#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 2.63 -0.29 1.61 1.02 -1.26 -4.90 119.74 118.55 1yun s LYS 3 Ca 0.00 -1.08 -0.02 0.00 0.02 0.00 0.00 55.97 54.89 1yun s LYS 3 Cb 0.00 -2.62 0.04 0.00 -0.52 0.00 0.00 37.83 34.73 1yun s LYS 3 CO 0.00 -0.54 -0.01 1.03 -0.92 0.00 0.00 175.35 174.91 1yun s ARG 4 N -4.57 2.58 -0.19 1.68 0.52 -1.26 -1.49 118.95 116.21 1yun s ARG 4 Ca 0.57 -1.16 -0.01 0.00 -0.52 0.00 0.00 55.73 54.60 1yun s ARG 4 Cb -0.10 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.23 1yun s ARG 4 CO 0.36 -0.55 -0.13 0.42 0.02 0.00 0.00 175.30 175.42 1yun s ILE 5 N 1.29 2.70 0.25 1.52 1.01 0.61 0.13 121.20 128.72 1yun s ILE 5 Ca -0.03 -0.73 -0.13 0.00 0.00 0.00 0.00 60.65 59.76 1yun s ILE 5 Cb -0.19 -2.18 -0.08 0.00 0.01 0.00 0.00 42.46 40.02 1yun s ILE 5 CO -0.02 0.49 0.63 -0.83 0.00 0.00 0.00 174.94 175.21 1yun s GLY 6 N 1.29 2.34 -0.16 6.18 0.00 0.15 -1.10 107.32 116.03 1yun s GLY 6 Ca 0.04 -0.11 0.01 0.00 0.00 0.00 0.00 44.72 44.66 1yun s GLY 6 CO -0.07 0.08 -0.20 1.08 0.00 0.00 0.00 173.10 173.99 1yun s LEU 7 N -2.73 2.20 -0.43 0.66 1.43 -0.15 -0.89 118.68 118.77 1yun s LEU 7 Ca 0.49 -0.59 0.03 0.00 -1.03 0.00 0.00 54.13 53.03 1yun s LEU 7 Cb -0.12 -1.48 0.12 0.00 0.03 0.00 0.00 46.19 44.74 1yun s LEU 7 CO 0.19 0.05 0.19 0.12 0.23 0.00 0.00 176.35 177.14 1yun s PHE 8 N 0.98 2.81 0.60 0.29 5.36 0.84 -1.56 117.98 127.30 1yun s PHE 8 Ca -0.03 -2.77 -0.15 0.00 -0.96 0.00 0.00 56.93 53.03 1yun s PHE 8 Cb -0.15 -2.46 -0.03 0.00 -0.34 0.00 0.00 43.02 40.04 1yun s PHE 8 CO -0.05 -0.81 1.04 0.20 -1.46 0.00 0.00 175.22 174.14 1yun s GLY 9 N 0.36 1.99 0.00 13.12 0.00 -1.26 0.12 107.32 121.65 1yun s GLY 9 Ca 0.15 0.26 0.00 0.00 0.00 0.00 0.00 44.72 45.13 1yun s GLY 9 CO -0.04 0.57 0.00 0.61 0.00 0.00 0.00 173.10 174.23 1yun n GLY 10 N -1.40 1.09 0.09 0.20 0.00 -0.69 -4.79 105.19 99.68 1yun n GLY 10 Ca 0.08 -1.08 -0.11 0.00 0.00 0.00 0.00 46.02 44.91 1yun n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yun h THR 11 N 1.37 1.03 -6.17 2.61 1.03 -1.88 1.53 112.91 112.42 1yun h THR 11 Ca 0.00 -2.82 -0.28 0.00 -0.01 0.00 0.00 66.41 63.30 1yun h THR 11 Cb 0.00 2.56 0.00 0.00 -1.07 0.00 0.00 68.15 69.64 1yun h THR 11 CO 0.00 0.66 -0.68 0.49 -0.01 0.00 0.00 175.52 175.99 1yun n PHE 12 N -3.20 -2.49 -3.15 0.00 0.99 -1.26 -4.57 117.46 103.77 1yun n PHE 12 Ca -0.15 0.99 -0.24 0.00 -0.00 0.00 0.00 57.45 58.05 1yun n PHE 12 Cb 1.03 -3.26 -0.05 0.00 -1.00 0.00 0.00 39.48 36.20 1yun n PHE 12 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1yun n ASP 13 N -2.06 2.58 -4.98 4.37 2.03 -1.26 -2.91 116.55 114.33 1yun n ASP 13 Ca -0.17 -3.28 -0.19 0.00 0.52 0.00 0.00 54.79 51.67 1yun n ASP 13 Cb 0.61 -0.61 -0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 -2.58 3.02 0.19 -0.67 0.04 -1.26 -4.69 135.00 129.05 1yun s PRO 14 Ca 0.42 -1.09 -0.33 0.00 0.04 0.00 0.00 61.00 60.05 1yun s PRO 14 Cb 0.25 -2.78 -0.15 0.00 0.04 0.00 0.00 34.50 31.87 1yun s PRO 14 CO -0.09 -0.01 1.36 1.55 0.04 0.00 0.00 177.00 179.85 1yun n VAL 15 N -1.67 0.65 -4.46 -0.36 3.14 -1.14 -4.66 118.33 109.83 1yun n VAL 15 Ca 0.02 -0.16 -0.24 0.00 -2.96 0.00 0.00 64.34 60.99 1yun n VAL 15 Cb 0.58 -1.22 -0.07 0.00 -1.06 0.00 0.00 33.84 32.07 1yun n VAL 15 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1yun n HIS 16 N 2.12 -0.07 0.21 1.45 1.44 -1.26 -4.74 115.22 114.37 1yun n HIS 16 Ca 0.14 -2.71 0.10 0.00 -2.01 0.00 0.00 57.72 53.24 1yun n HIS 16 Cb 0.27 0.06 0.64 0.00 0.12 0.00 0.00 29.99 31.08 1yun n HIS 16 CO 0.00 0.00 0.00 0.82 -2.81 0.00 0.00 176.34 174.35 1yun h ILE 17 N 1.78 0.97 -0.33 0.61 5.03 -0.98 -0.95 117.51 123.63 1yun h ILE 17 Ca -0.31 -0.01 -0.15 0.00 -0.12 0.00 0.00 64.86 64.27 1yun h ILE 17 Cb 1.23 0.94 -0.00 0.00 -3.03 0.00 0.00 36.82 35.96 1yun h ILE 17 CO 0.48 0.00 -0.39 1.23 -0.68 0.00 0.00 178.15 178.79 1yun h GLY 18 N 0.02 0.92 0.98 5.37 0.00 -1.86 -2.09 103.07 106.42 1yun h GLY 18 Ca 0.04 -0.98 -0.00 0.00 0.00 0.00 0.00 47.33 46.39 1yun h GLY 18 CO -0.00 0.88 0.20 0.45 0.00 0.00 0.00 176.54 178.07 1yun h HIS 19 N 0.63 0.45 -0.31 5.60 3.86 -1.57 -2.99 115.15 120.82 1yun h HIS 19 Ca 0.04 -0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.10 1yun h HIS 19 Cb 0.98 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 29.30 1yun h HIS 19 CO 0.07 0.34 -0.40 0.52 0.86 0.00 0.00 177.93 179.32 1yun h MET 20 N 0.44 0.82 -0.78 2.45 2.07 -1.34 -1.72 114.93 116.88 1yun h MET 20 Ca 0.12 -0.47 0.02 0.00 -2.07 0.00 0.00 59.70 57.30 1yun h MET 20 Cb 0.02 0.03 -0.04 0.00 -1.87 0.00 0.00 31.60 29.74 1yun h MET 20 CO -0.02 1.10 0.51 -0.09 1.07 0.00 0.00 176.91 179.48 1yun h ARG 21 N 0.60 0.98 -0.67 1.72 9.65 -1.41 0.24 114.38 125.50 1yun h ARG 21 Ca 0.04 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 58.82 1yun h ARG 21 Cb 0.99 -0.22 -0.03 0.00 -1.39 0.00 0.00 29.97 29.32 1yun h ARG 21 CO 0.09 0.65 0.26 1.03 2.80 0.00 0.00 179.97 184.81 1yun h SER 22 N 1.01 0.90 -0.45 -3.80 0.87 -1.36 0.26 113.55 110.98 1yun h SER 22 Ca 0.30 -0.13 -0.10 0.00 -1.23 0.00 0.00 61.79 60.63 1yun h SER 22 Cb -0.06 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.65 1yun h SER 22 CO -0.08 0.81 -0.09 0.00 -0.53 0.00 0.00 176.83 176.93 1yun h ALA 23 N 1.32 0.62 -0.14 6.23 0.00 -0.52 -1.03 119.26 125.74 1yun h ALA 23 Ca 0.23 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1yun h ALA 23 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1yun h ALA 23 CO -0.02 0.50 -0.41 0.28 0.00 0.00 0.00 179.25 179.60 1yun h VAL 24 N 0.70 1.31 -0.00 0.00 2.07 -0.48 -0.67 116.25 119.19 1yun h VAL 24 Ca 0.12 -1.55 -0.21 0.00 0.82 0.00 0.00 66.70 65.88 1yun h VAL 24 Cb 0.63 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1yun h VAL 24 CO 0.04 0.47 -0.91 -0.33 0.02 0.00 0.00 177.57 176.86 1yun h GLU 25 N 0.26 0.32 -0.12 1.57 5.08 -0.82 -1.62 114.58 119.24 1yun h GLU 25 Ca 0.02 -0.34 -0.16 0.00 -1.00 0.00 0.00 59.36 57.89 1yun h GLU 25 Cb 0.84 0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.20 1yun h GLU 25 CO 0.07 1.03 -0.53 1.98 -1.00 0.00 0.00 179.01 180.56 1yun h MET 26 N 0.18 0.58 -0.43 2.33 4.05 -1.13 0.13 114.93 120.64 1yun h MET 26 Ca -0.06 -0.46 0.03 0.00 -0.28 0.00 0.00 59.70 58.93 1yun h MET 26 Cb 1.54 0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 32.41 1yun h MET 26 CO 0.15 1.08 0.28 0.00 0.23 0.00 0.00 176.91 178.66 1yun h ALA 27 N 0.50 1.83 0.04 0.39 0.00 -1.10 -1.18 119.26 119.74 1yun h ALA 27 Ca -0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1yun h ALA 27 Cb 1.17 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1yun h ALA 27 CO 0.11 0.12 -0.02 0.93 0.00 0.00 0.00 179.25 180.39 1yun h GLU 28 N 0.46 -0.05 -0.64 0.00 5.08 -1.18 0.80 114.58 119.05 1yun h GLU 28 Ca 0.17 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.67 1yun h GLU 28 Cb 0.12 0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.27 1yun h GLU 28 CO -0.04 0.61 -0.00 0.37 -1.00 0.00 0.00 179.01 178.95 1yun h GLN 29 N -0.91 0.11 -0.46 2.33 4.15 -0.54 0.58 115.11 120.38 1yun h GLN 29 Ca -0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1yun