01 -0.01 0.00 0.00 -1.99 -1.29 119.26 118.34 1yun h ALA 98 Ca -0.47 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1yun h ALA 98 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1yun h ALA 98 CO 0.63 0.18 -0.12 -0.40 0.00 0.00 0.00 179.25 179.54 1yun n ASP 99 N -3.29 1.12 -4.77 0.00 5.75 -1.26 -4.67 116.55 109.43 1yun n ASP 99 Ca 0.00 -1.11 -0.38 0.00 -0.01 0.00 0.00 54.79 53.29 1yun n ASP 99 Cb 0.39 0.05 -0.01 0.00 -1.03 0.00 0.00 41.12 40.53 1yun n ASP 99 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1yun s ASP 100 N -2.27 6.22 -0.20 -1.12 1.01 -0.49 -2.73 116.67 117.09 1yun s ASP 100 Ca 0.31 2.46 -0.13 0.00 0.71 0.00 0.00 52.55 55.91 1yun s ASP 100 Cb 0.20 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.47 1yun s ASP 100 CO 0.43 -0.90 0.26 -1.10 0.21 0.00 0.00 175.17 174.07 1yun s GLN 101 N -2.47 4.17 -0.09 8.23 -0.21 0.44 -4.36 119.66 125.36 1yun s GLN 101 Ca 0.61 -0.04 0.01 0.00 0.02 0.00 0.00 55.36 55.95 1yun s GLN 101 Cb -0.33 -3.49 -0.02 0.00 1.00 0.00 0.00 33.01 30.16 1yun s GLN 101 CO 0.41 0.11 -0.10 -1.17 -2.12 0.00 0.00 175.29 172.43 1yun s LEU 102 N 0.88 2.97 -0.22 2.90 2.96 -0.13 -2.13 118.68 125.90 1yun s LEU 102 Ca 0.13 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 53.90 1yun s LEU 102 Cb -0.13 -1.65 0.05 0.00 0.50 0.00 0.00 46.19 44.95 1yun s LEU 102 CO 0.04 0.28 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.89 1yun s PHE 103 N -0.32 2.72 -0.24 5.38 0.40 -0.11 0.14 117.98 125.95 1yun s PHE 103 Ca 0.04 -1.87 -0.14 0.00 -0.60 0.00 0.00 56.93 54.37 1yun s PHE 103 Cb -0.13 -1.74 -0.04 0.00 0.51 0.00 0.00 43.02 41.62 1yun s PHE 103 CO 0.02 -0.80 0.30 1.41 0.70 0.00 0.00 175.22 176.86 1yun s MET 104 N 1.29 4.07 -0.26 0.44 1.75 0.52 0.83 119.30 127.94 1yun s MET 104 Ca -0.04 -0.03 -0.11 0.00 -1.25 0.00 0.00 55.69 54.26 1yun s MET 104 Cb -0.18 -3.59 -0.05 0.00 2.84 0.00 0.00 34.83 33.86 1yun s MET 104 CO -0.07 -0.10 0.18 -1.17 -0.65 0.00 0.00 175.02 173.21 1yun s LEU 105 N 1.52 4.07 0.13 4.11 2.96 0.10 -0.49 118.68 131.09 1yun s LEU 105 Ca 0.13 0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.15 1yun s LEU 105 Cb -0.15 -2.12 -0.04 0.00 0.50 0.00 0.00 46.19 44.38 1yun s LEU 105 CO 0.08 0.01 -0.11 0.27 -1.32 0.00 0.00 176.35 175.28 1yun s ILE 106 N 1.41 1.16 0.33 6.68 -4.36 0.03 -4.40 121.20 122.04 1yun s ILE 106 Ca 0.08 -1.92 -0.14 0.00 -0.26 0.00 0.00 60.65 58.40 1yun s ILE 106 Cb -0.15 -1.70 -0.09 0.00 1.25 0.00 0.00 42.46 41.78 1yun s ILE 106 CO 0.08 -0.65 0.73 -0.83 0.24 0.00 0.00 174.94 174.50 1yun s GLY 107 N -2.91 2.29 0.15 6.27 0.00 -1.26 0.16 107.32 112.01 1yun s GLY 107 Ca 0.13 -0.00 -0.27 0.00 0.00 0.00 0.00 44.72 44.58 1yun s GLY 107 CO 0.01 0.20 1.58 -0.25 0.00 0.00 0.00 173.10 174.64 1yun h TRP 108 N 2.16 -1.17 -0.26 1.90 2.91 -1.64 0.61 115.95 120.46 1yun h TRP 108 Ca -0.48 0.06 0.07 0.00 1.13 0.00 0.00 58.89 59.67 1yun h TRP 108 Cb 1.18 0.56 -0.01 0.00 -0.51 0.00 0.00 29.16 30.37 1yun h TRP 108 CO 0.62 -0.44 0.18 -0.44 -1.03 0.00 0.00 178.44 177.33 1yun h ASP 109 N -0.37 0.03 0.15 2.65 3.32 -1.92 0.26 116.42 120.54 1yun h ASP 109 Ca 0.12 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.91 1yun h ASP 109 Cb 0.59 -0.01 0.03 0.00 0.22 0.00 0.00 39.33 40.16 1yun h ASP 109 CO -0.51 0.02 -1.12 0.00 -1.72 0.00 0.00 179.24 175.91 1yun h ALA 110 N 1.87 -0.07 -0.46 3.45 0.00 -1.19 -3.15 119.26 119.71 1yun h ALA 110 Ca 0.12 -0.75 0.03 0.00 0.00 0.00 0.00 54.91 54.31 1yun h ALA 110 Cb 0.44 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1yun h ALA 110 CO -0.01 0.56 0.31 0.35 0.00 0.00 0.00 179.25 180.46 1yun h PHE 111 N 0.02 0.48 0.00 0.00 3.57 0.10 -1.21 116.94 119.90 1yun h PHE 111 Ca -0.18 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.30 1yun h PHE 111 Cb 1.85 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 40.42 1yun h PHE 111 CO 0.15 0.28 -0.12 0.00 -2.23 0.00 0.00 