#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bxh h GLU 6 N 0.00 0.63 -0.45 -1.46 4.57 -1.76 -3.00 114.58 113.10 2bxh h GLU 6 Ca 0.00 -0.34 0.09 0.00 -1.18 0.00 0.00 59.36 57.93 2bxh h GLU 6 Cb 0.00 0.02 -0.08 0.00 -0.16 0.00 0.00 28.75 28.52 2bxh h GLU 6 CO 0.00 0.94 -0.10 0.28 -1.18 0.00 0.00 179.01 178.95 2bxh h VAL 7 N 0.51 0.56 -0.07 0.32 2.07 -1.85 -0.31 116.25 117.46 2bxh h VAL 7 Ca 0.03 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.59 2bxh h VAL 7 Cb 0.97 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 2bxh h VAL 7 CO 0.09 0.00 -0.40 0.00 0.02 0.00 0.00 177.57 177.28 2bxh h ALA 8 N 1.45 -0.57 -0.78 1.67 0.00 -1.83 0.37 119.26 119.57 2bxh h ALA 8 Ca 0.22 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.28 2bxh h ALA 8 Cb 0.33 0.73 -0.05 0.00 0.00 0.00 0.00 17.79 18.80 2bxh h ALA 8 CO -0.46 -0.91 0.52 1.25 0.00 0.00 0.00 179.25 179.66 2bxh h HIS 9 N -0.51 0.44 0.00 0.00 6.17 -1.28 -2.13 115.15 117.85 2bxh h HIS 9 Ca 0.07 0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.16 2bxh h HIS 9 Cb 0.62 -0.14 0.00 0.00 2.52 0.00 0.00 27.41 30.41 2bxh h HIS 9 CO -0.44 0.15 -0.00 0.00 0.71 0.00 0.00 177.93 178.35 2bxh h ARG 10 N 0.36 -0.00 -0.84 5.26 2.47 0.81 -2.79 114.38 119.65 2bxh h ARG 10 Ca 0.39 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 59.23 2bxh h ARG 10 Cb 0.97 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 29.21 2bxh h ARG 10 CO -0.12 0.74 0.46 0.35 0.56 0.00 0.00 179.97 181.96 2bxh h PHE 11 N -0.74 0.82 0.24 3.04 3.04 0.02 -1.30 116.94 122.05 2bxh h PHE 11 Ca -0.00 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 2bxh h PHE 11 Cb 0.74 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 39.01 2bxh h PHE 11 CO 0.19 0.27 -0.12 0.87 -2.02 0.00 0.00 178.31 177.50 2bxh h LYS 12 N 0.71 -0.31 -0.48 1.11 1.79 -1.47 0.52 116.57 118.44 2bxh h LYS 12 Ca 0.43 0.02 0.05 0.00 -2.18 0.00 0.00 60.65 58.97 2bxh h LYS 12 Cb 0.51 0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 31.19 2bxh h LYS 12 CO -0.30 -0.08 0.23 -0.44 -1.08 0.00 0.00 179.45 177.77 2bxh h ASP 13 N -0.50 0.31 0.00 0.86 3.32 -1.18 -3.35 116.42 115.88 2bxh h ASP 13 Ca -0.03 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2bxh h ASP 13 Cb 0.38 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2bxh h ASP 13 CO 0.05 0.22 -0.25 -0.07 -1.72 0.00 0.00 179.24 177.47 2bxh h LEU 14 N 0.45 0.00 0.00 1.55 3.38 -1.27 -3.51 115.31 115.91 2bxh h LEU 14 Ca 0.21 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2bxh h LEU 14 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2bxh h LEU 14 CO -0.16 0.66 0.00 0.61 0.09 0.00 0.00 178.44 179.64 2bxh n GLY 15 N 1.69 3.14 0.32 0.83 0.00 0.17 -4.68 105.19 106.67 2bxh n GLY 15 Ca -0.04 -1.95 -0.07 0.00 0.00 0.00 0.00 46.02 43.95 2bxh n GLY 15 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2bxh h GLU 16 N 0.00 1.11 0.47 1.61 4.81 -1.95 -1.49 114.58 119.15 2bxh h GLU 16 Ca 0.00 -0.28 -0.02 0.00 -0.13 0.00 0.00 59.36 58.92 2bxh h GLU 16 Cb 0.00 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.25 2bxh h GLU 16 CO 0.00 1.00 -0.23 0.93 -0.73 0.00 0.00 179.01 179.98 2bxh h GLU 17 N 1.05 -0.61 -1.01 1.92 5.08 -1.96 -0.38 114.58 118.67 2bxh h GLU 17 Ca 0.21 0.04 0.16 0.00 -1.00 0.00 0.00 59.36 58.77 2bxh h GLU 17 Cb 0.41 0.14 -0.10 0.00 0.50 0.00 0.00 28.75 29.70 2bxh h GLU 17 CO 0.01 -0.41 0.62 -0.91 -1.00 0.00 0.00 179.01 177.32 2bxh h ASN 18 N -0.85 0.86 0.36 1.42 2.35 -1.83 -1.61 115.58 