#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ixh n PRO 5 N 0.00 0.00 -0.28 0.00 -0.02 -1.26 -4.05 135.00 129.39 3ixh n PRO 5 Ca 0.00 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.56 3ixh n PRO 5 Cb 0.00 -0.99 0.19 0.00 -0.02 0.00 0.00 33.50 32.69 3ixh n PRO 5 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3ixh h GLN 6 N 0.86 0.08 -0.63 -0.52 -0.00 -2.05 0.26 115.11 113.12 3ixh h GLN 6 Ca -0.29 -0.01 0.08 0.00 -0.00 0.00 0.00 58.65 58.43 3ixh h GLN 6 Cb 1.42 -0.02 -0.06 0.00 0.00 0.00 0.00 27.48 28.82 3ixh h GLN 6 CO 0.54 0.06 0.29 -0.56 0.00 0.00 0.00 178.83 179.16 3ixh h GLN 7 N 0.09 0.50 0.43 1.69 -0.00 -2.00 -1.89 115.11 113.93 3ixh h GLN 7 Ca 0.46 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.65 59.06 3ixh h GLN 7 Cb 0.85 -0.11 0.00 0.00 -0.00 0.00 0.00 27.48 28.22 3ixh h GLN 7 CO -0.74 0.33 -0.21 0.82 -0.00 0.00 0.00 178.83 179.04 3ixh h ILE 8 N 0.52 0.19 -0.64 1.86 2.04 -1.25 -2.93 117.51 117.30 3ixh h ILE 8 Ca 0.31 -0.61 0.11 0.00 1.00 0.00 0.00 64.86 65.67 3ixh h ILE 8 Cb 0.31 0.30 -0.12 0.00 -0.74 0.00 0.00 36.82 36.57 3ixh h ILE 8 CO -0.25 0.04 -0.33 0.78 0.00 0.00 0.00 178.15 178.39 3ixh h ASN 9 N -1.09 -1.14 0.05 1.72 4.21 -1.48 0.10 115.58 117.95 3ixh h ASN 9 Ca -0.06 0.23 0.01 0.00 1.21 0.00 0.00 56.30 57.69 3ixh h ASN 9 Cb 0.51 0.58 -0.03 0.00 -1.12 0.00 0.00 38.32 38.26 3ixh h ASN 9 CO 0.10 -0.30 -0.36 -0.78 -1.29 0.00 0.00 177.43 174.80 3ixh h ASP 10 N -0.13 -1.10 -0.62 5.81 3.58 -1.46 -2.22 116.42 120.28 3ixh h ASP 10 Ca 0.25 0.12 -0.04 0.00 0.42 0.00 0.00 57.03 57.78 3ixh h ASP 10 Cb 0.55 0.41 -0.03 0.00 1.72 0.00 0.00 39.33 41.99 3ixh h ASP 10 CO -0.71 -0.37 0.23 -0.29 -2.88 0.00 0.00 179.24 175.22 3ixh h ILE 11 N -0.49 1.24 0.36 2.25 6.09 -1.28 -1.71 117.51 123.96 3ixh h ILE 11 Ca 0.00 -0.76 -0.01 0.00 -1.37 0.00 0.00 64.86 62.72 3ixh h ILE 11 Cb 0.50 0.58 -0.01 0.00 0.47 0.00 0.00 36.82 38.36 3ixh h ILE 11 CO -0.21 0.30 -0.26 0.58 -3.07 0.00 0.00 178.15 175.48 3ixh h VAL 12 N 0.87 0.45 -0.55 2.19 2.07 -0.81 -0.91 116.25 119.56 3ixh h VAL 12 Ca 0.20 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.64 3ixh h VAL 12 Cb 0.24 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 3ixh h VAL 12 CO -0.01 0.00 0.03 0.45 0.02 0.00 0.00 177.57 178.06 3ixh h HIS 13 N -0.62 0.98 -0.83 1.57 3.86 -1.36 0.51 115.15 119.25 3ixh h HIS 13 Ca -0.03 -0.14 0.03 0.00 -1.16 0.00 0.00 60.37 59.07 3ixh h HIS 13 Cb 0.53 -0.27 -0.05 0.00 1.06 0.00 0.00 27.41 28.69 3ixh h HIS 13 CO -0.13 0.87 0.54 0.00 0.86 0.00 0.00 177.93 180.07 3ixh h ARG 14 N 0.85 1.03 0.09 2.45 3.08 -1.20 -3.12 114.38 117.57 3ixh h ARG 14 Ca 0.17 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 59.99 3ixh h ARG 14 Cb 0.46 -0.23 0.01 0.00 0.08 0.00 0.00 29.97 30.29 3ixh h ARG 14 CO 0.02 0.68 -0.75 1.15 -1.07 0.00 0.00 179.97 180.00 3ixh h THR 15 N 1.06 1.46 0.12 2.04 2.02 -0.79 -3.40 112.91 115.41 3ixh h THR 15 Ca 0.33 -2.45 -0.27 0.00 0.77 0.00 0.00 66.41 64.79 3ixh h THR 15 Cb -0.01 3.11 0.01 0.00 -1.74 0.00 0.00 68.15 69.51 3ixh h THR 15 CO -0.11 0.66 -1.21 0.40 0.37 0.00 0.00 175.52 175.64 3ixh h ILE 16 N -0.55 1.43 0.69 3.11 1.08 -0.99 -3.30 117.51 118.99 3ixh h ILE 16 Ca -0.15 -2.84 -0.03 0.00 -0.39 0.00 0.00 64.86 61.46 3ixh h ILE 16 Cb 1.49 2.82 -0.01 0.00 -3.07 0.00 0.00 36.82 38.05 3ixh h ILE 16 CO 0.08 0.84 -0.50 0.74 -0.69 0.00 0.00 178.15 178.61 3ixh h THR 17 N 0.13 0.00 -0.66 -0.27 2.02 -1.76 -1.75 112.91 110.62 3ixh h THR 17 Ca -0.14 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.18 3ixh h THR 17 Cb 1.91 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 68.21 3ixh h THR 17 CO 0.21 0.00 0.09 -0.65 0.37 0.00 0.00 175.52 175.54 3ixh h PRO 18 N -1.14 0.19 -0.57 6.66 0.11 -1.78 -1.21 132.00 134.27 3ixh h PRO 18 Ca -0.09 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 66.12 3ixh h PRO 18 Cb 0.94 -0.04 -0.11 0.00 0.11 0.00 0.00 31.00 31.89 3ixh h PRO 18 CO 0.05 0.13 -0.23 1.25 -0.21 0.00 0.00 178.00 178.98 3ixh h LEU 19 N 0.20 -0.82 -0.77 2.35 5.85 -1.60 0.22 115.31 120.73 3ixh h LEU 19 Ca 0.36 0.20 0.01 0.00 0.84 0.00 0.00 57.88 59.28 3ixh h LEU 19 Cb 0.58 0.46 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 3ixh h LEU 19 CO -0.50 -0.26 0.51 0.40 -0.34 0.00 0.00 178.44 178.26 3ixh h ILE 20 N -0.09 1.20 -0.12 4.05 2.04 -0.32 0.14 117.51 124.41 3ixh h ILE 20 Ca 0.26 -0.36 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3ixh h ILE 20 Cb 0.50 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 3ixh h ILE 20 CO -0.63 0.19 0.00 -0.08 0.00 0.00 0.00 178.15 177.63 3ixh h GLU 21 N 1.04 0.20 -0.03 2.37 4.81 -0.85 0.41 114.58 122.53 3ixh h GLU 21 Ca 0.28 -0.06 -0.24 0.00 -0.13 0.00 0.00 59.36 59.21 3ixh h GLU 21 Cb -0.12 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.25 3ixh h GLU 21 CO -0.06 0.45 -0.94 1.96 -0.73 0.00 0.00 179.01 179.69 3ixh h GLN 22 N -0.06 0.58 0.00 1.92 4.20 -0.40 -3.19 115.11 118.15 3ixh h GLN 22 Ca 0.03 -0.58 0.00 0.00 0.06 0.00 0.00 58.65 58.16 3ixh h GLN 22 Cb 0.36 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.29 3ixh h GLN 22 CO 0.01 1.20 -0.33 1.04 -0.67 0.00 0.00 178.83 180.08 3ixh n GLN 23 N -3.82 0.16 -3.28 1.46 1.13 0.48 -4.97 117.38 108.54 3ixh n GLN 23 Ca -0.08 0.08 -0.17 0.00 -1.94 0.00 0.00 57.00 54.89 3ixh n GLN 23 Cb 0.83 -1.63 0.07 0.00 0.11 0.00 0.00 30.24 29.62 3ixh n GLN 23 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3ixh n LYS 24 N -1.87 -5.95 -2.77 -1.09 5.02 0.09 -4.98 118.16 106.59 3ixh n LYS 24 Ca 0.05 0.69 -0.42 0.00 -2.02 0.00 0.00 58.31 56.61 3ixh n LYS 24 Cb 0.39 -5.27 -0.03 0.00 -0.02 0.00 0.00 35.03 30.10 3ixh n LYS 24 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ixh s ILE 25 N -3.28 4.80 0.23 -0.18 1.01 -0.91 -4.97 121.20 117.91 3ixh s ILE 25 Ca 0.22 1.86 -0.06 0.00 0.00 0.00 0.00 60.65 62.67 3ixh s ILE 25 Cb -0.10 -4.24 0.15 0.00 0.01 0.00 0.00 42.46 38.29 3ixh s ILE 25 CO 0.60 -0.02 1.78 -0.65 0.00 0.00 0.00 174.94 176.65 3ixh h PRO 26 N 7.27 1.09 -2.76 2.79 0.11 -1.88 -3.45 132.00 135.17 3ixh h PRO 26 Ca -0.28 -0.22 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 3ixh h PRO 26 Cb 1.12 -0.17 -0.24 0.00 0.11 0.00 0.00 31.00 31.82 3ixh h PRO 26 CO 0.87 0.92 -0.25 0.20 -0.21 0.00 0.00 178.00 179.53 3ixh s GLY 27 N -3.45 -0.30 -0.09 -0.55 0.00 -1.21 -0.05 107.32 101.67 3ixh s GLY 27 Ca -0.12 1.16 -0.10 0.00 0.00 0.00 0.00 44.72 45.67 3ixh s GLY 27 CO 0.83 1.04 0.28 -0.29 0.00 0.00 0.00 173.10 174.96 3ixh s MET 28 N 0.32 0.37 0.07 2.90 1.75 -0.50 -2.04 119.30 122.17 3ixh s MET 28 Ca -0.01 0.29 0.08 0.00 -1.25 0.00 0.00 55.69 54.80 3ixh s MET 28 Cb -0.03 0.17 -0.03 0.00 2.84 0.00 0.00 34.83 37.78 3ixh s MET 28 CO -0.01 -0.06 -0.21 0.00 -0.65 0.00 0.00 175.02 174.10 3ixh s ALA 29 N -0.07 1.76 -0.01 4.11 0.00 0.10 -0.97 121.76 126.69 3ixh s ALA 29 Ca -0.02 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.81 3ixh s ALA 29 Cb -0.03 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.81 3ixh s ALA 29 CO 0.01 0.38 0.01 0.08 0.00 0.00 0.00 175.76 176.23 3ixh s VAL 30 N -0.95 -0.01 -0.08 0.00 1.01 -0.23 -1.19 120.40 118.95 3ixh s VAL 30 Ca 0.07 0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.16 3ixh s VAL 30 Cb -0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 36.38 36.23 3ixh s VAL 30 CO 0.03 0.03 -0.23 0.00 0.00 0.00 0.00 175.10 174.93 3ixh s ALA 31 N 0.37 2.24 -0.17 5.51 0.00 -0.90 -1.05 121.76 127.75 3ixh s ALA 31 Ca -0.03 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 50.90 3ixh s ALA 31 Cb -0.05 -0.80 -0.02 0.00 0.00 0.00 0.00 23.12 22.25 3ixh s ALA 31 CO -0.01 0.35 -0.05 0.08 0.00 0.00 0.00 175.76 176.13 3ixh s VAL 32 N 0.08 3.62 -0.24 0.00 1.01 0.07 -1.52 120.40 123.40 3ixh s VAL 32 Ca -0.10 -0.44 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 3ixh s VAL 32 Cb -0.16 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 3ixh s VAL 32 CO 0.06 0.48 0.12 -0.63 0.00 0.00 0.00 175.10 175.12 3ixh s ILE 33 N 0.65 4.87 -0.19 2.22 1.09 0.18 -0.92 121.20 129.10 3ixh s ILE 33 Ca -0.03 0.01 -0.05 0.00 -1.10 0.00 0.00 60.65 59.48 3ixh s ILE 33 Cb -0.15 -3.27 0.07 0.00 -1.06 0.00 0.00 42.46 38.05 3ixh s ILE 33 CO 0.02 0.34 0.09 -0.47 -0.10 0.00 0.00 174.94 174.83 3ixh s TYR 34 N 1.29 0.25 -1.47 3.97 5.04 -0.23 -1.59 117.35 124.61 3ixh s TYR 34 Ca 0.06 -0.42 -0.11 0.00 -2.44 0.00 0.00 57.07 54.16 3ixh s TYR 34 Cb -0.14 -0.74 0.05 0.00 0.35 0.00 0.00 41.96 41.48 3ixh s TYR 34 CO 0.05 -0.56 0.94 1.04 -1.34 0.00 0.00 175.55 175.68 3ixh n GLN 35 N 5.26 -5.88 -1.22 4.97 6.02 -0.65 -2.16 117.38 123.72 3ixh n GLN 35 Ca -0.07 0.69 0.00 0.00 -0.01 0.00 0.00 57.00 57.61 3ixh n GLN 35 Cb 0.48 -5.61 0.00 0.00 1.02 0.00 0.00 30.24 26.13 3ixh n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ixh n GLY 36 N -1.70 0.43 2.93 1.08 0.00 -1.26 -5.06 105.19 101.61 3ixh n GLY 36 Ca 0.01 -0.98 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 3ixh n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ixh s LYS 37 N -2.46 1.04 0.19 1.61 1.02 -0.92 -5.14 119.74 115.08 3ixh s LYS 37 Ca 0.00 -0.18 -0.14 0.00 0.02 0.00 0.00 55.97 55.67 3ixh s LYS 37 Cb 0.00 -0.97 -0.07 0.00 -0.52 0.00 0.00 37.83 36.26 3ixh s LYS 37 CO 0.00 -0.05 0.59 -1.25 -0.92 0.00 0.00 175.35 173.72 3ixh s PRO 38 N 0.83 3.97 -0.05 -1.68 0.04 -1.26 -1.06 135.00 135.80 3ixh s PRO 38 Ca -0.12 0.50 0.02 0.00 0.04 0.00 0.00 61.00 61.44 3ixh s PRO 38 Cb -0.15 -2.82 0.01 0.00 0.04 0.00 0.00 34.50 31.58 3ixh s PRO 38 CO 0.01 0.41 -0.10 0.71 0.04 0.00 0.00 177.00 178.07 3ixh s TYR 39 N -1.59 1.17 0.15 0.56 1.51 -0.09 -4.96 117.35 114.09 3ixh s TYR 39 Ca 0.42 -0.37 0.08 0.00 -1.01 0.00 0.00 57.07 56.19 3ixh s TYR 39 Cb -0.14 -0.87 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 3ixh s TYR 39 CO 0.20 -0.19 -0.10 0.71 -1.11 0.00 0.00 175.55 175.06 3ixh s TYR 40 N 0.50 2.67 -0.12 2.71 2.02 -1.26 -0.75 117.35 123.13 3ixh s TYR 40 Ca -0.09 -0.20 -0.09 0.00 -0.37 0.00 0.00 57.07 56.32 3ixh s TYR 40 Cb -0.13 -1.35 0.04 0.00 -0.40 0.00 0.00 41.96 40.12 3ixh s TYR 40 CO 0.02 0.47 0.29 -0.06 -1.57 0.00 0.00 175.55 174.70 3ixh s PHE 41 N -1.48 -0.36 0.07 2.71 0.40 -0.22 -5.01 117.98 114.10 3ixh s PHE 41 Ca 0.23 0.85 0.04 0.00 -0.60 0.00 0.00 56.93 57.44 3ixh s PHE 41 Cb -0.10 0.11 -0.03 0.00 0.51 0.00 0.00 43.02 43.51 3ixh s PHE 41 CO 0.14 -0.20 -0.11 0.95 0.70 0.00 0.00 175.22 176.70 3ixh s THR 42 N 0.63 0.86 -0.03 0.64 -4.23 -1.26 -1.06 115.64 111.18 3ixh s THR 42 Ca -0.04 -1.30 -0.07 0.00 -1.18 0.00 0.00 61.69 59.10 3ixh s THR 42 Cb -0.05 -0.97 0.01 0.00 1.34 0.00 0.00 72.50 72.83 3ixh s THR 42 CO -0.04 -0.36 0.16 0.26 -0.54 0.00 0.00 174.62 174.10 3ixh s TRP 43 N -1.58 -0.08 0.00 3.99 0.51 -0.14 -5.02 118.94 116.61 3ixh s TRP 43 Ca -0.03 0.19 0.00 0.00 -2.12 0.00 0.00 56.10 54.14 3ixh s TRP 43 Cb -0.08 0.01 0.00 0.00 -0.81 0.00 0.00 33.47 32.59 3ixh s TRP 43 CO 0.01 -0.18 0.00 0.41 -0.51 0.00 0.00 176.95 176.68 3ixh n GLY 44 N 2.26 0.33 3.28 0.98 0.00 -1.26 -1.41 105.19 109.38 3ixh n GLY 44 Ca -0.17 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 44.69 3ixh n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ixh s TYR 45 N 0.00 2.33 0.01 1.61 1.51 0.93 -1.90 117.35 121.84 3ixh s TYR 45 Ca 0.00 -0.57 0.11 0.00 -1.01 0.00 0.00 57.07 55.60 3ixh s TYR 45 Cb 0.00 -1.52 -0.22 0.00 -0.11 0.00 0.00 41.96 40.11 3ixh s TYR 45 CO 0.00 -0.13 0.86 0.00 -1.11 0.00 0.00 175.55 175.17 3ixh h ALA 46 N 5.78 0.64 -2.80 3.71 0.00 -0.62 -3.20 119.26 122.78 3ixh h ALA 46 Ca -0.37 -1.29 -0.42 0.00 0.00 0.00 0.00 54.91 52.82 3ixh h ALA 46 Cb 1.15 0.29 -0.39 0.00 0.00 0.00 0.00 17.79 18.84 3ixh h ALA 46 CO 0.47 1.48 -0.71 0.34 0.00 0.00 0.00 179.25 180.83 3ixh s ASP 47 N -6.28 2.23 0.07 0.00 -1.08 -1.07 -1.61 116.67 108.93 3ixh s ASP 47 Ca -0.03 -0.63 -0.17 0.00 -0.52 0.00 0.00 52.55 51.20 3ixh s ASP 47 Cb 0.09 -0.03 -0.11 0.00 -1.46 0.00 0.00 42.92 41.40 3ixh s ASP 47 CO 0.82 -0.36 1.39 0.40 0.52 0.00 0.00 175.17 177.94 3ixh h ILE 48 N 6.38 1.32 -0.70 4.11 2.04 -1.85 -1.37 117.51 127.43 3ixh h ILE 48 Ca -0.16 -1.38 -0.00 0.00 1.00 0.00 0.00 64.86 64.31 3ixh h ILE 48 Cb 1.12 1.70 -0.03 0.00 -0.74 0.00 0.00 36.82 38.86 3ixh h ILE 48 CO 0.32 0.43 0.42 0.00 0.00 0.00 0.00 178.15 179.32 3ixh h ALA 49 N 0.67 0.89 -0.36 1.87 0.00 -1.97 -2.46 119.26 117.89 3ixh h ALA 49 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3ixh h ALA 49 Cb 