178.31 176.39 1yun n GLY 113 N -0.47 2.61 0.30 0.00 0.00 -0.46 -4.66 105.19 102.50 1yun n GLY 113 Ca -0.01 -0.83 0.05 0.00 0.00 0.00 0.00 46.02 45.22 1yun n GLY 113 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yun h LEU 114 N 4.28 0.51 -0.61 0.99 5.85 -1.33 -1.78 115.31 123.22 1yun h LEU 114 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1yun h LEU 114 Cb 1.22 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1yun h LEU 114 CO 0.11 0.25 0.10 -2.65 -0.34 0.00 0.00 178.44 175.90 1yun n PRO 115 N -4.86 0.06 0.04 5.25 -0.02 -1.26 0.59 135.00 134.80 1yun n PRO 115 Ca 0.15 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 62.27 1yun n PRO 115 Cb 0.37 -1.80 0.23 0.00 -0.02 0.00 0.00 33.50 32.28 1yun n PRO 115 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1yun n THR 116 N -1.80 0.21 -2.40 3.45 -2.24 -0.67 -4.85 114.28 105.99 1yun n THR 116 Ca -0.01 -0.16 -0.41 0.00 -2.27 0.00 0.00 64.05 61.20 1yun n THR 116 Cb 0.11 -0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.27 1yun n THR 116 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1yun s TRP 117 N -3.10 3.46 -0.36 4.78 0.52 0.20 -4.89 118.94 119.55 1yun s TRP 117 Ca 0.08 1.57 -0.41 0.00 0.02 0.00 0.00 56.10 57.37 1yun s TRP 117 Cb 0.15 -3.38 -0.16 0.00 -1.15 0.00 0.00 33.47 28.93 1yun s TRP 117 CO 0.70 -0.93 1.89 1.58 0.02 0.00 0.00 176.95 180.21 1yun n HIS 118 N 1.60 1.78 -3.18 -1.98 -0.00 -1.26 -2.28 115.22 109.90 1yun n HIS 118 Ca 0.01 0.59 -0.19 0.00 -0.00 0.00 0.00 57.72 58.13 1yun n HIS 118 Cb 0.44 -2.42 0.05 0.00 -0.00 0.00 0.00 29.99 28.06 1yun n HIS 118 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1yun n ARG 119 N 6.19 -5.48 0.29 1.57 1.74 -1.26 -4.57 116.66 115.14 1yun n ARG 119 Ca 0.35 0.71 0.17 0.00 -0.77 0.00 0.00 57.85 58.31 1yun n ARG 119 Cb 0.10 -5.26 0.97 0.00 -1.02 0.00 0.00 32.46 27.25 1yun n ARG 119 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 1yun h TRP 120 N -1.77 0.00 0.00 -1.55 5.08 -1.76 -1.03 115.95 114.92 1yun h TRP 120 Ca -0.45 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.52 1yun h TRP 120 Cb 1.30 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.46 1yun h TRP 120 CO 0.42 0.00 0.00 0.93 -1.28 0.00 0.00 178.44 178.51 1yun h GLU 121 N 0.00 0.00 0.00 0.12 3.07 -1.89 -2.76 114.58 113.12 1yun h GLU 121 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1yun h GLU 121 Cb 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 1yun h GLU 121 CO -0.00 0.00 -1.56 0.00 -1.40 0.00 0.00 179.01 176.05 1yun n ALA 122 N -1.93 3.40 -0.18 3.43 0.00 -0.39 -4.61 120.51 120.23 1yun n ALA 122 Ca -0.01 -0.51 -0.02 0.00 0.00 0.00 0.00 53.44 52.90 1yun n ALA 122 Cb 0.12 -0.70 0.04 0.00 0.00 0.00 0.00 19.45 18.91 1yun n ALA 122 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1yun h LEU 123 N 0.00 -0.61 0.00 0.00 3.38 -1.64 0.24 115.31 116.68 1yun h LEU 123 Ca 0.00 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1yun h LEU 123 Cb 0.75 0.38 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1yun h LEU 123 CO 0.00 -0.21 0.00 0.18 0.09 0.00 0.00 178.44 178.50 1yun n LEU 124 N -5.40 0.00 -0.25 1.67 4.77 -1.26 -1.46 117.00 115.06 1yun n LEU 124 Ca 0.06 0.41 0.06 0.00 -0.03 0.00 0.00 56.01 56.51 1yun n LEU 124 Cb 0.31 -0.41 0.29 0.00 -2.33 0.00 0.00 43.42 41.28 1yun n LEU 124 CO 0.07 -0.26 1.23 0.44 -1.33 0.00 0.00 177.39 177.55 1yun h ASP 125 N 0.00 0.79 0.00 -1.43 3.32 -0.81 -2.48 116.42 115.81 1yun h ASP 125 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1yun h ASP 125 Cb 0.16 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1yun h ASP 125 CO 0.00 0.50 -1.53 1.41 -1.72 0.00 0.00 179.24 177.90 1yun n HIS 126 N -4.49 0.00 -4.03 4.55 8.25 -0.54 -4.78 115.22 114.18 1yun n HIS 126 Ca 0.13 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.47 1yun n HIS 126 Cb 0.23 -0.29 -0.04 0.00 1.12 0.00 0.00 29.99 31.01 1yun n HIS 126 