h GLN 29 Cb 0.68 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.34 1yun h GLN 29 CO 0.01 0.07 0.00 1.19 -1.93 0.00 0.00 178.83 178.17 1yun n PHE 30 N -5.29 0.61 -3.95 3.99 3.01 -0.46 -4.95 117.46 110.41 1yun n PHE 30 Ca 0.10 -0.30 -0.28 0.00 1.01 0.00 0.00 57.45 57.97 1yun n PHE 30 Cb 0.37 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.84 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 0.96 -1.69 -1.64 4.37 0.00 0.20 -4.90 120.51 117.81 1yun n ALA 31 Ca 0.17 -0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.18 1yun n ALA 31 Cb 0.44 -2.68 0.03 0.00 0.00 0.00 0.00 19.45 17.23 1yun n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yun s LEU 32 N -7.05 3.56 0.04 0.00 1.43 0.24 -4.90 118.68 112.01 1yun s LEU 32 Ca 0.31 2.10 -0.13 0.00 -1.03 0.00 0.00 54.13 55.37 1yun s LEU 32 Cb -0.16 -4.57 -0.34 0.00 0.03 0.00 0.00 46.19 41.15 1yun s LEU 32 CO 0.87 -1.45 1.02 0.44 0.23 0.00 0.00 176.35 177.46 1yun h ASP 33 N 0.58 0.76 -3.93 2.29 3.32 -0.65 -3.47 116.42 115.32 1yun h ASP 33 Ca -0.48 -0.82 -0.17 0.00 0.02 0.00 0.00 57.03 55.58 1yun h ASP 33 Cb 1.26 -0.25 -0.25 0.00 0.22 0.00 0.00 39.33 40.30 1yun h ASP 33 CO 0.55 1.64 -0.47 -0.70 -1.72 0.00 0.00 179.24 178.54 1yun s GLU 34 N -2.61 0.27 -0.18 3.56 2.12 -1.09 -4.70 118.70 116.07 1yun s GLU 34 Ca -0.08 0.22 0.01 0.00 0.36 0.00 0.00 54.97 55.48 1yun s GLU 34 Cb 0.05 0.13 0.02 0.00 0.26 0.00 0.00 34.13 34.59 1yun s GLU 34 CO 0.93 -0.04 -0.17 -1.17 -0.54 0.00 0.00 175.26 174.27 1yun s LEU 35 N -0.05 2.08 -0.29 2.70 0.20 0.12 0.31 118.68 123.75 1yun s LEU 35 Ca -0.02 -0.66 -0.13 0.00 0.69 0.00 0.00 54.13 54.02 1yun s LEU 35 Cb -0.02 -1.38 -0.04 0.00 -0.43 0.00 0.00 46.19 44.33 1yun s LEU 35 CO 0.00 -0.04 0.29 -0.13 -0.29 0.00 0.00 176.35 176.19 1yun s ARG 36 N 1.35 3.89 0.23 1.98 0.52 -0.07 -0.28 118.95 126.57 1yun s ARG 36 Ca 0.04 -0.20 -0.30 0.00 -0.52 0.00 0.00 55.73 54.75 1yun s ARG 36 Cb -0.14 -3.69 -0.09 0.00 0.52 0.00 0.00 34.95 31.56 1yun s ARG 36 CO -0.12 -0.29 1.09 -0.51 0.02 0.00 0.00 175.30 175.50 1yun s LEU 37 N 1.93 4.53 -0.48 2.53 1.02 0.31 -0.11 118.68 128.40 1yun s LEU 37 Ca 0.11 2.18 0.02 0.00 0.02 0.00 0.00 54.13 56.46 1yun s LEU 37 Cb -0.16 -3.62 0.13 0.00 0.02 0.00 0.00 46.19 42.56 1yun s LEU 37 CO 0.11 -0.16 0.23 -0.22 0.02 0.00 0.00 176.35 176.33 1yun s LEU 38 N -0.97 4.64 0.22 1.79 2.96 0.33 -1.10 118.68 126.55 1yun s LEU 38 Ca 0.46 -2.71 -0.32 0.00 -0.22 0.00 0.00 54.13 51.35 1yun s LEU 38 Cb -0.31 -1.69 -0.11 0.00 0.50 0.00 0.00 46.19 44.58 1yun s LEU 38 CO 0.38 -0.31 1.67 -2.16 -1.32 0.00 0.00 176.35 174.61 1yun s PRO 39 N 0.14 4.14 0.31 0.98 0.04 -1.26 -1.71 135.00 137.64 1yun s PRO 39 Ca 0.15 2.56 -0.24 0.00 0.04 0.00 0.00 61.00 63.51 1yun s PRO 39 Cb -0.23 -3.08 -0.10 0.00 0.04 0.00 0.00 34.50 31.14 1yun s PRO 39 CO -0.03 -0.70 0.89 -0.80 0.04 0.00 0.00 177.00 176.40 1yun s ASN 40 N 1.03 7.21 0.15 6.66 0.02 0.52 -4.56 114.94 125.97 1yun s ASN 40 Ca 0.72 1.71 -0.11 0.00 -1.02 0.00 0.00 52.86 54.16 1yun s ASN 40 Cb -0.48 -2.53 -0.07 0.00 0.02 0.00 0.00 41.25 38.19 1yun s ASN 40 CO 0.35 -0.09 0.49 0.00 0.02 0.00 0.00 177.10 177.87 1yun s ALA 41 N -1.68 3.64 0.20 0.60 0.00 -1.26 -4.85 121.76 118.41 1yun s ALA 41 Ca 0.50 -0.29 -0.09 0.00 0.00 0.00 0.00 51.96 52.08 1yun s ALA 41 Cb -0.17 -2.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.56 1yun s ALA 41 CO 0.22 0.53 0.32 -0.98 0.00 0.00 0.00 175.76 175.85 1yun s ARG 42 N -2.28 1.29 0.61 0.00 1.70 -1.26 -4.58 118.95 114.43 1yun s ARG 42 Ca 0.40 -1.27 -0.19 0.00 -0.47 0.00 0.00 55.73 54.20 1yun s ARG 42 Cb -0.13 0.39 -0.03 0.00 -0.57 0.00 0.00 34.95 34.61 1yun s ARG 42 CO 0.20 -0.49 1.25 -2.14 -1.08 0.00 0.00 175.30 173.04 1yun s PRO 43 N -4.01 2.85 0.42 3.89 0.02 -1.26 -4.70 135.00 132.20 1yun s PRO 43 Ca 0.22 1.94 0.10 0.00 0.02 0.00 0.00 61.00 63.29 1yun s PRO 43 Cb 0.03 -1.93 0.94 0.00 0.02 0.00 0.00 34.50 33.56 1yun s PRO 43 CO 0.05 -1.33 2.02 -1.35 -0.33 0.00 0.00 177.00 176.05 1yun h PRO 44 N 0.83 0.47 0.00 5.54 0.11 -1.99 -0.73 132.00 136.24 1yun h PRO 44 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1yun h PRO 44 Cb 1.31 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1yun h PRO 44 CO 0.55 0.31 0.00 -2.39 -0.21 0.00 0.00 178.00 176.26 1yun n HIS 45 N -4.47 0.00 1.05 0.65 1.44 -1.26 -0.79 115.22 111.83 1yun n HIS 45 Ca 0.07 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.89 1yun n HIS 45 Cb 0.22 -0.25 0.09 0.00 0.12 0.00 0.00 29.99 30.17 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 -1.25 0.42 -1.55 -1.40 5.12 -0.29 -4.93 116.66 112.77 1yun n ARG 46 Ca 0.10 -0.31 -0.33 0.00 -1.93 0.00 0.00 57.85 55.38 1yun n ARG 46 Cb 0.14 -1.49 0.07 0.00 -1.16 0.00 0.00 32.46 30.02 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 -2.79 2.44 0.25 5.56 0.41 0.03 -4.93 118.70 119.66 1yun s GLU 47 Ca 0.14 1.51 -0.30 0.00 -0.41 0.00 0.00 54.97 55.91 1yun s GLU 47 Cb 0.17 -1.89 -0.10 0.00 -1.78 0.00 0.00 34.13 30.53 1yun s GLU 47 CO 0.70 -1.55 1.50 0.95 -0.49 0.00 0.00 175.26 176.36 1yun s THR 48 N -2.27 2.48 0.07 3.63 -4.23 -1.25 -4.89 115.64 109.19 1yun s THR 48 Ca 0.69 0.40 -0.35 0.00 -1.18 0.00 0.00 61.69 61.25 1yun s THR 48 Cb -0.23 -3.26 -0.14 0.00 1.34 0.00 0.00 72.50 70.21 1yun s THR 48 CO 0.45 0.06 1.62 -2.65 -0.54 0.00 0.00 174.62 173.56 1yun n PRO 49 N 2.49 1.97 -1.04 3.99 -0.02 -1.26 -0.38 135.00 140.76 1yun n PRO 49 Ca 0.08 0.72 -0.01 0.00 -2.02 0.00 0.00 63.50 62.26 1yun n PRO 49 Cb 0.39 -2.48 -0.01 0.00 -0.02 0.00 0.00 33.50 31.39 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 4.14 -1.29 -4.00 -0.52 3.00 -1.26 -4.83 117.38 112.62 1yun n GLN 50 Ca 0.19 0.39 -0.32 0.00 -0.01 0.00 0.00 57.00 57.24 1yun n GLN 50 Cb 0.27 -4.39 -0.15 0.00 0.00 0.00 0.00 30.24 25.97 1yun n GLN 50 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1yun s VAL 51 N -1.44 2.42 0.41 5.09 1.01 0.48 -4.81 120.40 123.57 1yun s VAL 51 Ca 0.00 -1.92 -0.19 0.00 0.00 0.00 0.00 61.98 59.87 1yun s VAL 51 Cb 0.00 -2.59 -0.10 0.00 0.00 0.00 0.00 36.38 33.69 1yun s VAL 51 CO 0.00 -0.32 0.90 -0.94 0.00 0.00 0.00 175.10 174.74 1yun s SER 52 N 1.11 6.87 0.28 3.32 1.04 -1.26 -3.74 113.70 121.31 1yun s SER 52 Ca 0.01 1.57 0.01 0.00 0.48 0.00 0.00 55.95 58.02 1yun s SER 52 Cb -0.20 -2.49 0.68 0.00 0.10 0.00 0.00 66.02 64.11 1yun s SER 52 CO -0.06 -0.34 1.64 0.00 0.98 0.00 0.00 173.24 175.46 1yun h ALA 53 N 1.90 1.20 -0.75 5.32 0.00 -1.98 0.90 119.26 125.83 1yun h ALA 53 Ca -0.49 0.24 0.11 0.00 0.00 0.00 0.00 54.91 54.78 1yun h ALA 53 Cb 1.18 0.36 -0.08 0.00 0.00 0.00 0.00 17.79 19.25 1yun h ALA 53 CO 0.62 -0.48 0.37 0.00 0.00 0.00 0.00 179.25 179.76 1yun h ALA 54 N 1.79 1.07 -0.16 0.00 0.00 -1.99 0.14 119.26 120.12 1yun h ALA 54 Ca 0.54 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 55.35 1yun h ALA 54 Cb 1.08 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1yun h ALA 54 CO -0.69 -0.07 -0.62 1.96 0.00 0.00 0.00 179.25 179.84 1yun h GLN 55 N 0.60 0.55 -0.58 0.00 4.20 0.36 0.36 115.11 120.59 1yun h GLN 55 Ca 0.39 -0.38 0.03 0.00 0.06 