0.77 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3ixh h ALA 49 CO 0.06 0.37 0.00 1.63 0.00 0.00 0.00 179.25 181.30 3ixh n LYS 50 N -4.54 2.12 -2.40 0.00 5.02 -1.22 -4.96 118.16 112.19 3ixh n LYS 50 Ca 0.06 -1.71 -0.14 0.00 -2.02 0.00 0.00 58.31 54.49 3ixh n LYS 50 Cb 0.06 -1.43 -0.01 0.00 -0.02 0.00 0.00 35.03 33.63 3ixh n LYS 50 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3ixh n LYS 51 N 0.91 -2.07 -2.49 1.97 5.02 -0.58 -4.96 118.16 115.96 3ixh n LYS 51 Ca 0.17 0.70 -0.43 0.00 -2.02 0.00 0.00 58.31 56.74 3ixh n LYS 51 Cb 0.45 -5.31 -0.02 0.00 -0.02 0.00 0.00 35.03 30.12 3ixh n LYS 51 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3ixh s GLN 52 N -4.98 4.28 0.70 1.97 1.11 -0.83 -4.97 119.66 116.94 3ixh s GLN 52 Ca 0.00 1.59 -0.12 0.00 0.01 0.00 0.00 55.36 56.84 3ixh s GLN 52 Cb 0.00 -3.68 0.02 0.00 -1.01 0.00 0.00 33.01 28.34 3ixh s GLN 52 CO 0.00 -0.61 1.07 -1.25 0.01 0.00 0.00 175.29 174.51 3ixh s PRO 53 N 3.06 2.79 0.19 2.91 0.04 -1.26 -0.02 135.00 142.70 3ixh s PRO 53 Ca 0.52 1.08 -0.30 0.00 0.04 0.00 0.00 61.00 62.34 3ixh s PRO 53 Cb -0.21 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 3ixh s PRO 53 CO 0.15 -1.23 1.36 0.08 0.04 0.00 0.00 177.00 177.40 3ixh s VAL 54 N -2.88 3.11 0.31 -0.36 1.01 -0.80 -4.24 120.40 116.55 3ixh s VAL 54 Ca 0.60 0.88 0.03 0.00 0.00 0.00 0.00 61.98 63.49 3ixh s VAL 54 Cb -0.16 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 3ixh s VAL 54 CO 0.52 0.12 0.09 0.42 0.00 0.00 0.00 175.10 176.25 3ixh s THR 55 N 0.32 0.79 -1.44 3.92 -4.23 -1.26 -4.76 115.64 108.98 3ixh s THR 55 Ca 0.59 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 3ixh s THR 55 Cb -0.38 -2.65 0.01 0.00 1.34 0.00 0.00 72.50 70.82 3ixh s THR 55 CO 0.37 0.00 0.80 0.00 -0.54 0.00 0.00 174.62 175.25 3ixh n GLN 56 N -0.62 0.01 -0.00 3.99 6.02 -1.26 -1.82 117.38 123.69 3ixh n GLN 56 Ca -0.02 0.27 0.06 0.00 -0.01 0.00 0.00 57.00 57.31 3ixh n GLN 56 Cb 0.66 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.47 3ixh n GLN 56 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3ixh n GLN 57 N -1.28 0.69 -1.97 -1.09 1.13 -1.26 -4.07 117.38 109.53 3ixh n GLN 57 Ca 0.00 -1.22 -0.41 0.00 -1.94 0.00 0.00 57.00 53.42 3ixh n GLN 57 Cb 0.00 -1.23 -0.02 0.00 0.11 0.00 0.00 30.24 29.10 3ixh n GLN 57 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3ixh s THR 58 N -1.00 2.58 -0.16 5.09 2.01 -0.75 -4.83 115.64 118.57 3ixh s THR 58 Ca 0.14 0.47 -0.18 0.00 0.31 0.00 0.00 61.69 62.44 3ixh s THR 58 Cb 0.10 -3.30 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 3ixh s THR 58 CO 0.15 0.07 0.48 -0.76 -0.69 0.00 0.00 174.62 173.87 3ixh s LEU 59 N -0.16 4.21 0.03 4.42 1.43 0.56 -4.11 118.68 125.06 3ixh s LEU 59 Ca 0.61 0.71 0.04 0.00 -1.03 0.00 0.00 54.13 54.46 3ixh s LEU 59 Cb -0.43 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 3ixh s LEU 59 CO 0.42 -0.08 -0.06 -0.36 0.23 0.00 0.00 176.35 176.50 3ixh s PHE 60 N 1.12 2.88 0.01 0.29 0.40 0.05 -2.19 117.98 120.54 3ixh s PHE 60 Ca 0.24 -0.06 -0.30 0.00 -0.60 0.00 0.00 56.93 56.21 3ixh s PHE 60 Cb -0.15 -1.57 -0.06 0.00 0.51 0.00 0.00 43.02 41.75 3ixh s PHE 60 CO 0.09 0.40 1.54 -1.21 0.70 0.00 0.00 175.22 176.74 3ixh s GLU 61 N -1.67 4.23 0.31 0.44 2.02 -1.26 -1.65 118.70 121.12 3ixh s GLU 61 Ca 0.19 2.13 0.22 0.00 0.02 0.00 0.00 54.97 57.53 3ixh s GLU 61 Cb -0.11 -3.67 0.16 0.00 0.10 0.00 0.00 34.13 30.61 3ixh s GLU 61 CO 0.10 -0.69 1.32 -0.07 0.02 0.00 0.00 175.26 175.94 3ixh h LEU 62 N 8.84 0.00 0.00 1.80 3.38 -1.19 -3.43 115.31 124.71 3ixh h LEU 62 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 3ixh h LEU 62 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3ixh h LEU 62 CO 0.92 0.03 0.00 0.61 0.09 0.00 0.00 178.44 180.10 3ixh n GLY 63 N 1.15 2.48 0.04 0.83 0.00 -1.25 -2.65 105.19 105.78 3ixh n GLY 63 Ca 0.02 -0.30 0.03 0.00 0.00 0.00 0.00 46.02 45.76 3ixh n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ixh n SER 64 N 0.35 0.13 0.31 1.61 7.64 -1.26 -0.02 113.62 122.38 3ixh n SER 64 Ca 0.00 0.56 0.20 0.00 1.01 0.00 0.00 58.87 60.64 3ixh n SER 64 Cb 0.00 -0.58 1.04 0.00 -1.01 0.00 0.00 64.21 63.66 3ixh n SER 64 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3ixh h VAL 65 N 0.00 0.15 -0.31 0.44 2.07 -1.59 -1.55 116.25 115.46 3ixh h VAL 65 Ca 0.00 -0.14 0.09 0.00 0.82 0.00 0.00 66.70 67.47 3ixh h VAL 65 Cb 0.01 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3ixh h VAL 65 CO 0.00 0.01 0.26 0.28 0.02 0.00 0.00 177.57 178.15 3ixh h SER 66 N 0.00 0.00 0.11 0.57 0.02 -0.63 -2.22 113.55 111.39 3ixh h SER 66 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3ixh h SER 66 Cb 0.11 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 3ixh h SER 66 CO 0.00 0.00 -0.03 0.11 -1.14 0.00 0.00 176.83 175.77 3ixh h LYS 67 N 0.00 0.00 -0.44 3.45 1.57 -1.44 -2.08 116.57 117.63 3ixh h LYS 67 Ca 0.15 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.84 3ixh h LYS 67 Cb 0.67 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 3ixh h LYS 67 CO -0.00 0.03 -0.08 1.79 -0.57 0.00 0.00 179.45 180.62 3ixh h THR 68 N 0.00 1.27 -0.54 -0.16 1.35 -1.59 0.48 112.91 113.73 3ixh h THR 68 Ca -0.00 -1.18 -0.05 0.00 -0.55 0.00 0.00 66.41 64.63 3ixh h THR 68 Cb 0.09 1.13 -0.02 0.00 -1.73 0.00 0.00 68.15 67.62 3ixh h THR 68 CO 0.00 0.40 0.13 -0.26 -0.25 0.00 0.00 175.52 175.55 3ixh h PHE 69 N 0.66 0.90 -0.52 4.73 0.04 -1.54 -1.16 116.94 120.06 3ixh h PHE 69 Ca 0.11 -0.11 0.04 0.00 2.80 0.00 0.00 57.97 60.81 3ixh h PHE 69 Cb 0.61 -0.25 -0.04 0.00 2.20 0.00 0.00 35.95 38.47 3ixh h PHE 69 CO 0.05 0.79 0.28 1.15 -0.60 0.00 0.00 178.31 179.98 3ixh h THR 70 N 0.76 1.00 -0.63 -1.55 2.02 -1.31 0.14 112.91 113.34 3ixh h THR 70 Ca 0.17 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 3ixh h THR 70 Cb 0.34 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 3ixh h THR 70 CO 0.00 0.10 0.26 1.23 0.37 0.00 0.00 175.52 177.49 3ixh h GLY 71 N 0.56 1.00 1.12 2.16 0.00 -0.73 -1.28 103.07 105.90 3ixh h GLY 71 Ca 0.22 -0.54 -0.17 0.00 0.00 0.00 0.00 47.33 46.85 3ixh h GLY 71 CO -0.13 0.51 -0.43 -2.08 0.00 0.00 0.00 176.54 174.40 3ixh h VAL 72 N 0.88 1.27 -0.84 4.60 2.07 -1.01 -0.42 116.25 122.80 3ixh h VAL 72 Ca 0.21 -1.61 0.01 0.00 0.82 0.00 0.00 66.70 66.13 3ixh h VAL 72 Cb 0.19 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 3ixh h VAL 72 CO -0.02 0.53 0.55 0.25 0.02 0.00 0.00 177.57 178.90 3ixh h LEU 73 N 0.72 0.97 -0.23 2.57 5.85 -0.60 -1.45 115.31 123.13 3ixh h LEU 73 Ca 0.04 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3ixh h LEU 73 Cb 1.03 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 3ixh h LEU 73 CO 0.10 0.71 0.14 1.23 -0.34 0.00 0.00 178.44 180.28 3ixh h GLY 74 N 1.14 0.34 -0.06 3.75 0.00 -1.15 -2.04 103.07 105.04 3ixh h GLY 74 Ca 0.31 -0.14 0.16 0.00 0.00 0.00 0.00 47.33 47.65 3ixh h GLY 74 CO -0.06 0.14 0.19 -1.33 0.00 0.00 0.00 176.54 175.47 3ixh h GLY 75 N 0.28 1.03 1.90 4.60 0.00 -0.80 -0.50 103.07 109.58 3ixh h GLY 75 Ca 0.08 -0.04 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 3ixh h GLY 75 CO -0.02 -0.20 -0.34 -1.80 0.00 0.00 0.00 176.54 174.19 3ixh h ASP 76 N 0.28 0.12 -0.47 0.19 3.58 -1.13 -1.55 116.42 117.44 3ixh h ASP 76 Ca 0.42 -0.04 -0.13 0.00 0.42 0.00 0.00 57.03 57.69 3ixh h ASP 76 Cb 0.71 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.71 3ixh h ASP 76 CO -0.51 0.46 -0.23 0.00 -2.88 0.00 0.00 179.24 176.09 3ixh h ALA 77 N 1.55 0.70 0.02 -0.78 0.00 -0.38 -1.34 119.26 119.02 3ixh h ALA 77 Ca 0.01 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 3ixh h ALA 77 Cb 0.66 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3ixh h ALA 77 CO 0.05 0.67 -0.01 0.82 0.00 0.00 0.00 179.25 180.79 3ixh h ILE 78 N 0.85 1.03 0.00 0.00 2.04 -1.18 -1.35 117.51 118.90 3ixh h ILE 78 Ca 0.11 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 3ixh h ILE 78 Cb 0.80 1.13 -0.00 0.00 -0.74 0.00 0.00 36.82 38.02 3ixh h ILE 78 CO 0.07 0.04 -0.05 0.00 0.00 0.00 0.00 178.15 178.21 3ixh h ALA 79 N 0.90 1.84 0.00 1.87 0.00 -1.16 0.11 119.26 122.82 3ixh h ALA 79 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3ixh h ALA 79 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3ixh h ALA 79 CO 0.00 0.06 0.00 0.54 0.00 0.00 0.00 179.25 179.85 3ixh n ARG 80 N -4.36 0.61 -1.21 0.00 1.74 -0.52 -4.89 116.66 108.04 3ixh n ARG 80 Ca -0.03 0.01 -0.07 0.00 -0.77 0.00 0.00 57.85 56.99 3ixh n ARG 80 Cb 0.13 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 3ixh n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ixh n GLY 81 N 1.09 0.89 0.14 -0.13 0.00 0.38 -4.90 105.19 102.66 3ixh n GLY 81 Ca 0.17 -0.37 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 3ixh n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ixh h GLU 82 N 0.16 0.29 -4.26 1.61 5.08 -1.45 -3.48 114.58 112.53 3ixh h GLU 82 Ca -0.15 -0.29 -0.15 0.00 -1.00 0.00 0.00 59.36 57.77 3ixh h GLU 82 Cb 0.63 0.08 -0.15 0.00 0.50 0.00 0.00 28.75 29.81 3ixh h GLU 82 CO 0.22 0.99 -0.60 0.96 -1.00 0.00 0.00 179.01 179.57 3ixh s ILE 83 N -3.32 0.13 0.01 3.13 -4.36 -1.17 -4.84 121.20 110.79 3ixh s ILE 83 Ca -0.04 -1.77 0.05 0.00 -0.26 0.00 0.00 60.65 58.63 3ixh s ILE 83 Cb 0.10 -1.82 -0.02 0.00 1.25 0.00 0.00 42.46 41.97 3ixh s ILE 83 CO 0.84 -0.61 -0.16 -0.54 0.24 0.00 0.00 174.94 174.71 3ixh s LYS 84 N -3.99 1.20 0.58 0.37 1.02 -1.26 -4.15 119.74 113.51 3ixh s LYS 84 Ca 0.17 -0.69 0.33 0.00 0.02 0.00 0.00 55.97 55.80 3ixh s LYS 84 Cb 0.07 -1.21 1.81 0.00 -0.52 0.00 0.00 37.83 37.98 3ixh s LYS 84 CO -0.03 0.32 2.19 -0.07 -0.92 0.00 0.00 175.35 176.85 3ixh h LEU 85 N 5.35 0.00 -0.08 3.17 3.38 -1.98 -1.72 115.31 123.42 3ixh h LEU 85 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3ixh h LEU 85 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3ixh h LEU 85 CO 0.46 0.04 -0.10 -1.54 0.09 0.00 0.00 178.44 177.40 3ixh n SER 86 N -3.50 0.23 -4.76 -0.43 3.41 -1.26 -1.42 113.62 105.88 3ixh n SER 86 Ca -0.02 -0.16 -0.41 0.00 -0.26 0.00 0.00 58.87 58.03 3ixh n SER 86 Cb 0.16 -0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 63.88 3ixh n SER 86 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3ixh s ASP 87 N -2.69 7.03 0.52 4.04 1.01 -0.65 -4.86 116.67 121.08 3ixh s ASP 87 Ca 0.23 2.46 -0.23 0.00 0.71 0.00 0.00 52.55 55.73 3ixh s ASP 87 Cb 0.20 -2.64 -0.06 0.00 1.01 0.00 0.00 42.92 41.43 3ixh s ASP 87 CO 0.51 -0.33 1.35 -2.84 0.21 0.00 0.00 175.17 174.06 3ixh s PRO 88 N -1.52 3.31 0.30 8.23 0.02 -1.26 -1.57 135.00 142.51 3ixh s PRO 88 Ca 0.47 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.70 3ixh s PRO 88 Cb -0.36 -2.35 0.52 0.00 0.02 0.00 0.00 34.50 32.33 3ixh s PRO 88 CO 0.46 -1.04 1.92 1.15 -0.33 0.00 0.00 177.00 179.16 3ixh h THR 89 N 1.65 1.08 -1.04 0.99 2.02 -1.43 -2.00 112.91 114.19 3ixh h THR 89 Ca -0.51 -0.36 0.27 0.00 0.77 0.00 0.00 66.41 66.59 3ixh h THR 89 Cb 1.29 -0.05 -0.08 0.00 -1.74 0.00 0.00 68.15 67.57 3ixh h THR 89 CO 0.58 0.19 0.70 0.74 0.37 0.00 0.00 175.52 178.10 3ixh h THR 90 N 1.04 0.52 0.00 3.16 2.02 -1.81 -0.68 112.91 117.16 3ixh h THR 90 Ca 0.38 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.44 3ixh h THR 90 Cb 0.16 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 66.79 3ixh h THR 90 CO -0.14 0.05 -0.10 0.50 0.37 0.00 0.00 175.52 176.20 3ixh h LYS 91 N 0.28 0.00 -0.00 6.66 3.64 -1.73 -2.63 116.57 122.78 3ixh h LYS 91 Ca 0.56 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.94 3ixh h LYS 91 Cb 1.64 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.46 3ixh h LYS 91 CO -0.20 0.10 -0.32 0.66 -2.27 0.00 0.00 179.45 177.43 3ixh n TYR 92 N -3.63 0.00 -3.46 1.91 4.02 -0.33 -4.68 117.16 111.00 3ixh n TYR 92 Ca -0.02 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.60 3ixh n TYR 92 Cb 0.22 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.44 3ixh n TYR 92 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 3ixh n TRP 93 N -0.79 0.08 0.27 -0.72 -0.00 -0.82 -5.01 117.44 110.45 3ixh n TRP 93 Ca 0.03 -3.56 0.11 0.00 -0.00 0.00 0.00 57.50 54.09 3ixh n TRP 93 Cb 0.16 -0.01 0.76 0.00 -0.00 0.00 0.00 31.31 32.23 3ixh n TRP 93 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 3ixh h PRO 94 N 5.31 0.00 0.00 5.87 0.11 -1.75 -0.78 132.00 140.76 3ixh h PRO 94 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 3ixh h PRO 94 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3ixh h PRO 94 CO 0.46 