#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ix9 s TYR 2 N 0.00 2.24 0.10 0.66 2.02 -1.26 -5.05 117.35 116.06 1ix9 s TYR 2 Ca 0.00 1.53 0.03 0.00 -0.37 0.00 0.00 57.07 58.26 1ix9 s TYR 2 Cb 0.00 -3.52 -0.04 0.00 -0.40 0.00 0.00 41.96 38.00 1ix9 s TYR 2 CO 0.00 -2.47 -0.09 0.95 -1.57 0.00 0.00 175.55 172.37 1ix9 s THR 3 N -1.67 0.91 -0.14 -0.71 -4.23 -1.26 -4.95 115.64 103.59 1ix9 s THR 3 Ca 0.78 -1.77 -0.29 0.00 -1.18 0.00 0.00 61.69 59.22 1ix9 s THR 3 Cb -0.31 -1.50 -0.03 0.00 1.34 0.00 0.00 72.50 72.00 1ix9 s THR 3 CO 0.38 -0.66 1.46 -0.22 -0.54 0.00 0.00 174.62 175.04 1ix9 s LEU 4 N -2.69 4.18 0.35 4.79 2.96 -1.26 -4.98 118.68 122.04 1ix9 s LEU 4 Ca 0.08 1.87 -0.27 0.00 -0.22 0.00 0.00 54.13 55.60 1ix9 s LEU 4 Cb -0.00 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.06 1ix9 s LEU 4 CO -0.01 -0.90 1.11 -2.16 -1.32 0.00 0.00 176.35 173.07 1ix9 s PRO 5 N 3.89 4.32 0.47 0.98 0.04 -1.26 -4.99 135.00 138.45 1ix9 s PRO 5 Ca 0.64 1.75 -0.24 0.00 0.04 0.00 0.00 61.00 63.20 1ix9 s PRO 5 Cb -0.26 -2.85 -0.07 0.00 0.04 0.00 0.00 34.50 31.35 1ix9 s PRO 5 CO 0.23 -0.06 1.28 -1.54 0.04 0.00 0.00 177.00 176.95 1ix9 s SER 6 N -1.13 5.91 0.75 6.66 1.04 -1.26 -5.00 113.70 120.67 1ix9 s SER 6 Ca 0.52 2.58 -0.11 0.00 0.48 0.00 0.00 55.95 59.43 1ix9 s SER 6 Cb -0.29 -2.63 0.04 0.00 0.10 0.00 0.00 66.02 63.24 1ix9 s SER 6 CO 0.37 -1.12 1.08 -0.76 0.98 0.00 0.00 173.24 173.79 1ix9 s LEU 7 N -2.99 3.04 0.00 2.42 1.43 -1.26 -4.94 118.68 116.37 1ix9 s LEU 7 Ca 0.64 1.72 0.22 0.00 -1.03 0.00 0.00 54.13 55.68 1ix9 s LEU 7 Cb -0.36 -4.48 1.30 0.00 0.03 0.00 0.00 46.19 42.68 1ix9 s LEU 7 CO 0.44 -1.82 1.81 -2.65 0.23 0.00 0.00 176.35 174.35 1ix9 n PRO 8 N -3.38 0.96 -3.58 1.29 -0.02 -1.26 -4.87 135.00 124.14 1ix9 n PRO 8 Ca 0.08 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.46 1ix9 n PRO 8 Cb 0.53 -1.35 -0.02 0.00 -0.02 0.00 0.00 33.50 32.64 1ix9 n PRO 8 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1ix9 s TYR 9 N -2.00 -0.40 0.84 6.00 -0.85 -1.26 -5.16 117.35 114.52 1ix9 s TYR 9 Ca 0.33 0.11 -0.11 0.00 -0.52 0.00 0.00 57.07 56.88 1ix9 s TYR 9 Cb 0.15 0.61 0.10 0.00 0.38 0.00 0.00 41.96 43.20 1ix9 s TYR 9 CO 0.25 -0.95 1.14 0.00 -1.52 0.00 0.00 175.55 174.47 1ix9 s ALA 10 N -3.75 1.82 0.49 9.51 0.00 -1.26 -4.94 121.76 123.64 1ix9 s ALA 10 Ca 0.05 0.54 0.29 0.00 0.00 0.00 0.00 51.96 52.84 1ix9 s ALA 10 Cb -0.03 -3.40 1.63 0.00 0.00 0.00 0.00 23.12 21.32 1ix9 s ALA 10 CO -0.06 -2.31 2.16 1.88 0.00 0.00 0.00 175.76 177.43 1ix9 h TYR 11 N -1.37 0.00 -0.37 0.00 0.05 -1.97 -1.64 116.97 111.67 1ix9 h TYR 11 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.34 1ix9 h TYR 11 Cb 1.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.00 1ix9 h TYR 11 CO 0.52 0.07 0.00 -0.40 -1.05 0.00 0.00 178.16 177.30 1ix9 n ASP 12 N -3.72 2.30 0.06 3.88 5.75 -1.26 -4.15 116.55 119.41 1ix9 n ASP 12 Ca -0.02 -1.92 0.11 0.00 -0.01 0.00 0.00 54.79 52.94 1ix9 n ASP 12 Cb 0.17 -0.24 0.45 0.00 -1.03 0.00 0.00 41.12 40.46 1ix9 n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ix9 n ALA 13 N 0.75 1.93 0.45 2.12 0.00 -0.62 -2.29 120.51 122.85 1ix9 n ALA 13 Ca 0.16 -0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.67 1ix9 n ALA 13 Cb 0.39 -1.37 0.13 0.00 0.00 0.00 0.00 19.45 18.59 1ix9 n ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ix9 n LEU 14 N -1.86 2.83 -4.76 0.00 4.77 -1.26 -4.59 117.00 112.13 1ix9 n LEU 14 Ca 0.04 -1.30 -0.39 0.00 -0.03 0.00 0.00 56.01 54.34 1ix9 n LEU 14 Cb 0.27 -0.11 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 1ix9 n LEU 14 CO 0.21 0.57 0.96 -1.61 -1.33 0.00 0.00 177.39 176.20 1ix9 s GLU 15 N -1.37 3.52 -0.13 3.23 0.41 -0.97 -0.72 118.70 122.67 1ix9 s GLU 15 Ca 0.26 2.16 0.09 0.00 -0.41 0.00 0.00 54.97 57.08 1ix9 s GLU 15 Cb 0.17 -2.45 0.49 0.00 -1.78 0.00 0.00 34.13 30.55 1ix9 s GLU 15 CO 0.24 -0.87 1.27 -0.35 -0.49 0.00 0.00 175.26 175.06 1ix9 n PRO 16 N -0.55 3.23 -0.08 0.39 -0.04 -1.26 -4.91 135.00 131.77 1ix9 n PRO 16 Ca 0.08 -1.88 -0.09 0.00 -0.04 0.00 0.00 63.50 61.56 1ix9 n PRO 16 Cb 0.45 -1.90 -0.04 0.00 -0.04 0.00 0.00 33.50 31.96 1ix9 n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ix9 h HIS 17 N 2.45 0.00 -3.41 0.54 3.86 -1.30 -3.46 115.15 113.83 1ix9 h HIS 17 Ca 0.00 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.55 1ix9 h HIS 17 Cb 1.31 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 29.58 1ix9 h HIS 17 CO 0.63 0.40 -0.67 -0.06 0.86 0.00 0.00 177.93 179.09 1ix9 s PHE 18 N -2.25 3.01 0.26 2.45 0.40 -0.81 -4.96 117.98 116.09 1ix9 s PHE 18 Ca -0.18 -0.15 -0.30 0.00 -0.60 0.00 0.00 56.93 55.71 1ix9 s PHE 18 Cb 0.03 -1.86 -0.09 0.00 0.51 0.00 0.00 43.02 41.61 1ix9 s PHE 18 CO 0.31 0.13 0.99 0.16 0.70 0.00 0.00 175.22 177.51 1ix9 s ASP 19 N -0.14 7.51 0.21 1.36 -4.77 -1.26 -3.39 116.67 116.19 1ix9 s ASP 19 Ca 0.03 2.03 -0.10 0.00 -3.30 0.00 0.00 52.55 51.22 1ix9 s ASP 19 Cb -0.13 -2.61 0.31 0.00 -1.09 0.00 0.00 42.92 39.40 1ix9 s ASP 19 CO 0.03 0.05 1.69 0.50 0.70 0.00 0.00 175.17 178.14 1ix9 h LYS 20 N 3.97 0.22 -0.34 2.11 3.64 -1.92 -1.87 116.57 122.38 1ix9 h LYS 20 Ca -0.46 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 1ix9 h LYS 20 Cb 1.20 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 1ix9 h LYS 20 CO 0.67 0.15 0.13 0.37 -2.27 0.00 0.00 179.45 178.50 1ix9 h GLN 21 N 0.23 0.52 -0.53 1.90 5.75 -1.93 -1.54 115.11 119.51 1ix9 h GLN 21 Ca 0.33 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.72 1ix9 h GLN 21 Cb 0.50 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.95 1ix9 h GLN 21 CO -0.44 0.53 0.29 1.15 -2.65 0.00 0.00 178.83 177.71 1ix9 h THR 22 N 0.40 1.18 -0.65 2.39 2.02 -1.88 -1.39 112.91 114.97 1ix9 h THR 22 Ca 0.11 -0.44 0.11 0.00 0.77 0.00 0.00 66.41 66.96 1ix9 h THR 22 Cb 0.21 0.51 -0.08 0.00 -1.74 0.00 0.00 68.15 67.05 1ix9 h THR 22 CO -0.01 0.19 0.23 0.24 0.37 0.00 0.00 175.52 176.54 1ix9 h MET 23 N 0.70 0.37 -0.25 6.66 2.86 -0.93 0.22 114.93 124.57 1ix9 h MET 23 Ca 0.19 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.75 1ix9 h MET 23 Cb 0.04 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 1ix9 h MET 23 CO -0.03 0.25 -0.05 1.49 1.06 0.00 0.00 176.91 179.63 1ix9 h GLU 24 N 0.39 0.48 0.08 1.72 4.81 -0.98 -1.59 114.58 119.49 1ix9 h GLU 24 Ca 0.34 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1ix9 h GLU 24 Cb 0.47 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1ix9 h GLU 24 CO -0.36 0.69 -0.04 0.82 -0.73 0.00 0.00 179.01 179.40 1ix9 h ILE 25 N 0.23 0.95 -0.82 2.32 2.04 -0.95 -0.75 117.51 120.53 1ix9 h ILE 25 Ca 0.07 -0.08 0.06 0.00 1.00 0.00 0.00 64.86 65.90 1ix9 h ILE 25 Cb 0.51 1.