0.00 0.00 58.65 58.75 1yun h GLN 55 Cb 0.47 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.26 1yun h GLN 55 CO -0.31 0.99 0.34 0.00 -0.67 0.00 0.00 178.83 179.19 1yun h ARG 56 N 0.40 0.65 -0.60 1.46 3.08 -0.14 0.64 114.38 119.89 1yun h ARG 56 Ca -0.01 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 1yun h ARG 56 Cb 1.18 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.06 1yun h ARG 56 CO 0.11 0.43 -0.01 1.25 -1.07 0.00 0.00 179.97 180.69 1yun h LEU 57 N 0.67 1.03 -0.75 3.04 5.85 -0.25 -2.16 115.31 122.74 1yun h LEU 57 Ca 0.24 -0.29 0.02 0.00 0.84 0.00 0.00 57.88 58.69 1yun h LEU 57 Cb 0.05 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 1yun h LEU 57 CO -0.11 1.08 0.48 0.00 -0.34 0.00 0.00 178.44 179.56 1yun h ALA 58 N 1.02 0.98 -0.36 1.25 0.00 0.22 0.22 119.26 122.59 1yun h ALA 58 Ca 0.17 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1yun h ALA 58 Cb 0.56 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1yun h ALA 58 CO 0.03 0.31 -0.16 0.52 0.00 0.00 0.00 179.25 179.94 1yun h MET 59 N 0.96 0.66 -0.02 0.00 2.86 -0.63 -0.60 114.93 118.17 1yun h MET 59 Ca 0.29 -0.23 -0.16 0.00 -2.06 0.00 0.00 59.70 57.54 1yun h MET 59 Cb -0.03 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 1yun h MET 59 CO -0.09 0.79 -0.73 0.28 1.06 0.00 0.00 176.91 178.21 1yun h VAL 60 N 0.59 1.48 -0.25 -2.22 2.07 -0.76 -0.47 116.25 116.70 1yun h VAL 60 Ca 0.10 -2.39 -0.06 0.00 0.82 0.00 0.00 66.70 65.17 1yun h VAL 60 Cb 0.62 2.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1yun h VAL 60 CO 0.04 0.69 -0.12 -0.33 0.02 0.00 0.00 177.57 177.87 1yun h GLU 61 N 0.07 0.41 -0.54 1.57 5.08 -0.18 -2.46 114.58 118.54 1yun h GLU 61 Ca -0.02 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.16 1yun h GLU 61 Cb 1.30 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 1yun h GLU 61 CO 0.10 0.54 0.03 0.00 -1.00 0.00 0.00 179.01 178.68 1yun h ARG 62 N 0.39 0.93 -0.83 2.33 2.47 -0.34 -1.82 114.38 117.50 1yun h ARG 62 Ca 0.07 -0.28 0.14 0.00 -1.26 0.00 0.00 59.98 58.65 1yun h ARG 62 Cb 0.45 -0.09 -0.06 0.00 -1.65 0.00 0.00 29.97 28.61 1yun h ARG 62 CO 0.03 0.93 0.54 0.00 0.56 0.00 0.00 179.97 182.03 1yun h ALA 63 N 0.97 1.92 -0.01 0.04 0.00 -0.66 -2.67 119.26 118.85 1yun h ALA 63 Ca 0.16 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1yun h ALA 63 Cb 0.49 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1yun h ALA 63 CO 0.02 -0.13 -0.55 1.33 0.00 0.00 0.00 179.25 179.91 1yun n VAL 64 N -4.53 0.00 -1.71 0.00 0.24 -1.00 -4.88 118.33 106.46 1yun n VAL 64 Ca 0.16 -0.22 -0.43 0.00 -2.04 0.00 0.00 64.34 61.80 1yun n VAL 64 Cb 0.47 1.13 -0.03 0.00 -1.47 0.00 0.00 33.84 33.95 1yun n VAL 64 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yun n ALA 65 N -0.59 2.16 -3.86 2.33 0.00 -0.69 -2.01 120.51 117.84 1yun n ALA 65 Ca 0.06 0.40 -0.30 0.00 0.00 0.00 0.00 53.44 53.59 1yun n ALA 65 Cb 0.34 -2.43 -0.01 0.00 0.00 0.00 0.00 19.45 17.35 1yun n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yun n GLY 66 N 2.85 -0.47 3.68 0.00 0.00 -1.26 -4.98 105.19 105.01 1yun n GLY 66 Ca 0.12 0.12 -0.24 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.12 2.97 0.01 1.61 1.01 -0.85 -5.10 120.40 116.92 1yun s VAL 67 Ca 0.60 -1.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.44 1yun s VAL 67 Cb -0.33 -2.88 -0.08 0.00 0.00 0.00 0.00 36.38 33.09 1yun s VAL 67 CO 0.74 -0.23 1.99 -1.83 0.00 0.00 0.00 175.10 175.77 1yun s GLU 68 N -3.76 4.04 0.00 2.72 -1.05 -1.26 -4.07 118.70 115.32 1yun s GLU 68 Ca 0.35 2.55 0.00 0.00 -0.15 0.00 0.00 54.97 57.72 1yun s GLU 68 Cb -0.02 -4.18 0.00 0.00 -0.44 0.00 0.00 34.13 29.48 1yun s GLU 68 CO 0.21 -1.07 0.00 0.54 0.95 0.00 0.00 175.26 175.89 1yun n ARG 69 N 7.66 -0.48 -3.94 -4.83 1.74 -1.26 -4.93 116.66 110.62 1yun n ARG 69 Ca 0.21 0.10 -0.36 0.00 -0.77 0.00 0.00 57.85 57.03 1yun n ARG 69 Cb 0.41 -4.12 -0.08 0.00 -1.02 0.00 0.00 32.46 27.66 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 4.14 0.00 0.55 1.43 -1.26 -0.70 118.68 122.84 1yun s LEU 70 Ca 0.00 0.31 0.07 0.00 -1.03 0.00 0.00 54.13 53.48 1yun s LEU 70 Cb 0.00 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1yun s LEU 70 CO 0.00 0.32 0.28 0.35 0.23 0.00 0.00 176.35 177.53 1yun n THR 71 N 2.59 0.00 -5.24 5.49 -2.24 0.61 -4.83 114.28 110.66 1yun n THR 71 Ca -0.18 -2.33 -0.30 0.00 -2.27 0.00 0.00 64.05 58.97 1yun n THR 71 Cb 0.54 1.17 -0.16 0.00 -2.10 0.00 0.00 70.33 69.78 1yun n THR 71 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1yun s VAL 72 N -3.29 1.96 -0.42 2.28 1.01 -1.26 0.11 120.40 120.80 1yun s VAL 72 Ca 0.38 -1.06 0.04 0.00 0.00 0.00 0.00 61.98 61.33 1yun s VAL 72 Cb 0.02 -1.63 0.11 0.00 0.00 0.00 0.00 36.38 34.89 1yun s VAL 72 CO 0.27 0.55 0.15 -0.62 0.00 0.00 0.00 175.10 175.45 1yun s ASP 73 N -0.59 4.46 0.00 3.32 3.68 -0.26 -4.84 116.67 122.44 1yun s ASP 73 Ca 0.10 -2.49 0.21 0.00 2.13 0.00 0.00 52.55 52.49 1yun s ASP 73 Cb -0.10 -1.54 1.24 0.00 -1.45 0.00 0.00 42.92 41.07 1yun s ASP 73 CO -0.01 -0.32 1.67 -0.81 0.13 0.00 0.00 175.17 175.84 1yun n PRO 74 N 3.79 0.79 -0.17 4.34 -0.04 -1.26 -4.26 135.00 138.20 1yun n PRO 74 Ca 0.04 0.00 0.29 0.00 -0.04 0.00 0.00 63.50 63.79 1yun n PRO 74 Cb 0.38 -1.41 0.72 0.00 -0.04 0.00 0.00 33.50 33.15 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 0.00 0.00 -0.32 0.54 0.11 -1.93 0.71 114.38 113.49 1yun h ARG 75 Ca 0.00 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.96 1yun h ARG 75 Cb 0.00 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.07 1yun h ARG 75 CO 0.00 0.00 -0.29 0.93 0.10 0.00 0.00 179.97 180.71 1yun h GLU 76 N 0.00 0.66 -0.00 0.08 5.08 -1.82 -3.14 114.58 115.45 1yun h GLU 76 Ca 0.42 -0.29 -0.17 0.00 -1.00 0.00 0.00 59.36 58.32 1yun h GLU 76 Cb 1.77 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.98 1yun h GLU 76 CO -0.00 0.88 -0.80 -0.07 -1.00 0.00 0.00 179.01 178.01 1yun h LEU 77 N 0.57 0.09 -1.79 1.33 3.38 0.19 -2.95 115.31 116.13 1yun h LEU 77 Ca 0.07 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1yun h LEU 77 Cb 0.78 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 1yun h LEU 77 CO 0.06 0.85 -0.02 1.56 0.09 0.00 0.00 178.44 180.99 1yun h GLN 78 N 0.04 0.00 -7.09 1.13 1.08 -1.41 -3.43 115.11 105.44 1yun h GLN 78 Ca -0.02 0.00 -0.43 0.00 -1.45 0.00 0.00 58.65 56.75 1yun h GLN 78 Cb 1.40 0.00 0.22 0.00 -0.05 0.00 0.00 27.48 29.05 1yun h GLN 78 CO 0.11 0.02 -0.09 0.54 -0.95 0.00 0.00 178.83 178.46 1yun n ARG 79 N -3.13 -2.64 0.05 1.46 1.74 -1.12 -4.94 116.66 108.08 1yun n ARG 79 Ca -0.00 -0.74 0.11 0.00 -0.77 0.00 0.00 57.85 56.45 1yun n ARG 79 Cb 0.26 -2.13 0.06 0.00 -1.02 0.00 0.00 32.46 29.63 1yun n ARG 79 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1yun n ASP 80 N -4.88 0.65 -4.13 0.55 5.75 -1.26 -4.98 116.55 108.24 1yun n ASP 80 Ca 0.02 -0.03 -0.16 0.00 -0.01 0.00 0.00 54.79 54.61 1yun n ASP 80 Cb 0.54 0.61 -0.10 0.00 -1.03 0.00 0.00 41.12 41.15 1yun n ASP 80 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1yun s LYS 81 N -3.23 1.44 0.58 0.11 -0.14 -1.26 -5.10 119.74 112.15 1yun s LYS 