0.03 0.00 0.39 -0.21 0.00 0.00 178.00 178.67 3ixh n GLU 95 N -4.11 0.14 -2.52 1.05 4.71 -1.26 -4.24 120.64 114.41 3ixh n GLU 95 Ca -0.03 0.51 -0.41 0.00 -0.01 0.00 0.00 57.16 57.22 3ixh n GLU 95 Cb 0.12 -1.84 -0.01 0.00 -1.01 0.00 0.00 31.44 28.69 3ixh n GLU 95 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 3ixh s LEU 96 N -4.23 3.74 0.05 -4.62 2.96 -0.30 -4.73 118.68 111.55 3ixh s LEU 96 Ca 0.01 -2.35 0.22 0.00 -0.22 0.00 0.00 54.13 51.80 3ixh s LEU 96 Cb 0.07 -2.58 -0.07 0.00 0.50 0.00 0.00 46.19 44.11 3ixh s LEU 96 CO 0.26 -1.41 0.90 0.35 -1.32 0.00 0.00 176.35 175.13 3ixh n THR 97 N 6.58 0.18 -1.86 3.68 -2.24 -1.26 -4.84 114.28 114.52 3ixh n THR 97 Ca 0.48 -0.32 -0.40 0.00 -2.27 0.00 0.00 64.05 61.54 3ixh n THR 97 Cb 0.46 0.15 0.01 0.00 -2.10 0.00 0.00 70.33 68.85 3ixh n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ixh s ALA 98 N -3.28 3.33 0.46 6.98 0.00 -1.26 -4.86 121.76 123.14 3ixh s ALA 98 Ca 0.01 1.44 0.37 0.00 0.00 0.00 0.00 51.96 53.78 3ixh s ALA 98 Cb 0.14 -3.57 1.91 0.00 0.00 0.00 0.00 23.12 21.59 3ixh s ALA 98 CO 0.83 -1.07 2.20 1.57 0.00 0.00 0.00 175.76 179.29 3ixh h LYS 99 N 2.58 0.00 0.00 0.00 2.10 -1.94 -2.36 116.57 116.96 3ixh h LYS 99 Ca -0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 3ixh h LYS 99 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 3ixh h LYS 99 CO 0.62 0.03 0.00 -0.56 -2.00 0.00 0.00 179.45 177.54 3ixh h GLN 100 N 0.00 0.00 -0.00 0.07 -0.00 -1.95 -3.06 115.11 110.16 3ixh h GLN 100 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3ixh h GLN 100 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.69 3ixh h GLN 100 CO 0.00 0.00 -0.20 0.91 -0.00 0.00 0.00 178.83 179.54 3ixh n TRP 101 N -2.38 0.00 -0.09 0.06 7.02 -0.89 -4.60 117.44 116.56 3ixh n TRP 101 Ca 0.02 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.40 3ixh n TRP 101 Cb 0.23 -0.28 -0.04 0.00 -2.42 0.00 0.00 31.31 28.81 3ixh n TRP 101 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 3ixh h ASN 102 N 0.31 -1.28 -0.71 -0.99 -0.26 -1.75 -1.75 115.58 109.15 3ixh h ASN 102 Ca 0.00 0.20 -0.17 0.00 -0.56 0.00 0.00 56.30 55.77 3ixh h ASN 102 Cb 0.44 0.56 -0.10 0.00 -1.06 0.00 0.00 38.32 38.16 3ixh h ASN 102 CO 0.00 -0.37 0.21 0.61 -1.06 0.00 0.00 177.43 176.83 3ixh n GLY 103 N -1.42 3.46 3.50 2.83 0.00 -1.26 -4.88 105.19 107.42 3ixh n GLY 103 Ca -0.01 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 3ixh n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ixh s ILE 104 N -2.91 4.91 0.43 -0.61 1.01 -0.66 -4.87 121.20 118.50 3ixh s ILE 104 Ca 0.55 -0.09 0.05 0.00 0.00 0.00 0.00 60.65 61.15 3ixh s ILE 104 Cb 0.43 -4.16 0.01 0.00 0.01 0.00 0.00 42.46 38.75 3ixh s ILE 104 CO 0.14 -0.56 0.60 0.42 0.00 0.00 0.00 174.94 175.54 3ixh s THR 105 N 2.59 3.49 0.35 2.92 -4.23 -1.26 -1.17 115.64 118.33 3ixh s THR 105 Ca 0.19 -0.82 0.06 0.00 -1.18 0.00 0.00 61.69 59.93 3ixh s THR 105 Cb -0.15 -3.23 0.30 0.00 1.34 0.00 0.00 72.50 70.75 3ixh s THR 105 CO 0.17 -0.12 1.94 -0.07 -0.54 0.00 0.00 174.62 176.00 3ixh h LEU 106 N 0.55 0.69 -0.18 4.79 3.38 -1.27 -1.70 115.31 121.59 3ixh h LEU 106 Ca -0.44 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.59 3ixh h LEU 106 Cb 1.27 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.84 3ixh h LEU 106 CO 0.52 0.43 -0.11 0.25 0.09 0.00 0.00 178.44 179.62 3ixh h LEU 107 N 0.78 -0.36 -0.42 1.67 5.85 -1.52 -1.07 115.31 120.25 3ixh h LEU 107 Ca 0.34 0.08 0.09 0.00 0.84 0.00 0.00 57.88 59.23 3ixh h LEU 107 Cb 0.32 0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.45 3ixh h LEU 107 CO -0.12 -0.15 -0.16 0.45 -0.34 0.00 0.00 178.44 178.12 3ixh h HIS 108 N -0.11 -0.38 -0.28 1.25 3.86 -1.61 -2.14 115.15 115.75 3ixh h HIS 108 Ca 0.10 0.04 0.01 0.00 -1.16 0.00 0.00 60.37 59.37 3ixh h HIS 108 Cb 0.26 0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 3ixh h HIS 108 CO -0.26 -0.24 0.16 -0.07 0.86 0.00 0.00 177.93 178.38 3ixh h LEU 109 N -0.07 0.26 -1.79 2.43 3.38 -1.08 -1.37 115.31 117.07 3ixh h LEU 109 Ca 0.20 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 3ixh h LEU 109 Cb 0.38 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 3ixh h LEU 109 CO -0.47 0.19 -0.15 0.00 0.09 0.00 0.00 178.44 178.10 3ixh h ALA 110 N 1.13 1.50 -0.11 1.53 0.00 -0.83 -2.77 119.26 119.72 3ixh h ALA 110 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ixh h ALA 110 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3ixh h ALA 110 CO -0.06 0.19 0.00 0.25 0.00 0.00 0.00 179.25 179.63 3ixh n THR 111 N -4.00 1.27 -1.89 0.00 -2.24 -0.84 -4.46 114.28 102.13 3ixh n THR 111 Ca -0.02 -1.31 -0.12 0.00 -2.27 0.00 0.00 64.05 60.33 3ixh n THR 111 Cb 0.24 0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 68.74 3ixh n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3ixh n TYR 112 N -0.43 -0.35 -1.12 4.78 4.01 -0.90 -4.83 117.16 118.31 3ixh n TYR 112 Ca 0.07 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.89 3ixh n TYR 112 Cb 0.42 -2.52 0.19 0.00 -0.31 0.00 0.00 39.34 37.12 3ixh n TYR 112 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3ixh n THR 113 N -3.49 2.12 0.29 -0.72 -2.24 -0.57 -1.28 114.28 108.40 3ixh n THR 113 Ca -0.13 -2.26 0.17 0.00 -2.27 0.00 0.00 64.05 59.56 3ixh n THR 113 Cb 0.53 -0.25 0.65 0.00 -2.10 0.00 0.00 70.33 69.15 3ixh n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ixh h ALA 114 N 0.81 1.00 0.00 6.98 0.00 -1.80 -1.26 119.26 125.00 3ixh h ALA 114 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3ixh h ALA 114 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3ixh h ALA 114 CO 0.12 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.78 3ixh n GLY 115 N 0.08 1.20 0.25 0.00 0.00 -1.26 -4.21 105.19 101.25 3ixh n GLY 115 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3ixh n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ixh n GLY 116 N -0.01 1.65 3.72 -0.02 0.00 -1.26 -1.66 105.19 107.61 3ixh n GLY 116 Ca 0.00 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 3ixh n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ixh n LEU 117 N -0.01 3.97 -4.79 0.99 4.77 -1.26 -4.80 117.00 115.87 3ixh n LEU 117 Ca 0.00 1.21 -0.33 0.00 -0.03 0.00 0.00 56.01 56.86 3ixh n LEU 117 Cb 0.06 -1.53 0.02 0.00 -2.33 0.00 0.00 43.42 39.65 3ixh n LEU 117 CO 0.00 -0.30 0.73 -2.16 -1.33 0.00 0.00 177.39 174.33 3ixh s PRO 118 N -1.98 3.10 0.20 3.23 0.04 -1.26 -4.76 135.00 133.58 3ixh s PRO 118 Ca 0.55 1.33 -0.11 0.00 0.04 0.00 0.00 61.00 62.81 3ixh s PRO 118 Cb -0.54 -2.00 0.20 0.00 0.04 0.00 0.00 34.50 32.21 3ixh s PRO 118 CO 0.62 -1.00 1.81 1.25 0.04 0.00 0.00 177.00 179.72 3ixh h LEU 119 N 0.36 0.51 -8.90 -3.56 5.85 -1.92 -3.22 115.31 104.42 3ixh h LEU 119 Ca -0.47 0.03 -0.69 0.00 0.84 0.00 0.00 57.88 57.58 3ixh h LEU 119 Cb 1.24 -0.08 -0.22 0.00 0.37 0.00 0.00 40.66 41.97 3ixh h LEU 119 CO 0.56 0.34 -0.87 -1.10 -0.34 0.00 0.00 178.44 177.03 3ixh s GLN 120 N -6.11 1.48 0.11 1.25 -1.52 -1.26 -1.13 119.66 112.48 3ixh s GLN 120 Ca -0.13 -1.31 -0.30 0.00 -1.95 0.00 0.00 55.36 51.67 3ixh s GLN 120 Cb 0.15 -1.93 -0.06 0.00 -0.22 0.00 0.00 33.01 30.95 3ixh s GLN 120 CO 0.75 0.46 1.11 0.08 -0.25 0.00 0.00 175.29 177.45 3ixh s VAL 121 N -1.03 4.08 0.40 1.09 1.01 -1.26 -4.83 120.40 119.85 3ixh s VAL 121 Ca 0.14 1.63 -0.25 0.00 0.00 0.00 0.00 61.98 63.50 3ixh s VAL 121 Cb -0.10 -4.05 -0.11 0.00 0.00 0.00 0.00 36.38 32.13 3ixh s VAL 121 CO 0.06 0.21 1.12 -2.65 0.00 0.00 0.00 175.10 173.83 3ixh n PRO 122 N 3.12 1.60 0.07 2.72 -0.02 -1.26 -4.86 135.00 136.36 3ixh n PRO 122 Ca 0.05 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.22 3ixh n PRO 122 Cb 0.47 -2.15 0.59 0.00 -0.02 0.00 0.00 33.50 32.39 3ixh n PRO 122 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3ixh h ASP 123 N 1.85 0.16 -0.35 2.55 5.19 -2.01 -1.65 116.42 122.15 3ixh h ASP 123 Ca -0.45 0.00 0.10 0.00 -0.62 0.00 0.00 57.03 56.06 3ixh h ASP 123 Cb 1.32 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.78 3ixh h ASP 123 CO 0.59 0.10 0.57 -0.33 -3.12 0.00 0.00 179.24 177.04 3ixh h GLU 124 N 0.18 0.00 -5.90 3.56 3.07 -2.04 -3.42 114.58 110.03 3ixh h GLU 124 Ca 0.16 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 58.43 3ixh h GLU 124 Cb 0.40 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 28.23 3ixh h GLU 124 CO -0.02 0.00 0.55 0.08 -1.40 0.00 0.00 179.01 178.21 3ixh s VAL 125 N -4.39 4.80 0.00 3.13 1.01 -0.62 -4.88 120.40 119.45 3ixh s VAL 125 Ca -0.03 1.71 0.00 0.00 0.00 0.00 0.00 61.98 63.66 3ixh s VAL 125 Cb 0.12 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.33 3ixh s VAL 125 CO 0.42 -0.08 0.00 0.29 0.00 0.00 0.00 175.10 175.72 3ixh n LYS 126 N 5.93 3.12 -4.53 2.72 5.02 -1.26 -4.51 118.16 124.65 3ixh n LYS 126 Ca 0.07 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.11 3ixh n LYS 126 Cb 0.47 -0.66 -0.10 0.00 -0.02 0.00 0.00 35.03 34.73 3ixh n LYS 126 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3ixh s SER 127 N -0.98 2.95 0.18 4.39 1.04 -1.26 -5.02 113.70 115.00 3ixh s SER 127 Ca 0.00 -1.47 -0.16 0.00 0.48 0.00 0.00 55.95 54.80 3ixh s SER 127 Cb 0.00 0.04 0.13 0.00 0.10 0.00 0.00 66.02 66.29 3ixh s SER 127 CO 0.00 -0.67 1.66 0.28 0.98 0.00 0.00 173.24 175.49 3ixh h SER 128 N 1.89 -0.43 0.76 7.02 0.02 -2.00 -2.15 113.55 118.67 3ixh h SER 128 Ca -0.41 0.14 -0.18 0.00 -0.84 0.00 0.00 61.79 60.50 3ixh h SER 128 Cb 1.26 0.29 -0.02 0.00 0.14 0.00 0.00 62.40 64.06 3ixh h SER 128 CO 0.70 -0.15 -0.83 0.77 -1.14 0.00 0.00 176.83 176.18 3ixh h SER 129 N 0.00 0.05 -0.79 3.07 4.64 -1.99 -2.73 113.55 115.81 3ixh h SER 129 Ca 0.22 -0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.53 3ixh h SER 129 Cb 0.34 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 62.36 3ixh h SER 129 CO -0.48 0.85 0.50 0.44 -0.87 0.00 0.00 176.83 177.28 3ixh h ASP 130 N 0.02 0.81 -0.02 4.97 5.19 -1.91 -2.04 116.42 123.45 3ixh h ASP 130 Ca -0.02 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.19 3ixh h ASP 130 Cb 1.45 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.79 3ixh h ASP 130 CO 0.11 0.56 -0.73 0.25 -3.12 0.00 0.00 179.24 176.31 3ixh h LEU 131 N 0.96 0.78 0.43 1.55 5.85 -1.29 -2.38 115.31 121.21 3ixh h LEU 131 Ca 0.32 -0.49 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 3ixh h LEU 131 Cb 0.04 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 3ixh h LEU 131 CO -0.12 1.27 -0.33 0.25 -0.34 0.00 0.00 178.44 179.17 3ixh h LEU 132 N 0.46 -0.85 -0.86 2.25 5.85 -1.42 -2.39 115.31 118.35 3ixh h LEU 132 Ca -0.04 0.06 0.18 0.00 0.84 0.00 0.00 57.88 58.93 3ixh h LEU 132 Cb 1.33 0.27 -0.11 0.00 0.37 0.00 0.00 40.66 42.52 3ixh h LEU 132 CO 0.14 -0.49 0.39 0.03 -0.34 0.00 0.00 178.44 178.17 3ixh h ARG 133 N -0.75 0.46 -0.19 1.25 3.08 -1.38 0.98 114.38 117.83 3ixh h ARG 133 Ca -0.04 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.00 3ixh h ARG 133 Cb 0.64 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 3ixh h ARG 133 CO -0.00 0.30 0.09 0.35 -1.07 0.00 0.00 179.97 179.64 3ixh h PHE 134 N 0.47 0.16 -0.01 3.04 3.57 -1.15 -0.85 116.94 122.17 3ixh h PHE 134 Ca 0.50 0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.83 3ixh h PHE 134 Cb 0.86 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 3ixh h PHE 134 CO -0.13 0.09 -0.82 1.88 -2.23 0.00 0.00 178.31 177.10 3ixh h TYR 135 N 0.19 0.29 -0.96 0.41 0.05 -0.86 -2.44 116.97 113.64 3ixh h TYR 135 Ca 0.08 -0.15 0.01 0.00 0.05 0.00 0.00 58.73 58.72 3ixh h TYR 135 Cb 0.03 -0.04 -0.05 0.00 1.01 0.00 0.00 36.73 37.68 3ixh h TYR 135 CO -0.10 0.93 0.63 1.96 -1.05 0.00 0.00 178.16 180.53 3ixh h GLN 136 N 0.12 1.27 -0.00 4.88 1.08 -0.70 -3.23 115.11 118.53 3ixh h GLN 136 Ca -0.04 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 3ixh h GLN 136 Cb 1.42 -0.28 0.00 0.00 -0.05 0.00 0.00 27.48 28.57 3ixh h GLN 136 CO 0.12 0.85 -0.40 0.09 -0.95 0.00 0.00 178.83 178.54 3ixh n ASN 137 N -4.40 0.79 -4.74 1.46 5.03 -0.34 -4.86 115.26 108.19 3ixh n ASN 137 Ca 0.11 -0.60 -0.41 0.00 0.87 0.00 0.00 54.58 54.55 3ixh n ASN 137 Cb 0.02 0.22 -0.03 0.00 -1.02 0.00 0.00 39.78 38.98 3ixh n ASN 137 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 3ixh s TRP 138 N -2.76 3.12 -0.26 3.10 -0.00 -0.93 -5.00 118.94 116.21 3ixh s TRP 138 Ca 0.17 1.14 -0.02 0.00 -0.00 0.00 0.00 56.10 57.39 3ixh s TRP 138 Cb 0.18 -3.72 0.03 0.00 -0.00 0.00 0.00 33.47 29.96 3ixh s TRP 138 CO 0.62 -2.29 -0.04 -0.65 -0.00 0.00 0.00 