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yun s HIS 128 N -3.31 3.61 -0.24 0.00 0.09 0.37 -1.45 115.29 114.36 1yun s HIS 128 Ca 0.26 0.86 -0.07 0.00 -0.00 0.00 0.00 55.06 56.12 1yun s HIS 128 Cb -0.01 -2.21 -0.03 0.00 -0.00 0.00 0.00 32.58 30.33 1yun s HIS 128 CO 0.15 0.52 0.06 0.42 -0.00 0.00 0.00 174.74 175.89 1yun s ILE 129 N -1.37 4.31 -0.20 0.60 1.01 -0.47 -0.35 121.20 124.73 1yun s ILE 129 Ca 0.33 -0.18 -0.06 0.00 0.00 0.00 0.00 60.65 60.74 1yun s ILE 129 Cb -0.14 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 1yun s ILE 129 CO 0.18 0.36 0.02 -0.69 0.00 0.00 0.00 174.94 174.81 1yun s VAL 130 N 1.43 4.20 -0.24 2.92 1.01 0.36 -2.49 120.40 127.58 1yun s VAL 130 Ca 0.05 -0.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 1yun s VAL 130 Cb -0.15 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 1yun s VAL 130 CO 0.03 0.43 0.05 -0.69 0.00 0.00 0.00 175.10 174.92 1yun s VAL 131 N 0.86 4.17 -0.17 2.92 1.01 -0.96 -0.79 120.40 127.43 1yun s VAL 131 Ca 0.02 -0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 1yun s VAL 131 Cb -0.14 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1yun s VAL 131 CO 0.02 0.36 1.36 -0.22 0.00 0.00 0.00 175.10 176.63 1yun s LEU 132 N 1.53 4.14 0.06 3.92 2.96 0.41 -0.21 118.68 131.48 1yun s LEU 132 Ca 0.06 1.71 -0.05 0.00 -0.22 0.00 0.00 54.13 55.63 1yun s LEU 132 Cb -0.15 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.96 1yun s LEU 132 CO 0.03 -0.87 0.30 -1.10 -1.32 0.00 0.00 176.35 173.38 1yun s GLN 133 N 3.78 3.59 0.02 1.98 -1.52 0.49 -1.66 119.66 126.34 1yun s GLN 133 Ca 0.59 -0.11 -0.27 0.00 -1.95 0.00 0.00 55.36 53.62 1yun s GLN 133 Cb -0.23 -3.00 0.09 0.00 -0.22 0.00 0.00 33.01 29.65 1yun s GLN 133 CO 0.19 0.58 0.78 -0.98 -0.25 0.00 0.00 175.29 175.62 1yun s ARG 134 N -2.14 0.97 0.12 2.91 1.70 -1.26 -2.66 118.95 118.59 1yun s ARG 134 Ca 0.33 -0.21 0.02 0.00 -0.47 0.00 0.00 55.73 55.40 1yun s ARG 134 Cb -0.13 0.45 0.12 0.00 -0.57 0.00 0.00 34.95 34.82 1yun s ARG 134 CO 0.20 -0.40 0.77 -2.30 -1.08 0.00 0.00 175.30 172.50 1yun n PRO 135 N 0.02 0.02 -0.00 3.89 -0.02 -1.26 -2.05 135.00 135.60 1yun n PRO 135 Ca -0.13 0.27 0.04 0.00 -2.02 0.00 0.00 63.50 61.67 1yun n PRO 135 Cb 0.62 -1.99 -0.05 0.00 -0.02 0.00 0.00 33.50 32.05 1yun n PRO 135 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1yun n ASP 136 N -1.41 0.73 -4.09 2.55 8.00 -1.26 -4.85 116.55 116.22 1yun n ASP 136 Ca -0.00 -0.63 -0.35 0.00 0.71 0.00 0.00 54.79 54.52 1yun n ASP 136 Cb 0.43 1.05 -0.12 0.00 -0.02 0.00 0.00 41.12 42.47 1yun n ASP 136 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yun s ALA 137 N -1.97 3.25 -0.39 2.24 0.00 -0.87 -5.04 121.76 118.98 1yun s ALA 137 Ca 0.03 -2.78 -0.38 0.00 0.00 0.00 0.00 51.96 48.82 1yun s ALA 137 Cb 0.07 -2.41 -0.14 0.00 0.00 0.00 0.00 23.12 20.64 1yun s ALA 137 CO 0.38 -1.88 2.13 -0.40 0.00 0.00 0.00 175.76 175.98 1yun n ASP 138 N 4.16 1.73 -3.39 0.00 5.75 -1.26 -4.68 116.55 118.86 1yun n ASP 138 Ca 0.02 0.56 -0.32 0.00 -0.01 0.00 0.00 54.79 55.04 1yun n ASP 138 Cb 0.40 -1.14 -0.06 0.00 -1.03 0.00 0.00 41.12 39.29 1yun n ASP 138 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1yun n SER 139 N 8.66 1.90 -3.96 -1.12 2.88 -1.26 -4.74 113.62 115.99 1yun n SER 139 Ca 0.44 -2.43 -0.30 0.00 -1.33 0.00 0.00 58.87 55.25 1yun n SER 139 Cb 0.14 -0.79 -0.14 0.00 -0.75 0.00 0.00 64.21 62.67 1yun n SER 139 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1yun s GLU 140 N 5.42 1.85 0.31 -1.46 2.02 -1.26 -5.09 118.70 120.49 1yun s GLU 140 Ca 0.47 -2.45 -0.29 0.00 0.02 0.00 0.00 54.97 52.72 1yun s GLU 140 Cb 0.11 -3.27 -0.10 0.00 0.10 0.00 0.00 34.13 30.97 1yun s GLU 140 CO 0.15 -1.08 1.43 -2.14 0.02 0.00 0.00 175.26 173.64 1yun s PRO 141 N -0.03 4.24 0.30 0.39 0.02 -1.26 -4.98 135.00 133.68 1yun s PRO 141 Ca 0.16 2.37 -0.29 0.00 0.02 0.00 0.00 61.00 63.25 1yun s PRO 141 Cb -0.24 -3.06 -0.10 0.00 0.02 0.00 0.00 34.50 31.12 1yun s PRO 141 CO -0.02 -0.40 1.35 -1.25 -0.33 0.00 0.00 177.00 176.36 1yun s PRO 142 N -1.23 4.32 0.54 5.54 0.04 -1.26 -4.89 135.00 138.07 1yun s PRO 142 Ca 0.55 2.24 0.39 0.00 0.04 0.00 0.00 61.00 64.22 1yun s PRO 142 Cb -0.43 -3.09 1.58 0.00 0.04 0.00 0.00 34.50 32.61 1yun s PRO 142 CO 0.51 -0.27 1.76 1.49 0.04 0.00 0.00 177.00 180.54 1yun h GLU 143 N 3.96 0.00 0.00 4.56 4.57 -2.00 0.28 114.58 125.95 1yun h GLU 143 Ca -0.48 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1yun h GLU 143 Cb 1.22 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 1yun h GLU 143 CO 0.70 0.00 0.00 -1.13 -1.18 0.00 0.00 179.01 177.40 1yun n SER 144 N -4.14 0.63 -0.71 1.04 3.41 -1.26 -2.43 113.62 110.16 1yun n SER 144 Ca 0.29 0.73 0.06 0.00 -0.26 0.00 0.00 58.87 59.69 1yun n SER 144 Cb 1.38 -0.83 0.17 0.00 -0.26 0.00 0.00 64.21 64.67 1yun n SER 144 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1yun n LEU 145 N -2.27 3.04 0.07 1.04 4.77 0.98 -4.66 117.00 119.96 1yun n LEU 145 Ca 0.00 -2.02 -0.15 0.00 -0.03 0.00 0.00 56.01 53.81 1yun n LEU 145 Cb 0.12 -0.26 -0.07 0.00 -2.33 0.00 0.00 43.42 40.89 1yun n LEU 145 CO 0.14 0.75 0.13 -0.09 -1.33 0.00 0.00 177.39 177.00 1yun h ARG 146 N 2.22 0.47 -0.10 3.23 2.43 -1.58 -2.40 114.38 118.65 1yun h ARG 146 Ca 0.00 -0.53 -0.15 0.00 -0.81 0.00 0.00 59.98 58.49 1yun h ARG 146 Cb 0.77 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.47 1yun h ARG 146 CO 0.01 1.17 -0.58 0.22 -1.51 0.00 0.00 179.97 179.28 1yun h ASP 147 N 0.25 0.35 -0.05 -3.80 3.58 -1.83 -1.24 116.42 113.69 1yun h ASP 147 Ca -0.10 -0.20 -0.01 0.00 0.42 0.00 0.00 57.03 57.15 1yun h ASP 147 Cb 1.65 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 42.60 1yun h ASP 147 CO 0.18 0.86 0.00 0.25 -2.88 0.00 0.00 179.24 177.65 1yun h LEU 148 N 0.24 0.09 -2.09 2.28 5.85 -1.86 -0.82 115.31 119.00 1yun h LEU 148 Ca -0.00 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.44 1yun h LEU 148 Cb 1.09 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1yun h LEU 148 CO 0.09 0.37 0.07 -0.07 -0.34 0.00 0.00 178.44 178.56 1yun h LEU 149 N -0.19 0.00 -0.18 2.25 3.38 -1.36 -0.22 115.31 118.98 1yun h LEU 149 Ca 0.01 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.76 1yun h LEU 149 Cb 0.32 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.08 1yun h LEU 149 CO 0.00 0.00 -0.77 0.00 0.09 0.00 0.00 178.44 177.76 1yun h ALA 150 N 1.95 0.34 0.00 1.53 0.00 -0.76 -1.73 119.26 120.58 1yun h ALA 150 Ca 0.04 -0.60 -0.08 0.00 0.00 0.00 0.00 54.91 54.27 1yun h ALA 150 Cb 0.18 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1yun h ALA 150 CO -0.00 0.69 -0.55 0.00 0.00 0.00 0.00 179.25 179.39 1yun h ALA 151 N 0.59 0.73 0.00 0.00 0.00 -0.46 -3.41 119.26 116.71 1yun h ALA 151 Ca -0.05 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1yun h ALA 151 Cb 1.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1yun h ALA 151 CO 0.16 0.47 0.00 0.54 0.00 0.00 0.00 179.25 180.42 1yun n ARG 152 N -3.11 -0.12 -3.45 0.00 5.12 -0.16 -5.06 116.66 109.87 1yun n ARG 152 Ca 0.01 -0.33 -0.38 0.00 -1.93 0.00 0.00 57.85 55.22 1yun n ARG 152 Cb 0.69 -0.71 -0.06 0.00 -1.16 0.00 0.00 32.46 31.22 1yun n ARG 152 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1yun s SER 153 N -0.07 6.78 -0.13 0.55 1.04 -0.65 -1.01 113.70 120.21 1yun s SER 153 Ca 0.00 0.92 -0.04 0.00 0.48 0.00 0.00 55.95 57.31 1yun s SER 153 Cb 0.00 -2.26 -0.04 0.00 0.10 0.00 0.00 66.02 63.82 1yun s SER 153 CO 0.00 0.25 0.03 0.68 0.98 0.00 0.00 173.24 175.18 1yun s VAL 154 N -0.66 4.56 0.08 5.02 -7.23 0.12 -4.90 120.40 117.38 1yun s VAL 154 Ca 0.24 -0.14 0.11 0.00 -1.81 0.00 0.00 61.98 60.38 1yun s VAL 154 Cb -0.16 -2.97 -0.06 0.00 0.56 0.00 0.00 36.38 33.74 1yun s VAL 154 CO 0.12 0.55 1.44 0.00 -0.31 0.00 0.00 175.10 176.91 1yun h ALA 155 N 5.74 0.62 -2.45 1.32 0.00 -1.98 -3.39 