81 Ca 0.03 -1.80 -0.20 0.00 -1.36 0.00 0.00 55.97 52.65 1yun s LYS 81 Cb 0.13 -0.05 -0.05 0.00 -1.68 0.00 0.00 37.83 36.18 1yun s LYS 81 CO 0.78 -0.39 1.10 -2.30 -0.76 0.00 0.00 175.35 173.78 1yun n PRO 82 N -0.47 1.14 -4.61 -1.68 -0.02 -1.26 -4.91 135.00 123.19 1yun n PRO 82 Ca 0.01 0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 61.59 1yun n PRO 82 Cb 0.66 -2.29 -0.13 0.00 -0.02 0.00 0.00 33.50 31.72 1yun n PRO 82 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1yun s SER 83 N -1.14 4.44 0.30 2.55 0.01 -1.26 -5.04 113.70 113.55 1yun s SER 83 Ca 0.75 -0.19 -0.29 0.00 1.31 0.00 0.00 55.95 57.52 1yun s SER 83 Cb -0.43 -1.57 -0.11 0.00 0.21 0.00 0.00 66.02 64.13 1yun s SER 83 CO 0.48 0.21 1.46 -0.31 0.41 0.00 0.00 173.24 175.49 1yun s TYR 84 N 0.11 2.87 0.23 2.43 4.12 -1.26 -4.90 117.35 120.96 1yun s TYR 84 Ca -0.03 1.06 -0.07 0.00 0.02 0.00 0.00 57.07 58.05 1yun s TYR 84 Cb -0.14 -3.90 0.29 0.00 -1.52 0.00 0.00 41.96 36.69 1yun s TYR 84 CO 0.04 -2.82 1.85 1.15 0.02 0.00 0.00 175.55 175.79 1yun h THR 85 N 3.31 1.06 -0.15 -0.71 2.02 -1.99 -1.31 112.91 115.15 1yun h THR 85 Ca -0.48 -0.33 -0.05 0.00 0.77 0.00 0.00 66.41 66.33 1yun h THR 85 Cb 1.22 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1yun h THR 85 CO 0.73 0.17 -0.12 -0.29 0.37 0.00 0.00 175.52 176.39 1yun h ILE 86 N 0.96 1.17 -0.70 3.11 6.09 -1.91 0.26 117.51 126.49 1yun h ILE 86 Ca 0.35 -0.75 -0.05 0.00 -1.37 0.00 0.00 64.86 63.04 1yun h ILE 86 Cb 0.12 1.19 -0.03 0.00 0.47 0.00 0.00 36.82 38.57 1yun h ILE 86 CO -0.15 0.24 0.25 0.44 -3.07 0.00 0.00 178.15 175.86 1yun h ASP 87 N 0.22 0.99 -0.24 2.19 3.32 -1.64 0.14 116.42 121.41 1yun h ASP 87 Ca 0.05 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.91 1yun h ASP 87 Cb 0.36 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1yun h ASP 87 CO 0.02 0.91 0.15 0.74 -1.72 0.00 0.00 179.24 179.34 1yun h THR 88 N 1.02 1.09 -0.88 0.35 2.02 -0.54 1.08 112.91 117.05 1yun h THR 88 Ca 0.23 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1yun h THR 88 Cb 0.25 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1yun h THR 88 CO -0.01 0.09 0.53 0.25 0.37 0.00 0.00 175.52 176.75 1yun h LEU 89 N 0.30 1.05 -1.02 2.58 5.85 -0.87 0.36 115.31 123.56 1yun h LEU 89 Ca 0.09 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 1yun h LEU 89 Cb 0.02 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 1yun h LEU 89 CO -0.02 0.80 -0.49 -0.33 -0.34 0.00 0.00 178.44 178.07 1yun h GLU 90 N 1.21 0.00 -0.00 1.25 5.08 0.01 -2.12 114.58 120.01 1yun h GLU 90 Ca 0.32 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.54 1yun h GLU 90 Cb -0.05 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.21 1yun h GLU 90 CO -0.06 0.49 -0.54 1.03 -1.00 0.00 0.00 179.01 178.93 1yun h SER 91 N 0.00 0.48 -0.48 1.42 0.87 0.25 -3.14 113.55 112.95 1yun h SER 91 Ca -0.00 -0.76 -0.09 0.00 -1.23 0.00 0.00 61.79 59.70 1yun h SER 91 Cb 0.87 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 1yun h SER 91 CO 0.06 1.18 -0.07 0.58 -0.53 0.00 0.00 176.83 178.05 1yun h VAL 92 N -0.17 1.27 0.00 2.23 2.07 -0.27 -3.15 116.25 118.22 1yun h VAL 92 Ca -0.07 -1.17 -0.05 0.00 0.82 0.00 0.00 66.70 66.22 1yun h VAL 92 Cb 1.26 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1yun h VAL 92 CO 0.11 0.41 -0.26 -0.09 0.02 0.00 0.00 177.57 177.76 1yun h ARG 93 N 0.73 0.00 0.00 1.57 9.65 -1.49 -0.89 114.38 123.95 1yun h ARG 93 Ca 0.13 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.92 1yun h ARG 93 Cb 0.60 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.17 1yun h ARG 93 CO 0.04 0.26 -0.41 0.00 2.80 0.00 0.00 179.97 182.65 1yun h ALA 94 N 1.74 1.22 0.00 2.80 0.00 -1.50 -2.27 119.26 121.26 1yun h ALA 94 Ca -0.00 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 1yun h ALA 94 Cb 0.52 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1yun h ALA 94 CO 0.03 0.52 -0.28 0.93 0.00 0.00 0.00 179.25 180.44 1yun h GLU 95 N 0.00 0.00 -7.17 0.00 5.08 -1.23 -3.46 114.58 107.80 1yun h GLU 95 Ca -0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.86 1yun h GLU 95 Cb 0.78 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.06 1yun h GLU 95 CO 0.05 0.28 0.32 -0.51 -1.00 0.00 0.00 179.01 178.16 1yun s LEU 96 N -6.49 3.50 0.79 1.33 1.43 -0.85 -5.04 118.68 113.34 1yun s LEU 96 Ca 0.03 1.36 -0.13 0.00 -1.03 0.00 0.00 54.13 54.36 1yun s LEU 96 Cb 0.08 -4.33 0.07 0.00 0.03 0.00 0.00 46.19 42.04 1yun s LEU 96 CO 0.69 -0.67 1.17 0.00 0.23 0.00 0.00 176.35 177.77 1yun s ALA 97 N -2.82 1.94 0.43 4.21 0.00 -1.26 -4.88 121.76 119.38 1yun s ALA 97 Ca 0.55 0.70 0.14 0.00 0.00 0.00 0.00 51.96 53.35 1yun s ALA 97 Cb -0.10 -3.43 1.03 0.00 0.00 0.00 0.00 23.12 20.62 1yun s ALA 97 CO 0.42 -2.12 1.95 0.00 0.00 0.00 0.00 175.76 176.01 1yun h ALA 98 N -0.89 2.05 -0.63 0.00 0.00 -1.96 -1.69 119.26 116.14 1yun h ALA 98 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1yun h ALA 98 Cb 1.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1yun h ALA 98 CO 0.47 -0.22 0.00 -0.40 0.00 0.00 0.00 179.25 179.11 1yun n ASP 99 N -4.47 4.71 -4.75 0.00 5.75 -1.26 -4.81 116.55 111.72 1yun n ASP 99 Ca 0.12 -2.46 -0.40 0.00 -0.01 0.00 0.00 54.79 52.04 1yun n ASP 99 Cb 0.44 -0.57 -0.05 0.00 -1.03 0.00 0.00 41.12 39.91 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 -0.95 7.45 -0.25 -1.12 1.01 -0.64 -4.40 116.67 117.76 1yun s ASP 100 Ca 0.50 2.05 -0.10 0.00 0.71 0.00 0.00 52.55 55.71 1yun s ASP 100 Cb 0.33 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.60 1yun s ASP 100 CO 0.24 -0.02 0.16 -1.10 0.21 0.00 0.00 175.17 174.66 1yun s GLN 101 N -0.99 3.99 -0.23 8.23 -0.21 -0.56 -4.54 119.66 125.35 1yun s GLN 101 Ca 0.44 -0.31 -0.06 0.00 0.02 0.00 0.00 55.36 55.46 1yun s GLN 101 Cb -0.28 -3.56 -0.02 0.00 1.00 0.00 0.00 33.01 30.15 1yun s GLN 101 CO 0.35 -0.05 0.02 -1.17 -2.12 0.00 0.00 175.29 172.32 1yun s LEU 102 N 1.36 3.21 -0.27 2.90 2.96 -0.99 -0.28 118.68 127.57 1yun s LEU 102 Ca 0.07 -0.27 -0.05 0.00 -0.22 0.00 0.00 54.13 53.66 1yun s LEU 102 Cb -0.15 -1.84 0.01 0.00 0.50 0.00 0.00 46.19 44.71 1yun s LEU 102 CO 0.07 -0.01 0.03 -0.36 -1.32 0.00 0.00 176.35 174.76 1yun s PHE 103 N 1.43 3.11 -0.41 5.38 0.40 -0.25 -0.91 117.98 126.74 1yun s PHE 103 Ca 0.05 -1.10 -0.19 0.00 -0.60 0.00 0.00 56.93 55.09 1yun s PHE 103 Cb -0.15 -2.19 0.01 0.00 0.51 0.00 0.00 43.02 41.21 1yun s PHE 103 CO 0.01 -0.60 0.54 1.41 0.70 0.00 0.00 175.22 177.28 1yun s MET 104 N 1.46 3.33 -0.13 0.44 1.75 -0.15 -0.98 119.30 125.02 1yun s MET 104 Ca 0.02 -0.42 -0.22 0.00 -1.25 0.00 0.00 55.69 53.83 1yun s MET 104 Cb -0.17 -3.91 -0.03 0.00 2.84 0.00 0.00 34.83 33.56 1yun s MET 104 CO 0.00 -0.85 0.65 -1.17 -0.65 0.00 0.00 175.02 173.00 1yun s LEU 105 N 2.49 4.23 0.03 4.11 2.96 -0.60 -0.46 118.68 131.45 1yun s LEU 105 Ca 0.18 0.99 -0.04 0.00 -0.22 0.00 0.00 54.13 55.04 1yun s LEU 105 Cb -0.15 -2.96 -0.01 0.00 0.50 0.00 0.00 46.19 43.57 1yun s LEU 105 CO 0.16 -0.18 0.06 0.27 -1.32 0.00 0.00 176.35 175.34 1yun s ILE 106 N 1.29 0.13 0.61 6.68 -4.36 -0.06 -4.31 121.20 121.18 1yun s ILE 106 