176.95 174.58 3ixh s GLN 139 N -0.39 2.72 0.30 5.86 -1.52 -1.26 -5.01 119.66 120.35 3ixh s GLN 139 Ca 0.57 -1.06 -0.29 0.00 -1.95 0.00 0.00 55.36 52.63 3ixh s GLN 139 Cb -0.40 -3.04 -0.11 0.00 -0.22 0.00 0.00 33.01 29.25 3ixh s GLN 139 CO 0.42 -0.46 1.47 -2.14 -0.25 0.00 0.00 175.29 174.33 3ixh s PRO 140 N 1.30 4.21 0.16 2.91 0.02 -1.26 -4.94 135.00 137.40 3ixh s PRO 140 Ca -0.02 2.42 0.11 0.00 0.02 0.00 0.00 61.00 63.53 3ixh s PRO 140 Cb -0.18 -3.05 -0.12 0.00 0.02 0.00 0.00 34.50 31.18 3ixh s PRO 140 CO -0.03 -0.46 1.27 0.00 -0.33 0.00 0.00 177.00 177.44 3ixh h ALA 141 N 4.28 0.50 -2.69 -1.55 0.00 -1.63 -3.48 119.26 114.70 3ixh h ALA 141 Ca -0.48 -0.79 -0.26 0.00 0.00 0.00 0.00 54.91 53.38 3ixh h ALA 141 Cb 1.22 -0.06 -0.18 0.00 0.00 0.00 0.00 17.79 18.77 3ixh h ALA 141 CO 0.73 1.05 -0.72 -1.58 0.00 0.00 0.00 179.25 178.73 3ixh s TRP 142 N -2.80 0.84 0.80 0.00 0.51 -1.17 -5.07 118.94 112.06 3ixh s TRP 142 Ca 0.01 -0.71 -0.13 0.00 -2.12 0.00 0.00 56.10 53.16 3ixh s TRP 142 Cb 0.09 -0.49 0.08 0.00 -0.81 0.00 0.00 33.47 32.34 3ixh s TRP 142 CO 0.80 -0.10 1.19 0.00 -0.51 0.00 0.00 176.95 178.32 3ixh s ALA 143 N -2.54 1.87 0.39 0.98 0.00 -1.26 -4.41 121.76 116.80 3ixh s ALA 143 Ca 0.02 0.76 -0.27 0.00 0.00 0.00 0.00 51.96 52.47 3ixh s ALA 143 Cb -0.02 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.54 3ixh s ALA 143 CO -0.02 -2.23 1.39 -2.14 0.00 0.00 0.00 175.76 172.76 3ixh s PRO 144 N -4.23 4.02 -0.66 0.00 0.02 -1.26 -3.57 135.00 129.33 3ixh s PRO 144 Ca 0.71 2.36 -0.01 0.00 0.02 0.00 0.00 61.00 64.08 3ixh s PRO 144 Cb -0.27 -2.86 0.00 0.00 0.02 0.00 0.00 34.50 31.39 3ixh s PRO 144 CO 0.51 -0.52 0.13 0.41 -0.33 0.00 0.00 177.00 177.20 3ixh n GLY 145 N 0.61 0.13 0.00 0.52 0.00 -0.47 -4.92 105.19 101.05 3ixh n GLY 145 Ca 0.02 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.57 3ixh n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ixh n THR 146 N -3.86 0.00 -4.32 2.61 -2.24 -1.23 -4.86 114.28 100.38 3ixh n THR 146 Ca -0.07 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.53 3ixh n THR 146 Cb 0.56 -0.53 -0.15 0.00 -2.10 0.00 0.00 70.33 68.11 3ixh n THR 146 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3ixh s GLN 147 N -1.76 0.68 -0.27 -0.78 -0.21 -1.26 -1.57 119.66 114.49 3ixh s GLN 147 Ca 0.00 -0.29 -0.21 0.00 0.02 0.00 0.00 55.36 54.89 3ixh s GLN 147 Cb 0.00 -0.66 -0.01 0.00 1.00 0.00 0.00 33.01 33.34 3ixh s GLN 147 CO 0.00 0.16 0.66 0.50 -2.12 0.00 0.00 175.29 174.49 3ixh s ARG 148 N -0.14 4.04 -0.26 2.91 3.52 0.60 -4.23 118.95 125.39 3ixh s ARG 148 Ca 0.02 0.51 0.02 0.00 -0.13 0.00 0.00 55.73 56.15 3ixh s ARG 148 Cb -0.04 -3.68 0.07 0.00 -1.56 0.00 0.00 34.95 29.75 3ixh s ARG 148 CO -0.00 -0.49 -0.03 -1.17 -0.81 0.00 0.00 175.30 172.80 3ixh s LEU 149 N 2.59 3.10 -0.21 -0.88 2.96 -0.40 -1.79 118.68 124.05 3ixh s LEU 149 Ca 0.27 -1.43 -0.41 0.00 -0.22 0.00 0.00 54.13 52.34 3ixh s LEU 149 Cb -0.15 -1.30 -0.17 0.00 0.50 0.00 0.00 46.19 45.06 3ixh s LEU 149 CO 0.10 -0.27 1.55 0.00 -1.32 0.00 0.00 176.35 176.41 3ixh n TYR 150 N 4.56 1.71 -3.68 5.38 4.19 -1.26 -4.79 117.16 123.27 3ixh n TYR 150 Ca -0.09 0.75 -0.09 0.00 3.31 0.00 0.00 57.90 61.78 3ixh n TYR 150 Cb 0.43 -2.34 -0.10 0.00 0.49 0.00 0.00 39.34 37.82 3ixh n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 3ixh s ALA 151 N 2.34 -1.22 0.33 2.98 0.00 -1.26 -4.52 121.76 120.41 3ixh s ALA 151 Ca 0.96 1.70 0.15 0.00 0.00 0.00 0.00 51.96 54.77 3ixh s ALA 151 Cb -1.16 -1.07 0.75 0.00 0.00 0.00 0.00 23.12 21.65 3ixh s ALA 151 CO 0.64 -0.34 1.81 -0.91 0.00 0.00 0.00 175.76 176.96 3ixh h ASN 152 N 7.22 0.00 1.13 0.00 2.35 -1.29 -2.98 115.58 122.00 3ixh h ASN 152 Ca -0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 3ixh h ASN 152 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 3ixh h ASN 152 CO 0.25 0.37 0.00 0.77 -1.65 0.00 0.00 177.43 177.18 3ixh h SER 153 N 0.00 0.00 0.00 5.81 4.64 -1.62 -1.88 113.55 120.50 3ixh h SER 153 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ixh h SER 153 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3ixh h SER 153 CO 0.05 0.00 -0.18 -1.28 -0.87 0.00 0.00 176.83 174.55 3ixh h SER 154 N 0.00 0.00 0.50 4.97 0.87 -1.77 -3.24 113.55 114.89 3ixh h SER 154 Ca 0.00 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.51 3ixh h SER 154 Cb 0.56 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 3ixh h SER 154 CO 0.00 0.31 -0.24 -0.29 -0.53 0.00 0.00 176.83 176.07 3ixh h ILE 155 N -0.44 0.83 -0.51 2.23 2.10 -1.43 -2.34 117.51 117.95 3ixh h ILE 155 Ca 0.00 -0.97 -0.03 0.00 1.08 0.00 0.00 64.86 64.94 3ixh h ILE 155 Cb 0.18 1.58 -0.02 0.00 -1.09 0.00 0.00 36.82 37.47 3ixh h ILE 155 CO 0.00 0.24 0.19 1.23 -1.08 0.00 0.00 178.15 178.73 3ixh h GLY 156 N 1.25 0.83 1.31 8.18 0.00 -1.55 0.16 103.07 113.26 3ixh h GLY 156 Ca -0.00 -0.47 -0.09 0.00 0.00 0.00 0.00 47.33 46.77 3ixh h GLY 156 CO 0.03 0.44 -0.05 -2.00 0.00 0.00 0.00 176.54 174.96 3ixh h LEU 157 N 0.69 0.81 -0.66 3.11 5.85 -1.50 -1.72 115.31 121.89 3ixh h LEU 157 Ca 0.17 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.68 3ixh h LEU 157 Cb 0.22 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 3ixh h LEU 157 CO -0.01 0.91 0.42 0.15 -0.34 0.00 0.00 178.44 179.57 3ixh h PHE 158 N 0.76 0.80 0.22 1.25 3.57 -1.05 -0.91 116.94 121.58 3ixh h PHE 158 Ca 0.14 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.67 3ixh h PHE 158 Cb 0.53 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 3ixh h PHE 158 CO 0.03 0.48 -0.43 0.78 -2.23 0.00 0.00 178.31 176.93 3ixh h GLY 159 N 0.85 -0.94 1.55 2.40 0.00 -0.64 0.48 103.07 106.76 3ixh h GLY 159 Ca 0.25 0.52 0.00 0.00 0.00 0.00 0.00 47.33 48.10 3ixh h GLY 159 CO -0.08 -0.29 0.29 0.00 0.00 0.00 0.00 176.54 176.46 3ixh h ALA 160 N -0.34 1.66 0.15 3.60 0.00 -0.93 -2.82 119.26 120.57 3ixh h ALA 160 Ca -0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 54.91 54.57 3ixh h ALA 160 Cb 0.72 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.33 3ixh h ALA 160 CO -0.19 0.31 -1.36 -0.07 0.00 0.00 0.00 179.25 177.94 3ixh h LEU 161 N 0.62 0.49 -2.33 0.00 3.38 -1.04 -3.35 115.31 113.09 3ixh h LEU 161 Ca 0.17 -0.56 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 3ixh h LEU 161 Cb -0.05 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 3ixh h LEU 161 CO -0.03 1.45 -0.03 0.00 0.09 0.00 0.00 178.44 179.91 3ixh h ALA 162 N 0.48 1.47 -0.33 1.53 0.00 -0.63 -1.24 119.26 120.54 3ixh h ALA 162 Ca -0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3ixh h ALA 162 Cb 2.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.81 3ixh h ALA 162 CO 0.21 0.04 0.00 1.33 0.00 0.00 0.00 179.25 180.83 3ixh n VAL 163 N -3.81 0.43 -0.04 0.00 0.24 -1.22 -4.61 118.33 109.32 3ixh n VAL 163 Ca -0.03 -0.57 -0.12 0.00 -2.04 0.00 0.00 64.34 61.58 3ixh n VAL 163 Cb 0.12 0.60 -0.07 0.00 -1.47 0.00 0.00 33.84 33.02 3ixh n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 3ixh h LYS 164 N 3.26 0.23 0.00 7.34 1.79 -1.37 -3.06 116.57 124.75 3ixh h LYS 164 Ca 0.00 -0.08 -0.01 0.00 -2.18 0.00 0.00 60.65 58.38 3ixh h LYS 164 Cb 0.72 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.36 3ixh h LYS 164 CO 0.00 0.52 -0.04 -1.35 -1.08 0.00 0.00 179.45 177.50 3ixh h PRO 165 N -0.08 0.00 -0.33 3.15 0.11 -1.81 -2.14 132.00 130.89 3ixh h PRO 165 Ca 0.03 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.00 3ixh h PRO 165 Cb 0.43 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 3ixh h PRO 165 CO 0.01 0.04 -0.35 0.66 -0.21 0.00 0.00 178.00 178.14 3ixh h SER 166 N 0.00 0.80 0.00 -2.05 4.64 -1.85 -3.47 113.55 111.62 3ixh h SER 166 Ca -0.00 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 3ixh h SER 166 Cb 0.26 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3ixh h SER 166 CO 0.00 1.07 0.00 0.61 -0.87 0.00 0.00 176.83 177.65 3ixh n GLY 167 N -0.01 1.10 3.88 -0.77 0.00 -0.81 -5.06 105.19 103.52 3ixh n GLY 167 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 3ixh n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ixh s LEU 168 N 0.00 3.25 0.87 0.99 1.43 -1.26 -5.07 118.68 118.89 3ixh s LEU 168 Ca 0.00 1.34 -0.12 0.00 -1.03 0.00 0.00 54.13 54.32 3ixh s LEU 168 Cb 0.00 -4.36 0.11 0.00 0.03 0.00 0.00 46.19 41.98 3ixh s LEU 168 CO 0.00 -0.88 1.11 -0.94 0.23 0.00 0.00 176.35 175.88 3ixh s SER 169 N -4.19 3.82 0.14 2.29 1.04 -1.26 -4.79 113.70 110.75 3ixh s SER 169 Ca 0.54 1.15 -0.15 0.00 0.48 0.00 0.00 55.95 57.97 3ixh s SER 169 Cb -0.11 -1.80 0.01 0.00 0.10 0.00 0.00 66.02 64.22 3ixh s SER 169 CO 0.53 -2.38 1.72 0.15 0.98 0.00 0.00 173.24 174.24 3ixh h PHE 170 N -1.37 0.62 -0.47 5.02 3.57 -1.94 -0.16 116.94 122.20 3ixh h PHE 170 Ca -0.49 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 60.97 3ixh h PHE 170 Cb 1.30 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.83 3ixh h PHE 170 CO 0.37 0.51 0.28 1.49 -2.23 0.00 0.00 178.31 178.73 3ixh h GLU 171 N 0.55 0.64 -0.38 1.11 4.81 -1.99 -0.02 114.58 119.31 3ixh h GLU 171 Ca 0.15 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 3ixh h GLU 171 Cb 0.13 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 3ixh h GLU 171 CO -0.02 0.48 0.11 1.96 -0.73 0.00 0.00 179.01 180.81 3ixh h GLN 172 N 0.63 0.59 -0.41 1.92 1.08 -1.88 0.90 115.11 117.95 3ixh h GLN 172 Ca 0.17 -0.13 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 3ixh h GLN 172 Cb 0.00 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 3ixh h GLN 172 CO -0.03 0.60 0.23 0.00 -0.95 0.00 0.00 178.83 178.68 3ixh h ALA 173 N 0.96 0.52 -0.62 3.87 0.00 -0.84 -1.47 119.26 121.68 3ixh h ALA 173 Ca 0.12 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.96 3ixh h ALA 173 Cb 0.26 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3ixh h ALA 173 CO -0.00 0.03 0.41 1.98 0.00 0.00 0.00 179.25 181.67 3ixh h MET 174 N 0.53 0.81 0.25 0.00 1.85 -0.75 -0.59 114.93 117.03 3ixh h MET 174 Ca 0.14 -0.05 -0.01 0.00 -0.61 0.00 0.00 59.70 59.17 3ixh h MET 174 Cb 0.04 -0.18 0.00 0.00 0.43 0.00 0.00 31.60 31.89 3ixh h MET 174 CO -0.02 0.54 -0.12 0.37 -0.40 0.00 0.00 176.91 177.27 3ixh h GLN 175 N 0.84 -0.33 0.00 0.39 4.15 -0.59 -2.02 115.11 117.55 3ixh h GLN 175 Ca 0.23 0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.56 3ixh h GLN 175 Cb -0.09 0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 3ixh h GLN 175 CO -0.05 -0.04 -0.52 1.79 -1.93 0.00 0.00 178.83 178.07 3ixh h THR 176 N -0.60 1.01 0.00 2.39 1.35 -1.27 -0.37 112.91 115.41 3ixh h THR 176 Ca -0.03 -2.10 0.00 0.00 -0.55 0.00 0.00 66.41 63.73 3ixh h THR 176 Cb 0.43 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 3ixh h THR 176 CO 0.06 0.51 -1.45 0.54 -0.25 0.00 0.00 175.52 174.93 3ixh n ARG 177 N -3.39 0.48 0.07 4.72 1.74 -0.23 -4.42 116.66 115.64 3ixh n ARG 177 Ca 0.01 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 3ixh n ARG 177 Cb 0.67 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 3ixh n ARG 177 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3ixh n VAL 178 N -1.85 0.61 0.18 1.55 0.31 -0.93 -4.74 118.33 113.47 3ixh n VAL 178 Ca 0.00 0.20 -0.11 0.00 -0.01 0.00 0.00 64.34 64.42 3ixh n VAL 178 Cb 0.43 -1.06 -0.06 0.00 -0.91 0.00 0.00 33.84 32.24 3ixh n VAL 178 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3ixh h PHE 179 N 0.00 -0.89 0.27 3.52 0.04 -1.26 -2.74 116.94 115.88 3ixh h PHE 179 Ca 0.00 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 3ixh h PHE 179 Cb 0.00 0.35 -0.01 0.00 2.20 0.00 0.00 35.95 38.49 3ixh h PHE 179 CO 0.00 -0.42 -0.19 1.96 -0.60 0.00 0.00 178.31 179.05 3ixh h GLN 180 N -0.63 -0.45 -0.19 1.51 4.20 -1.32 0.43 115.11 118.66 3ixh h GLN 180 Ca -0.04 0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.76 3ixh h GLN 180 Cb 0.55 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 3ixh h GLN 180 CO -0.04 -0.30 0.19 -1.35 -0.67 0.00 0.00 178.83 176.66 3ixh h PRO 181 N -0.47 0.00 -0.69 1.46 0.11 -1.77 -0.88 132.00 129.76 3ixh h PRO 181 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3ixh h PRO 181 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 3ixh h PRO 181 CO 0.00 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.07 3ixh n LEU 182 N -3.88 3.72 -2.50 2.35 4.77 -0.93 -4.93 117.00 115.59 3ixh n LEU 182 Ca 0.02 -1.85 -0.21 0.00 -0.03 0.00 0.00 56.01 53.93 3ixh n LEU 182 Cb 0.32 -0.46 -0.00 0.00 -2.33 0.00 0.00 43.42 40.95 3ixh n LEU 182 CO 0.28 0.93 -0.22 0.29 -1.33 