119.26 119.13 1yun h ALA 155 Ca -0.45 -0.66 -0.69 0.00 0.00 0.00 0.00 54.91 53.11 1yun h ALA 155 Cb 1.19 -0.12 -0.18 0.00 0.00 0.00 0.00 17.79 18.68 1yun h ALA 155 CO 0.60 0.90 -0.25 0.34 0.00 0.00 0.00 179.25 180.85 1yun s ASP 156 N -6.63 6.18 0.47 0.00 3.68 -1.26 -4.70 116.67 114.41 1yun s ASP 156 Ca 0.01 -0.56 0.19 0.00 2.13 0.00 0.00 52.55 54.32 1yun s ASP 156 Cb 0.10 -2.21 1.18 0.00 -1.45 0.00 0.00 42.92 40.54 1yun s ASP 156 CO 0.77 -0.50 1.97 1.55 0.13 0.00 0.00 175.17 179.09 1yun h PRO 157 N 8.64 0.24 0.00 4.34 0.13 -1.86 0.96 132.00 144.45 1yun h PRO 157 Ca -0.27 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1yun h PRO 157 Cb 1.12 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 1yun h PRO 157 CO 0.76 0.16 -0.02 1.96 -0.23 0.00 0.00 178.00 180.63 1yun h GLN 158 N 0.25 0.00 -0.09 0.86 7.50 -1.96 -2.01 115.11 119.66 1yun h GLN 158 Ca 0.30 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.45 1yun h GLN 158 Cb 0.82 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.35 1yun h GLN 158 CO -0.06 0.02 0.00 0.00 -1.50 0.00 0.00 178.83 177.28 1yun n ALA 159 N -2.13 2.55 -1.77 3.87 0.00 0.33 -4.88 120.51 118.50 1yun n ALA 159 Ca -0.02 -0.47 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 1yun n ALA 159 Cb 0.15 -1.14 -0.02 0.00 0.00 0.00 0.00 19.45 18.45 1yun n ALA 159 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yun s LEU 160 N -1.78 4.35 0.01 0.00 1.43 -0.76 -4.97 118.68 116.96 1yun s LEU 160 Ca 0.35 2.94 0.01 0.00 -1.03 0.00 0.00 54.13 56.40 1yun s LEU 160 Cb 0.19 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.77 1yun s LEU 160 CO 0.30 -0.91 -0.05 -0.75 0.23 0.00 0.00 176.35 175.17 1yun s LYS 161 N -0.38 0.35 0.57 1.70 2.20 -1.26 -5.08 119.74 117.84 1yun s LYS 161 Ca 0.64 -0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.93 1yun s LYS 161 Cb -0.48 -0.25 0.00 0.00 -1.51 0.00 0.00 37.83 35.59 1yun s LYS 161 CO 0.47 0.06 0.00 0.41 -0.36 0.00 0.00 175.35 175.93 1yun n GLY 162 N 2.52 -2.16 0.06 5.54 0.00 -1.26 -4.34 105.19 105.56 1yun n GLY 162 Ca -0.16 -1.47 0.13 0.00 0.00 0.00 0.00 46.02 44.52 1yun n GLY 162 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yun n PRO 163 N -0.51 0.21 -3.86 1.61 -0.04 -1.26 -4.65 135.00 126.50 1yun n PRO 163 Ca 0.00 0.11 0.04 0.00 -0.04 0.00 0.00 63.50 63.61 1yun n PRO 163 Cb 0.01 -1.68 0.01 0.00 -0.04 0.00 0.00 33.50 31.79 1yun n PRO 163 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yun n GLY 164 N 1.37 0.13 0.00 0.55 0.00 -1.26 -0.96 105.19 105.02 1yun n GLY 164 Ca 0.05 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1yun n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yun n GLY 165 N -0.90 1.80 3.58 -0.02 0.00 -0.53 -4.85 105.19 104.27 1yun n GLY 165 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 1yun n GLY 165 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yun s GLN 166 N -0.06 1.88 -0.12 1.61 1.11 -1.26 -4.85 119.66 117.96 1yun s GLN 166 Ca 0.00 -2.04 0.03 0.00 0.01 0.00 0.00 55.36 53.36 1yun s GLN 166 Cb 0.00 -1.55 0.01 0.00 -1.01 0.00 0.00 33.01 30.45 1yun s GLN 166 CO 0.00 -0.02 -0.22 0.42 0.01 0.00 0.00 175.29 175.49 1yun s ILE 167 N -2.76 1.97 0.36 1.08 1.01 -0.18 -1.37 121.20 121.32 1yun s ILE 167 Ca 0.34 -0.94 0.04 0.00 0.00 0.00 0.00 60.65 60.09 1yun s ILE 167 Cb 0.08 -1.73 -0.05 0.00 0.01 0.00 0.00 42.46 40.77 1yun s ILE 167 CO 0.17 0.54 0.07 0.28 0.00 0.00 0.00 174.94 176.00 1yun s THR 168 N 0.66 1.07 0.05 2.92 -1.32 -1.04 0.11 115.64 118.09 1yun s THR 168 Ca -0.11 -2.00 0.08 0.00 -1.21 0.00 0.00 61.69 58.45 1yun s THR 168 Cb -0.16 -2.64 -0.03 0.00 -1.51 0.00 0.00 72.50 68.15 1yun s THR 168 CO 0.02 0.00 -0.22 -0.36 -2.21 0.00 0.00 174.62 171.85 1yun s PHE 169 N -3.22 2.44 0.09 9.09 0.40 -1.26 -2.27 117.98 123.24 1yun s PHE 169 Ca 0.31 -0.33 0.06 0.00 -0.60 0.00 0.00 56.93 56.36 1yun s PHE 169 Cb 0.07 -1.42 -0.03 0.00 0.51 0.00 