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 1ix9 h ILE 25 CO 0.02 0.02 0.51 -0.74 0.00 0.00 0.00 178.15 177.96 1ix9 h HIS 26 N -0.14 0.94 0.38 1.37 2.76 -0.53 0.89 115.15 120.81 1ix9 h HIS 26 Ca -0.01 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1ix9 h HIS 26 Cb 0.11 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 28.77 1ix9 h HIS 26 CO -0.06 0.48 -0.18 1.25 -1.30 0.00 0.00 177.93 178.12 1ix9 h HIS 27 N 0.93 -0.47 0.00 5.26 -0.00 -1.22 -1.03 115.15 118.62 1ix9 h HIS 27 Ca 0.36 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.67 1ix9 h HIS 27 Cb 0.15 0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.71 1ix9 h HIS 27 CO -0.04 -0.17 -0.20 1.79 -0.00 0.00 0.00 177.93 179.31 1ix9 h THR 28 N -1.02 0.36 0.00 6.26 1.35 -1.02 -2.90 112.91 115.94 1ix9 h THR 28 Ca -0.05 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 64.39 1ix9 h THR 28 Cb 0.51 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 1ix9 h THR 28 CO 0.08 0.20 -0.02 0.29 -0.25 0.00 0.00 175.52 175.82 1ix9 n LYS 29 N -3.17 0.01 0.16 4.72 4.76 0.29 -4.43 118.16 120.51 1ix9 n LYS 29 Ca 0.03 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.33 1ix9 n LYS 29 Cb 0.58 -0.33 -0.08 0.00 -1.84 0.00 0.00 35.03 33.36 1ix9 n LYS 29 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1ix9 h HIS 30 N -0.02 -0.34 -0.55 2.13 3.86 -1.40 -1.12 115.15 117.72 1ix9 h HIS 30 Ca 0.00 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 1ix9 h HIS 30 Cb 0.02 0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.58 1ix9 h HIS 30 CO -0.01 -0.15 0.20 1.25 0.86 0.00 0.00 177.93 180.08 1ix9 h HIS 31 N -0.45 0.86 -0.90 2.45 -0.00 -1.22 -2.68 115.15 113.22 1ix9 h HIS 31 Ca -0.04 -0.08 0.10 0.00 -0.00 0.00 0.00 60.37 60.35 1ix9 h HIS 31 Cb 0.34 -0.25 -0.07 0.00 -0.00 0.00 0.00 27.41 27.42 1ix9 h HIS 31 CO -0.03 0.71 0.54 0.37 -0.00 0.00 0.00 177.93 179.52 1ix9 h GLN 32 N 0.75 0.87 -0.80 5.26 5.75 -1.33 -1.49 115.11 124.12 1ix9 h GLN 32 Ca 0.18 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 58.58 1ix9 h GLN 32 Cb 0.24 -0.20 -0.04 0.00 1.07 0.00 0.00 27.48 28.56 1ix9 h GLN 32 CO -0.01 0.58 0.33 1.15 -2.65 0.00 0.00 178.83 178.23 1ix9 h THR 33 N 0.90 1.26 -0.62 2.39 2.02 -0.88 -0.23 112.91 117.76 1ix9 h THR 33 Ca 0.43 -0.80 -0.03 0.00 0.77 0.00 0.00 66.41 66.78 1ix9 h THR 33 Cb 0.37 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 1ix9 h THR 33 CO -0.24 0.33 0.27 1.88 0.37 0.00 0.00 175.52 178.13 1ix9 h TYR 34 N 1.16 0.92 -0.23 3.16 0.05 -1.06 0.07 116.97 121.04 1ix9 h TYR 34 Ca 0.27 -0.06 0.05 0.00 0.05 0.00 0.00 58.73 59.04 1ix9 h TYR 34 Cb 0.20 -0.28 -0.05 0.00 1.01 0.00 0.00 36.73 37.61 1ix9 h TYR 34 CO 0.02 0.72 -0.09 0.28 -1.05 0.00 0.00 178.16 178.04 1ix9 h VAL 35 N 0.86 0.70 -0.35 -2.88 2.07 -0.90 -0.26 116.25 115.49 1ix9 h VAL 35 Ca 0.21 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.69 1ix9 h VAL 35 Cb 0.17 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1ix9 h VAL 35 CO -0.02 0.00 0.08 0.78 0.02 0.00 0.00 177.57 178.43 1ix9 h ASN 36 N -0.05 0.53 0.24 0.57 2.35 -0.71 -0.61 115.58 117.91 1ix9 h ASN 36 Ca 0.12 -0.23 -0.18 0.00 -0.55 0.00 0.00 56.30 55.46 1ix9 h ASN 36 Cb 0.23 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1ix9 h ASN 36 CO -0.27 0.63 -0.69 0.78 -1.65 0.00 0.00 177.43 176.24 1ix9 h ASN 37 N 0.41 0.47 -0.45 5.81 2.35 -0.89 -1.32 115.58 121.96 1ix9 h ASN 37 Ca 0.11 -0.30 -0.03 0.00 -0.55 0.00 0.00 56.30 55.53 1ix9 h ASN 37 Cb 0.31 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 1ix9 h ASN 37 CO 0.00 1.02 0.16 0.00 -1.65 0.00 0.00 177.43 176.97 1ix9 h ALA 38 N 0.98 0.59 -0.78 -0.83 0.00 -0.97 -2.48 119.26 115.76 1ix9 h ALA 38 Ca -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1ix9 h ALA 38 Cb 1.25 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 1ix9 h ALA 38 CO 0.12 0.22 0.41 -0.91 0.00 0.00 0.00 179.25 179.08 1ix9 h ASN 39 N 0.59 0.97 -0.53 0.00 2.35 -0.88 -0.27 115.58 117.82 1ix9 h ASN 39 Ca 0.15 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1ix9 h ASN 39 Cb 0.22 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 1ix9 h ASN 39 CO -0.01 0.80 0.30 0.00 -1.65 0.00 0.00 177.43 176.87 1ix9 h ALA 40 N 1.36 0.68 0.00 -0.83 0.00 -1.12 -2.13 119.26 117.22 1ix9 h ALA 40 Ca 0.27 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1ix9 h ALA 40 Cb 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ix9 h ALA 40 CO -0.04 0.18 -0.23 0.00 0.00 0.00 0.00 179.25 179.16 1ix9 h ALA 41 N 1.14 1.05 0.00 0.00 0.00 -0.95 -3.15 119.26 117.35 1ix9 h ALA 41 Ca 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ix9 h ALA 41 Cb 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ix9 h ALA 41 CO -0.03 0.29 -0.54 1.28 0.00 0.00 0.00 179.25 180.25 1ix9 n LEU 42 N -3.44 0.61 -0.27 0.00 4.77 -0.16 -4.34 117.00 114.16 1ix9 n LEU 42 Ca -0.00 0.19 0.03 0.00 -0.03 0.00 0.00 56.01 56.20 1ix9 n LEU 42 Cb 0.42 -0.22 0.24 0.00 -2.33 0.00 0.00 43.42 41.53 1ix9 n LEU 42 CO 0.33 -0.01 1.25 -0.33 -1.33 0.00 0.00 177.39 177.30 1ix9 h GLU 43 N 0.00 0.99 0.00 3.23 5.08 -1.36 0.38 114.58 122.91 1ix9 h GLU 43 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1ix9 h GLU 43 Cb 0.66 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1ix9 h GLU 43 CO 0.00 0.66 0.00 -1.13 -1.00 0.00 0.00 179.01 177.54 1ix9 n SER 44 N -4.46 0.00 -3.33 1.42 3.41 -1.26 -4.26 113.62 105.14 1ix9 n SER 44 Ca 0.12 -0.88 -0.26 0.00 -0.26 0.00 0.00 58.87 57.58 1ix9 n SER 44 Cb 0.14 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.02 1ix9 n SER 44 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ix9 n LEU 45 N -1.00 3.33 0.09 1.04 4.77 0.12 -4.94 117.00 120.42 1ix9 n LEU 45 Ca 0.21 -5.37 0.18 0.00 -0.03 0.00 0.00 56.01 51.00 1ix9 n LEU 45 Cb 0.09 -0.46 0.73 0.00 -2.33 0.00 0.00 43.42 41.46 1ix9 n LEU 45 CO 0.16 2.10 1.17 -0.65 -1.33 0.00 0.00 177.39 178.83 1ix9 h PRO 46 N 3.99 0.00 0.00 3.23 0.11 -1.74 0.85 132.00 138.44 1ix9 h PRO 46 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1ix9 h PRO 46 Cb 0.68 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1ix9 h PRO 46 CO 0.78 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.72 1ix9 n GLU 47 N -4.13 0.11 0.00 1.05 0.00 -1.26 -3.71 120.64 112.70 1ix9 n GLU 47 Ca 0.06 0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.29 1ix9 n GLU 47 Cb 0.49 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.43 1ix9 n GLU 47 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1ix9 n PHE 48 N -1.43 0.00 0.25 -1.84 3.72 -0.05 -4.85 117.46 113.25 1ix9 n PHE 48 Ca 0.08 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.56 1ix9 n PHE 48 Cb 0.26 0.00 0.64 0.00 -0.94 0.00 0.00 39.48 39.44 1ix9 n PHE 48 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ix9 h ALA 49 N 0.00 1.73 -0.35 4.37 0.00 -1.01 -2.76 119.26 121.24 1ix9 h ALA 49 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ix9 h ALA 49 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ix9 h ALA 49 CO 0.00 0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.45 1ix9 n ASN 50 N -4.25 3.06 -4.81 0.00 3.02 -1.26 -4.31 115.26 106.71 1ix9 n ASN 50 Ca -0.03 -1.90 -0.33 0.00 -0.03 0.00 0.00 54.58 52.30 1ix9 n ASN 50 Cb 0.17 -0.23 -0.02 0.00 -0.61 0.00 0.00 39.78 39.09 1ix9 n ASN 50 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ix9 s LEU 51 N -1.14 3.66 0.48 3.41 1.43 -1.04 -5.00 118.68 120.48 1ix9 s LEU 51 Ca 0.30 1.80 -0.24 0.00 -1.03 0.00 0.00 54.13 54.96 1ix9 s LEU 51 Cb 0.17 -4.54 -0.07 0.00 0.03 0.00 0.00 46.19 41.78 1ix9 s LEU 51 CO 0.23 -0.89 1.42 -2.84 0.23 0.00 0.00 176.35 174.50 1ix9 s PRO 52 N -3.74 3.49 0.40 1.29 0.02 -1.26 -4.79 135.00 130.41 1ix9 s PRO 52 Ca 