0.00 0.00 177.39 177.34 3ixh n LYS 183 N 1.54 -2.23 -2.55 3.23 5.02 -0.34 -4.89 118.16 117.94 3ixh n LYS 183 Ca 0.23 0.99 -0.43 0.00 -2.02 0.00 0.00 58.31 57.08 3ixh n LYS 183 Cb 0.59 -5.69 0.00 0.00 -0.02 0.00 0.00 35.03 29.91 3ixh n LYS 183 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3ixh n LEU 184 N -3.18 5.53 -0.09 -0.35 4.77 0.09 -4.76 117.00 119.00 3ixh n LEU 184 Ca -0.22 -4.23 0.13 0.00 -0.03 0.00 0.00 56.01 51.66 3ixh n LEU 184 Cb 0.68 -1.66 0.47 0.00 -2.33 0.00 0.00 43.42 40.57 3ixh n LEU 184 CO 0.32 0.64 0.73 0.59 -1.33 0.00 0.00 177.39 178.33 3ixh n ASN 185 N 6.56 0.50 -2.28 -1.43 3.02 -1.26 -3.63 115.26 116.74 3ixh n ASN 185 Ca 0.44 -0.36 -0.18 0.00 -0.03 0.00 0.00 54.58 54.45 3ixh n ASN 185 Cb 0.43 -0.01 0.03 0.00 -0.61 0.00 0.00 39.78 39.61 3ixh n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3ixh n HIS 186 N -1.14 2.40 -4.75 3.10 8.25 -1.26 -5.02 115.22 116.79 3ixh n HIS 186 Ca 0.10 -2.31 -0.26 0.00 -0.26 0.00 0.00 57.72 54.99 3ixh n HIS 186 Cb 0.32 -0.29 -0.17 0.00 1.12 0.00 0.00 29.99 30.97 3ixh n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3ixh s THR 187 N -4.45 1.37 -0.00 1.59 2.01 -1.24 -3.75 115.64 111.17 3ixh s THR 187 Ca 0.44 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.78 3ixh s THR 187 Cb 0.39 -1.23 -0.00 0.00 0.01 0.00 0.00 72.50 71.67 3ixh s THR 187 CO -0.00 0.41 0.08 0.26 -0.69 0.00 0.00 174.62 174.67 3ixh s TRP 188 N 0.54 0.07 -0.17 4.92 0.52 0.00 -5.00 118.94 119.81 3ixh s TRP 188 Ca -0.15 -0.15 -0.15 0.00 0.02 0.00 0.00 56.10 55.68 3ixh s TRP 188 Cb -0.16 -0.07 -0.22 0.00 -1.15 0.00 0.00 33.47 31.87 3ixh s TRP 188 CO 0.05 -0.19 0.26 -0.89 0.02 0.00 0.00 176.95 176.20 3ixh n ILE 189 N 1.92 1.64 -3.93 2.03 5.41 -1.26 -0.96 119.36 124.21 3ixh n ILE 189 Ca -0.20 -0.31 -0.35 0.00 1.00 0.00 0.00 62.75 62.88 3ixh n ILE 189 Cb 0.56 -1.90 -0.13 0.00 -0.71 0.00 0.00 39.64 37.46 3ixh n ILE 189 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 3ixh s ASN 190 N -6.95 4.66 -0.08 4.38 0.01 -1.26 -4.77 114.94 110.93 3ixh s ASN 190 Ca -0.26 -0.29 -0.30 0.00 -0.71 0.00 0.00 52.86 51.30 3ixh s ASN 190 Cb 0.06 -1.81 -0.04 0.00 0.41 0.00 0.00 41.25 39.88 3ixh s ASN 190 CO 0.67 0.00 1.37 -0.69 -1.51 0.00 0.00 177.10 176.94 3ixh s VAL 191 N 1.36 3.98 0.50 1.60 1.01 -1.26 -5.01 120.40 122.58 3ixh s VAL 191 Ca 0.04 1.26 -0.18 0.00 0.00 0.00 0.00 61.98 63.10 3ixh s VAL 191 Cb -0.15 -3.81 -0.08 0.00 0.00 0.00 0.00 36.38 32.34 3ixh s VAL 191 CO 0.00 -0.06 1.00 -2.16 0.00 0.00 0.00 175.10 173.87 3ixh s PRO 192 N 3.11 3.89 0.44 2.72 0.04 -1.26 -4.92 135.00 139.02 3ixh s PRO 192 Ca 0.61 1.10 0.23 0.00 0.04 0.00 0.00 61.00 62.99 3ixh s PRO 192 Cb -0.27 -2.12 1.23 0.00 0.04 0.00 0.00 34.50 33.38 3ixh s PRO 192 CO 0.22 -0.33 1.79 -1.35 0.04 0.00 0.00 177.00 177.37 3ixh h PRO 193 N 1.19 0.27 0.00 0.56 0.11 -2.02 -0.05 132.00 132.06 3ixh h PRO 193 Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3ixh h PRO 193 Cb 1.20 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3ixh h PRO 193 CO 0.60 0.18 -0.01 0.00 -0.21 0.00 0.00 178.00 178.56 3ixh h ALA 194 N 1.57 1.07 -0.01 -0.75 0.00 -2.03 -2.84 119.26 116.27 3ixh h ALA 194 Ca 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.47 3ixh h ALA 194 Cb 1.68 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.46 3ixh h ALA 194 CO -0.21 0.01 -0.56 0.39 0.00 0.00 0.00 179.25 178.89 3ixh n GLU 195 N -3.19 1.44 -0.32 0.00 -0.58 -0.03 -4.60 120.64 113.35 3ixh n GLU 195 Ca -0.02 -0.52 0.10 0.00 -0.42 0.00 0.00 57.16 56.30 3ixh n GLU 195 Cb 0.13 -1.33 0.27 0.00 -0.57 0.00 0.00 31.44 29.94 3ixh n GLU 195 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3ixh h GLU 196 N 1.20 0.64 -0.13 3.49 5.08 -1.49 0.24 114.58 123.61 3ixh h GLU 196 Ca 0.00 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3ixh h GLU 196 Cb 0.53 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 3ixh h GLU 196 CO 0.00 0.43 0.24 1.57 -1.00 0.00 0.00 179.01 180.24 3ixh h LYS 197 N 0.66 0.00 -0.00 2.33 2.10 -1.81 0.36 116.57 120.21 3ixh h LYS 197 Ca 0.52 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.17 3ixh h LYS 197 Cb 0.79 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 3ixh h LYS 197 CO -0.39 0.00 -0.73 0.09 -2.00 0.00 0.00 179.45 176.42 3ixh n ASN 198 N -3.42 1.00 -4.57 7.07 3.02 0.82 -4.89 115.26 114.28 3ixh n ASN 198 Ca 0.01 -0.85 -0.42 0.00 -0.03 0.00 0.00 54.58 53.29 3ixh n ASN 198 Cb 0.34 0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 40.14 3ixh n ASN 198 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3ixh s TYR 199 N -2.89 2.47 0.58 3.10 5.04 0.12 -0.32 117.35 125.44 3ixh s TYR 199 Ca 0.11 0.35 -0.20 0.00 -2.44 0.00 0.00 57.07 54.89 3ixh s TYR 199 Cb 0.17 -4.51 -0.04 0.00 0.35 0.00 0.00 41.96 37.93 3ixh s TYR 199 CO 0.76 -1.77 1.17 0.00 -1.34 0.00 0.00 175.55 174.37 3ixh n ALA 200 N 8.91 0.87 -2.00 3.97 0.00 -0.93 -4.95 120.51 126.37 3ixh n ALA 200 Ca 0.09 0.06 -0.36 0.00 0.00 0.00 0.00 53.44 53.22 3ixh n ALA 200 Cb 0.49 -2.24 -0.06 0.00 0.00 0.00 0.00 19.45 17.64 3ixh n ALA 200 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3ixh s TRP 201 N -1.39 3.65 0.39 0.00 0.52 -0.64 -4.94 118.94 116.54 3ixh s TRP 201 Ca 0.75 1.50 -0.04 0.00 0.02 0.00 0.00 56.10 58.34 3ixh s TRP 201 Cb -0.42 -2.71 -0.04 0.00 -1.15 0.00 0.00 33.47 29.15 3ixh s TRP 201 CO 0.47 0.29 0.66 0.20 0.02 0.00 0.00 176.95 178.58 3ixh s GLY 202 N -1.66 1.56 -0.20 0.98 0.00 -0.92 -4.84 107.32 102.23 3ixh s GLY 202 Ca 0.46 -0.62 0.01 0.00 0.00 0.00 0.00 44.72 44.56 3ixh s GLY 202 CO 0.22 -0.50 -0.08 -0.19 0.00 0.00 0.00 173.10 172.54 3ixh s TYR 203 N -2.43 2.32 -0.21 1.90 2.02 -0.90 -1.54 117.35 118.52 3ixh s TYR 203 Ca 0.45 -1.57 -0.02 0.00 -0.37 0.00 0.00 57.07 55.56 3ixh s TYR 203 Cb -0.10 -1.58 0.00 0.00 -0.40 0.00 0.00 41.96 39.88 3ixh s TYR 203 CO 0.38 -0.73 -0.10 0.50 -1.57 0.00 0.00 175.55 174.02 3ixh s ARG 204 N 1.43 3.19 -1.55 -0.62 3.52 -0.44 -4.51 118.95 119.97 3ixh s ARG 204 Ca -0.02 -0.73 -0.14 0.00 -0.13 0.00 0.00 55.73 54.70 3ixh s ARG 204 Cb -0.17 -2.85 0.09 0.00 -1.56 0.00 0.00 34.95 30.46 3ixh s ARG 204 CO -0.08 -0.22 0.98 0.39 -0.81 0.00 0.00 175.30 175.56 3ixh n GLU 205 N 4.72 -5.40 -0.97 5.12 1.02 -1.26 -0.20 120.64 123.67 3ixh n GLU 205 Ca -0.19 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.53 3ixh n GLU 205 Cb 0.50 -5.47 0.00 0.00 -0.02 0.00 0.00 31.44 26.45 3ixh n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ixh n GLY 206 N -1.68 0.34 3.72 0.62 0.00 -1.26 -5.01 105.19 101.92 3ixh n GLY 206 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 3ixh n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ixh s LYS 207 N -0.76 3.54 -0.08 1.61 1.02 0.72 -5.07 119.74 120.71 3ixh s LYS 207 Ca 0.00 -0.30 -0.30 0.00 0.02 0.00 0.00 55.97 55.40 3ixh s LYS 207 Cb 0.00 -3.09 -0.04 0.00 -0.52 0.00 0.00 37.83 34.18 3ixh s LYS 207 CO 0.00 0.55 1.36 0.00 -0.92 0.00 0.00 175.35 176.33 3ixh s ALA 208 N -0.40 3.60 0.01 5.17 0.00 -1.26 -1.33 121.76 127.55 3ixh s ALA 208 Ca 0.10 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.74 3ixh s ALA 208 Cb -0.12 -3.62 -0.01 0.00 0.00 0.00 0.00 23.12 19.38 3ixh s ALA 208 CO 0.02 -1.07 -0.02 0.14 0.00 0.00 0.00 175.76 174.83 3ixh s VAL 209 N 3.07 0.14 0.09 0.00 -7.23 -0.59 -4.97 120.40 110.92 3ixh s VAL 209 Ca 0.61 -0.33 0.10 0.00 -1.81 0.00 0.00 61.98 60.55 3ixh s VAL 209 Cb -0.27 -0.18 -0.03 0.00 0.56 0.00 0.00 36.38 36.46 3ixh s VAL 209 CO 0.22 -0.12 -0.26 -1.00 -0.31 0.00 0.00 175.10 173.63 3ixh s HIS 210 N -0.45 2.25 0.46 2.82 3.76 -1.26 -2.17 115.29 120.70 3ixh s HIS 210 Ca -0.04 -0.39 -0.25 0.00 -0.15 0.00 0.00 55.06 54.23 3ixh s HIS 210 Cb -0.03 -1.27 -0.08 0.00 1.11 0.00 0.00 32.58 32.30 3ixh s HIS 210 CO -0.00 0.24 1.37 1.55 -0.85 0.00 0.00 174.74 177.06 3ixh n VAL 211 N 1.27 2.88 -3.92 -0.90 3.14 -1.26 -4.98 118.33 114.56 3ixh n VAL 211 Ca -0.18 -0.50 -0.29 0.00 -2.96 0.00 0.00 64.34 60.41 3ixh n VAL 211 Cb 0.53 -1.74 -0.13 0.00 -1.06 0.00 0.00 33.84 31.44 3ixh n VAL 211 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 3ixh s SER 212 N -0.55 4.58 0.27 6.55 0.01 -1.26 -5.10 113.70 118.21 3ixh s SER 212 Ca 0.63 -3.38 -0.30 0.00 1.31 0.00 0.00 55.95 54.21 3ixh s SER 212 Cb -0.46 -1.65 -0.11 0.00 0.21 0.00 0.00 66.02 64.01 3ixh s SER 212 CO 0.56 -0.17 1.55 -2.16 0.41 0.00 0.00 173.24 173.43 3ixh s PRO 213 N -0.80 4.17 0.00 12.44 0.04 -1.26 -5.04 135.00 144.55 3ixh s PRO 213 Ca 0.20 2.48 0.00 0.00 0.04 0.00 0.00 61.00 63.73 3ixh s PRO 213 Cb -0.17 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.32 3ixh s PRO 213 CO -0.07 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 176.81 3ixh n GLY 214 N 2.23 2.55 3.65 0.56 0.00 -1.26 -5.00 105.19 107.92 3ixh n GLY 214 Ca 0.08 -2.09 -0.52 0.00 0.00 0.00 0.00 46.02 43.48 3ixh n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ixh n ALA 215 N -3.00 -0.16 -1.61 4.61 0.00 -1.26 -2.57 120.51 116.52 3ixh n ALA 215 Ca 0.00 0.44 -0.20 0.00 0.00 0.00 0.00 53.44 53.68 3ixh n ALA 215 Cb 0.00 -2.21 -0.08 0.00 0.00 0.00 0.00 19.45 17.15 3ixh n ALA 215 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ixh n LEU 216 N 3.90 -1.49 0.10 0.00 4.77 -1.26 -4.81 117.00 118.21 3ixh n LEU 216 Ca 0.21 0.49 -0.03 0.00 -0.03 0.00 0.00 56.01 56.64 3ixh n LEU 216 Cb 0.20 -2.80 0.17 0.00 -2.33 0.00 0.00 43.42 38.67 3ixh n LEU 216 CO 0.69 -1.04 0.53 0.44 -1.33 0.00 0.00 177.39 176.68 3ixh h ASP 217 N 0.00 0.19 -0.49 -1.43 3.32 -1.89 -1.87 116.42 114.25 3ixh h ASP 217 Ca -0.42 -0.10 0.10 0.00 0.02 0.00 0.00 57.03 56.63 3ixh h ASP 217 Cb 1.32 -0.05 -0.08 0.00 0.22 0.00 0.00 39.33 40.73 3ixh h ASP 217 CO 0.61 0.70 -0.04 0.00 -1.72 0.00 0.00 179.24 178.80 3ixh h ALA 218 N 1.30 0.42 -0.09 3.45 0.00 -1.91 0.60 119.26 123.04 3ixh h ALA 218 Ca -0.00 0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 3ixh h ALA 218 Cb 1.02 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 3ixh h ALA 218 CO 0.08 -0.41 -0.59 0.93 0.00 0.00 0.00 179.25 179.26 3ixh h GLU 219 N 0.08 0.28 0.00 0.00 3.07 -1.85 -3.23 114.58 112.94 3ixh h GLU 219 Ca 0.24 -0.19 -0.36 0.00 -0.50 0.00 0.00 59.36 58.56 3ixh h GLU 219 Cb 0.37 0.03 -0.06 0.00 -0.84 0.00 0.00 28.75 28.24 3ixh h GLU 219 CO -0.44 0.79 -2.25 0.00 -1.40 0.00 0.00 179.01 175.71 3ixh n ALA 220 N -2.48 1.47 -2.07 3.43 0.00 -0.72 -4.62 120.51 115.52 3ixh n ALA 220 Ca -0.02 -1.17 -0.03 0.00 0.00 0.00 0.00 53.44 52.21 3ixh n ALA 220 Cb 0.61 -0.32 -0.00 0.00 0.00 0.00 0.00 19.45 19.73 3ixh n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ixh n GLY 221 N 1.78 0.38 1.22 0.00 0.00 0.19 -4.18 105.19 104.58 3ixh n GLY 221 Ca -0.31 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 45.77 3ixh n GLY 221 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ixh n GLY 222 N -0.32 2.72 3.75 -0.02 0.00 -0.09 -3.82 105.19 107.42 3ixh n GLY 222 Ca -0.15 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 44.75 3ixh n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ixh s VAL 223 N -1.32 4.78 -0.07 1.61 1.01 -1.26 -4.35 120.40 120.80 3ixh s VAL 223 Ca 0.43 1.48 0.05 0.00 0.00 0.00 0.00 61.98 63.95 3ixh s VAL 223 Cb 0.25 -4.