0.00 43.02 42.15 1yun s PHE 169 CO 0.14 0.21 -0.15 0.14 0.70 0.00 0.00 175.22 176.26 1yun s VAL 170 N -0.89 1.23 -0.17 -0.44 -7.23 0.70 -4.78 120.40 108.82 1yun s VAL 170 Ca 0.13 -1.46 -0.07 0.00 -1.81 0.00 0.00 61.98 58.77 1yun s VAL 170 Cb -0.10 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.53 1yun s VAL 170 CO 0.04 -0.28 0.05 0.86 -0.31 0.00 0.00 175.10 175.46 1yun s TRP 171 N -1.56 3.23 0.04 2.82 -0.11 -1.26 0.18 118.94 122.27 1yun s TRP 171 Ca 0.02 0.04 -0.04 0.00 1.22 0.00 0.00 56.10 57.35 1yun s TRP 171 Cb -0.08 -2.05 -0.02 0.00 -1.50 0.00 0.00 33.47 29.82 1yun s TRP 171 CO 0.03 0.16 0.05 -0.65 -4.62 0.00 0.00 176.95 171.91 1yun s GLN 172 N 0.28 0.53 -0.71 5.86 -0.21 -1.09 -4.95 119.66 119.37 1yun s GLN 172 Ca 0.03 -0.80 -0.03 0.00 0.02 0.00 0.00 55.36 54.58 1yun s GLN 172 Cb -0.13 0.20 0.18 0.00 1.00 0.00 0.00 33.01 34.27 1yun s GLN 172 CO 0.01 -0.12 0.54 0.95 -2.12 0.00 0.00 175.29 174.55 1yun s THR 173 N -2.57 3.94 0.33 -0.19 -4.23 -1.26 -4.53 115.64 107.14 1yun s THR 173 Ca -0.05 -3.21 -0.29 0.00 -1.18 0.00 0.00 61.69 56.96 1yun s THR 173 Cb -0.02 -3.53 -0.10 0.00 1.34 0.00 0.00 72.50 70.20 1yun s THR 173 CO -0.05 -0.94 1.29 -2.84 -0.54 0.00 0.00 174.62 171.54 1yun s PRO 174 N -0.43 4.35 0.58 3.99 0.02 -1.26 -4.94 135.00 137.31 1yun s PRO 174 Ca 0.20 2.18 -0.19 0.00 0.02 0.00 0.00 61.00 63.20 1yun s PRO 174 Cb -0.16 -3.05 -0.06 0.00 0.02 0.00 0.00 34.50 31.25 1yun s PRO 174 CO -0.06 -0.18 0.93 1.28 -0.33 0.00 0.00 177.00 178.64 1yun n LEU 175 N 0.77 3.30 -3.46 -5.54 4.77 -1.26 -4.80 117.00 110.78 1yun n LEU 175 Ca 0.00 0.83 -0.39 0.00 -0.03 0.00 0.00 56.01 56.42 1yun n LEU 175 Cb 0.42 -1.37 -0.02 0.00 -2.33 0.00 0.00 43.42 40.13 1yun n LEU 175 CO 0.58 -1.92 2.98 0.00 -1.33 0.00 0.00 177.39 177.71 1yun n ALA 176 N -1.58 6.34 -3.02 -1.18 0.00 -1.26 -4.82 120.51 115.00 1yun n ALA 176 Ca 0.13 -3.50 -0.29 0.00 0.00 0.00 0.00 53.44 49.78 1yun n ALA 176 Cb 0.46 -3.42 -0.17 0.00 0.00 0.00 0.00 19.45 16.33 1yun n ALA 176 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yun s VAL 177 N 2.82 1.78 -0.01 0.00 1.01 -1.26 -5.12 120.40 119.62 1yun s VAL 177 Ca 0.58 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.72 1yun s VAL 177 Cb 0.16 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 1yun s VAL 177 CO -0.06 0.50 -0.13 -0.55 0.00 0.00 0.00 175.10 174.86 1yun s SER 178 N 0.15 1.59 0.34 3.32 0.15 -1.26 -4.75 113.70 113.24 1yun s SER 178 Ca -0.10 -0.25 0.14 0.00 0.70 0.00 0.00 55.95 56.44 1yun s SER 178 Cb -0.15 -0.22 0.61 0.00 -1.71 0.00 0.00 66.02 64.56 1yun s SER 178 CO 0.05 0.16 1.74 0.00 1.20 0.00 0.00 173.24 176.39 1yun h ALA 179 N 5.89 1.15 -0.22 5.45 0.00 -1.89 -1.89 119.26 127.76 1yun h ALA 179 Ca -0.34 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.14 1yun h ALA 179 Cb 1.16 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1yun h ALA 179 CO 0.49 0.56 0.04 1.15 0.00 0.00 0.00 179.25 181.50 1yun h THR 180 N 0.00 1.22 -0.91 0.00 2.02 -1.96 -1.34 112.91 111.94 1yun h THR 180 Ca -0.00 -0.72 0.10 0.00 0.77 0.00 0.00 66.41 66.55 1yun h THR 180 Cb 0.85 1.28 -0.08 0.00 -1.74 0.00 0.00 68.15 68.46 1yun h THR 180 CO 0.06 0.23 0.55 -0.61 0.37 0.00 0.00 175.52 176.11 1yun h GLN 181 N 0.17 0.88 -0.20 6.66 4.15 -1.95 -2.48 115.11 122.34 1yun h GLN 181 Ca 0.07 -0.05 -0.13 0.00 0.77 0.00 0.00 58.65 59.31 1yun h GLN 181 Cb 0.30 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1yun h GLN 181 CO 0.00 0.58 -0.42 0.82 -1.93 0.00 0.00 178.83 177.88 1yun h ILE 182 N 0.90 1.31 -0.46 2.39 5.03 -0.62 -1.54 117.51 124.51 1yun h ILE 182 Ca 0.44 -1.58 -0.09 0.00 -0.12 0.00 0.00 64.86 63.50 1yun h ILE 182 Cb 0.39 1.61 -0.02 0.00 -3.03 0.00 0.00 36.82 35.78 1yun h ILE 182 CO -0.25 0.49 -0.07 0.03 -0.68 0.00 0.00 178.15 177.67 1yun h ARG 183 N 0.38 0.86 -0.51 2.37 3.08 -0.84 -0.77 114.38 118.96 1yun h ARG 183 Ca 0.03 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 