0.64 2.39 0.07 0.00 0.02 0.00 0.00 61.00 64.12 1ix9 s PRO 52 Cb -0.15 -2.53 0.84 0.00 0.02 0.00 0.00 34.50 32.69 1ix9 s PRO 52 CO 0.29 -0.96 2.03 -0.24 -0.33 0.00 0.00 177.00 177.79 1ix9 h VAL 53 N 2.02 1.08 0.00 3.83 3.04 -1.96 -0.37 116.25 123.89 1ix9 h VAL 53 Ca -0.51 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 64.98 1ix9 h VAL 53 Cb 1.28 0.43 0.00 0.00 -2.01 0.00 0.00 31.29 30.98 1ix9 h VAL 53 CO 0.60 0.11 0.00 1.05 -1.01 0.00 0.00 177.57 178.32 1ix9 h GLU 54 N 0.60 0.00 0.01 4.17 9.09 -1.93 -1.84 114.58 124.68 1ix9 h GLU 54 Ca 0.19 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.53 1ix9 h GLU 54 Cb 0.05 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.15 1ix9 h GLU 54 CO -0.05 0.00 -0.28 0.93 0.05 0.00 0.00 179.01 179.66 1ix9 h GLU 55 N 0.00 0.17 -0.85 1.06 4.39 -1.48 -3.34 114.58 114.53 1ix9 h GLU 55 Ca 0.00 -0.20 0.14 0.00 0.34 0.00 0.00 59.36 59.64 1ix9 h GLU 55 Cb 0.61 0.06 -0.09 0.00 -0.10 0.00 0.00 28.75 29.23 1ix9 h GLU 55 CO 0.00 0.96 0.44 1.25 -1.16 0.00 0.00 179.01 180.50 1ix9 h LEU 56 N -0.53 0.53 0.00 1.33 5.85 -0.65 -1.72 115.31 120.12 1ix9 h LEU 56 Ca -0.04 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1ix9 h LEU 56 Cb 1.07 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.11 1ix9 h LEU 56 CO 0.06 0.22 0.00 2.30 -0.34 0.00 0.00 178.44 180.68 1ix9 n ILE 57 N -4.87 0.37 1.27 4.05 -5.35 -0.74 -1.19 119.36 112.89 1ix9 n ILE 57 Ca 0.17 0.09 0.13 0.00 -0.27 0.00 0.00 62.75 62.87 1ix9 n ILE 57 Cb 0.43 -0.77 0.40 0.00 -1.74 0.00 0.00 39.64 37.96 1ix9 n ILE 57 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1ix9 n THR 58 N -1.25 0.00 -2.72 7.28 -2.24 -0.65 -3.90 114.28 110.80 1ix9 n THR 58 Ca 0.10 -0.13 -0.04 0.00 -2.27 0.00 0.00 64.05 61.71 1ix9 n THR 58 Cb 0.15 0.37 0.04 0.00 -2.10 0.00 0.00 70.33 68.79 1ix9 n THR 58 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1ix9 n LYS 59 N -0.63 1.93 0.17 -0.78 2.85 -0.33 -4.81 118.16 116.56 1ix9 n LYS 59 Ca 0.13 -3.58 0.06 0.00 -1.05 0.00 0.00 58.31 53.87 1ix9 n LYS 59 Cb 0.34 -1.66 0.55 0.00 -0.65 0.00 0.00 35.03 33.61 1ix9 n LYS 59 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 1ix9 h LEU 60 N 2.60 0.15 0.00 -5.58 3.38 -1.74 0.07 115.31 114.19 1ix9 h LEU 60 Ca -0.07 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1ix9 h LEU 60 Cb 1.29 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1ix9 h LEU 60 CO 0.29 0.14 0.00 0.47 0.09 0.00 0.00 178.44 179.44 1ix9 n ASP 61 N -4.48 0.00 0.00 -0.43 8.00 -1.26 -2.29 116.55 116.10 1ix9 n ASP 61 Ca -0.01 0.14 0.12 0.00 0.71 0.00 0.00 54.79 55.75 1ix9 n ASP 61 Cb 0.11 -0.34 0.30 0.00 -0.02 0.00 0.00 41.12 41.17 1ix9 n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ix9 n GLN 62 N -1.34 0.02 -1.61 -1.24 1.13 0.01 -4.96 117.38 109.40 1ix9 n GLN 62 Ca 0.08 0.01 -0.30 0.00 -1.94 0.00 0.00 57.00 54.84 1ix9 n GLN 62 Cb 0.17 -1.51 0.07 0.00 0.11 0.00 0.00 30.24 29.07 1ix9 n GLN 62 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1ix9 s LEU 63 N -3.10 2.82 0.68 1.08 1.43 -0.97 -5.02 118.68 115.60 1ix9 s LEU 63 Ca 0.11 1.38 -0.17 0.00 -1.03 0.00 0.00 54.13 54.42 1ix9 s LEU 63 Cb 0.17 -4.11 0.01 0.00 0.03 0.00 0.00 46.19 42.29 1ix9 s LEU 63 CO 0.68 -1.70 1.26 -2.84 0.23 0.00 0.00 176.35 173.98 1ix9 s PRO 64 N -5.15 2.38 0.28 1.29 0.02 -1.26 -4.88 135.00 127.69 1ix9 s PRO 64 Ca 0.59 1.95 -0.03 0.00 0.02 0.00 0.00 61.00 63.53 1ix9 s PRO 64 Cb -0.14 -1.84 0.37 0.00 0.02 0.00 0.00 34.50 32.92 1ix9 s PRO 64 CO 0.54 -1.70 1.95 0.00 -0.33 0.00 0.00 177.00 177.46 1ix9 h ALA 65 N 0.23 1.36 0.00 -1.55 0.00 -1.96 -0.59 119.26 116.74 1ix9 h ALA 65 Ca -0.50 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1ix9 h ALA 65 Cb 1.32 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1ix9 h ALA 65 CO 0.52 0.59 0.00 -0.40 0.00 0.00 0.00 179.25 179.96 1ix9 n ASP 66 N -4.39 0.00 -0.00 0.00 5.75 -1.26 -2.95 116.55 113.70 1ix9 n ASP 66 Ca 0.10 -1.12 0.05 0.00 -0.01 0.00 0.00 54.79 53.82 1ix9 n ASP 66 Cb 0.03 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.05 1ix9 n ASP 66 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ix9 n LYS 67 N -0.93 3.22 -0.04 0.11 4.76 -0.24 -4.74 118.16 120.30 1ix9 n LYS 67 Ca 0.20 -0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.53 1ix9 n LYS 67 Cb 0.09 -1.04 -0.05 0.00 -1.84 0.00 0.00 35.03 32.20 1ix9 n LYS 67 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 1ix9 h LYS 68 N 0.00 0.23 -0.09 1.97 1.57 -1.47 -2.33 116.57 116.46 1ix9 h LYS 68 Ca 0.00 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1ix9 h LYS 68 Cb 0.27 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1ix9 h LYS 68 CO 0.00 0.30 -0.13 1.15 -0.57 0.00 0.00 179.45 180.19 1ix9 h THR 69 N 0.11 1.39 -0.54 -0.16 2.02 -1.85 -0.38 112.91 113.50 1ix9 h THR 69 Ca 0.05 -1.38 -0.04 0.00 0.77 0.00 0.00 66.41 65.82 1ix9 h THR 69 Cb 0.15 2.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.62 1ix9 h THR 69 CO -0.01 0.39 0.18 1.62 0.37 0.00 0.00 175.52 178.08 1ix9 h VAL 70 N -0.20 1.21 0.12 3.16 3.04 -1.85 -0.95 116.25 120.77 1ix9 h VAL 70 Ca 0.01 -0.69 -0.27 0.00 -1.01 0.00 0.00 66.70 64.74 1ix9 h VAL 70 Cb 0.69 0.60 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 1ix9 h VAL 70 CO 0.03 0.26 -1.25 -0.07 -1.01 0.00 0.00 177.57 175.53 1ix9 h LEU 71 N 0.78 0.40 -0.47 3.16 3.38 -1.42 -1.09 115.31 120.06 1ix9 h LEU 71 Ca 0.18 -0.44 0.10 0.00 0.09 0.00 0.00 57.88 57.81 1ix9 h LEU 71 Cb 0.20 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.73 1ix9 h LEU 71 CO -0.01 1.34 -0.16 -0.09 0.09 0.00 0.00 178.44 179.61 1ix9 h ARG 72 N 0.07 -0.06 -0.06 1.13 2.43 -0.73 0.20 114.38 117.36 1ix9 h ARG 72 Ca -0.14 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.02 1ix9 h ARG 72 Cb 1.97 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 31.53 1ix9 h ARG 72 CO 0.20 -0.04 -0.03 -0.91 -1.51 0.00 0.00 179.97 177.68 1ix9 h ASN 73 N -0.06 0.14 0.15 -3.80 2.35 -1.17 -1.55 115.58 111.64 1ix9 h ASN 73 Ca 0.22 -0.41 -0.36 0.00 -0.55 0.00 0.00 56.30 55.20 1ix9 h ASN 73 Cb 0.40 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 1ix9 h ASN 73 CO -0.51 0.52 -1.95 0.78 -1.65 0.00 0.00 177.43 174.61 1ix9 h ASN 74 N -0.25 0.43 -0.26 5.81 2.35 -1.09 -1.33 115.58 121.25 1ix9 h ASN 74 Ca 0.01 -0.93 -0.11 0.00 -0.55 0.00 0.00 56.30 54.72 1ix9 h ASN 74 Cb 0.47 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 1ix9 h ASN 74 CO 0.01 1.83 -0.23 0.00 -1.65 0.00 0.00 177.43 177.38 1ix9 h ALA 75 N 0.11 0.89 -0.41 -0.83 0.00 -0.77 -0.60 119.26 117.65 1ix9 h ALA 75 Ca -0.41 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.19 1ix9 h ALA 75 Cb 2.04 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 19.63 1ix9 h ALA 75 CO 0.10 0.62 0.07 0.78 0.00 0.00 0.00 179.25 180.83 1ix9 h GLY 76 N 0.97 0.47 1.00 0.00 0.00 -1.17 0.22 103.07 104.56 1ix9 h GLY 76 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1ix9 h GLY 76 CO 0.06 -0.05 0.36 -1.33 0.00 0.00 0.00 176.54 175.58 1ix9 h GLY 77 N 0.19 0.79 0.95 4.60 0.00 -0.89 0.47 103.07 109.18 1ix9 h GLY 77 Ca 0.20 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 1ix9 h GLY 77 CO -0.27 0.30 0.08 0.84 0.00 0.00 0.00 176.54 