Ca 0.32 -1.06 -0.12 0.00 -0.26 0.00 0.00 60.65 59.53 1yun s ILE 106 Cb -0.16 -0.73 -0.04 0.00 1.25 0.00 0.00 42.46 42.77 1yun s ILE 106 CO 0.13 -0.59 1.03 -0.83 0.24 0.00 0.00 174.94 174.93 1yun s GLY 107 N -1.93 1.73 0.13 6.27 0.00 -1.26 0.61 107.32 112.87 1yun s GLY 107 Ca -0.08 -0.01 -0.26 0.00 0.00 0.00 0.00 44.72 44.36 1yun s GLY 107 CO -0.03 0.26 1.61 -0.25 0.00 0.00 0.00 173.10 174.69 1yun h TRP 108 N -0.16 -0.87 -0.21 1.90 2.91 -1.73 -1.99 115.95 115.80 1yun h TRP 108 Ca -0.44 0.03 0.02 0.00 1.13 0.00 0.00 58.89 59.63 1yun h TRP 108 Cb 1.19 0.39 -0.03 0.00 -0.51 0.00 0.00 29.16 30.21 1yun h TRP 108 CO 0.65 -0.40 0.05 -0.44 -1.03 0.00 0.00 178.44 177.27 1yun h ASP 109 N -0.43 0.03 -0.96 2.65 3.32 -1.94 0.01 116.42 119.11 1yun h ASP 109 Ca 0.08 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.25 1yun h ASP 109 Cb 0.55 0.03 -0.08 0.00 0.22 0.00 0.00 39.33 40.05 1yun h ASP 109 CO -0.31 0.05 0.60 0.00 -1.72 0.00 0.00 179.24 177.86 1yun h ALA 110 N 1.14 1.40 -0.08 3.45 0.00 -1.94 -2.13 119.26 121.10 1yun h ALA 110 Ca 0.09 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1yun h ALA 110 Cb 0.08 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1yun h ALA 110 CO -0.11 0.27 -0.14 0.35 0.00 0.00 0.00 179.25 179.62 1yun h PHE 111 N 1.01 -0.35 0.00 0.00 3.57 -0.27 -1.51 116.94 119.39 1yun h PHE 111 Ca 0.45 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.97 1yun h PHE 111 Cb 0.36 0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.26 1yun h PHE 111 CO -0.02 -0.20 0.11 0.00 -2.23 0.00 0.00 178.31 175.98 1yun n GLY 113 N -1.21 2.45 0.30 0.00 0.00 -0.58 -4.62 105.19 101.53 1yun n GLY 113 Ca -0.02 -0.79 0.08 0.00 0.00 0.00 0.00 46.02 45.29 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 4.01 0.42 0.00 0.99 5.85 0.21 0.16 115.31 126.96 1yun h LEU 114 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1yun h LEU 114 Cb 1.20 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1yun h LEU 114 CO 0.13 0.15 0.00 -2.65 -0.34 0.00 0.00 178.44 175.72 1yun n PRO 115 N -4.94 0.06 0.00 5.25 -0.02 -1.26 -1.47 135.00 132.62 1yun n PRO 115 Ca 0.17 0.28 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 1yun n PRO 115 Cb 0.47 -1.50 0.24 0.00 -0.02 0.00 0.00 33.50 32.69 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 -1.39 0.00 -1.71 3.45 -2.24 0.57 -4.87 114.28 108.08 1yun n THR 116 Ca 0.03 -0.01 -0.31 0.00 -2.27 0.00 0.00 64.05 61.49 1yun n THR 116 Cb 0.08 0.30 0.05 0.00 -2.10 0.00 0.00 70.33 68.66 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 -2.96 3.23 0.06 4.78 0.52 -0.54 -4.95 118.94 119.07 1yun s TRP 117 Ca 0.12 1.25 -0.31 0.00 0.02 0.00 0.00 56.10 57.18 1yun s TRP 117 Cb 0.18 -2.93 -0.07 0.00 -1.15 0.00 0.00 33.47 29.49 1yun s TRP 117 CO 0.69 -1.20 1.50 -1.58 0.02 0.00 0.00 176.95 176.39 1yun s HIS 118 N -3.17 2.78 -1.55 -1.98 2.46 -1.26 -1.59 115.29 110.98 1yun s HIS 118 Ca 0.58 0.65 -0.16 0.00 0.47 0.00 0.00 55.06 56.60 1yun s HIS 118 Cb -0.13 -3.79 0.13 0.00 -0.13 0.00 0.00 32.58 28.66 1yun s HIS 118 CO 0.54 -3.00 0.72 0.54 -2.47 0.00 0.00 174.74 171.07 1yun n ARG 119 N 5.11 -3.44 -0.19 2.88 1.74 -1.26 -4.48 116.66 117.03 1yun n ARG 119 Ca 0.14 0.41 0.29 0.00 -0.77 0.00 0.00 57.85 57.92 1yun n ARG 119 Cb 0.42 -5.15 0.73 0.00 -1.02 0.00 0.00 32.46 27.43 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 -1.39 0.00 0.00 -1.55 5.08 -1.58 0.83 115.95 117.35 1yun h TRP 120 Ca -0.54 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.41 1yun h TRP 120 Cb 1.35 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.51 1yun h TRP 120 CO 0.65 0.00 -0.12 0.93 -1.28 0.00 0.00 178.44 178.62 1yun h GLU 121 N 0.00 0.00 0.00 0.12 5.08 -1.87 -3.17 114.58 114.74 1yun h GLU 121 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1yun h GLU 121 Cb 1.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.03 1yun h GLU 121 CO -0.00 0.12 0.00 0.00 -1.00 0.00 0.00 179.01 178.12 1yun h ALA 122 N 1.88 1.00 -0.34 3.43 0.00 0.37 -3.36 119.26 122.24 1yun h ALA 122 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1yun h ALA 122 Cb 0.76 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1yun h ALA 122 CO 0.02 0.00 0.10 -0.07 0.00 0.00 0.00 179.25 179.29 1yun h LEU 123 N 0.00 0.08 0.00 0.00 3.38 -1.58 -2.59 115.31 114.60 1yun h LEU 123 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1yun h LEU 123 Cb 0.60 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1yun h LEU 123 CO 0.00 0.08 0.00 0.18 0.09 0.00 0.00 178.44 178.79 1yun n LEU 124 N -5.05 0.00 0.26 1.67 4.77 -1.26 -1.90 117.00 115.49 1yun n LEU 124 Ca 0.01 0.30 0.18 0.00 -0.03 0.00 0.00 56.01 56.46 1yun n LEU 124 Cb 0.13 -0.30 0.79 0.00 -2.33 0.00 0.00 43.42 41.71 1yun n LEU 124 CO 0.27 -0.15 1.01 0.44 -1.33 0.00 0.00 177.39 177.63 1yun h ASP 125 N 0.00 0.00 0.00 -1.43 5.19 -1.72 -2.68 116.42 115.78 1yun h ASP 125 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1yun h ASP 125 Cb 0.15 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.66 1yun h ASP 125 CO 0.00 0.00 0.00 1.41 -3.12 0.00 0.00 179.24 177.53 1yun n HIS 126 N -2.91 0.00 -3.62 4.55 8.25 -0.80 -4.87 115.22 115.82 1yun n HIS 126 Ca -0.00 -0.06 -0.03 0.00 -0.26 0.00 0.00 57.72 57.36 1yun n HIS 126 Cb 0.22 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.30 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 -2.19 3.60 -0.27 0.00 0.09 -0.08 -1.26 115.29 115.17 1yun s HIS 128 Ca 0.10 1.51 -0.09 0.00 -0.00 0.00 0.00 55.06 56.58 1yun s HIS 128 Cb -0.01 -2.72 -0.03 0.00 -0.00 0.00 0.00 32.58 29.82 1yun s HIS 128 CO -0.04 0.23 0.14 0.42 -0.00 0.00 0.00 174.74 175.49 1yun s ILE 129 N -1.66 4.79 -0.44 0.60 1.01 0.41 -0.98 121.20 124.93 1yun s ILE 129 Ca 0.48 -0.08 -0.22 0.00 0.00 0.00 0.00 60.65 60.84 1yun s ILE 129 Cb -0.16 -3.30 0.02 0.00 0.01 0.00 0.00 42.46 39.04 1yun s ILE 129 CO 0.21 0.25 0.70 -0.69 0.00 0.00 0.00 174.94 175.40 1yun s VAL 130 N 1.68 4.76 -0.18 2.92 1.01 0.40 -1.51 120.40 129.47 1yun s VAL 130 Ca 0.06 0.24 -0.16 0.00 0.00 0.00 0.00 61.98 62.12 1yun s VAL 130 Cb -0.16 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 1yun s VAL 130 CO 0.07 -0.64 0.38 -0.69 0.00 0.00 0.00 175.10 174.22 1yun s VAL 131 N 2.99 5.23 -0.35 2.92 1.01 0.14 -0.88 120.40 131.45 1yun s VAL 131 Ca 0.25 0.70 -0.13 0.00 0.00 0.00 0.00 61.98 62.81 1yun s VAL 131 Cb -0.13 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 1yun s VAL 131 CO 0.20 0.30 0.23 -0.22 0.00 0.00 0.00 175.10 175.62 1yun s LEU 132 N 0.97 4.58 -0.13 3.92 0.20 0.20 -1.34 118.68 127.07 1yun s LEU 132 Ca 0.19 -0.57 -0.06 0.00 0.69 0.00 0.00 54.13 54.38 1yun s LEU 132 Cb -0.14 -2.11 -0.04 0.00 -0.43 0.00 0.00 46.19 43.47 1yun s LEU 132 CO 0.07 -0.28 0.09 -1.10 -0.29 0.00 0.00 176.35 174.84 1yun s GLN 133 N 1.68 3.53 0.13 1.98 -0.21 -0.76 -1.91 119.66 124.10 1yun s GLN 133 Ca 0.05 -0.24 -0.02 0.00 0.02 0.00 0.00 55.36 55.17 1yun s GLN 133 Cb -0.18 -3.13 -0.04 0.00 1.00 0.00 0.00 33.01 30.66 1yun s GLN 133 CO 0.09 0.61 0.08 -0.98 -2.12 0.00 0.00 175.29 172.97 1yun s ARG 134 N -0.57 0.93 0.49 2.91 1.70 -1.24 