59.73 1yun h ARG 183 Cb 0.90 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.87 1yun h ARG 183 CO 0.08 0.95 0.14 0.00 -1.07 0.00 0.00 179.97 180.06 1yun h ALA 184 N 0.89 0.67 -0.66 0.04 0.00 -1.23 0.71 119.26 119.68 1yun h ALA 184 Ca 0.12 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1yun h ALA 184 Cb 0.60 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1yun h ALA 184 CO 0.04 0.34 0.40 -0.07 0.00 0.00 0.00 179.25 179.96 1yun h LEU 185 N 0.70 0.65 -0.30 0.00 3.38 -1.05 0.19 115.31 118.88 1yun h LEU 185 Ca 0.16 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1yun h LEU 185 Cb 0.30 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1yun h LEU 185 CO -0.00 0.45 -0.02 -0.07 0.09 0.00 0.00 178.44 178.89 1yun h LEU 186 N 0.78 0.54 -1.00 1.67 3.38 -0.39 0.30 115.31 120.60 1yun h LEU 186 Ca 0.27 -0.32 0.11 0.00 0.09 0.00 0.00 57.88 58.02 1yun h LEU 186 Cb 0.04 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.57 1yun h LEU 186 CO -0.12 0.73 0.63 1.23 0.09 0.00 0.00 178.44 181.01 1yun h GLY 187 N 0.34 1.61 1.05 0.83 0.00 0.93 -0.27 103.07 107.56 1yun h GLY 187 Ca 0.08 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1yun h GLY 187 CO 0.02 0.20 0.00 0.00 0.00 0.00 0.00 176.54 176.76 1yun n ALA 188 N -2.35 2.41 -1.07 3.60 0.00 0.63 -4.89 120.51 118.85 1yun n ALA 188 Ca 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 53.44 53.44 1yun n ALA 188 Cb 0.31 -1.41 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 1yun n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yun n GLY 189 N 0.58 0.57 4.00 0.00 0.00 -0.11 -5.03 105.19 105.20 1yun n GLY 189 Ca 0.18 -0.94 -0.20 0.00 0.00 0.00 0.00 46.02 45.06 1yun n GLY 189 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yun s ARG 190 N -2.14 2.34 -0.25 1.61 1.81 0.97 -4.99 118.95 118.30 1yun s ARG 190 Ca 0.00 -1.19 -0.21 0.00 -1.72 0.00 0.00 55.73 52.61 1yun s ARG 190 Cb 0.00 -2.56 -0.02 0.00 -0.45 0.00 0.00 34.95 31.93 1yun s ARG 190 CO 0.00 -0.82 0.64 0.45 -0.68 0.00 0.00 175.30 174.89 1yun s SER 191 N -4.54 6.59 -0.27 0.23 0.15 -1.26 -4.42 113.70 110.18 1yun s SER 191 Ca 0.60 0.73 0.13 0.00 0.70 0.00 0.00 55.95 58.10 1yun s SER 191 Cb -0.08 -2.34 0.81 0.00 -1.71 0.00 0.00 66.02 62.70 1yun s SER 191 CO 0.39 -0.38 1.78 1.33 1.20 0.00 0.00 173.24 177.56 1yun n VAL 192 N 5.19 2.84 -1.71 4.45 0.24 -1.26 -4.97 118.33 123.10 1yun n VAL 192 Ca -0.00 -1.48 -0.42 0.00 -2.04 0.00 0.00 64.34 60.40 1yun n VAL 192 Cb 0.49 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.56 1yun n VAL 192 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1yun n ARG 193 N 0.39 2.14 -0.36 7.34 0.63 -1.26 -0.81 116.66 124.73 1yun n ARG 193 Ca 0.32 0.75 0.00 0.00 -0.92 0.00 0.00 57.85 58.00 1yun n ARG 193 Cb 1.27 -2.42 0.00 0.00 0.45 0.00 0.00 32.46 31.76 1yun n ARG 193 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1yun n PHE 194 N 0.10 0.00 0.84 -0.14 3.01 -1.26 -4.72 117.46 115.29 1yun n PHE 194 Ca 0.05 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.62 1yun n PHE 194 Cb 0.38 -0.70 0.02 0.00 -0.01 0.00 0.00 39.48 39.17 1yun n PHE 194 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1yun n LEU 195 N 0.00 0.71 -4.18 4.37 4.77 0.01 -4.92 117.00 117.76 1yun n LEU 195 Ca 0.00 -0.21 -0.14 0.00 -0.03 0.00 0.00 56.01 55.62 1yun n LEU 195 Cb 0.00 -0.09 -0.11 0.00 -2.33 0.00 0.00 43.42 40.89 1yun n LEU 195 CO 0.00 0.15 -0.42 0.68 -1.33 0.00 0.00 177.39 176.47 1yun s VAL 196 N -3.08 0.95 0.57 4.08 -7.23 -1.20 -2.24 120.40 112.26 1yun s VAL 196 Ca 0.07 -1.64 -0.18 0.00 -1.81 0.00 0.00 61.98 58.42 1yun s VAL 196 Cb 0.16 -1.36 -0.08 0.00 0.56 0.00 0.00 36.38 35.66 1yun s VAL 196 CO 0.81 -0.55 0.57 -2.65 -0.31 0.00 0.00 175.10 172.97 1yun n PRO 197 N 0.57 0.55 -0.24 4.82 -0.02 -1.26 -4.61 135.00 134.81 1yun n PRO 197 Ca -0.16 0.21 -0.05 0.00 -2.02 0.00 0.00 63.50 61.48 1yun