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 3ixh s VAL 223 CO 0.25 0.40 -0.23 -0.54 0.00 0.00 0.00 175.10 174.98 3ixh s LYS 224 N -0.18 2.67 0.24 2.72 3.01 -0.13 -0.66 119.74 127.41 3ixh s LYS 224 Ca 0.35 -0.87 -0.12 0.00 -1.01 0.00 0.00 55.97 54.33 3ixh s LYS 224 Cb -0.20 -2.23 -0.01 0.00 -1.01 0.00 0.00 37.83 34.39 3ixh s LYS 224 CO 0.21 0.37 0.44 0.45 0.51 0.00 0.00 175.35 177.33 3ixh s SER 225 N -0.11 -0.07 0.36 2.83 0.15 -0.66 -0.82 113.70 115.38 3ixh s SER 225 Ca -0.05 -0.94 0.07 0.00 0.70 0.00 0.00 55.95 55.74 3ixh s SER 225 Cb -0.14 0.56 -0.02 0.00 -1.71 0.00 0.00 66.02 64.71 3ixh s SER 225 CO 0.04 -1.10 0.37 0.42 1.20 0.00 0.00 173.24 174.17 3ixh s THR 226 N -4.02 3.38 0.35 6.45 -4.23 -1.25 -0.77 115.64 115.56 3ixh s THR 226 Ca 0.23 -1.27 0.02 0.00 -1.18 0.00 0.00 61.69 59.49 3ixh s THR 226 Cb 0.00 -3.16 0.26 0.00 1.34 0.00 0.00 72.50 70.94 3ixh s THR 226 CO 0.08 -0.12 2.01 -0.29 -0.54 0.00 0.00 174.62 175.76 3ixh h ILE 227 N 1.08 1.16 -0.35 2.99 6.09 -1.74 -1.89 117.51 124.86 3ixh h ILE 227 Ca -0.44 -0.31 -0.06 0.00 -1.37 0.00 0.00 64.86 62.69 3ixh h ILE 227 Cb 1.26 0.25 -0.01 0.00 0.47 0.00 0.00 36.82 38.79 3ixh h ILE 227 CO 0.56 0.16 0.00 -0.33 -3.07 0.00 0.00 178.15 175.47 3ixh h GLU 228 N 0.85 0.62 -0.26 2.19 5.08 -1.94 -1.85 114.58 119.27 3ixh h GLU 228 Ca 0.23 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 3ixh h GLU 228 Cb -0.09 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3ixh h GLU 228 CO -0.05 0.74 -0.39 -0.44 -1.00 0.00 0.00 179.01 177.87 3ixh h ASP 229 N 0.44 0.64 -0.55 1.42 5.19 -1.85 -2.64 116.42 119.08 3ixh h ASP 229 Ca 0.10 -0.28 -0.06 0.00 -0.62 0.00 0.00 57.03 56.18 3ixh h ASP 229 Cb 0.46 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.76 3ixh h ASP 229 CO 0.02 0.96 0.14 0.24 -3.12 0.00 0.00 179.24 177.47 3ixh h MET 230 N 0.50 0.92 -0.57 3.56 2.86 -1.32 0.91 114.93 121.79 3ixh h MET 230 Ca 0.05 -0.20 -0.05 0.00 -2.06 0.00 0.00 59.70 57.43 3ixh h MET 230 Cb 0.89 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 3ixh h MET 230 CO 0.08 0.83 0.15 0.00 1.06 0.00 0.00 176.91 179.02 3ixh h ALA 231 N 1.27 0.75 -0.64 6.32 0.00 -1.25 -0.66 119.26 125.05 3ixh h ALA 231 Ca 0.19 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3ixh h ALA 231 Cb 0.33 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3ixh h ALA 231 CO 0.00 0.45 0.22 -0.09 0.00 0.00 0.00 179.25 179.83 3ixh h ARG 232 N 0.82 0.95 -0.23 0.00 2.43 -1.11 0.25 114.38 117.48 3ixh h ARG 232 Ca 0.18 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 3ixh h ARG 232 Cb 0.33 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 3ixh h ARG 232 CO 0.00 0.80 0.07 2.35 -1.51 0.00 0.00 179.97 181.68 3ixh h TRP 233 N 0.93 0.38 -0.10 2.20 -0.00 -0.60 -0.40 115.95 118.36 3ixh h TRP 233 Ca 0.21 -0.04 0.01 0.00 -0.00 0.00 0.00 58.89 59.07 3ixh h TRP 233 Cb 0.23 -0.11 -0.01 0.00 -0.00 0.00 0.00 29.16 29.27 3ixh h TRP 233 CO 0.02 0.44 0.02 0.28 -0.00 0.00 0.00 178.44 179.19 3ixh h VAL 234 N 0.21 0.96 -0.47 2.65 2.07 -0.88 -1.51 116.25 119.28 3ixh h VAL 234 Ca 0.08 -0.02 0.10 0.00 0.82 0.00 0.00 66.70 67.67 3ixh h VAL 234 Cb 0.24 0.89 -0.10 0.00 -1.52 0.00 0.00 31.29 30.80 3ixh h VAL 234 CO -0.00 0.01 -0.21 1.56 0.02 0.00 0.00 177.57 178.95 3ixh h GLN 235 N 0.06 -0.10 -0.57 1.57 4.20 -0.36 0.09 115.11 120.00 3ixh h GLN 235 Ca 0.04 0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.83 3ixh h GLN 235 Cb 0.04 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 27.78 3ixh h GLN 235 CO -0.06 -0.07 0.25 0.77 -0.67 0.00 0.00 178.83 179.06 3ixh h SER 236 N -0.10 0.31 0.77 1.46 0.02 -0.83 -1.61 113.55 113.56 3ixh h SER 236 Ca 0.22 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 61.16 3ixh h SER 236 Cb 0.45 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 3ixh h SER 236 CO -0.54 0.20 -0.33 0.78 -1.14 0.00 0.00 176.83 175.80 3ixh h ASN 237 N 0.47 0.00 -0.07 3.07 2.35 -0.76 -2.83 115.58 117.80 3ixh h ASN 237 Ca 0.27 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.79 3ixh h ASN 237 Cb 0.26 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.64 3ixh h ASN 237 CO -0.24 0.33 -0.82 -0.07 -1.65 0.00 0.00 177.43 174.98 3ixh h LEU 238 N 0.00 0.89 -6.26 1.61 3.38 -0.08 -3.40 115.31 111.45 3ixh h LEU 238 Ca -0.00 -0.61 -0.58 0.00 0.09 0.00 0.00 57.88 56.78 3ixh h LEU 238 Cb 0.81 -0.26 -0.40 0.00 0.09 0.00 0.00 40.66 40.89 3ixh h LEU 238 CO 0.04 1.40 -0.90 0.29 0.09 0.00 0.00 178.44 179.37 3ixh n LYS 239 N -3.91 1.14 0.27 1.13 5.02 -0.76 -4.81 118.16 116.24 3ixh n LYS 239 Ca -0.08 -3.69 0.14 0.00 -2.02 0.00 0.00 58.31 52.65 3ixh n LYS 239 Cb 0.77 -1.69 0.74 0.00 -0.02 0.00 0.00 35.03 34.83 3ixh n LYS 239 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3ixh h PRO 240 N 4.59 0.00 0.00 1.97 0.13 -1.72 -2.84 132.00 134.14 3ixh h PRO 240 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3ixh h PRO 240 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3ixh h PRO 240 CO 0.56 0.11 0.00 1.28 -0.23 0.00 0.00 178.00 179.71 3ixh n LEU 241 N -3.53 0.02 -0.24 1.56 4.77 -1.26 -1.98 117.00 116.34 3ixh n LEU 241 Ca -0.02 0.50 0.15 0.00 -0.03 0.00 0.00 56.01 56.61 3ixh n LEU 241 Cb 0.25 -0.50 0.69 0.00 -2.33 0.00 0.00 43.42 41.53 3ixh n LEU 241 CO 0.29 -0.04 0.95 0.47 -1.33 0.00 0.00 177.39 177.74 3ixh n ASP 242 N -1.52 0.79 -4.74 -1.43 8.00 -1.07 -4.88 116.55 111.70 3ixh n ASP 242 Ca 0.07 -1.16 -0.40 0.00 0.71 0.00 0.00 54.79 54.01 3ixh n ASP 242 Cb 0.32 -0.01 -0.05 0.00 -0.02 0.00 0.00 41.12 41.36 3ixh n ASP 242 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ixh s ILE 243 N -2.09 4.90 0.06 0.53 1.01 -0.84 -5.01 121.20 119.77 3ixh s ILE 243 Ca 0.40 1.47 -0.27 0.00 0.00 0.00 0.00 60.65 62.24 3ixh s ILE 243 Cb 0.21 -4.04 -0.17 0.00 0.01 0.00 0.00 42.46 38.47 3ixh s ILE 243 CO 0.37 0.33 1.55 0.78 0.00 0.00 0.00 174.94 177.98 3ixh h ASN 244 N 6.11 -0.38 -2.96 3.58 2.35 -1.90 -3.44 115.58 118.94 3ixh h ASN 244 Ca -0.43 -0.05 -0.56 0.00 -0.55 0.00 0.00 56.30 54.70 3ixh h ASN 244 Cb 1.20 0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.64 3ixh h ASN 244 CO 0.72 -0.19 0.84 -1.61 -1.65 0.00 0.00 177.43 175.55 3ixh s GLU 245 N -5.68 4.27 0.13 0.81 8.01 -1.26 -4.93 118.70 120.04 3ixh s GLU 245 Ca -0.15 1.68 -0.19 0.00 0.01 0.00 0.00 54.97 56.32 3ixh s GLU 245 Cb 0.04 -3.70 -0.03 0.00 -4.31 0.00 0.00 34.13 26.13 3ixh s GLU 245 CO 0.62 -0.62 1.78 0.87 0.01 0.00 0.00 175.26 177.91 3ixh h LYS 246 N 7.97 0.29 -0.43 1.61 1.57 -2.00 -2.34 116.57 123.25 3ixh h LYS 246 Ca -0.29 -0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.33 3ixh h LYS 246 Cb 1.12 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 3ixh h LYS 246 CO 0.94 0.19 -0.30 1.79 -0.57 0.00 0.00 179.45 181.50 3ixh h THR 247 N 0.30 1.27 -0.97 -0.16 1.35 -1.91 -2.16 112.91 110.63 3ixh h THR 247 Ca 0.10 -1.47 0.01 0.00 -0.55 0.00 0.00 66.41 64.50 3ixh h THR 247 Cb 0.00 1.26 -0.05 0.00 -1.73 0.00 0.00 68.15 67.63 3ixh h THR 247 CO -0.05 0.50 0.64 0.25 -0.25 0.00 0.00 175.52 176.61 3ixh h LEU 248 N 0.79 1.12 0.08 3.87 5.85 -1.86 0.48 115.31 125.63 3ixh h LEU 248 Ca 0.08 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 3ixh h LEU 248 Cb 0.89 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3ixh h LEU 248 CO 0.08 0.81 -0.04 -0.61 -0.34 0.00 0.00 178.44 178.34 3ixh h GLN 249 N 1.32 -0.10 0.05 1.25 4.15 -1.26 -1.44 115.11 119.08 3ixh h GLN 249 Ca 0.36 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.80 3ixh h GLN 249 Cb -0.15 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.54 3ixh h GLN 249 CO -0.08 -0.00 -0.14 1.96 -1.93 0.00 0.00 178.83 178.64 3ixh h GLN 250 N -0.17 -0.25 -0.84 1.69 4.20 -1.10 -2.95 115.11 115.69 3ixh h GLN 250 Ca -0.01 0.02 0.17 0.00 0.06 0.00 0.00 58.65 58.89 3ixh h GLN 250 Cb 0.14 0.06 -0.11 0.00 0.30 0.00 0.00 27.48 27.87 3ixh h GLN 250 CO 0.02 -0.17 0.39 0.78 -0.67 0.00 0.00 178.83 179.18 3ixh h GLY 251 N -0.26 1.38 0.96 3.46 0.00 0.20 0.12 103.07 108.92 3ixh h GLY 251 Ca 0.03 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 3ixh h GLY 251 CO -0.10 -0.14 -0.08 -2.22 0.00 0.00 0.00 176.54 174.00 3ixh h ILE 252 N 0.50 0.82 -0.63 2.60 2.04 -1.25 -0.90 117.51 120.69 3ixh h ILE 252 Ca 0.49 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.40 3ixh h ILE 252 Cb 0.80 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.64 3ixh h ILE 252 CO -0.43 0.00 0.34 1.56 0.00 0.00 0.00 178.15 179.62 3ixh h GLN 253 N -0.21 0.62 -0.66 2.37 4.20 -0.93 -1.64 115.11 118.86 3ixh h GLN 253 Ca -0.01 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 3ixh h GLN 253 Cb 0.18 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 3ixh h GLN 253 CO 0.01 0.41 0.27 -0.07 -0.67 0.00 0.00 178.83 178.78 3ixh h LEU 254 N 0.64 0.88 -1.70 1.46 3.38 -0.75 -2.26 115.31 116.96 3ixh h LEU 254 Ca 0.28 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 3ixh h LEU 254 Cb 0.18 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3ixh h LEU 254 CO -0.18 0.79 -0.16 0.00 0.09 0.00 0.00 178.44 178.98 3ixh h ALA 255 N 1.34 1.70 -0.55 1.53 0.00 -0.22 -2.61 119.26 120.44 3ixh h ALA 255 Ca 0.22 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3ixh h ALA 255 Cb 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3ixh h ALA 255 CO -0.02 0.20 0.00 1.04 0.00 0.00 0.00 179.25 180.47 3ixh n GLN 256 N -4.29 2.71 -1.92 0.00 6.02 -0.89 -1.16 117.38 117.84 3ixh n GLN 256 Ca -0.02 -2.16 -0.33 0.00 -0.01 0.00 0.00 57.00 54.48 3ixh n GLN 256 Cb 0.23 -1.59 0.02 0.00 1.02 0.00 0.00 30.24 29.92 3ixh n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3ixh s SER 257 N -0.91 5.56 -0.43 1.08 0.01 -0.98 -4.01 113.70 114.02 3ixh s SER 257 Ca 0.39 1.85 -0.13 0.00 1.31 0.00 0.00 55.95 59.38 3ixh s SER 257 Cb 0.23 -2.53 0.06 0.00 0.21 0.00 0.00 66.02 63.98 3ixh s SER 257 CO 0.23 -1.32 0.31 -0.13 0.41 0.00 0.00 173.24 172.74 3ixh s ARG 258 N -4.16 2.83 -0.09 12.44 0.52 -0.15 -4.00 118.95 126.35 3ixh s ARG 258 Ca 0.64 -1.29 0.10 0.00 -0.52 0.00 0.00 55.73 54.66 3ixh s ARG 258 Cb -0.17 -3.93 -0.24 0.00 0.52 0.00 0.00 34.95 31.13 3ixh s ARG 258 CO 0.40 -0.91 0.49 0.66 0.02 0.00 0.00 175.30 175.95 3ixh n TYR 259 N 5.07 0.83 -3.89 -0.53 4.01 -0.69 -2.79 117.16 119.18 3ixh n TYR 259 Ca -0.11 0.27 -0.11 0.00 -0.16 0.00 0.00 57.90 57.79 3ixh n TYR 259 Cb 0.44 -1.15 -0.11 0.00 -0.31 0.00 0.00 39.34 38.22 3ixh n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3ixh s TRP 260 N -2.57 0.05 -0.03 -0.72 0.52 -1.24 -1.59 118.94 113.36 3ixh s TRP 260 Ca -0.09 -0.12 0.07 0.00 0.02 0.00 0.00 56.10 55.98 3ixh s TRP 260 Cb 0.07 -0.06 -0.02 0.00 -1.15 0.00 0.00 33.47 32.32 3ixh s TRP 260 CO 0.81 -0.20 -0.25 -1.14 0.02 0.00 0.00 176.95 176.19 3ixh s GLN 261 N -1.03 2.17 -0.16 4.98 0.74 -0.50 -1.31 119.66 124.56 3ixh s GLN 261 Ca -0.11 -0.90 -0.04 0.00 0.05 0.00 0.00 55.36 54.36 3ixh s GLN 261 Cb -0.06 -2.02 0.07 0.00 1.10 0.00 0.00 33.01 32.10 3ixh s GLN 261 CO 0.01 0.49 0.18 -0.08 -0.55 0.00 0.00 175.29 175.34 3ixh s THR 262 N -0.47 -0.26 0.00 -0.34 -1.32 -0.40 -1.39 115.64 111.47 3ixh s THR 262 Ca 0.06 0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.56 3ixh s THR 262 Cb -0.11 -0.54 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 3ixh s THR 262 CO 0.00 -0.11 0.00 0.61 -2.21 0.00 0.00 174.62 172.91 3ixh n GLY 263 N 5.31 2.95 0.39 6.08 0.00 -1.26 -1.21 105.19 117.45 3ixh n GLY 263 Ca -0.06 -0.21 0.13 0.00 0.00 0.00 0.00 46.02 45.89 3ixh n GLY 263 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ixh n ASP 264 N 5.98 1.35 -4.81 1.61 9.92 -1.26 -4.94 116.55 124.40 3ixh n ASP 264 Ca 0.00 -1.24 -0.38 0.00 -0.53 0.00 0.00 54.79 52.64 3ixh n ASP 264 Cb 0.00 0.07 -0.06 0.00 -0.64 0.00 0.00 41.12 40.49 3ixh n ASP 264 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 3ixh s MET 265 N -2.24 4.09 -0.10 -1.24 1.75 -0.35 -4.51 119.30 116.70 3ixh s MET 265 Ca 0.31 0.54 0.02 0.00 -1.25 0.00 0.00 55.69 55.31 3ixh s MET 265 Cb 0.20 -3.26 -0.01 0.00 2.84 0.00 0.00 34.83 34.60 3ixh s MET 265 CO 0.42 0.59 -0.16 0.71 -0.65 0.00 0.00 175.02 175.93 3ixh s TYR 266 N -0.83 2.72 -0.21 4.11 2.02 0.29 -1.27 117.35 124.18 3ixh s TYR 266 Ca 0.26 -0.60 -0.20 0.00 -0.37 0.00 0.00 57.07 56.16 3ixh s TYR 266 Cb -0.18 -1.76 -0.03 0.00 -0.40 0.00 0.00 41.96 39.60 3ixh s TYR 266 CO 0.15 -0.15 0.61 -1.14 -1.57 0.00 0.00 175.55 173.44 3ixh s GLN 267 N 0.06 4.19 0.00 -0.62 2.00 -0.42 -1.23 119.66 123.64 3ixh s GLN 267 Ca -0.06 0.56 0.00 0.00 -2.00 0.00 0.00 55.36 53.86 3ixh s GLN 267 Cb -0.15 -3.59 0.00 0.00 0.80 0.00 0.00 33.01 30.07 3ixh s GLN 267 CO 0.05 -0.25 0.00 0.41 -0.50 0.00 0.00 175.29 175.00 3ixh n GLY 268 N 3.89 1.69 3.42 2.59 0.00 0.18 -1.71 105.19 115.25 3ixh n GLY 268 Ca -0.02 -2.01 -0.44 0.00 0.00 0.00 0.00 46.02 43.55 3ixh n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ixh s LEU 269 N 0.00 4.80 0.00 0.99 1.43 -0.31 -4.56 118.68 121.03 3ixh s LEU 269 Ca 0.00 -1.21 0.00 0.00 -1.03 0.00 0.00 54.13 51.89 3ixh s LEU 269 Cb 0.00 -2.37 0.00 0.00 0.03 0.00 0.00 46.19 43.85 3ixh s LEU 269 CO 0.00 -1.30 0.00 0.61 0.23 0.00 0.00 176.35 175.89 3ixh n GLY 270 N 5.31 1.81 3.77 -3.19 0.00 -1.26 -4.25 105.19 107.38 3ixh n GLY 270 Ca -0.05 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 3ixh n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ixh s TRP 271 N 0.00 2.67 0.01 1.61 0.52 -1.26 -4.58 118.94 117.91 3ixh s TRP 271 Ca 0.00 1.54 0.07 0.00 0.02 0.00 0.00 56.10 57.74 3ixh s TRP 271 Cb 0.00 -3.29 -0.02 0.00 -1.15 0.00 0.00 33.47 29.01 3ixh s TRP 271 CO 0.00 -1.57 -0.23 -1.21 0.02 0.00 0.00 176.95 173.96 3ixh s GLU 272 N -3.29 1.71 0.10 4.98 2.02 -0.91 -0.65 118.70 122.67 3ixh s GLU 272 