177.50 1ix9 h HIS 78 N 0.75 0.73 -0.27 5.60 6.17 -0.80 -1.62 115.15 125.71 1ix9 h HIS 78 Ca 0.20 -0.10 0.00 0.00 0.71 0.00 0.00 60.37 61.19 1ix9 h HIS 78 Cb -0.06 -0.20 -0.01 0.00 2.52 0.00 0.00 27.41 29.65 1ix9 h HIS 78 CO -0.03 0.70 0.17 0.00 0.71 0.00 0.00 177.93 179.48 1ix9 h ALA 79 N 0.95 0.34 -0.30 5.26 0.00 -0.70 -1.66 119.26 123.15 1ix9 h ALA 79 Ca 0.13 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1ix9 h ALA 79 Cb 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ix9 h ALA 79 CO 0.01 -0.19 -0.17 -0.91 0.00 0.00 0.00 179.25 177.99 1ix9 h ASN 80 N 0.36 0.67 -0.43 0.00 2.35 -0.82 -1.70 115.58 116.00 1ix9 h ASN 80 Ca 0.10 -0.42 -0.12 0.00 -0.55 0.00 0.00 56.30 55.31 1ix9 h ASN 80 Cb -0.03 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 1ix9 h ASN 80 CO -0.02 0.94 -0.17 0.45 -1.65 0.00 0.00 177.43 176.99 1ix9 h HIS 81 N 0.39 1.03 -0.88 1.19 3.86 -1.26 -0.14 115.15 119.35 1ix9 h HIS 81 Ca 0.06 -0.23 0.03 0.00 -1.16 0.00 0.00 60.37 59.08 1ix9 h HIS 81 Cb 0.71 -0.25 -0.05 0.00 1.06 0.00 0.00 27.41 28.87 1ix9 h HIS 81 CO 0.06 1.01 0.57 0.77 0.86 0.00 0.00 177.93 181.20 1ix9 h SER 82 N 0.81 0.94 -0.31 2.45 0.02 -1.10 -1.14 113.55 115.22 1ix9 h SER 82 Ca 0.12 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1ix9 h SER 82 Cb 0.71 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 1ix9 h SER 82 CO 0.05 0.65 0.04 0.25 -1.14 0.00 0.00 176.83 176.68 1ix9 h LEU 83 N 1.10 0.50 -0.39 5.07 6.46 -1.08 -3.11 115.31 123.87 1ix9 h LEU 83 Ca 0.35 -0.28 0.05 0.00 -0.12 0.00 0.00 57.88 57.89 1ix9 h LEU 83 Cb 0.01 -0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 39.75 1ix9 h LEU 83 CO -0.12 0.65 0.12 0.15 -0.62 0.00 0.00 178.44 178.62 1ix9 h PHE 84 N 0.34 0.20 -0.65 1.25 3.57 -0.37 0.41 116.94 121.69 1ix9 h PHE 84 Ca 0.09 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1ix9 h PHE 84 Cb 0.37 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1ix9 h PHE 84 CO 0.03 0.07 0.27 -1.49 -2.23 0.00 0.00 178.31 174.96 1ix9 h TRP 85 N 0.26 0.98 0.00 0.41 -0.00 -1.23 -1.31 115.95 115.07 1ix9 h TRP 85 Ca 0.18 -0.07 0.00 0.00 -0.00 0.00 0.00 58.89 59.00 1ix9 h TRP 85 Cb 0.18 -0.30 0.00 0.00 -0.00 0.00 0.00 29.16 29.05 1ix9 h TRP 85 CO -0.16 0.76 0.00 0.87 -0.00 0.00 0.00 178.44 179.91 1ix9 h LYS 86 N 0.92 0.00 -0.44 0.49 1.57 -1.40 -3.05 116.57 114.65 1ix9 h LYS 86 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1ix9 h LYS 86 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1ix9 h LYS 86 CO -0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.27 1ix9 n GLY 87 N 0.16 1.12 3.26 3.86 0.00 0.10 -4.81 105.19 108.90 1ix9 n GLY 87 Ca 0.01 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 1ix9 n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ix9 s LEU 88 N -1.06 2.04 -0.29 0.99 1.43 -1.07 -0.82 118.68 119.90 1ix9 s LEU 88 Ca 0.31 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.78 1ix9 s LEU 88 Cb 0.16 -1.25 0.18 0.00 0.03 0.00 0.00 46.19 45.31 1ix9 s LEU 88 CO 0.22 0.27 1.18 -0.75 0.23 0.00 0.00 176.35 177.50 1ix9 s LYS 89 N -0.43 0.20 0.60 1.70 2.20 0.27 -4.69 119.74 119.58 1ix9 s LYS 89 Ca 0.05 0.31 -0.14 0.00 -0.36 0.00 0.00 55.97 55.83 1ix9 s LYS 89 Cb -0.10 0.06 -0.04 0.00 -1.51 0.00 0.00 37.83 36.23 1ix9 s LYS 89 CO 0.00 -0.04 1.03 0.15 -0.36 0.00 0.00 175.35 176.14 1ix9 s LYS 90 N 0.86 3.48 0.00 4.03 1.02 -1.26 -4.23 119.74 123.64 1ix9 s LYS 90 Ca -0.04 0.99 0.00 0.00 0.02 0.00 0.00 55.97 56.93 1ix9 s LYS 90 Cb -0.03 -2.06 0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1ix9 s LYS 90 CO -0.12 -0.66 0.00 0.41 -0.92 0.00 0.00 175.35 174.06 1ix9 n GLY 91 N -1.73 0.58 3.41 -3.33 0.00 -1.26 -5.06 105.19 97.80 1ix9 n GLY 91 Ca 0.07 -0.78 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 1ix9 n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ix9 s THR 92 N -2.11 2.20 -0.03 2.61 -4.23 -1.26 -5.06 115.64 107.75 1ix9 s THR 92 Ca 0.00 -2.12 0.03 0.00 -1.18 0.00 0.00 61.69 58.42 1ix9 s THR 92 Cb 0.00 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.75 1ix9 s THR 92 CO 0.00 -0.29 -0.11 -0.89 -0.54 0.00 0.00 174.62 172.79 1ix9 s THR 93 N -2.11 0.98 -0.07 3.99 2.01 -1.26 -4.85 115.64 114.33 1ix9 s THR 93 Ca 0.22 -0.46 -0.30 0.00 0.31 0.00 0.00 61.69 61.47 1ix9 s THR 93 Cb -0.06 -0.87 -0.05 0.00 0.01 0.00 0.00 72.50 71.54 1ix9 s THR 93 CO 0.10 0.30 1.56 -0.22 -0.69 0.00 0.00 174.62 175.68 1ix9 s LEU 94 N 0.23 4.29 0.00 4.42 2.96 -1.26 -4.76 118.68 124.56 1ix9 s LEU 94 Ca -0.05 2.12 -0.16 0.00 -0.22 0.00 0.00 54.13 55.82 1ix9 s LEU 94 Cb -0.10 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 43.11 1ix9 s LEU 94 CO 0.01 -0.88 0.80 0.00 -1.32 0.00 0.00 176.35 174.96 1ix9 n GLN 95 N 6.95 0.83 0.00 1.98 10.64 -1.26 -4.88 117.38 131.64 1ix9 n GLN 95 Ca 0.16 -1.71 0.00 0.00 -1.83 0.00 0.00 57.00 53.63 1ix9 n GLN 95 Cb 0.43 2.19 0.00 0.00 -0.86 0.00 0.00 30.24 32.00 1ix9 n GLN 95 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ix9 n GLY 96 N -0.55 1.21 0.36 2.61 0.00 -1.26 -2.56 105.19 105.00 1ix9 n GLY 96 Ca -0.05 -0.57 0.02 0.00 0.00 0.00 0.00 46.02 45.41 1ix9 n GLY 96 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ix9 h ASP 97 N 8.35 0.90 -0.47 1.61 3.32 -1.99 -1.89 116.42 126.25 1ix9 h ASP 97 Ca 0.00 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 1ix9 h ASP 97 Cb 0.00 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1ix9 h ASP 97 CO 0.00 0.62 0.04 0.25 -1.72 0.00 0.00 179.24 178.44 1ix9 h LEU 98 N 1.05 0.78 -0.40 1.55 5.85 -1.92 -0.11 115.31 122.10 1ix9 h LEU 98 Ca 0.32 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1ix9 h LEU 98 Cb -0.00 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 1ix9 h LEU 98 CO -0.09 0.86 0.22 0.50 -0.34 0.00 0.00 178.44 179.59 1ix9 h LYS 99 N 0.66 0.43 -0.67 1.25 3.64 -1.17 -0.52 116.57 120.20 1ix9 h LYS 99 Ca 0.14 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1ix9 h LYS 99 Cb 0.44 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 1ix9 h LYS 99 CO 0.02 0.29 0.32 0.00 -2.27 0.00 0.00 179.45 177.80 1ix9 h ALA 100 N 1.19 1.31 -0.44 5.00 0.00 -1.04 -0.76 119.26 124.52 1ix9 h ALA 100 Ca 0.16 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1ix9 h ALA 100 Cb 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1ix9 h ALA 100 CO -0.09 0.54 -0.24 0.00 0.00 0.00 0.00 179.25 179.46 1ix9 h ALA 101 N 1.41 0.74 -0.49 0.00 0.00 -0.53 -0.10 119.26 120.29 1ix9 h ALA 101 Ca 0.23 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1ix9 h ALA 101 Cb 0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1ix9 h ALA 101 CO -0.03 0.66 0.25 0.82 0.00 0.00 0.00 179.25 180.95 1ix9 h ILE 102 N 0.78 1.18 -0.60 0.00 2.04 -0.73 0.19 117.51 120.37 1ix9 h ILE 102 Ca 0.10 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1ix9 h ILE 102 Cb 0.80 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 1ix9 h ILE 102 CO 0.07 0.20 0.39 -0.33 0.00 0.00 0.00 178.15 178.47 1ix9 h GLU 103 N 0.65 0.80 -0.27 2.37 5.08 -0.91 0.26 114.58 122.56 1ix9 h GLU 103 Ca 0.17 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1ix9 h GLU 103 Cb 0.09 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1ix9 h GLU 103 CO -0.02 0.54 0.14 -0.09 -1.00 0.00 0.00 179.01 178.58 1ix9 h ARG 104 N 0.81 0.29 0.00 2.33 2.43 -0.70 0.65 114.38 120.20 1ix9 h ARG 104 Ca 0.22 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.27 1ix9 h ARG 104 Cb -0.07 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 1ix9 h ARG 104 CO -0.05 0.19 -0.97 -0.44 -1.51 0.00 0.00 179.97 177.20 1ix9 h ASP 105 N 0.30 0.00 -0.00 -3.80 3.32 -0.63 -3.33 116.42 112.27 1ix9 h ASP 105 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1ix9 h ASP 105 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1ix9 h ASP 105 CO -0.07 0.40 -0.25 0.49 -1.72 0.00 0.00 179.24 178.10 1ix9 n PHE 106 N -2.96 0.00 0.00 4.55 3.72 0.05 -4.98 117.46 117.85 1ix9 n PHE 106 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1ix9 n PHE 106 Cb 0.73 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.27 1ix9 n PHE 106 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ix9 n GLY 107 N 0.97 2.48 3.48 1.37 0.00 0.22 -4.56 105.19 109.15 1ix9 n GLY 107 Ca 0.02 -0.39 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 1ix9 n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ix9 s SER 108 N 0.19 -0.42 0.21 1.61 1.04 -1.22 -4.79 113.70 110.31 1ix9 s SER 108 Ca 0.00 0.00 -0.10 0.00 0.48 0.00 0.00 55.95 56.33 1ix9 s SER 108 Cb 0.00 0.44 0.15 0.00 0.10 0.00 0.00 66.02 66.71 1ix9 s SER 108 CO 0.00 -0.71 1.85 0.58 0.98 0.00 0.00 173.24 175.93 1ix9 h VAL 109 N 2.00 1.22 -0.21 5.02 2.07 -1.91 -2.32 116.25 122.12 1ix9 h VAL 109 Ca -0.25 -0.49 -0.09 0.00 0.82 0.00 0.00 66.70 66.69 1ix9 h VAL 109 Cb 1.26 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1ix9 h VAL 109 CO 0.33 0.23 -0.26 0.44 0.02 0.00 0.00 177.57 178.33 1ix9 h ASP 110 N 1.03 0.40 -0.42 0.57 3.32 -1.96 0.27 116.42 119.62 1ix9 h ASP 110 Ca 0.27 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1ix9 h ASP 110 Cb -0.02 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1ix9 h ASP 110 CO -0.05 0.65 0.17 0.78 -1.72 0.00 0.00 179.24 179.07 1ix9 h ASN 111 N 0.35 0.58 -0.27 6.45 2.35 -1.78 -0.94 115.58 122.32 1ix9 h ASN 111 Ca 0.05 -0.17 0.04 0.00 -0.55 0.00 0.00 56.30 55.67 1ix9 h ASN 111 Cb 0.64 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.83 1ix9 h ASN 111 CO 0.05 0.60 0.05 0.15 -1.65 0.00 0.00 177.43 176.62 1ix9 h PHE 112 N 0.54 0.08 -0.68 1.19 3.57 -0.87 -1.25 116.94 119.52 1ix9 h PHE 112 Ca 0.14 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 1ix9 h PHE 112 Cb 0.20 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1ix9 h PHE 112 CO 0.00 0.01 0.32 0.87 -2.23 0.00 0.00 178.31 177.29 1ix9 h LYS 113 N 0.15 0.97 -0.73 1.11 1.57 -0.72 0.50 116.57 119.41 1ix9 h LYS 113 Ca 0.13 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1ix9 h LYS 113 Cb 0.14 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1ix9 h LYS 113 CO -0.17 0.77 0.41 0.00 -0.57 0.00 0.00 179.45 179.89 1ix9 h ALA 114 N 1.15 0.93 -0.50 3.86 0.00 -0.97 0.99 119.26 124.73 1ix9 h ALA 114 Ca 0.23 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 1ix9 h ALA 114 Cb 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1ix9 h ALA 114 CO -0.03 0.43 -0.19 0.93 0.00 0.00 0.00 179.25 180.39 1ix9 h GLU 115 N 1.00 1.01 -0.43 0.00 4.39 -0.70 -0.28 114.58 119.57 1ix9 h GLU 115 Ca 0.26 -0.42 -0.02 0.00 0.34 0.00 0.00 59.36 59.52 1ix9 h GLU 115 Cb 0.01 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1ix9 h GLU 115 CO -0.04 1.10 0.20 0.35 -1.16 0.00 0.00 179.01 179.45 1ix9 h PHE 116 N 0.87 0.63 -0.93 4.33 3.57 -0.62 -1.08 116.94 123.72 1ix9 h PHE 116 Ca 0.12 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1ix9 h PHE 116 Cb 0.77 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 39.27 1ix9 h PHE 116 CO 0.05 0.53 0.60 0.93 -2.23 0.00 0.00 178.31 178.19 1ix9 h GLU 117 N 0.56 1.23 -0.32 1.11 5.08 -0.59 0.32 114.58 121.96 1ix9 h GLU 117 Ca 0.15 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1ix9 h GLU 117 Cb 0.14 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1ix9 h GLU 117 CO -0.02 0.83 0.08 -0.22 -1.00 0.00 0.00 179.01 178.68 1ix9 h LYS 118 N 1.26 0.52 -0.54 2.33 3.64 -0.86 -1.11 116.57 121.81 1ix9 h LYS 118 Ca 0.34 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.52 1ix9 h LYS 118 Cb -0.12 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 1ix9 h LYS 118 CO -0.07 0.58 0.07 0.00 -2.27 0.00 0.00 179.45 177.77 1ix9 h ALA 119 N 0.92 0.72 -0.51 5.00 0.00 -0.83 -0.70 119.26 123.86 1ix9 h ALA 119 Ca 0.10 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1ix9 h ALA 119 Cb 0.30 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ix9 h ALA 119 CO 0.00 0.48 0.02 0.00 0.00 0.00 0.00 179.25 179.75 1ix9 h ALA 120 N 0.98 1.08 0.00 0.00 0.00 -0.90 -2.87 119.26 117.56 1ix9 h ALA 120 Ca 0.16 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 1ix9 h ALA 120 Cb 0.43 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1ix9 h ALA 120 CO 0.01 0.58 -0.86 0.00 0.00 0.00 0.00 179.25 178.98 1ix9 h ALA 121 N 1.24 0.57 -0.00 0.00 0.00 -0.90 -3.31 119.26 116.86 1ix9 h ALA 121 Ca 0.16 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1ix9 h ALA 121 Cb 0.44 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ix9 h ALA 121 CO 0.02 1.00 -0.16 0.43 0.00 0.00 0.00 179.25 180.53 1ix9 n SER 122 N -3.58 0.27 -4.55 0.00 7.64 -0.29 -4.73 113.62 108.37 1ix9 n SER 122 Ca -0.02 -0.05 -0.40 0.00 1.01 0.00 0.00 58.87 59.41 1ix9 n SER 122 Cb 0.81 -0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.81 1ix9 n SER 122 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1ix9 s ARG 123 N -2.82 3.04 0.05 1.43 6.06 -1.10 -4.98 118.95 120.63 1ix9 s ARG 123 Ca 0.18 0.06 -0.28 0.00 -2.50 0.00 0.00 55.73 53.20 1ix9 s ARG 123 Cb 0.19 -4.23 -0.05 0.00 0.06 0.00 0.00 34.95 30.92 1ix9 s ARG 123 CO 0.55 -2.30 0.88 0.12 -2.50 0.00 0.00 175.30 172.06 1ix9 s PHE 124 N 6.72 3.73 0.00 5.12 5.36 -1.26 -4.74 117.98 132.91 1ix9 s PHE 124 Ca 0.46 1.63 0.00 0.00 -0.96 0.00 0.00 56.93 58.05 1ix9 s PHE 124 Cb -0.10 -2.97 0.00 0.00 -0.34 0.00 0.00 43.02 39.61 1ix9 s PHE 124 CO 0.17 0.17 0.00 0.41 -1.46 0.00 0.00 175.22 174.51 1ix9 n GLY 125 N 2.52 -0.56 3.85 13.12 0.00 -1.26 -4.91 105.19 117.94 1ix9 n GLY 125 Ca 0.01 -1.30 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 1ix9 n GLY 125 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ix9 s SER 126 N -4.00 6.76 0.00 1.61 0.01 -1.26 -4.81 113.70 112.01 1ix9 s SER 126 Ca 0.00 1.07 0.00 0.00 1.31 0.00 0.00 55.95 58.33 1ix9 s SER 126 Cb 0.00 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.94 1ix9 s SER 126 CO 0.00 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.25 1ix9 n GLY 127 N 0.28 -0.59 2.96 3.44 0.00 -1.26 -0.90 105.19 109.14 1ix9 n GLY 127 Ca -0.02 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 1ix9 n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ix9 s TRP 128 N -3.00 0.14 -0.07 1.61 0.52 -0.55 -0.92 118.94 116.66 1ix9 s TRP 128 Ca 0.00 -0.29 -0.00 0.00 0.02 0.00 0.00 56.10 55.83 1ix9 s TRP 128 Cb 0.00 -0.11 -0.03 0.00 -1.15 0.00 0.00 33.47 32.18 1ix9 s TRP 128 CO 0.00 -0.14 -0.04 0.00 0.02 0.00 0.00 176.95 176.79 1ix9 s ALA 129 N -0.95 3.12 0.04 0.98 0.00 -0.44 -1.14 121.76 