0.12 118.95 123.28 1yun s ARG 134 Ca 0.12 -1.40 0.26 0.00 -0.47 0.00 0.00 55.73 54.24 1yun s ARG 134 Cb -0.12 0.26 1.33 0.00 -0.57 0.00 0.00 34.95 35.85 1yun s ARG 134 CO 0.02 -0.27 1.86 -1.00 -1.08 0.00 0.00 175.30 174.84 1yun h PRO 135 N 2.85 0.16 -2.12 3.89 0.13 -1.99 -2.71 132.00 132.19 1yun h PRO 135 Ca -0.35 -0.01 -0.71 0.00 -0.87 0.00 0.00 66.00 64.07 1yun h PRO 135 Cb 1.20 -0.04 -0.23 0.00 0.13 0.00 0.00 31.00 32.06 1yun h PRO 135 CO 0.58 0.10 1.04 -0.25 -0.23 0.00 0.00 178.00 179.25 1yun n ASP 136 N -4.37 7.29 0.00 1.44 9.92 -1.26 -4.90 116.55 124.66 1yun n ASP 136 Ca 0.20 -3.57 0.00 0.00 -0.53 0.00 0.00 54.79 50.89 1yun n ASP 136 Cb 0.89 -1.17 0.00 0.00 -0.64 0.00 0.00 41.12 40.20 1yun n ASP 136 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1yun n ALA 137 N 0.18 0.00 -2.94 2.24 0.00 -1.02 -4.99 120.51 113.98 1yun n ALA 137 Ca 0.52 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.98 1yun n ALA 137 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 1yun n ALA 137 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1yun s ASP 138 N 1.00 -0.72 0.00 0.00 -4.77 -1.26 -5.06 116.67 105.86 1yun s ASP 138 Ca 0.00 -0.30 0.00 0.00 -3.30 0.00 0.00 52.55 48.95 1yun s ASP 138 Cb 0.00 0.98 0.00 0.00 -1.09 0.00 0.00 42.92 42.81 1yun s ASP 138 CO 0.00 -0.09 1.09 -0.24 0.70 0.00 0.00 175.17 176.63 1yun n SER 139 N 4.09 2.93 -4.02 2.11 2.88 -1.26 -4.52 113.62 115.83 1yun n SER 139 Ca 0.07 -1.75 -0.32 0.00 -1.33 0.00 0.00 58.87 55.54 1yun n SER 139 Cb 0.61 -0.61 -0.14 0.00 -0.75 0.00 0.00 64.21 63.31 1yun n SER 139 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1yun s GLU 140 N 0.85 1.73 0.93 -1.46 2.56 -1.26 -5.11 118.70 116.92 1yun s GLU 140 Ca 0.00 -2.07 -0.12 0.00 0.00 0.00 0.00 54.97 52.78 1yun s GLU 140 Cb 0.00 -3.32 0.15 0.00 2.00 0.00 0.00 34.13 32.96 1yun s GLU 140 CO 0.00 -1.01 1.10 -1.25 -0.56 0.00 0.00 175.26 173.54 1yun s PRO 141 N 0.62 1.02 0.62 4.30 0.04 -1.26 -5.04 135.00 135.30 1yun s PRO 141 Ca 0.12 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.67 1yun s PRO 141 Cb -0.21 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 1yun s PRO 141 CO -0.05 -2.36 1.03 -1.25 0.04 0.00 0.00 177.00 174.41 1yun s PRO 142 N -5.01 3.47 0.41 0.56 0.04 -1.26 -4.93 135.00 128.27 1yun s PRO 142 Ca 0.64 0.88 0.20 0.00 0.04 0.00 0.00 61.00 62.76 1yun s PRO 142 Cb -0.17 -2.06 1.14 0.00 0.04 0.00 0.00 34.50 33.44 1yun s PRO 142 CO 0.56 -0.67 1.77 1.49 0.04 0.00 0.00 177.00 180.19 1yun h GLU 143 N -0.12 0.35 -0.07 4.56 4.57 -2.00 -2.30 114.58 119.57 1yun h GLU 143 Ca -0.45 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 57.73 1yun h GLU 143 Cb 1.20 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 29.70 1yun h GLU 143 CO 0.60 0.23 0.11 0.66 -1.18 0.00 0.00 179.01 179.44 1yun h SER 144 N 0.36 0.00 -0.28 1.04 4.64 -1.99 0.33 113.55 117.66 1yun h SER 144 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 1yun h SER 144 Cb 1.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 1yun h SER 144 CO -0.29 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.85 1yun n LEU 145 N -3.57 3.09 -0.06 5.97 4.77 -0.86 -4.73 117.00 121.60 1yun n LEU 145 Ca -0.01 -1.42 -0.08 0.00 -0.03 0.00 0.00 56.01 54.47 1yun n LEU 145 Cb 0.21 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 1yun n LEU 145 CO 0.24 0.65 0.88 -0.09 -1.33 0.00 0.00 177.39 177.75 1yun h ARG 146 N 3.81 0.12 0.00 3.23 2.43 -0.40 -0.07 114.38 123.50 1yun h ARG 146 Ca 0.00 -0.01 -0.18 0.00 -0.81 0.00 0.00 59.98 58.98 1yun h ARG 146 Cb 0.87 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.36 1yun h ARG 146 CO 0.00 0.08 -1.24 -0.44 -1.51 0.00 0.00 179.97 176.86 1yun h ASP 147 N 0.13 0.00 -0.74 -3.80 3.32 -1.85 0.17 116.42 113.65 1yun h ASP 147 Ca 0.12 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.24 1yun h ASP 147 Cb 0.13 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.61 1yun h ASP 147 CO -0.16 0.67 0.41 0.25 -1.72 0.00 0.00 179.24 178.68 1yun h LEU 148 N 0.00 0.59 -0.26 1.55 5.85 -1.83 0.85 115.31 122.06 1yun h LEU 148 Ca -0.14 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 1yun h LEU 148 Cb 1.63 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.57 1yun h LEU 148 CO 0.06 0.36 0.16 -0.07 -0.34 0.00 0.00 178.44 178.61 1yun h LEU 149 N 0.72 0.31 -0.86 2.25 3.38 -0.85 0.12 115.31 120.38 1yun h LEU 149 Ca 0.34 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.32 1yun h LEU 149 Cb 0.27 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 1yun h LEU 149 CO -0.22 0.27 0.54 0.00 0.09 0.00 0.00 178.44 179.12 1yun h ALA 150 N 1.05 1.17 -0.14 1.53 0.00 0.29 0.51 119.26 123.68 1yun h ALA 150 Ca 0.09 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 1yun h ALA 150 Cb 0.02 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1yun h ALA 150 CO -0.02 0.31 -0.63 0.00 0.00 0.00 0.00 179.25 178.91 1yun h ALA 151 N 1.39 0.63 0.00 0.00 0.00 0.98 -3.41 119.26 118.86 1yun h ALA 151 Ca 0.37 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1yun h ALA 151 Cb 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1yun h ALA 151 CO -0.16 0.72 -0.78 0.54 0.00 0.00 0.00 179.25 179.57 1yun n ARG 152 N -3.91 1.35 -1.64 0.00 5.12 0.41 -5.07 116.66 112.91 1yun n ARG 152 Ca -0.04 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.55 1yun n ARG 152 Cb 0.65 -0.88 0.06 0.00 -1.16 0.00 0.00 32.46 31.13 1yun n ARG 152 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 1yun s SER 153 N -1.64 4.88 -0.09 0.55 0.01 0.13 -1.72 113.70 115.82 1yun s SER 153 Ca 0.00 2.03 -0.07 0.00 1.31 0.00 0.00 55.95 59.22 1yun s SER 153 Cb 0.00 -2.55 0.03 0.00 0.21 0.00 0.00 66.02 63.71 1yun s SER 153 CO 0.00 -1.78 0.24 0.68 0.41 0.00 0.00 173.24 172.78 1yun s VAL 154 N -2.36 -0.01 0.15 3.43 -7.23 -0.54 -4.83 120.40 109.02 1yun s VAL 154 Ca 0.67 0.05 -0.14 0.00 -1.81 0.00 0.00 61.98 60.75 1yun s VAL 154 Cb -0.21 -0.35 0.12 0.00 0.56 0.00 0.00 36.38 36.50 1yun s VAL 154 CO 0.44 0.02 1.05 0.00 -0.31 0.00 0.00 175.10 176.30 1yun n ALA 155 N 3.36 -0.15 -2.53 1.32 0.00 -1.26 -4.49 120.51 116.76 1yun n ALA 155 Ca -0.17 0.66 -0.09 0.00 0.00 0.00 0.00 53.44 53.84 1yun n ALA 155 Cb 0.57 -0.26 -0.07 0.00 0.00 0.00 0.00 19.45 19.68 1yun n ALA 155 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1yun s ASP 156 N -5.26 0.14 0.18 0.00 -4.77 -1.26 -4.65 116.67 101.05 1yun s ASP 156 Ca -0.09 -0.70 -0.12 0.00 -3.30 0.00 0.00 52.55 48.34 1yun s ASP 156 Cb 0.13 0.34 0.22 0.00 -1.09 0.00 0.00 42.92 42.51 1yun s ASP 156 CO 0.47 -0.73 1.19 -2.65 0.70 0.00 0.00 175.17 174.15 1yun n PRO 157 N -0.06 -0.15 -0.25 2.11 -0.02 -1.26 0.15 135.00 135.52 1yun n PRO 157 Ca -0.14 1.18 0.15 0.00 -2.02 0.00 0.00 63.50 62.67 1yun n PRO 157 Cb 0.62 -1.75 0.44 0.00 -0.02 0.00 0.00 33.50 32.79 1yun n PRO 157 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 1yun h GLN 158 N 0.00 0.53 0.00 -0.52 3.07 -1.96 -0.25 115.11 115.98 1yun h GLN 158 Ca 0.29 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 59.00 1yun h GLN 158 Cb 0.48 -0.12 0.00 0.00 0.08 0.00 0.00 27.48 27.92 1yun