Ca 0.73 -0.90 0.05 0.00 0.02 0.00 0.00 54.97 54.87 3ixh s GLU 272 Cb -0.24 -1.74 -0.04 0.00 0.10 0.00 0.00 34.13 32.22 3ixh s GLU 272 CO 0.27 0.46 -0.13 -1.64 0.02 0.00 0.00 175.26 174.24 3ixh s MET 273 N -0.84 0.94 0.10 1.61 -1.94 -0.36 -0.93 119.30 117.88 3ixh s MET 273 Ca 0.09 -1.16 0.02 0.00 -1.71 0.00 0.00 55.69 52.93 3ixh s MET 273 Cb -0.09 -0.81 -0.04 0.00 2.01 0.00 0.00 34.83 35.90 3ixh s MET 273 CO 0.00 0.16 -0.07 -0.51 -0.01 0.00 0.00 175.02 174.59 3ixh s LEU 274 N -2.29 2.49 0.28 -0.03 1.02 -0.55 -0.55 118.68 119.06 3ixh s LEU 274 Ca 0.06 -0.97 -0.29 0.00 0.02 0.00 0.00 54.13 52.94 3ixh s LEU 274 Cb -0.06 -0.10 -0.10 0.00 0.02 0.00 0.00 46.19 45.95 3ixh s LEU 274 CO 0.02 -0.43 1.33 -1.81 0.02 0.00 0.00 176.35 175.48 3ixh s ASP 275 N -2.93 6.79 -0.19 2.29 1.01 -1.26 -0.35 116.67 122.03 3ixh s ASP 275 Ca 0.10 2.61 -0.07 0.00 0.71 0.00 0.00 52.55 55.90 3ixh s ASP 275 Cb 0.04 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 3ixh s ASP 275 CO -0.04 -0.56 0.06 0.86 0.21 0.00 0.00 175.17 175.71 3ixh s TRP 276 N -0.63 3.25 0.52 4.23 -0.11 -0.03 -3.57 118.94 122.60 3ixh s TRP 276 Ca 0.53 0.06 -0.09 0.00 1.22 0.00 0.00 56.10 57.82 3ixh s TRP 276 Cb -0.39 -2.09 -0.04 0.00 -1.50 0.00 0.00 33.47 29.45 3ixh s TRP 276 CO 0.47 0.14 0.88 -1.25 -4.62 0.00 0.00 176.95 172.57 3ixh s PRO 277 N 0.42 3.62 0.39 5.86 0.04 -1.26 -4.74 135.00 139.33 3ixh s PRO 277 Ca 0.03 0.46 0.08 0.00 0.04 0.00 0.00 61.00 61.61 3ixh s PRO 277 Cb -0.12 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 32.08 3ixh s PRO 277 CO 0.00 -0.31 0.02 0.14 0.04 0.00 0.00 177.00 176.90 3ixh s VAL 278 N -2.83 2.15 -0.35 -0.36 -7.23 -1.23 -5.09 120.40 105.45 3ixh s VAL 278 Ca 0.51 -1.98 -0.15 0.00 -1.81 0.00 0.00 61.98 58.55 3ixh s VAL 278 Cb -0.10 -2.92 -0.01 0.00 0.56 0.00 0.00 36.38 33.90 3ixh s VAL 278 CO 0.45 -0.05 0.35 0.21 -0.31 0.00 0.00 175.10 175.75 3ixh s ASN 279 N -3.73 6.16 0.33 4.85 2.47 -1.26 -4.97 114.94 118.80 3ixh s ASN 279 Ca 0.36 -0.31 0.12 0.00 0.42 0.00 0.00 52.86 53.45 3ixh s ASN 279 Cb 0.07 -2.19 1.05 0.00 -1.45 0.00 0.00 41.25 38.73 3ixh s ASN 279 CO 0.19 -0.34 1.63 1.55 -3.72 0.00 0.00 177.10 176.40 3ixh h PRO 280 N 8.49 0.18 0.00 0.43 0.13 -1.99 0.93 132.00 140.17 3ixh h PRO 280 Ca -0.30 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.81 3ixh h PRO 280 Cb 1.14 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 3ixh h PRO 280 CO 0.69 0.12 -0.04 -0.44 -0.23 0.00 0.00 178.00 178.11 3ixh h ASP 281 N 0.19 0.00 -0.27 1.44 3.32 -1.98 0.36 116.42 119.48 3ixh h ASP 281 Ca 0.71 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.61 3ixh h ASP 281 Cb 1.67 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.21 3ixh h ASP 281 CO -0.69 0.04 -0.39 -1.28 -1.72 0.00 0.00 179.24 175.19 3ixh h SER 282 N 0.00 0.87 0.00 6.45 0.87 0.51 -3.07 113.55 119.17 3ixh h SER 282 Ca -0.00 -0.39 -0.05 0.00 -1.23 0.00 0.00 61.79 60.12 3ixh h SER 282 Cb 0.11 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3ixh h SER 282 CO 0.00 1.15 -0.28 0.16 -0.53 0.00 0.00 176.83 177.33 3ixh h ILE 283 N 0.67 1.53 -1.02 2.23 3.07 -1.20 -3.36 117.51 119.43 3ixh h ILE 283 Ca 0.06 -2.26 0.26 0.00 1.55 0.00 0.00 64.86 64.47 3ixh h ILE 283 Cb 0.95 3.00 -0.12 0.00 -0.27 0.00 0.00 36.82 40.39 3ixh h ILE 283 CO 0.09 0.52 0.61 0.40 -1.05 0.00 0.00 178.15 178.72 3ixh h ILE 284 N -1.00 0.50 -0.99 0.16 2.04 -0.43 0.65 117.51 118.44 3ixh h ILE 284 Ca -0.08 -0.18 -0.65 0.00 1.00 0.00 0.00 64.86 64.95 3ixh h ILE 284 Cb 1.03 -0.06 -0.29 0.00 -0.74 0.00 0.00 36.82 36.76 3ixh h ILE 284 CO -0.05 0.09 0.80 0.59 0.00 0.00 0.00 178.15 179.59 3ixh n ASN 285 N -4.85 7.09 -2.49 1.72 3.02 -1.16 -4.40 115.26 114.19 3ixh n ASN 285 Ca 0.27 -3.76 -0.12 0.00 -0.03 0.00 0.00 54.58 50.94 3ixh n ASN 285 Cb 0.81 -0.94 0.03 0.00 -0.61 0.00 0.00 39.78 39.07 3ixh n ASN 285 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ixh n GLY 286 N -0.95 3.81 0.00 7.41 0.00 0.23 -4.89 105.19 110.81 3ixh n GLY 286 Ca 0.62 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.83 3ixh n GLY 286 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ixh n SER 287 N -0.59 0.00 -4.03 1.61 3.41 -1.26 -4.51 113.62 108.24 3ixh n SER 287 Ca 0.23 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.55 3ixh n SER 287 Cb 0.86 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.92 3ixh n SER 287 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3ixh n ASP 288 N -0.83 -2.66 0.18 4.04 2.03 -1.26 -3.67 116.55 114.39 3ixh n ASP 288 Ca 0.00 -0.14 0.12 0.00 0.52 0.00 0.00 54.79 55.29 3ixh n ASP 288 Cb 0.00 -0.75 0.63 0.00 -0.72 0.00 0.00 41.12 40.28 3ixh n ASP 288 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 3ixh h ASN 289 N -1.88 0.00 0.00 1.67 2.35 -1.99 -2.09 115.58 113.65 3ixh h ASN 289 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 3ixh h ASN 289 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 3ixh h ASN 289 CO 0.27 0.00 0.00 2.29 -1.65 0.00 0.00 177.43 178.34 3ixh n LYS 290 N -2.33 2.55 -0.07 0.81 -0.00 -1.26 -4.53 118.16 113.34 3ixh n LYS 290 Ca -0.02 -0.23 -0.06 0.00 -0.00 0.00 0.00 58.31 58.01 3ixh n LYS 290 Cb 0.08 -0.71 -0.02 0.00 -0.00 0.00 0.00 35.03 34.39 3ixh n LYS 290 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 3ixh n ILE 291 N -0.43 1.23 0.45 0.58 5.41 -0.83 -4.06 119.36 121.71 3ixh n ILE 291 Ca 0.00 0.23 0.12 0.00 1.00 0.00 0.00 62.75 64.10 3ixh n ILE 291 Cb 0.01 -2.24 0.47 0.00 -0.71 0.00 0.00 39.64 37.18 3ixh n ILE 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ixh n ALA 292 N -3.79 1.80 -1.57 -1.39 0.00 -0.91 -2.90 120.51 111.75 3ixh n ALA 292 Ca -0.09 0.06 -0.12 0.00 0.00 0.00 0.00 53.44 53.29 3ixh n ALA 292 Cb 0.33 -1.40 0.15 0.00 0.00 0.00 0.00 19.45 18.52 3ixh n ALA 292 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ixh n LEU 293 N -2.23 4.72 -4.71 0.00 4.77 -1.25 -4.43 117.00 113.87 3ixh n LEU 293 Ca 0.03 -4.07 -0.29 0.00 -0.03 0.00 0.00 56.01 51.65 3ixh n LEU 293 Cb 0.27 -0.61 -0.07 0.00 -2.33 0.00 0.00 43.42 40.68 3ixh n LEU 293 CO 0.22 1.48 -0.31 0.00 -1.33 0.00 0.00 177.39 177.46 3ixh s ALA 294 N -3.40 3.36 0.06 -1.18 0.00 -1.14 -4.84 121.76 114.62 3ixh s ALA 294 Ca 0.48 -1.16 -0.31 0.00 0.00 0.00 0.00 51.96 50.98 3ixh s ALA 294 Cb 0.42 -1.22 -0.06 0.00 0.00 0.00 0.00 23.12 22.26 3ixh s ALA 294 CO 0.00 0.65 1.26 0.00 0.00 0.00 0.00 175.76 177.67 3ixh s ALA 295 N -1.45 3.46 -0.03 0.00 0.00 -1.26 -4.55 121.76 117.92 3ixh s ALA 295 Ca 0.27 0.89 -0.00 0.00 0.00 0.00 0.00 51.96 53.12 3ixh s ALA 295 Cb -0.11 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.55 3ixh s ALA 295 CO 0.20 -0.54 0.02 1.03 0.00 0.00 0.00 175.76 176.46 3ixh s ARG 296 N 1.28 0.17 0.34 0.00 1.81 -0.74 -5.00 118.95 116.81 3ixh s ARG 296 Ca 0.60 0.14 -0.29 0.00 -1.72 0.00 0.00 55.73 54.47 3ixh s ARG 296 Cb -0.31 -0.43 -0.11 0.00 -0.45 0.00 0.00 34.95 33.65 3ixh s ARG 296 CO 0.29 -0.17 1.43 -2.14 -0.68 0.00 0.00 175.30 174.02 3ixh s PRO 297 N 1.19 4.21 0.12 3.54 0.02 -1.26 -0.29 135.00 142.53 3ixh s PRO 297 Ca -0.08 2.42 0.08 0.00 0.02 0.00 0.00 61.00 63.45 3ixh s PRO 297 Cb -0.13 -3.03 -0.04 0.00 0.02 0.00 0.00 34.50 31.32 3ixh s PRO 297 CO -0.02 -0.41 -0.15 0.14 -0.33 0.00 0.00 177.00 176.23 3ixh s VAL 298 N -0.89 3.03 -0.18 3.83 -7.23 -0.61 -4.67 120.40 113.68 3ixh s VAL 298 Ca 0.53 -1.45 -0.09 0.00 -1.81 0.00 0.00 61.98 59.17 3ixh s VAL 298 Cb -0.44 -2.41 -0.05 0.00 0.56 0.00 0.00 36.38 34.05 3ixh s VAL 298 CO 0.56 0.08 0.11 -1.59 -0.31 0.00 0.00 175.10 173.95 3ixh s LYS 299 N -2.23 4.01 0.31 4.82 -2.85 -0.48 -4.83 119.74 118.50 3ixh s LYS 299 Ca 0.20 -0.25 -0.29 0.00 -1.00 0.00 0.00 55.97 54.62 3ixh s LYS 299 Cb -0.11 -3.32 -0.11 0.00 -2.06 0.00 0.00 37.83 32.24 3ixh s LYS 299 CO 0.12 0.36 1.48 0.00 0.10 0.00 0.00 175.35 177.40 3ixh s ALA 300 N 0.18 3.63 -0.41 0.59 0.00 -1.26 -1.41 121.76 123.08 3ixh s ALA 300 Ca 0.07 1.47 -0.15 0.00 0.00 0.00 0.00 51.96 53.35 3ixh s ALA 300 Cb -0.12 -3.59 0.02 0.00 0.00 0.00 0.00 23.12 19.43 3ixh s ALA 300 CO -0.01 -0.89 0.33 0.42 0.00 0.00 0.00 175.76 175.61 3ixh s ILE 301 N -0.49 5.22 -0.36 0.00 1.01 -0.62 -4.89 121.20 121.07 3ixh s ILE 301 Ca 0.57 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.71 3ixh s ILE 301 Cb -0.45 -3.94 0.10 0.00 0.01 0.00 0.00 42.46 38.19 3ixh s ILE 301 CO 0.52 -0.31 0.09 -0.89 0.00 0.00 0.00 174.94 174.34 3ixh s THR 302 N 1.79 2.43 0.62 2.92 2.01 -1.26 -1.51 115.64 122.64 3ixh s THR 302 Ca 0.07 -2.40 -0.07 0.00 0.31 0.00 0.00 61.69 59.60 3ixh s THR 302 Cb -0.18 -2.77 0.01 0.00 0.01 0.00 0.00 72.50 69.57 3ixh s THR 302 CO 0.11 -0.63 0.94 -2.16 -0.69 0.00 0.00 174.62 172.19 3ixh s PRO 303 N 0.83 2.84 0.39 4.92 0.04 -1.26 -5.10 135.00 137.67 3ixh s PRO 303 Ca 0.11 0.03 -0.26 0.00 0.04 0.00 0.00 61.00 60.92 3ixh s PRO 303 Cb -0.20 -2.23 -0.11 0.00 0.04 0.00 0.00 34.50 32.00 3ixh s PRO 303 CO -0.07 -0.79 1.26 -2.30 0.04 0.00 0.00 177.00 175.14 3ixh n PRO 304 N -2.67 1.95 -2.46 0.56 -0.02 -0.57 -4.95 135.00 126.85 3ixh n PRO 304 Ca 0.05 0.69 -0.42 0.00 -2.02 0.00 0.00 63.50 61.80 3ixh n PRO 304 Cb 0.58 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 3ixh n PRO 304 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3ixh s THR 305 N -1.17 4.09 0.91 3.45 2.01 -1.12 -4.85 115.64 118.96 3ixh s THR 305 Ca 0.59 1.53 -0.12 0.00 0.31 0.00 0.00 61.69 64.00 3ixh s THR 305 Cb -0.53 -3.98 0.14 0.00 0.01 0.00 0.00 72.50 68.13 3ixh s THR 305 CO 0.59 0.13 1.12 -2.84 -0.69 0.00 0.00 174.62 172.94 3ixh s PRO 306 N 0.90 1.18 -0.34 4.92 0.02 -1.26 -0.97 135.00 139.44 3ixh s PRO 306 Ca 0.57 0.40 -0.41 0.00 0.02 0.00 0.00 61.00 61.57 3ixh s PRO 306 Cb -0.29 -1.83 -0.16 0.00 0.02 0.00 0.00 34.50 32.24 3ixh s PRO 306 CO 0.30 -2.19 1.78 0.00 -0.33 0.00 0.00 177.00 176.56 3ixh n ALA 307 N -3.78 -0.28 -2.52 -1.55 0.00 -1.26 -4.77 120.51 106.35 3ixh n ALA 307 Ca 0.06 0.36 -0.43 0.00 0.00 0.00 0.00 53.44 53.44 3ixh n ALA 307 Cb 0.58 -2.19 -0.07 0.00 0.00 0.00 0.00 19.45 17.78 3ixh n ALA 307 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3ixh s VAL 308 N 3.93 4.88 0.43 0.00 1.01 -1.26 -4.93 120.40 124.46 3ixh s VAL 308 Ca 1.02 0.14 0.16 0.00 0.00 0.00 0.00 61.98 63.30 3ixh s VAL 308 Cb -1.16 -4.15 0.35 0.00 0.00 0.00 0.00 36.38 31.43 3ixh s VAL 308 CO 0.68 -0.50 1.93 0.03 0.00 0.00 0.00 175.10 177.23 3ixh h ARG 309 N 8.76 0.39 -2.66 2.72 3.08 -1.97 -2.91 114.38 121.79 3ixh h ARG 309 Ca -0.26 -0.02 -0.66 0.00 0.07 0.00 0.00 59.98 59.11 3ixh h ARG 309 Cb 1.10 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 30.99 3ixh h ARG 309 CO 0.86 0.26 2.58 0.00 -1.07 0.00 0.00 179.97 182.60 3ixh n ALA 310 N -2.53 7.03 -2.22 0.04 0.00 -1.26 -1.35 120.51 120.22 3ixh n ALA 310 Ca 0.14 -3.66 -0.12 0.00 0.00 0.00 0.00 53.44 49.79 3ixh n ALA 310 Cb 0.51 -2.90 -0.10 0.00 0.00 0.00 0.00 19.45 16.96 3ixh n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3ixh s SER 311 N 1.11 1.46 -0.43 0.00 0.01 -1.10 -0.85 113.70 113.90 3ixh s SER 311 Ca 0.61 -1.00 -0.18 0.00 1.31 0.00 0.00 55.95 56.69 3ixh s SER 311 Cb 0.21 0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.51 3ixh s SER 311 CO -0.09 -0.39 0.49 0.86 0.41 0.00 0.00 173.24 174.52 3ixh s TRP 312 N -3.44 3.14 -0.16 2.43 -0.11 0.53 -4.08 118.94 117.25 3ixh s TRP 312 Ca 0.14 -0.34 -0.05 0.00 1.22 0.00 0.00 56.10 57.07 3ixh s TRP 312 Cb 0.04 -3.04 -0.03 0.00 -1.50 0.00 0.00 33.47 28.94 3ixh s TRP 312 CO -0.02 -0.76 0.01 0.08 -4.62 0.00 0.00 176.95 171.64 3ixh s VAL 313 N 2.30 4.31 0.23 5.86 1.01 -0.01 -1.48 120.40 132.61 3ixh s VAL 313 Ca 0.14 -0.21 -0.17 0.00 0.00 0.00 0.00 61.98 61.74 3ixh s VAL 313 Cb -0.17 -2.91 0.01 0.00 0.00 0.00 0.00 36.38 33.32 3ixh s VAL 313 CO 0.14 0.49 0.56 -1.38 0.00 0.00 0.00 175.10 174.91 3ixh s HIS 314 N 0.26 0.03 -0.21 5.22 -3.43 -0.10 -0.50 115.29 116.57 3ixh s HIS 314 Ca 0.00 -0.41 -0.23 0.00 -0.80 0.00 0.00 55.06 53.62 3ixh s HIS 314 Cb -0.13 0.40 0.06 0.00 -1.43 0.00 0.00 32.58 31.48 3ixh s HIS 314 CO 0.02 -1.02 0.63 0.21 -2.00 0.00 0.00 174.74 172.58 3ixh s LYS 315 N -3.93 0.78 0.22 -0.38 2.47 -0.83 -2.13 119.74 115.94 3ixh s LYS 315 Ca 0.14 0.77 0.06 0.00 -1.56 0.00 0.00 55.97 55.39 3ixh s LYS 315 Cb -0.02 0.38 -0.04 0.00 -1.46 0.00 0.00 37.83 36.69 3ixh s LYS 315 CO 0.04 -0.12 0.17 0.95 0.16 0.00 0.00 175.35 176.55 3ixh s THR 316 N 0.09 4.47 -0.03 3.43 -4.23 -1.26 -2.06 115.64 116.04 3ixh s THR 316 Ca -0.02 -1.27 -0.28 0.00 -1.18 0.00 0.00 61.69 58.94 3ixh s THR 316 Cb -0.04 -3.36 0.06 0.00 1.34 0.00 0.00 72.50 70.50 3ixh s THR 316 CO 0.02 -0.25 0.61 -0.83 -0.54 0.00 0.00 174.62 173.63 3ixh s GLY 317 N -3.54 -0.51 -0.01 3.99 0.00 -0.79 -3.72 107.32 102.74 3ixh s GLY 317 Ca 0.32 1.10 -0.15 0.00 0.00 0.00 0.00 44.72 45.99 3ixh s GLY 317 CO 0.24 0.77 0.32 0.00 0.00 0.00 0.00 173.10 174.43 3ixh s ALA 318 N -1.36 -0.80 0.34 3.20 0.00 -1.26 -0.46 121.76 121.42 3ixh s ALA 318 Ca -0.11 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.17 3ixh s ALA 318 Cb -0.01 0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.21 3ixh s ALA 318 CO 0.08 -0.28 0.01 0.25 0.00 0.00 0.00 175.76 175.82 3ixh n THR 319 N 1.19 0.00 -0.27 0.00 -2.24 -0.89 -4.27 114.28 107.80 3ixh n THR 319 Ca -0.21 -1.62 0.08 0.00 -2.27 0.00 0.00 64.05 60.03 3ixh n THR 319 Cb 0.56 0.35 0.21 0.00 -2.10 0.00 0.00 70.33 69.36 3ixh n THR 319 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3ixh h GLY 320 N 0.85 1.10 -1.12 3.38 0.00 -1.97 -2.99 103.07 102.32 3ixh h GLY 320 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 3ixh h GLY 320 CO 0.46 -0.28 0.00 0.61 0.00 0.00 0.00 176.54 177.33 3ixh n GLY 321 N -1.38 1.11 3.23 4.60 0.00 -1.26 -4.53 105.19 106.96 3ixh n GLY 321 Ca 0.17 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 3ixh n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ixh s PHE 322 N -0.98 1.18 -0.15 1.61 0.40 -1.13 -2.12 117.98 116.79 3ixh s PHE 322 Ca 0.18 -0.79 -0.06 0.00 -0.60 0.00 0.00 56.93 55.67 3ixh s PHE 322 Cb 0.11 -0.61 0.07 0.00 0.51 0.00 0.00 43.02 43.09 3ixh s PHE 322 CO 0.15 0.03 0.31 0.20 0.70 0.00 0.00 175.22 176.62 3ixh s GLY 323 N -3.12 -0.20 0.16 4.36 0.00 -0.57 -2.10 107.32 105.85 3ixh s GLY 323 Ca 0.15 1.16 0.09 0.00 0.00 0.00 0.00 44.72 46.12 3ixh s GLY 323 CO -0.01 1.90 -0.20 -0.56 0.00 0.00 0.00 173.10 174.23 3ixh s SER 324 N 2.11 2.84 -0.08 1.64 0.01 0.39 -1.83 113.70 118.78 3ixh s SER 324 Ca -0.03 -0.84 -0.11 0.00 1.31 0.00 0.00 55.95 56.28 3ixh s SER 324 Cb -0.11 -0.18 0.02 0.00 0.21 0.00 0.00 66.02 65.97 3ixh s SER 324 CO -0.10 0.01 0.28 -0.47 0.41 0.00 0.00 173.24 173.37 3ixh s TYR 325 N -1.86 -0.26 -0.01 2.43 5.04 0.01 -1.89 117.35 120.81 3ixh s TYR 325 Ca 0.16 0.59 0.00 0.00 -2.44 0.00 0.00 57.07 55.38 3ixh s TYR 325 Cb -0.07 0.09 0.01 0.00 0.35 0.00 0.00 41.96 42.34 3ixh s TYR 325 CO 0.07 -0.21 -0.00 0.08 -1.34 0.00 0.00 175.55 174.14 3ixh s VAL 326 N -0.29 0.10 -0.09 3.14 1.01 -0.87 -0.61 120.40 122.78 3ixh s VAL 326 Ca -0.04 0.01 -0.17 0.00 0.00 0.00 0.00 61.98 61.78 3ixh s VAL 326 Cb -0.03 -0.13 0.04 0.00 0.00 0.00 0.00 36.38 36.26 3ixh s VAL 326 CO 0.01 0.06 0.42 0.00 0.00 0.00 0.00 175.10 175.59 3ixh s ALA 327 N 0.34 -1.05 0.14 5.51 0.00 -0.62 -1.96 121.76 124.11 3ixh s ALA 327 Ca -0.03 0.88 -0.17 0.00 0.00 0.00 0.00 51.96 52.64 3ixh s ALA 327 Cb -0.05 -0.31 0.04 0.00 0.00 0.00 0.00 23.12 22.80 3ixh s ALA 327 CO -0.01 -0.25 0.44 -0.59 0.00 0.00 0.00 175.76 175.36 3ixh s PHE 328 N -0.58 -0.23 -0.37 0.00 -0.71 0.35 -0.48 117.98 115.97 3ixh s PHE 328 Ca -0.07 -0.08 0.01 0.00 -1.04 0.00 0.00 56.93 55.75 3ixh s PHE 328 Cb -0.04 0.32 0.11 0.00 -1.21 0.00 0.00 43.02 42.20 3ixh s PHE 328 CO 0.03 -0.75 0.14 0.42 -1.34 0.00 0.00 175.22 173.72 3ixh s ILE 329 N -3.81 1.35 0.38 -4.49 1.01 0.08 -0.83 121.20 114.88 3ixh s ILE 329 Ca 0.04 -2.01 0.14 0.00 0.00 0.00 0.00 60.65 58.81 3ixh s ILE 329 Cb 0.01 -1.98 0.35 0.00 0.01 0.00 0.00 42.46 40.85 3ixh s ILE 329 CO -0.11 -0.74 1.82 -0.65 0.00 0.00 0.00 174.94 175.26 3ixh h PRO 330 N 7.49 0.52 0.00 2.79 0.11 -1.71 -1.23 132.00 139.98 3ixh h PRO 330 Ca -0.08 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3ixh h PRO 330 Cb 0.98 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.97 3ixh h PRO 330 CO 0.49 0.34 0.00 1.05 -0.21 0.00 0.00 178.00 179.68 3ixh h GLU 331 N 0.54 0.00 -0.17 1.05 4.11 -1.52 -2.73 114.58 115.85 3ixh h GLU 331 Ca 0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.95 3ixh h GLU 331 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 3ixh h GLU 331 CO -0.25 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.46 3ixh n LYS 332 N -2.48 1.69 -3.82 1.06 4.76 -0.47 -4.98 118.16 113.92 3ixh n LYS 332 Ca 0.02 -1.69 -0.26 0.00 -2.87 0.00 0.00 58.31 53.51 3ixh n LYS 332 Cb 0.26 -1.32 0.03 0.00 -1.84 0.00 0.00 35.03 32.16 3ixh n LYS 332 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3ixh n GLU 333 N 0.87 -5.20 -4.09 1.97 1.02 -1.03 -4.62 120.64 109.56 3ixh n GLU 333 Ca 0.11 0.60 -0.14 0.00 -0.02 0.00 0.00 57.16 57.71 3ixh n GLU 333 Cb 0.42 -5.32 -0.14 0.00 -0.02 0.00 0.00 31.44 26.39 3ixh n GLU 333 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3ixh s LEU 334 N -7.00 2.06 0.17 -4.62 2.96 -1.22 -1.64 118.68 109.39 3ixh s LEU 334 Ca 0.34 -0.18 -0.24 0.00 -0.22 0.00 0.00 54.13 53.83 3ixh s LEU 334 Cb -0.17 -0.19 0.07 0.00 0.50 0.00 0.00 46.19 46.40 3ixh s LEU 334 CO 0.82 -0.01 0.98 -0.83 -1.32 0.00 0.00 176.35 175.99 3ixh s GLY 335 N -0.42 -0.14 0.02 7.98 0.00 -0.62 -0.74 107.32 113.40 3ixh s GLY 335 Ca -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 44.72 44.69 3ixh s GLY 335 CO -0.00 0.50 -0.00 -1.50 0.00 0.00 0.00 173.10 172.10 3ixh s ILE 336 N -2.99 0.10 -0.01 0.90 2.07 0.37 0.50 121.20 122.14 3ixh s ILE 336 Ca 0.14 -0.84 0.04 0.00 -1.41 0.00 0.00 60.65 58.59 3ixh s ILE 336 Cb -0.02 -0.28 -0.01 0.00 0.13 0.00 0.00 42.46 42.28 3ixh s ILE 336 CO 0.03 -0.46 -0.14 -0.69 -1.91 0.00 0.00 174.94 171.77 3ixh s VAL 337 N -1.38 1.14 -0.13 4.00 1.01 -0.58 -1.59 120.40 122.87 3ixh s VAL 337 Ca -0.15 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 3ixh s VAL 337 Cb -0.09 -0.95 0.04 0.00 0.00 0.00 0.00 36.38 35.38 3ixh s VAL 337 CO -0.01 0.32 0.02 -0.04 0.00 0.00 0.00 175.10 175.40 3ixh s MET 338 N -0.33 0.64 -0.13 2.72 -1.94 0.22 -2.12 119.30 118.37 3ixh s MET 338 Ca 0.05 -0.15 0.02 0.00 -1.71 0.00 0.00 55.69 53.90 3ixh s MET 338 Cb -0.06 -1.55 0.01 0.00 2.01 0.00 0.00 34.83 35.25 3ixh s MET 338 CO -0.00 -0.47 -0.18 -0.51 -0.01 0.00 0.00 175.02 173.84 3ixh s LEU 339 N 1.92 1.90 0.03 -0.03 1.43 -0.33 -0.81 118.68 122.77 3ixh s LEU 339 Ca 0.02 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 3ixh s LEU 339 Cb -0.15 -1.27 -0.02 0.00 0.03 0.00 0.00 46.19 44.79 3ixh s LEU 339 CO -0.07 0.03 -0.07 0.00 0.23 0.00 0.00 176.35 176.48 3ixh s ALA 340 N 0.99 0.52 -0.63 4.21 0.00 -0.76 -0.72 121.76 125.37 3ixh s ALA 340 Ca -0.05 -0.58 -0.02 0.00 0.00 0.00 0.00 51.96 51.31 3ixh s ALA 340 Cb -0.15 -0.01 0.36 0.00 0.00 0.00 0.00 23.12 23.33 3ixh s ALA 340 CO -0.03 0.02 2.08 0.27 0.00 0.00 0.00 175.76 178.10 3ixh n ASN 341 N 1.96 7.38 -3.81 0.00 6.94 -0.86 -1.51 115.26 125.36 3ixh n ASN 341 Ca -0.19 -3.63 -0.13 0.00 -0.02 0.00 0.00 54.58 50.61 3ixh n ASN 341 Cb 0.56 -1.03 -0.13 0.00 -2.36 0.00 0.00 39.78 36.82 3ixh n ASN 341 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 3ixh s LYS 342 N -3.37 0.11 -0.61 -3.83 2.20 -1.09 -2.11 119.74 111.04 3ixh s LYS 342 Ca 0.56 0.21 -0.28 0.00 -0.36 0.00 0.00 55.97 56.10 3ixh s LYS 342 Cb 0.44 -0.01 0.01 0.00 -1.51 0.00 0.00 37.83 36.76 3ixh s LYS 342 CO -0.10 -0.06 1.44 1.21 -0.36 0.00 0.00 175.35 177.48 3ixh s ASN 343 N 0.38 6.04 0.27 1.43 2.47 -1.24 -2.67 114.94 121.61 3ixh s ASN 343 Ca -0.03 0.13 0.11 0.00 0.42 0.00 0.00 52.86 53.50 3ixh s ASN 343 Cb -0.04 -2.55 -0.05 0.00 -1.45 0.00 0.00 41.25 37.17 3ixh s ASN 343 CO -0.01 -1.81 -0.13 -0.72 -3.72 0.00 0.00 177.10 170.70 3ixh s TYR 344 N 6.33 2.43 -0.42 0.43 -0.85 -1.26 -4.96 117.35 119.05 3ixh s TYR 344 Ca 0.50 -0.29 -0.44 0.00 -0.52 0.00 0.00 57.07 56.31 3ixh s TYR 344 Cb -0.10 -1.06 -0.18 0.00 0.38 0.00 0.00 41.96 40.99 3ixh s TYR 344 CO 0.22 0.68 1.65 -2.30 -1.52 0.00 0.00 175.55 174.29 3ixh n PRO 345 N -0.70 0.43 -0.30 -3.49 -0.02 -1.26 -4.92 135.00 124.74 3ixh n PRO 345 Ca -0.06 0.16 0.08 0.00 -2.02 0.00 0.00 63.50 61.66 3ixh n PRO 345 Cb 0.60 -1.73 0.20 0.00 -0.02 0.00 0.00 33.50 32.55 3ixh n PRO 345 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3ixh h ASN 346 N 5.82 -0.46 -0.59 2.55 2.35 -1.97 -2.48 115.58 120.80 3ixh h ASN 346 Ca -0.45 0.24 0.06 0.00 -0.55 0.00 0.00 56.30 55.60 3ixh h ASN 346 Cb 1.35 0.42 -0.05 0.00 0.05 0.00 0.00 38.32 40.09 3ixh h ASN 346 CO 0.97 -0.25 0.30 -0.65 -1.65 0.00 0.00 177.43 176.15 3ixh h PRO 347 N 0.06 0.55 -0.73 0.81 0.11 -1.92 0.13 132.00 131.01 3ixh h PRO 347 Ca 0.48 -0.03 0.16 0.00 0.11 0.00 0.00 66.00 66.72 3ixh h PRO 347 Cb 0.89 -0.12 -0.13 0.00 0.11 0.00 0.00 31.00 31.75 3ixh h PRO 347 CO -0.79 0.36 -0.00 0.00 -0.21 0.00 0.00 178.00 177.36 3ixh h ALA 348 N 1.33 0.74 0.13 -0.75 0.00 -1.81 0.22 119.26 119.12 3ixh h ALA 348 Ca 0.27 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.41 3ixh h ALA 348 Cb 0.20 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3ixh h ALA 348 CO -0.19 -0.42 -0.09 0.00 0.00 0.00 0.00 179.25 178.55 3ixh h ARG 349 N 0.10 -0.21 -0.71 0.00 3.08 -0.84 -2.10 114.38 113.70 3ixh h ARG 349 Ca 0.39 0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.39 3ixh h ARG 349 Cb 0.68 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 3ixh h ARG 349 CO -0.64 -0.14 0.18 0.28 -1.07 0.00 0.00 179.97 178.58 3ixh h VAL 350 N -0.22 1.26 -0.33 2.04 2.07 -0.89 -1.43 116.25 118.75 3ixh h VAL 350 Ca -0.01 -0.96 0.07 0.00 0.82 0.00 0.00 66.70 66.63 3ixh h VAL 350 Cb 0.18 0.53 -0.08 0.00 -1.52 0.00 0.00 31.29 30.41 3ixh h VAL 350 CO 0.01 0.37 -0.23 -0.78 0.02 0.00 0.00 177.57 176.95 3ixh h ASP 351 N 1.06 -0.77 -0.12 0.57 1.82 -0.40 0.18 116.42 118.76 3ixh h ASP 351 Ca 0.22 0.15 -0.03 0.00 -0.39 0.00 0.00 57.03 56.98 3ixh h ASP 351 Cb 0.36 0.38 -0.00 0.00 0.68 0.00 0.00 39.33 40.75 3ixh h ASP 351 CO 0.00 -0.26 -0.06 0.00 -1.61 0.00 0.00 179.24 177.31 3ixh h ALA 352 N 0.95 0.17 -0.51 -0.78 0.00 -1.13 -0.66 119.26 117.29 3ixh h ALA 352 Ca 0.17 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 54.88 3ixh h ALA 352 Cb 0.46 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 3ixh h ALA 352 CO -0.45 -0.04 0.23 0.00 0.00 0.00 0.00 179.25 178.98 3ixh h ALA 353 N 0.65 0.65 0.30 0.00 0.00 -1.17 -2.65 119.26 117.04 3ixh h ALA 353 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ixh h ALA 353 Cb 0.52 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3ixh h ALA 353 CO 0.02 -0.15 -0.34 2.35 0.00 0.00 0.00 179.25 181.13 3ixh h TRP 354 N 0.44 -0.91 -0.82 0.00 2.91 -0.36 -1.99 115.95 115.22 3ixh h TRP 354 Ca 0.24 0.01 0.16 0.00 1.13 0.00 0.00 58.89 60.42 3ixh h TRP 354 Cb 0.20 0.36 -0.15 0.00 -0.51 0.00 0.00 29.16 29.06 3ixh h TRP 354 CO -0.13 -0.47 -0.24 1.96 -1.03 0.00 0.00 178.44 178.53 3ixh h GLN 355 N -0.68 -0.02 0.25 2.65 1.08 -0.90 -1.57 115.11 115.93 3ixh h GLN 355 Ca -0.01 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 3ixh h GLN 355 Cb 0.63 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.07 3ixh h GLN 355 CO -0.08 -0.01 -0.12 0.82 -0.95 0.00 0.00 178.83 178.48 3ixh h ILE 356 N -0.02 0.75 -0.37 2.54 2.04 -1.15 -2.95 117.51 118.35 3ixh h ILE 356 Ca 0.38 -0.79 -0.10 0.00 1.00 0.00 0.00 64.86 65.35 3ixh h ILE 356 Cb 0.60 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 3ixh h ILE 356 CO -0.85 0.15 -0.19 -0.07 0.00 0.00 0.00 178.15 177.19 3ixh h LEU 357 N -0.79 0.70 -0.52 1.44 3.38 -1.20 -2.67 115.31 115.65 3ixh h LEU 357 Ca -0.03 -0.23 0.06 0.00 0.09 0.00 0.00 57.88 57.77 3ixh h LEU 357 Cb 0.51 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.01 3ixh h LEU 357 CO 0.06 0.89 0.22 -1.13 0.09 0.00 0.00 178.44 178.57 3ixh h ASN 358 N 0.62 0.26 0.89 -0.43 -1.24 -1.35 -1.21 115.58 113.12 3ixh h ASN 358 Ca 0.09 0.05 -0.05 0.00 0.71 0.00 0.00 56.30 57.11 3ixh h ASN 358 Cb 0.67 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 39.73 3ixh h ASN 358 CO 0.05 0.18 -0.24 0.00 -1.29 0.00 0.00 177.43 176.12 3ixh h ALA 359 N 1.33 1.03 0.12 1.57 0.00 -1.32 -3.25 119.26 118.75 3ixh h ALA 359 Ca 0.25 -0.22 -0.35 0.00 0.00 0.00 0.00 54.91 54.59 3ixh h ALA 359 Cb 0.24 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3ixh h ALA 359 CO -0.22 0.30 -1.85 -0.07 0.00 0.00 0.00 179.25 177.41 3ixh h LEU 360 N 0.00 0.40 0.00 0.00 3.38 -1.14 -3.51 115.31 114.44 3ixh h LEU 360 Ca -0.00 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.20 3ixh h LEU 360 Cb 0.75 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.37 3ixh h LEU 360 CO 0.03 1.68 0.00 1.67 0.09 0.00 0.00 178.44 181.91