123.37 1ix9 s ALA 129 Ca -0.10 -0.85 0.03 0.00 0.00 0.00 0.00 51.96 51.03 1ix9 s ALA 129 Cb -0.06 -1.34 -0.02 0.00 0.00 0.00 0.00 23.12 21.69 1ix9 s ALA 129 CO -0.00 0.58 -0.10 -1.58 0.00 0.00 0.00 175.76 174.66 1ix9 s TRP 130 N -0.85 0.84 -0.30 0.00 0.52 0.37 -0.36 118.94 119.16 1ix9 s TRP 130 Ca 0.13 -0.38 -0.12 0.00 0.02 0.00 0.00 56.10 55.75 1ix9 s TRP 130 Cb -0.11 -0.50 -0.04 0.00 -1.15 0.00 0.00 33.47 31.67 1ix9 s TRP 130 CO 0.02 -0.02 0.24 -1.17 0.02 0.00 0.00 176.95 176.04 1ix9 s LEU 131 N -1.20 4.17 0.28 2.99 2.96 -0.70 -1.85 118.68 125.34 1ix9 s LEU 131 Ca -0.04 -0.08 0.10 0.00 -0.22 0.00 0.00 54.13 53.89 1ix9 s LEU 131 Cb -0.08 -2.19 -0.05 0.00 0.50 0.00 0.00 46.19 44.37 1ix9 s LEU 131 CO 0.01 -0.14 -0.15 0.68 -1.32 0.00 0.00 176.35 175.43 1ix9 s VAL 132 N 1.82 2.20 -0.26 1.68 -7.23 0.20 -0.08 120.40 118.73 1ix9 s VAL 132 Ca 0.08 -2.30 -0.06 0.00 -1.81 0.00 0.00 61.98 57.89 1ix9 s VAL 132 Cb -0.16 -2.34 -0.01 0.00 0.56 0.00 0.00 36.38 34.43 1ix9 s VAL 132 CO 0.11 -0.38 0.04 -0.22 -0.31 0.00 0.00 175.10 174.34 1ix9 s LEU 133 N -3.49 3.46 -0.52 1.32 2.96 0.10 -0.77 118.68 121.74 1ix9 s LEU 133 Ca 0.29 -0.47 -0.06 0.00 -0.22 0.00 0.00 54.13 53.67 1ix9 s LEU 133 Cb -0.02 -1.85 0.14 0.00 0.50 0.00 0.00 46.19 44.95 1ix9 s LEU 133 CO 0.13 -0.09 0.37 -0.54 -1.32 0.00 0.00 176.35 174.90 1ix9 s LYS 134 N 1.53 2.46 0.00 1.98 1.02 -0.37 -0.97 119.74 125.39 1ix9 s LYS 134 Ca 0.05 -2.03 0.00 0.00 0.02 0.00 0.00 55.97 54.00 1ix9 s LYS 134 Cb -0.16 -3.83 0.00 0.00 -0.52 0.00 0.00 37.83 33.32 1ix9 s LYS 134 CO 0.01 -1.17 0.00 0.41 -0.92 0.00 0.00 175.35 173.69 1ix9 n GLY 135 N 4.39 2.80 0.00 -3.33 0.00 -1.26 -1.09 105.19 106.70 1ix9 n GLY 135 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1ix9 n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ix9 n ASP 136 N 0.18 0.00 -4.09 1.61 9.92 -1.26 -5.18 116.55 117.73 1ix9 n ASP 136 Ca 0.00 0.00 -0.25 0.00 -0.53 0.00 0.00 54.79 54.01 1ix9 n ASP 136 Cb 0.00 0.00 -0.16 0.00 -0.64 0.00 0.00 41.12 40.32 1ix9 n ASP 136 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1ix9 s LYS 137 N 0.00 1.76 0.38 -1.24 2.20 -0.25 -5.12 119.74 117.48 1ix9 s LYS 137 Ca 0.00 -0.54 -0.24 0.00 -0.36 0.00 0.00 55.97 54.83 1ix9 s LYS 137 Cb 0.00 -1.49 -0.09 0.00 -1.51 0.00 0.00 37.83 34.74 1ix9 s LYS 137 CO 0.00 0.16 1.01 -0.51 -0.36 0.00 0.00 175.35 175.65 1ix9 s LEU 138 N 0.27 4.18 0.04 5.43 1.43 -1.26 -1.24 118.68 127.53 1ix9 s LEU 138 Ca -0.08 1.96 -0.13 0.00 -1.03 0.00 0.00 54.13 54.84 1ix9 s LEU 138 Cb -0.13 -4.16 0.02 0.00 0.03 0.00 0.00 46.19 41.95 1ix9 s LEU 138 CO 0.03 -0.36 0.30 0.00 0.23 0.00 0.00 176.35 176.54 1ix9 s ALA 139 N -1.69 -0.66 -0.19 4.21 0.00 0.05 -4.90 121.76 118.59 1ix9 s ALA 139 Ca 0.56 -0.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.43 1ix9 s ALA 139 Cb -0.20 0.32 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 1ix9 s ALA 139 CO 0.25 -0.41 0.07 0.08 0.00 0.00 0.00 175.76 175.75 1ix9 s VAL 140 N -2.56 4.80 0.12 0.00 1.01 -1.26 -0.63 120.40 121.88 1ix9 s VAL 140 Ca -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 1ix9 s VAL 140 Cb -0.01 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1ix9 s VAL 140 CO -0.03 0.46 0.04 0.68 0.00 0.00 0.00 175.10 176.24 1ix9 s VAL 141 N 0.41 0.14 0.12 2.92 -7.23 -0.77 -5.00 120.40 110.98 1ix9 s VAL 141 Ca 0.03 -1.90 0.04 0.00 -1.81 0.00 0.00 61.98 58.34 1ix9 s VAL 141 Cb -0.12 -1.98 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 1ix9 s VAL 141 CO 0.00 -0.54 -0.11 -0.94 -0.31 0.00 0.00 175.10 173.21 1ix9 s SER 142 N -3.04 1.65 0.12 4.85 1.04 -1.26 -0.48 113.70 116.59 1ix9 s SER 142 Ca 0.22 -0.90 0.04 0.00 0.48 0.00 0.00 55.95 55.80 1ix9 s SER 142 Cb 0.07 -0.01 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 1ix9 s SER 142 CO 0.00 -0.28 -0.11 0.42 0.98 0.00 0.00 173.24 174.26 1ix9 s THR 143 N -2.78 1.10 0.33 2.02 -4.23 -0.29 -4.74 115.64 107.05 1ix9 s THR 143 Ca 0.10 -1.84 -0.18 0.00 -1.18 0.00 0.00 61.69 58.59 1ix9 s THR 143 Cb -0.01 -1.61 -0.09 0.00 1.34 0.00 0.00 72.50 72.13 1ix9 s THR 143 CO 0.00 -0.63 0.80 0.00 -0.54 0.00 0.00 174.62 174.26 1ix9 s ALA 144 N -2.81 3.27 0.00 3.99 0.00 -1.26 -1.48 121.76 123.47 1ix9 s ALA 144 Ca 0.11 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.26 1ix9 s ALA 144 Cb -0.01 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 20.21 1ix9 s ALA 144 CO 0.01 0.27 0.00 0.09 0.00 0.00 0.00 175.76 176.13 1ix9 n ASN 145 N -0.13 0.00 -1.44 0.00 3.02 -0.07 -0.99 115.26 115.65 1ix9 n ASN 145 Ca 0.03 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.56 1ix9 n ASN 145 Cb 0.53 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.95 1ix9 n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ix9 n GLN 146 N 14.00 2.90 -2.03 3.52 1.13 -1.26 -4.09 117.38 131.54 1ix9 n GLN 146 Ca 0.00 -3.04 -0.34 0.00 -1.94 0.00 0.00 57.00 51.68 1ix9 n GLN 146 Cb 0.00 -1.99 0.02 0.00 0.11 0.00 0.00 30.24 28.38 1ix9 n GLN 146 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1ix9 s ASP 147 N -1.74 5.42 0.06 1.08 1.01 -0.16 -4.07 116.67 118.27 1ix9 s ASP 147 Ca 0.48 2.13 0.06 0.00 0.71 0.00 0.00 52.55 55.94 1ix9 s ASP 147 Cb 0.40 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.74 1ix9 s ASP 147 CO 0.08 -1.43 -0.17 -0.55 0.21 0.00 0.00 175.17 173.32 1ix9 s SER 148 N -2.07 1.98 0.66 0.27 0.15 -1.26 -4.74 113.70 108.69 1ix9 s SER 148 Ca 0.71 -0.55 0.43 0.00 0.70 0.00 0.00 55.95 57.25 1ix9 s SER 148 Cb -0.23 -0.12 2.38 0.00 -1.71 0.00 0.00 66.02 66.34 1ix9 s SER 148 CO 0.33 0.04 2.36 1.55 1.20 0.00 0.00 173.24 178.72 1ix9 h PRO 149 N 4.61 0.00 0.00 5.44 0.13 -1.84 0.02 132.00 140.36 1ix9 h PRO 149 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1ix9 h PRO 149 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1ix9 h PRO 149 CO 0.42 0.00 0.00 -0.07 -0.23 0.00 0.00 178.00 178.12 1ix9 h LEU 150 N 0.00 0.00 -0.13 1.56 3.38 -1.88 -1.98 115.31 116.26 1ix9 h LEU 150 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ix9 h LEU 150 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1ix9 h LEU 150 CO 0.00 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.76 1ix9 n MET 151 N -2.80 0.18 0.00 1.13 2.81 -0.01 -4.28 117.12 114.15 1ix9 n MET 151 Ca -0.01 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1ix9 n MET 151 Cb 0.15 -1.74 0.00 0.00 -0.71 0.00 0.00 33.22 30.92 1ix9 n MET 151 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ix9 n GLY 152 N 1.03 -0.27 0.22 3.03 0.00 -0.74 -4.54 105.19 103.91 1ix9 n GLY 152 Ca 0.05 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.22 1ix9 n GLY 152 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ix9 h GLU 153 N 0.00 0.70 -0.78 1.61 4.39 -1.69 -0.52 114.58 118.30 1ix9 h GLU 153 Ca 0.00 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 1ix9 h GLU 153 Cb 0.00 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.54 1ix9 h GLU 153 CO 0.00 0.77 0.47 0.00 -1.16 0.00 0.00 179.01 179.09 1ix9 h ALA 154 N 0.90 1.36 0.00 3.43 0.00 -1.87 0.11 119.26 123.20 1ix9 h ALA 154 Ca 0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1ix9 h ALA 154 Cb 0.44 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ix9 h ALA 154 CO 0.02 0.55 -0.24 0.82 0.00 0.00 0.00 179.25 180.40 1ix9 h ILE 155 N 1.07 1.27 0.00 0.00 2.04 -1.78 -3.41 117.51 116.70 1ix9 h ILE 155 Ca 0.28 -2.03 0.00 0.00 1.00 0.00 0.00 64.86 64.11 1ix9 h ILE 155 Cb -0.05 2.