h GLN 158 CO -0.76 0.35 0.00 0.00 0.09 0.00 0.00 178.83 178.51 1yun n ALA 159 N -2.47 1.87 -2.47 0.06 0.00 0.40 -4.75 120.51 113.14 1yun n ALA 159 Ca 0.18 -0.07 -0.42 0.00 0.00 0.00 0.00 53.44 53.13 1yun n ALA 159 Cb 0.57 -1.27 -0.04 0.00 0.00 0.00 0.00 19.45 18.72 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 -2.66 4.42 0.06 0.00 1.43 -0.11 -4.96 118.68 116.86 1yun s LEU 160 Ca 0.14 1.78 0.05 0.00 -1.03 0.00 0.00 54.13 55.07 1yun s LEU 160 Cb 0.11 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.72 1yun s LEU 160 CO 0.26 -0.21 -0.14 -0.75 0.23 0.00 0.00 176.35 175.73 1yun s LYS 161 N 0.56 0.87 1.34 1.70 2.20 -1.26 -5.08 119.74 120.06 1yun s LYS 161 Ca 0.51 -0.88 0.00 0.00 -0.36 0.00 0.00 55.97 55.23 1yun s LYS 161 Cb -0.23 -0.88 0.00 0.00 -1.51 0.00 0.00 37.83 35.20 1yun s LYS 161 CO 0.29 0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.90 1yun n GLY 162 N 1.51 -1.43 0.39 5.54 0.00 -1.26 -4.44 105.19 105.50 1yun n GLY 162 Ca -0.20 -1.14 -0.09 0.00 0.00 0.00 0.00 46.02 44.59 1yun n GLY 162 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1yun h PRO 163 N 0.00 -0.28 0.00 1.61 0.11 -1.86 -3.44 132.00 128.14 1yun h PRO 163 Ca 0.01 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1yun h PRO 163 Cb 0.28 0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.45 1yun h PRO 163 CO 0.00 -0.19 0.00 0.41 -0.21 0.00 0.00 178.00 178.02 1yun n GLY 164 N -1.41 2.84 0.00 -0.55 0.00 -1.26 -2.33 105.19 102.47 1yun n GLY 164 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 0.00 1.29 3.39 -0.02 0.00 -0.39 -4.73 105.19 104.73 1yun n GLY 165 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.52 1.45 -0.03 1.61 -0.21 -1.26 -4.84 119.66 115.85 1yun s GLN 166 Ca 0.00 -1.52 0.03 0.00 0.02 0.00 0.00 55.36 53.89 1yun s GLN 166 Cb 0.00 -1.63 -0.03 0.00 1.00 0.00 0.00 33.01 32.35 1yun s GLN 166 CO 0.00 0.34 -0.10 0.42 -2.12 0.00 0.00 175.29 173.82 1yun s ILE 167 N -1.95 3.39 0.20 1.08 1.01 -0.70 -0.44 121.20 123.78 1yun s ILE 167 Ca 0.20 -0.70 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 1yun s ILE 167 Cb -0.07 -2.39 -0.01 0.00 0.01 0.00 0.00 42.46 40.00 1yun s ILE 167 CO 0.09 0.52 0.32 0.28 0.00 0.00 0.00 174.94 176.16 1yun s THR 168 N -0.84 0.03 -0.02 2.92 -1.32 -0.57 -1.46 115.64 114.38 1yun s THR 168 Ca 0.13 -1.49 0.07 0.00 -1.21 0.00 0.00 61.69 59.20 1yun s THR 168 Cb -0.11 -2.07 -0.02 0.00 -1.51 0.00 0.00 72.50 68.80 1yun s THR 168 CO 0.03 -0.15 -0.24 -0.36 -2.21 0.00 0.00 174.62 171.69 1yun s PHE 169 N -4.02 2.16 0.43 9.09 0.40 -1.26 0.25 117.98 125.04 1yun s PHE 169 Ca 0.22 -0.41 0.03 0.00 -0.60 0.00 0.00 56.93 56.18 1yun s PHE 169 Cb 0.03 -1.39 -0.03 0.00 0.51 0.00 0.00 43.02 42.14 1yun s PHE 169 CO 0.05 -0.03 0.08 0.14 0.70 0.00 0.00 175.22 176.16 1yun s VAL 170 N -0.58 0.88 -0.19 -0.44 -7.23 -0.45 -4.81 120.40 107.58 1yun s VAL 170 Ca 0.09 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.24 1yun s VAL 170 Cb -0.09 -2.36 -0.00 0.00 0.56 0.00 0.00 36.38 34.49 1yun s VAL 170 CO -0.01 0.00 -0.09 0.86 -0.31 0.00 0.00 175.10 175.55 1yun s TRP 171 N -3.09 2.89 0.15 2.82 -0.11 -1.26 -1.83 118.94 118.50 1yun s TRP 171 Ca 0.20 -1.03 0.09 0.00 1.22 0.00 0.00 56.10 56.58 1yun s TRP 171 Cb 0.03 -2.01 -0.04 0.00 -1.50 0.00 0.00 33.47 29.95 1yun s TRP 171 CO 0.11 -0.54 -0.21 -1.14 -4.62 0.00 0.00 176.95 170.55 1yun s GLN 172 N 1.21 1.30 -0.46 5.86 0.74 0.31 -4.95 119.66 123.67 1yun s GLN 172 Ca 0.02 -1.36 0.03 0.00 0.05 0.00 0.00 55.36 54.11 1yun s GLN 172 Cb -0.14 -1.53 0.13 0.00 1.10 0.00 0.00 33.01 32.57 1yun s GLN 172 CO -0.04 0.33 0.22 0.99 -0.55 0.00 0.00 175.29 176.24 1yun s THR 173 N -1.60 2.06 0.52 -0.34 2.01 -1.26 -3.72 115.64 113.32 1yun s THR 173 Ca 0.14 -2.84 -0.19 0.00 0.31 0.00 0.00 61.69 59.11 1yun s THR 173 Cb -0.08 -2.45 -0.07 0.00 0.01 0.00 0.00 72.50 69.91 1yun s THR 173 CO 0.07 -0.80 1.06 -2.16 -0.69 0.00 0.00 174.62 172.10 1yun s PRO 174 N 0.18 3.61 0.10 4.92 0.04 -1.26 -4.99 135.00 137.61 1yun s PRO 174 Ca 0.16 1.39 -0.31 0.00 0.04 0.00 0.00 61.00 62.28 1yun s PRO 174 Cb -0.24 -2.06 -0.11 0.00 0.04 0.00 0.00 34.50 32.13 1yun s PRO 174 CO -0.02 -0.59 1.86 1.28 0.04 0.00 0.00 177.00 179.56 1yun n LEU 175 N -1.24 4.04 -4.51 -3.56 4.77 -1.26 -4.87 117.00 110.37 1yun n LEU 175 Ca 0.10 0.97 -0.35 0.00 -0.03 0.00 0.00 56.01 56.70 1yun n LEU 175 Cb 0.52 -1.54 -0.04 0.00 -2.33 0.00 0.00 43.42 40.04 1yun n LEU 175 CO 0.41 0.17 1.76 0.00 -1.33 0.00 0.00 177.39 178.40 1yun n ALA 176 N 5.94 2.68 -2.83 -1.18 0.00 -1.26 -4.77 120.51 119.09 1yun n ALA 176 Ca 0.18 -3.38 -0.14 0.00 0.00 0.00 0.00 53.44 50.11 1yun n ALA 176 Cb 0.37 -3.54 -0.14 0.00 0.00 0.00 0.00 19.45 16.15 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 7.88 0.26 0.12 0.00 1.01 -1.26 -5.11 120.40 123.29 1yun s VAL 177 Ca 0.62 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.33 1yun s VAL 177 Cb 0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.11 1yun s VAL 177 CO 0.11 -0.04 -0.13 -0.94 0.00 0.00 0.00 175.10 174.10 1yun s SER 178 N -0.38 1.81 0.16 3.32 1.04 -1.26 -4.82 113.70 113.57 1yun s SER 178 Ca -0.02 -0.82 -0.12 0.00 0.48 0.00 0.00 55.95 55.46 1yun s SER 178 Cb -0.03 -0.04 0.04 0.00 0.10 0.00 0.00 66.02 66.09 1yun s SER 178 CO -0.00 -0.19 1.66 0.00 0.98 0.00 0.00 173.24 175.69 1yun h ALA 179 N 3.49 0.70 -0.88 5.32 0.00 -1.89 -2.33 119.26 123.67 1yun h ALA 179 Ca -0.39 -0.22 0.19 0.00 0.00 0.00 0.00 54.91 54.49 1yun h ALA 179 Cb 1.19 -0.20 -0.11 0.00 0.00 0.00 0.00 17.79 18.67 1yun h ALA 179 CO 0.52 0.41 0.41 1.15 0.00 0.00 0.00 179.25 181.74 1yun h THR 180 N 0.75 0.58 0.09 0.00 2.02 -1.94 0.36 112.91 114.77 1yun h THR 180 Ca 0.17 -0.17 -0.26 0.00 0.77 0.00 0.00 66.41 66.92 1yun h THR 180 Cb 0.35 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1yun h THR 180 CO 0.00 0.09 -1.14 -0.61 0.37 0.00 0.00 175.52 174.23 1yun h GLN 181 N 0.50 0.29 -0.53 6.66 4.15 -1.93 -2.13 115.11 122.12 1yun h GLN 181 Ca 0.52 -0.43 -0.06 0.00 0.77 0.00 0.00 58.65 59.44 1yun h GLN 181 Cb 0.89 0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.71 1yun h GLN 181 CO -0.46 1.17 0.08 0.82 -1.93 0.00 0.00 178.83 178.51 1yun h ILE 182 N 0.11 1.25 -0.66 2.39 2.04 -0.83 -1.26 117.51 120.56 1yun h ILE 182 Ca -0.11 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.78 1yun h ILE 182 Cb 1.85 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.75 1yun h ILE 182 CO 0.19 0.35 0.39 0.03 0.00 0.00 0.00 178.15 179.11 1yun h ARG 183 N 0.76 0.89 -0.72 2.37 3.08 -0.28 -1.99 114.38 118.50 1yun h ARG 183 Ca 0.16 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 60.07 1yun h ARG 183 Cb 0.42 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 1yun h ARG 183 CO 0.01 0.63 0.20 0.00 -1.07 0.00 0.00 179.97 179.75 1yun h ALA 184 N 1.52 0.95 0.14 0.04 0.00 -0.76 -1.27 119.26 119.88 1yun h ALA 184 Ca 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1yun h ALA 184 Cb -0.03 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1yun h ALA 184 CO -0.04 0.65 -0.07 -0.07 0.00 0.00 0.00 179.25 179.72 1yun h LEU 185 N 1.08 -0.16 -1.81 