n PRO 197 Cb 0.58 -1.75 0.11 0.00 -0.02 0.00 0.00 33.50 32.41 1yun n PRO 197 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1yun h ASP 198 N 0.25 1.00 0.27 2.55 3.32 -1.98 0.13 116.42 121.95 1yun h ASP 198 Ca -0.46 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 56.34 1yun h ASP 198 Cb 1.40 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 1yun h ASP 198 CO 0.47 0.92 -0.34 0.00 -1.72 0.00 0.00 179.24 178.57 1yun h ALA 199 N 1.22 1.33 -0.12 3.45 0.00 -1.90 -1.17 119.26 122.06 1yun h ALA 199 Ca 0.23 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1yun h ALA 199 Cb 0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1yun h ALA 199 CO -0.01 0.48 -0.02 0.28 0.00 0.00 0.00 179.25 179.98 1yun h VAL 200 N 0.10 1.28 -0.20 0.00 2.07 -1.50 -2.36 116.25 115.65 1yun h VAL 200 Ca 0.01 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.62 1yun h VAL 200 Cb 0.65 1.66 -0.04 0.00 -1.52 0.00 0.00 31.29 32.04 1yun h VAL 200 CO 0.05 0.27 -0.32 0.25 0.02 0.00 0.00 177.57 177.84 1yun h LEU 201 N -0.07 -1.06 -1.38 2.57 7.12 -0.46 -0.24 115.31 121.79 1yun h LEU 201 Ca 0.03 0.14 0.34 0.00 0.13 0.00 0.00 57.88 58.52 1yun h LEU 201 Cb 0.43 0.43 -0.11 0.00 -0.53 0.00 0.00 40.66 40.88 1yun h LEU 201 CO 0.01 -0.24 0.74 0.78 -0.13 0.00 0.00 178.44 179.60 1yun h ASN 202 N -0.26 0.35 -0.16 1.25 2.35 -1.28 -0.05 115.58 117.78 1yun h ASN 202 Ca 0.04 0.11 -0.16 0.00 -0.55 0.00 0.00 56.30 55.74 1yun h ASN 202 Cb 0.36 0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.80 1yun h ASN 202 CO -0.32 -0.04 -0.52 0.22 -1.65 0.00 0.00 177.43 175.11 1yun h TYR 203 N 0.25 0.83 -0.21 1.19 5.03 -0.54 -1.35 116.97 122.17 1yun h TYR 203 Ca 0.69 -0.34 -0.01 0.00 2.58 0.00 0.00 58.73 61.66 1yun h TYR 203 Cb 1.98 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 40.11 1yun h TYR 203 CO -0.00 1.13 0.11 0.82 -1.32 0.00 0.00 178.16 178.89 1yun h ILE 204 N 0.30 1.13 0.45 1.81 2.04 0.50 -0.83 117.51 122.90 1yun h ILE 204 Ca -0.02 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 1yun h ILE 204 Cb 1.15 0.97 -0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1yun h ILE 204 CO 0.11 0.12 -0.26 -0.33 0.00 0.00 0.00 178.15 177.80 1yun h GLU 205 N 0.22 -0.65 0.00 2.37 5.08 -1.23 0.95 114.58 121.33 1yun h GLU 205 Ca 0.07 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1yun h GLU 205 Cb 0.10 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 1yun h GLU 205 CO -0.01 -0.43 -0.03 0.00 -1.00 0.00 0.00 179.01 177.53 1yun h ALA 206 N -0.15 1.86 -0.26 3.43 0.00 -1.12 -2.37 119.26 120.64 1yun h ALA 206 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1yun h ALA 206 Cb 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1yun h ALA 206 CO 0.07 0.04 0.00 0.72 0.00 0.00 0.00 179.25 180.08 1yun n HIS 207 N -4.38 0.34 -3.78 0.00 8.25 -0.33 -4.98 115.22 110.35 1yun n HIS 207 Ca -0.03 -0.32 -0.29 0.00 -0.26 0.00 0.00 57.72 56.82 1yun n HIS 207 Cb 0.12 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.24 1yun n HIS 207 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1yun n HIS 208 N 0.69 -1.81 -3.59 4.41 -0.00 0.26 -4.95 115.22 110.22 1yun n HIS 208 Ca 0.11 0.57 -0.26 0.00 -0.00 0.00 0.00 57.72 58.14 1yun n HIS 208 Cb 0.41 -3.60 -0.03 0.00 -0.00 0.00 0.00 29.99 26.77 1yun n HIS 208 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1yun s LEU 209 N -6.67 4.16 -1.74 2.41 1.43 -0.76 -4.05 118.68 113.46 1yun s LEU 209 Ca 0.28 0.44 0.00 0.00 -1.03 0.00 0.00 54.13 53.82 1yun s LEU 209 Cb -0.10 -3.24 0.00 0.00 0.03 0.00 0.00 46.19 42.88 1yun s LEU 209 CO 0.87 -0.12 0.00 -1.22 0.23 0.00 0.00 176.35 176.11 1yun n TYR 210 N -0.99 -0.36 -0.63 0.29 4.02 -1.26 -4.90 117.16 113.33 1yun n TYR 210 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 1yun n TYR 210 Cb 0.54 -3.26 0.00 0.00 -0.02 0.00 0.00 39.34 36.60 1yun n TYR 210 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74