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1ix9 h ILE 155 CO -0.05 0.43 -1.15 -1.54 0.00 0.00 0.00 178.15 175.84 1ix9 n SER 156 N -4.61 0.69 0.00 1.72 3.41 -0.21 -4.96 113.62 109.66 1ix9 n SER 156 Ca -0.12 -0.58 0.00 0.00 -0.26 0.00 0.00 58.87 57.91 1ix9 n SER 156 Cb 0.42 1.07 0.00 0.00 -0.26 0.00 0.00 64.21 65.45 1ix9 n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ix9 n GLY 157 N 1.43 0.61 3.36 5.00 0.00 0.37 -4.61 105.19 111.36 1ix9 n GLY 157 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 1ix9 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ix9 s ALA 158 N -2.59 0.78 0.29 4.61 0.00 -1.26 -4.94 121.76 118.65 1ix9 s ALA 158 Ca 0.00 -1.48 -0.21 0.00 0.00 0.00 0.00 51.96 50.28 1ix9 s ALA 158 Cb 0.00 1.27 0.03 0.00 0.00 0.00 0.00 23.12 24.42 1ix9 s ALA 158 CO 0.00 -0.70 0.75 -1.54 0.00 0.00 0.00 175.76 174.27 1ix9 s SER 159 N -3.15 -0.21 0.00 0.00 1.04 -1.26 -2.01 113.70 108.10 1ix9 s SER 159 Ca 0.33 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1ix9 s SER 159 Cb 0.03 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.88 1ix9 s SER 159 CO 0.14 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 173.60 1ix9 n GLY 160 N -0.47 2.35 3.63 7.32 0.00 -1.25 -4.84 105.19 111.94 1ix9 n GLY 160 Ca -0.05 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.53 1ix9 n GLY 160 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ix9 s PHE 161 N -2.45 3.24 0.17 1.61 5.36 -0.14 -3.98 117.98 121.79 1ix9 s PHE 161 Ca 0.00 1.07 -0.31 0.00 -0.96 0.00 0.00 56.93 56.73 1ix9 s PHE 161 Cb 0.00 -3.27 -0.10 0.00 -0.34 0.00 0.00 43.02 39.32 1ix9 s PHE 161 CO 0.00 -0.54 1.50 -2.14 -1.46 0.00 0.00 175.22 172.58 1ix9 s PRO 162 N 3.09 4.25 -0.20 10.12 0.02 -1.26 -0.72 135.00 150.30 1ix9 s PRO 162 Ca 0.37 2.28 -0.18 0.00 0.02 0.00 0.00 61.00 63.50 1ix9 s PRO 162 Cb -0.14 -3.17 -0.20 0.00 0.02 0.00 0.00 34.50 31.01 1ix9 s PRO 162 CO 0.11 -0.53 0.20 -0.89 -0.33 0.00 0.00 177.00 175.55 1ix9 n ILE 163 N 3.68 1.59 -3.93 2.83 2.08 0.89 -4.91 119.36 121.58 1ix9 n ILE 163 Ca 0.12 -0.19 -0.09 0.00 0.56 0.00 0.00 62.75 63.16 1ix9 n ILE 163 Cb 0.40 -1.96 -0.03 0.00 -0.75 0.00 0.00 39.64 37.30 1ix9 n ILE 163 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ix9 s MET 164 N -2.42 1.75 0.18 0.38 0.23 -1.12 -4.39 119.30 113.91 1ix9 s MET 164 Ca -0.28 -1.21 -0.22 0.00 -1.03 0.00 0.00 55.69 52.95 1ix9 s MET 164 Cb 0.07 0.54 0.06 0.00 -1.53 0.00 0.00 34.83 33.97 1ix9 s MET 164 CO 0.62 -0.77 0.60 0.20 -2.03 0.00 0.00 175.02 173.64 1ix9 s GLY 165 N -3.00 -0.50 -0.12 3.16 0.00 -1.26 -1.72 107.32 103.88 1ix9 s GLY 165 Ca 0.18 0.31 0.02 0.00 0.00 0.00 0.00 44.72 45.23 1ix9 s GLY 165 CO 0.09 0.08 -0.19 -2.27 0.00 0.00 0.00 173.10 170.81 1ix9 s LEU 166 N -2.78 1.92 -0.15 0.66 2.96 0.52 -4.90 118.68 116.91 1ix9 s LEU 166 Ca 0.03 -0.52 -0.29 0.00 -0.22 0.00 0.00 54.13 53.13 1ix9 s LEU 166 Cb -0.02 -1.27 -0.01 0.00 0.50 0.00 0.00 46.19 45.39 1ix9 s LEU 166 CO -0.10 0.05 1.21 -0.62 -1.32 0.00 0.00 176.35 175.58 1ix9 s ASP 167 N 0.88 7.00 -0.15 3.68 -1.08 -1.26 -1.33 116.67 124.40 1ix9 s ASP 167 Ca -0.07 1.67 0.17 0.00 -0.52 0.00 0.00 52.55 53.80 1ix9 s ASP 167 Cb -0.15 -2.54 0.40 0.00 -1.46 0.00 0.00 42.92 39.16 1ix9 s ASP 167 CO -0.01 -0.70 1.28 1.33 0.52 0.00 0.00 175.17 177.58 1ix9 n VAL 168 N 5.18 2.04 -1.74 1.11 0.24 -0.10 -4.86 118.33 120.21 1ix9 n VAL 168 Ca 0.13 -2.04 -0.38 0.00 -2.04 0.00 0.00 64.34 60.01 1ix9 n VAL 168 Cb 0.45 -0.22 0.05 0.00 -1.47 0.00 0.00 33.84 32.65 1ix9 n VAL 168 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 1ix9 n TRP 169 N -0.94 2.23 -0.10 6.34 7.02 -1.13 -4.41 117.44 126.45 1ix9 n TRP 169 Ca 0.18 0.43 0.05 0.00 -1.02 0.00 0.00 57.50 57.14 1ix9 n TRP 169 Cb 0.75 -2.35 0.39 0.00 -2.42 0.00 0.00 31.31 27.68 1ix9 n TRP 169 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 1ix9 h GLU 170 N 1.27 0.65 -0.03 -0.99 5.08 -1.94 -1.07 114.58 117.56 1ix9 h GLU 170 Ca -0.51 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 57.82 1ix9 h GLU 170 Cb 1.31 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1ix9 h GLU 170 CO 0.56 0.43 0.05 1.12 -1.00 0.00 0.00 179.01 180.17 1ix9 h HIS 171 N 0.67 0.00 0.00 4.33 2.07 -1.99 -0.55 115.15 119.68 1ix9 h HIS 171 Ca 0.23 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.75 1ix9 h HIS 171 Cb 0.10 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.08 1ix9 h HIS 171 CO -0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 1ix9 h ALA 172 N 1.93 1.00 0.00 6.11 0.00 -1.52 -3.37 119.26 123.41 1ix9 h ALA 172 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ix9 h ALA 172 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ix9 h ALA 172 CO -0.00 0.00 0.00 2.48 0.00 0.00 0.00 179.25 181.73 1ix9 n TYR 173 N -2.86 0.00 -0.00 0.00 0.18 -0.74 -4.93 117.16 108.80 1ix9 n TYR 173 Ca 0.02 0.00 -0.12 0.00 1.88 0.00 0.00 57.90 59.69 1ix9 n TYR 173 Cb 0.37 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.26 1ix9 n TYR 173 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 1ix9 h PHE 174 N 0.00 0.10 -0.50 -3.48 3.57 -1.30 0.02 116.94 115.35 1ix9 h PHE 174 Ca 0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1ix9 h PHE 174 Cb 0.55 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 1ix9 h PHE 174 CO 0.00 0.22 0.30 -0.07 -2.23 0.00 0.00 178.31 176.53 1ix9 h LEU 175 N -0.04 0.60 0.10 0.59 3.38 -1.86 0.04 115.31 118.11 1ix9 h LEU 175 Ca 0.02 -0.05 -0.33 0.00 0.09 0.00 0.00 57.88 57.61 1ix9 h LEU 175 Cb 0.16 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1ix9 h LEU 175 CO -0.00 0.48 -1.75 0.50 0.09 0.00 0.00 178.44 177.76 1ix9 h LYS 176 N 0.67 0.21 -0.00 1.13 3.64 -1.94 -3.41 116.57 116.86 1ix9 h LYS 176 Ca 0.18 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 1ix9 h LYS 176 Cb -0.01 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1ix9 h LYS 176 CO -0.03 1.03 -0.28 1.19 -2.27 0.00 0.00 179.45 179.09 1ix9 n PHE 177 N -3.38 0.00 0.00 1.91 3.01 -0.02 -5.07 117.46 113.90 1ix9 n PHE 177 Ca -0.22 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.24 1ix9 n PHE 177 Cb 1.05 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 1ix9 n PHE 177 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1ix9 n GLN 178 N -0.88 0.00 -0.41 -1.08 6.02 -0.00 -0.67 117.38 120.36 1ix9 n GLN 178 Ca 0.02 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.09 1ix9 n GLN 178 Cb 0.13 0.00 0.26 0.00 1.02 0.00 0.00 30.24 31.65 1ix9 n GLN 178 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1ix9 n ASN 179 N 4.85 3.49 -3.61 1.08 2.04 -1.26 -4.35 115.26 117.49 1ix9 n ASN 179 Ca 0.00 -2.23 -0.41 0.00 -0.44 0.00 0.00 54.58 51.50 1ix9 n ASN 179 Cb 0.00 -0.46 -0.01 0.00 -2.53 0.00 0.00 39.78 36.78 1ix9 n ASN 179 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1ix9 n ARG 180 N 0.90 3.87 -0.33 -3.83 1.74 0.16 -4.77 116.66 114.40 1ix9 n ARG 180 Ca 0.19 -3.14 0.03 0.00 -0.77 0.00 0.00 57.85 54.17 1ix9 n ARG 