0.00 3.38 -0.89 -2.81 115.31 114.10 1yun h LEU 185 Ca 0.23 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.01 1yun h LEU 185 Cb 0.34 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1yun h LEU 185 CO -0.00 0.14 0.20 -0.07 0.09 0.00 0.00 178.44 178.80 1yun h LEU 186 N -0.47 0.22 -1.73 1.67 3.38 -1.37 -0.51 115.31 116.50 1yun h LEU 186 Ca -0.02 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1yun h LEU 186 Cb 0.37 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1yun h LEU 186 CO 0.03 0.15 0.01 1.23 0.09 0.00 0.00 178.44 179.95 1yun h GLY 187 N 0.25 0.18 -1.49 0.83 0.00 -0.97 -1.52 103.07 100.35 1yun h GLY 187 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1yun h GLY 187 CO -0.02 0.08 0.00 0.00 0.00 0.00 0.00 176.54 176.59 1yun n ALA 188 N -2.51 2.46 -1.24 3.60 0.00 -0.24 -4.93 120.51 117.66 1yun n ALA 188 Ca -0.01 -0.74 -0.06 0.00 0.00 0.00 0.00 53.44 52.63 1yun n ALA 188 Cb 0.14 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 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 1.27 0.77 3.94 0.00 0.00 -0.57 -5.01 105.19 105.58 1yun n GLY 189 Ca 0.17 -0.79 -0.21 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.63 3.19 0.14 1.61 0.52 -0.95 -5.02 118.95 115.81 1yun s ARG 190 Ca 0.00 -0.93 -0.30 0.00 -0.52 0.00 0.00 55.73 53.98 1yun s ARG 190 Cb 0.00 -2.77 -0.07 0.00 0.52 0.00 0.00 34.95 32.63 1yun s ARG 190 CO 0.00 0.30 1.01 0.45 0.02 0.00 0.00 175.30 177.08 1yun s SER 191 N -4.00 7.42 -0.09 0.23 0.15 -1.26 -3.97 113.70 112.18 1yun s SER 191 Ca 0.37 1.91 0.13 0.00 0.70 0.00 0.00 55.95 59.06 1yun s SER 191 Cb -0.09 -2.60 0.33 0.00 -1.71 0.00 0.00 66.02 61.96 1yun s SER 191 CO 0.29 -0.11 1.25 1.33 1.20 0.00 0.00 173.24 177.20 1yun n VAL 192 N 2.57 1.64 -1.57 4.45 0.24 -1.26 -4.94 118.33 119.46 1yun n VAL 192 Ca 0.02 -1.57 -0.43 0.00 -2.04 0.00 0.00 64.34 60.32 1yun n VAL 192 Cb 0.48 0.08 -0.01 0.00 -1.47 0.00 0.00 33.84 32.93 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 -0.42 1.21 -1.25 7.34 0.63 -1.26 -1.10 116.66 121.81 1yun n ARG 193 Ca 0.14 0.43 -0.09 0.00 -0.92 0.00 0.00 57.85 57.41 1yun n ARG 193 Cb 0.60 -1.83 -0.04 0.00 0.45 0.00 0.00 32.46 31.64 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 -0.13 0.00 0.15 -0.14 3.01 -1.26 -4.78 117.46 114.31 1yun n PHE 194 Ca 0.10 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.60 1yun n PHE 194 Cb 0.35 -2.10 -0.06 0.00 -0.01 0.00 0.00 39.48 37.65 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 -0.99 0.15 -4.16 4.37 4.77 -0.26 -4.98 117.00 115.89 1yun n LEU 195 Ca -0.09 -0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 55.61 1yun n LEU 195 Cb 0.43 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.42 1yun n LEU 195 CO 0.13 0.04 -0.35 0.68 -1.33 0.00 0.00 177.39 176.56 1yun s VAL 196 N -2.34 0.45 0.65 4.08 -7.23 -1.23 -0.33 120.40 114.44 1yun s VAL 196 Ca -0.01 -1.91 -0.17 0.00 -1.81 0.00 0.00 61.98 58.08 1yun s VAL 196 Cb 0.06 -1.83 -0.01 0.00 0.56 0.00 0.00 36.38 35.16 1yun s VAL 196 CO 0.37 -0.72 1.19 -2.84 -0.31 0.00 0.00 175.10 172.80 1yun s PRO 197 N -3.92 2.69 0.45 4.82 0.02 -1.26 -4.76 135.00 133.04 1yun s PRO 197 Ca 0.16 1.73 0.16 0.00 0.02 0.00 0.00 61.00 63.07 1yun s PRO 197 Cb 0.07 -1.90 1.09 0.00 0.02 0.00 0.00 34.50 33.77 1yun s PRO 197 CO -0.02 -1.41 1.98 -0.44 -0.33 0.00 0.00 177.00 176.78 1yun h ASP 198 N 0.38 0.31 -0.18 2.53 3.32 -1.99 -0.03 116.42 120.76 1yun h ASP 198 Ca -0.49 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.46 1yun h ASP 198 Cb 1.29 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 1yun h ASP 198 CO 0.53 0.18 -0.25 0.00 -1.72 0.00 0.00 179.24 177.99 1yun h ALA 199 N 1.71 0.96 -0.07 3.45 0.00 -1.88 -2.49 119.26 120.94 1yun h ALA 199 Ca 0.27 -0.37 -0.22 0.00 0.00 0.00 0.00 54.91 54.60 1yun h ALA 199 Cb 0.62 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1yun h ALA 199 CO -0.07 0.60 -0.84 0.28 0.00 0.00 0.00 179.25 179.22 1yun h VAL 200 N 0.56 1.34 -0.60 0.00 2.07 -1.34 -2.47 116.25 115.81 1yun h VAL 200 Ca 0.08 -2.18 0.10 0.00 0.82 0.00 0.00 66.70 65.52 1yun h VAL 200 Cb 0.72 2.19 -0.08 0.00 -1.52 0.00 0.00 31.29 32.60 1yun h VAL 200 CO 0.06 0.67 0.19 0.25 0.02 0.00 0.00 177.57 178.75 1yun h LEU 201 N 0.36 0.14 -0.13 2.57 7.12 -1.27 -1.06 115.31 123.04 1yun h LEU 201 Ca -0.06 0.09 -0.02 0.00 0.13 0.00 0.00 57.88 58.01 1yun h LEU 201 Cb 1.46 0.09 -0.00 0.00 -0.53 0.00 0.00 40.66 41.68 1yun h LEU 201 CO 0.16 0.08 -0.01 0.78 -0.13 0.00 0.00 178.44 179.32 1yun h ASN 202 N 0.35 0.23 -0.44 1.25 4.21 -1.38 0.23 115.58 120.04 1yun h ASN 202 Ca 0.31 -0.32 0.05 0.00 1.21 0.00 0.00 56.30 57.55 1yun h ASN 202 Cb 0.41 -0.06 -0.05 0.00 -1.12 0.00 0.00 38.32 37.50 1yun h ASN 202 CO -0.34 0.50 0.16 0.22 -1.29 0.00 0.00 177.43 176.68 1yun h TYR 203 N -0.04 0.29 -0.51 1.19 5.03 -1.40 1.24 116.97 122.76 1yun h TYR 203 Ca 0.04 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.33 1yun h TYR 203 Cb 0.39 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.58 1yun h TYR 203 CO 0.04 0.11 0.16 0.82 -1.32 0.00 0.00 178.16 177.97 1yun h ILE 204 N 0.34 1.23 0.08 1.81 2.04 -0.97 0.81 117.51 122.85 1yun h ILE 204 Ca 0.20 -0.76 -0.26 0.00 1.00 0.00 0.00 64.86 65.04 1yun h ILE 204 Cb 0.19 0.76 0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1yun h ILE 204 CO -0.20 0.28 -1.14 -0.33 0.00 0.00 0.00 178.15 176.76 1yun h GLU 205 N 0.70 0.39 -0.19 2.37 5.08 -0.35 -0.39 114.58 122.18 1yun h GLU 205 Ca 0.17 -0.53 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1yun h GLU 205 Cb 0.27 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1yun h GLU 205 CO -0.01 1.21 0.11 0.00 -1.00 0.00 0.00 179.01 179.32 1yun h ALA 206 N 0.58 0.25 -0.37 3.43 0.00 0.17 -2.72 119.26 120.60 1yun h ALA 206 Ca -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1yun h ALA 206 Cb 1.82 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1yun h ALA 206 CO 0.20 -0.23 0.00 0.72 0.00 0.00 0.00 179.25 179.93 1yun n HIS 207 N -4.91 0.49 -2.27 0.00 8.25 0.26 -4.95 115.22 112.09 1yun n HIS 207 Ca -0.04 -0.24 -0.16 0.00 -0.26 0.00 0.00 57.72 57.02 1yun n HIS 207 Cb 0.06 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.16 1yun n HIS 207 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1yun n HIS 208 N 0.65 -0.73 -2.10 4.41 -0.00 -0.57 -4.96 115.22 111.91 1yun n HIS 208 Ca 0.14 0.00 -0.36 0.00 0.46 0.00 0.00 57.72 57.96 1yun n HIS 208 Cb 0.35 -3.27 0.02 0.00 -0.12 0.00 0.00 29.99 26.97 1yun n HIS 208 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 1yun s LEU 209 N -4.58 3.77 -0.89 0.27 1.43 -0.26 -4.11 118.68 114.31 1yun s LEU 209 Ca 0.00 2.35 -0.06 0.00 -1.03 0.00 0.00 54.13 55.40 1yun s LEU 209 Cb 0.00 -4.50 0.01 0.00 0.03 0.00 0.00 46.19 41.73 1yun s LEU 209 CO 0.00 -1.37 0.78 -1.22 0.23 0.00 0.00 176.35 174.77 1yun n TYR 210 N -1.26 -1.89 0.00 0.29 4.02 -1.26 -4.93 117.16 112.13 1yun n TYR 210 Ca 0.12 0.67 0.00 0.00 -0.01 0.00 0.00 57.90 58.68 1yun n TYR 210 Cb 0.49 -3.68 0.00 0.00 -0.02 0.00 0.00 39.34 36.13 1yun n TYR 210 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72