180 Cb 0.63 -2.85 0.18 0.00 -1.02 0.00 0.00 32.46 29.40 1ix9 n ARG 180 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1ix9 h ARG 181 N 5.24 0.93 -0.74 5.56 2.43 -1.83 -1.75 114.38 124.23 1ix9 h ARG 181 Ca 0.61 -0.06 0.12 0.00 -0.81 0.00 0.00 59.98 59.85 1ix9 h ARG 181 Cb 0.45 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 29.74 1ix9 h ARG 181 CO 1.64 0.62 0.49 -1.35 -1.51 0.00 0.00 179.97 179.86 1ix9 h PRO 182 N 0.96 0.50 -0.52 0.20 0.11 -1.97 -0.15 132.00 131.12 1ix9 h PRO 182 Ca 0.42 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 66.39 1ix9 h PRO 182 Cb 0.31 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.29 1ix9 h PRO 182 CO -0.22 0.33 -0.13 -0.44 -0.21 0.00 0.00 178.00 177.33 1ix9 h ASP 183 N 0.51 0.99 -0.53 -2.05 3.32 -1.73 -1.77 116.42 115.17 1ix9 h ASP 183 Ca 0.35 -0.33 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 1ix9 h ASP 183 Cb 0.67 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1ix9 h ASP 183 CO -0.12 1.11 0.14 0.22 -1.72 0.00 0.00 179.24 178.87 1ix9 h TYR 184 N 0.87 0.88 -0.70 4.55 3.20 -1.11 -2.31 116.97 122.36 1ix9 h TYR 184 Ca 0.13 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1ix9 h TYR 184 Cb 0.68 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.66 1ix9 h TYR 184 CO 0.04 0.76 0.44 0.82 -1.64 0.00 0.00 178.16 178.59 1ix9 h ILE 185 N 0.73 1.12 -0.63 1.81 2.04 -0.95 -1.43 117.51 120.20 1ix9 h ILE 185 Ca 0.17 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.74 1ix9 h ILE 185 Cb 0.32 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 1ix9 h ILE 185 CO -0.00 0.16 0.40 0.11 0.00 0.00 0.00 178.15 178.82 1ix9 h LYS 186 N 0.88 0.78 -0.04 2.37 1.57 -1.12 -2.44 116.57 118.58 1ix9 h LYS 186 Ca 0.27 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.95 1ix9 h LYS 186 Cb -0.02 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1ix9 h LYS 186 CO -0.09 0.52 -0.21 0.93 -0.57 0.00 0.00 179.45 180.03 1ix9 h GLU 187 N 0.81 0.06 -0.91 3.15 4.39 -0.76 -2.79 114.58 118.52 1ix9 h GLU 187 Ca 0.25 -0.01 0.18 0.00 0.34 0.00 0.00 59.36 60.11 1ix9 h GLU 187 Cb -0.03 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.54 1ix9 h GLU 187 CO -0.08 0.27 0.59 0.35 -1.16 0.00 0.00 179.01 178.98 1ix9 h PHE 188 N 0.06 0.73 0.00 4.33 3.57 -0.78 -0.59 116.94 124.26 1ix9 h PHE 188 Ca 0.01 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1ix9 h PHE 188 Cb 0.41 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.92 1ix9 h PHE 188 CO 0.00 0.22 -0.02 -1.49 -2.23 0.00 0.00 178.31 174.80 1ix9 h TRP 189 N 0.57 0.00 0.00 0.41 -0.00 -1.57 0.07 115.95 115.43 1ix9 h TRP 189 Ca 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.37 1ix9 h TRP 189 Cb 0.95 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.11 1ix9 h TRP 189 CO -0.00 0.02 0.00 0.09 -0.00 0.00 0.00 178.44 178.54 1ix9 n ASN 190 N -3.91 0.69 0.00 -3.49 3.02 -0.23 -4.19 115.26 107.15 1ix9 n ASN 190 Ca -0.03 0.58 0.00 0.00 -0.03 0.00 0.00 54.58 55.10 1ix9 n ASN 190 Cb 0.10 -0.76 0.00 0.00 -0.61 0.00 0.00 39.78 38.51 1ix9 n ASN 190 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1ix9 n VAL 191 N -2.16 0.00 -1.99 2.41 0.24 -0.35 -4.64 118.33 111.84 1ix9 n VAL 191 Ca 0.05 -0.35 -0.41 0.00 -2.04 0.00 0.00 64.34 61.59 1ix9 n VAL 191 Cb 0.39 1.15 -0.02 0.00 -1.47 0.00 0.00 33.84 33.88 1ix9 n VAL 191 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ix9 s VAL 192 N -0.35 2.61 -0.84 3.34 0.11 -0.13 -0.57 120.40 124.57 1ix9 s VAL 192 Ca 0.00 0.51 -0.22 0.00 -2.93 0.00 0.00 61.98 59.34 1ix9 s VAL 192 Cb 0.00 -3.32 0.08 0.00 -1.53 0.00 0.00 36.38 31.61 1ix9 s VAL 192 CO 0.00 0.08 1.16 0.21 -3.33 0.00 0.00 175.10 173.22 1ix9 s ASN 193 N 0.47 6.41 0.39 3.54 3.84 -0.00 -4.58 114.94 125.01 1ix9 s ASN 193 Ca 0.61 -1.41 0.28 0.00 0.21 0.00 0.00 52.86 52.55 1ix9 s ASN 193 Cb -0.42 -2.46 1.09 0.00 -0.55 0.00 0.00 41.25 38.91 1ix9 s ASN 193 CO 0.42 -1.36 1.83 -0.50 -2.79 0.00 0.00 177.10 174.69 1ix9 h TRP 194 N 9.40 0.00 -0.26 0.43 4.06 -1.87 -1.46 115.95 126.25 1ix9 h TRP 194 Ca -0.02 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.81 1ix9 h TRP 194 Cb 1.04 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.20 1ix9 h TRP 194 CO 1.12 0.00 -0.30 -0.44 -3.56 0.00 0.00 178.44 175.26 1ix9 h ASP 195 N 0.00 0.72 -0.41 -3.49 3.32 -1.89 -1.15 116.42 113.52 1ix9 h ASP 195 Ca 0.00 -0.49 -0.13 0.00 0.02 0.00 0.00 57.03 56.43 1ix9 h ASP 195 Cb 0.49 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1ix9 h ASP 195 CO 0.00 1.07 -0.25 -0.08 -1.72 0.00 0.00 179.24 178.26 1ix9 h GLU 196 N 0.40 0.90 -0.52 3.56 4.57 -1.83 -0.47 114.58 121.19 1ix9 h GLU 196 Ca 0.04 -0.41 0.06 0.00 -1.18 0.00 0.00 59.36 57.86 1ix9 h GLU 196 Cb 0.88 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.40 1ix9 h GLU 196 CO 0.07 1.06 0.22 0.00 -1.18 0.00 0.00 179.01 179.19 1ix9 h ALA 197 N 0.81 0.65 -0.74 2.92 0.00 -1.27 0.07 119.26 121.70 1ix9 h ALA 197 Ca 0.09 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1ix9 h ALA 197 Cb 0.82 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1ix9 h ALA 197 CO 0.07 -0.15 0.36 0.00 0.00 0.00 0.00 179.25 179.53 1ix9 h ALA 198 N 1.32 1.24 -0.57 0.00 0.00 -0.87 0.59 119.26 120.96 1ix9 h ALA 198 Ca 0.24 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1ix9 h ALA 198 Cb 0.21 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1ix9 h ALA 198 CO -0.21 0.59 -0.07 0.00 0.00 0.00 0.00 179.25 179.56 1ix9 h ALA 199 N 1.35 0.78 -0.54 0.00 0.00 -0.45 0.33 119.26 120.73 1ix9 h ALA 199 Ca 0.26 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1ix9 h ALA 199 Cb 0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1ix9 h ALA 199 CO -0.03 0.68 0.05 0.00 0.00 0.00 0.00 179.25 179.94 1ix9 h ARG 200 N 0.95 0.92 -0.74 0.00 3.08 -0.66 -1.42 114.38 116.51 1ix9 h ARG 200 Ca 0.15 -0.27 0.02 0.00 0.07 0.00 0.00 59.98 59.95 1ix9 h ARG 200 Cb 0.64 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.56 1ix9 h ARG 200 CO 0.04 0.91 0.48 0.35 -1.07 0.00 0.00 179.97 180.69 1ix9 h PHE 201 N 0.80 0.91 -0.40 3.04 3.57 -0.71 -0.43 116.94 123.72 1ix9 h PHE 201 Ca 0.16 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 1ix9 h PHE 201 Cb 0.47 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 1ix9 h PHE 201 CO 0.03 0.55 0.05 0.00 -2.23 0.00 0.00 178.31 176.71 1ix9 h ALA 202 N 1.29 1.33 0.10 2.41 0.00 -0.61 -3.12 119.26 120.66 1ix9 h ALA 202 Ca 0.28 -0.20 -0.29 0.00 0.00 0.00 0.00 54.91 54.71 1ix9 h ALA 202 Cb -0.06 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.58 1ix9 h ALA 202 CO -0.08 0.46 -1.20 0.00 0.00 0.00 0.00 179.25 178.44 1ix9 h ALA 203 N 1.46 0.06 0.00 0.00 0.00 -0.79 -3.47 119.26 116.53 1ix9 h ALA 203 Ca 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1ix9 h ALA 203 Cb 0.31 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ix9 h ALA 203 CO 0.01 0.74 0.00 1.63 0.00 0.00 0.00 179.25 181.62 1ix9 n LYS 204 N -3.76 -0.89 0.00 0.00 5.02 -0.21 -5.11 118.16 113.21 1ix9 n LYS 204 Ca -0.12 0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1ix9 n LYS 204 Cb 0.97 -3.98 0.00 0.00 -0.02 0.00 0.00 35.03 32.00 1ix9 n LYS 204 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24