116.27 2bxh h ASN 18 Ca -0.07 0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 2bxh h ASN 18 Cb 0.49 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2bxh h ASN 18 CO 0.11 0.38 -0.17 0.15 -1.65 0.00 0.00 177.43 176.25 2bxh h PHE 19 N 0.88 -0.45 -0.53 1.19 3.04 -1.28 0.23 116.94 120.02 2bxh h PHE 19 Ca 0.54 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 62.57 2bxh h PHE 19 Cb 0.70 0.15 -0.07 0.00 2.56 0.00 0.00 35.95 39.29 2bxh h PHE 19 CO -0.00 -0.23 0.12 0.87 -2.02 0.00 0.00 178.31 177.05 2bxh h LYS 20 N -0.56 0.26 0.13 1.11 1.57 -0.37 -0.93 116.57 117.77 2bxh h LYS 20 Ca -0.05 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2bxh h LYS 20 Cb 0.42 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2bxh h LYS 20 CO 0.08 0.17 -0.06 0.00 -0.57 0.00 0.00 179.45 179.07 2bxh h ALA 21 N 1.41 -0.17 -0.86 3.86 0.00 -1.16 -2.09 119.26 120.24 2bxh h ALA 21 Ca 0.27 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2bxh h ALA 21 Cb 0.36 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2bxh h ALA 21 CO -0.34 -0.51 0.56 -0.07 0.00 0.00 0.00 179.25 178.90 2bxh h LEU 22 N -0.34 0.85 -0.61 0.00 3.38 -0.28 -1.08 115.31 117.23 2bxh h LEU 22 Ca -0.02 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 2bxh h LEU 22 Cb 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2bxh h LEU 22 CO 0.03 0.55 -0.36 0.58 0.09 0.00 0.00 178.44 179.33 2bxh h VAL 23 N 0.97 1.29 -0.25 1.22 2.07 -1.09 -2.56 116.25 117.89 2bxh h VAL 23 Ca 0.37 -1.52 -0.13 0.00 0.82 0.00 0.00 66.70 66.25 2bxh h VAL 23 Cb 0.21 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2bxh h VAL 23 CO -0.14 0.49 -0.38 0.25 0.02 0.00 0.00 177.57 177.82 2bxh h LEU 24 N 0.58 0.59 -0.87 2.57 5.85 -0.59 -2.37 115.31 121.07 2bxh h LEU 24 Ca 0.06 -0.25 -0.11 0.00 0.84 0.00 0.00 57.88 58.42 2bxh h LEU 24 Cb 0.89 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2bxh h LEU 24 CO 0.08 0.91 -0.30 0.40 -0.34 0.00 0.00 178.44 179.19 2bxh h ILE 25 N 0.47 1.28 -0.36 4.05 2.04 -1.17 -1.02 117.51 122.80 2bxh h ILE 25 Ca 0.04 -1.36 -0.07 0.00 1.00 0.00 0.00 64.86 64.47 2bxh h ILE 25 Cb 0.87 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 2bxh h ILE 25 CO 0.07 0.43 -0.05 0.00 0.00 0.00 0.00 178.15 178.60 2bxh h ALA 26 N 1.26 0.49 -0.29 1.87 0.00 -1.20 -1.15 119.26 120.25 2bxh h ALA 26 Ca 0.05 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2bxh h ALA 26 Cb 0.74 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2bxh h ALA 26 CO 0.06 0.30 -0.28 0.74 0.00 0.00 0.00 179.25 180.07 2bxh h PHE 27 N 0.47 0.84 -0.62 0.00 -1.00 -1.34 -2.43 116.94 112.86 2bxh h PHE 27 Ca 0.10 -0.25 0.04 0.00 2.81 0.00 0.00 57.97 60.66 2bxh h PHE 27 Cb 0.54 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 39.88 2bxh h PHE 27 CO 0.04 1.00 0.41 0.00 -1.61 0.00 0.00 178.31 178.15 2bxh h ALA 28 N 0.71 1.70 0.00 2.45 0.00 -1.07 -1.04 119.26 122.00 2bxh h ALA 28 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bxh h ALA 28 Cb 0.85 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2bxh h ALA 28 CO 0.07 0.23 -0.26 1.04 0.00 0.00 0.00 179.25 180.33 2bxh n GLN 29 N -4.47 0.22 -0.09 0.00 6.02 -0.45 -3.67 117.38 114.95 2bxh n GLN 29 Ca 0.08 0.13 -0.23 0.00 -0.01 0.00 0.00 57.00 56.97 2bxh n GLN 29 Cb 0.16 -1.70 -0.12 0.00 1.02 0.00 0.00 30.24 29.59 2bxh n GLN 29 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2bxh n TYR 30 N -2.06 0.68 -3.90 1.08 4.01 -0.83 -4.70 117.16 111.44 2bxh n TYR 30 Ca 0.05 0.21 -0.30 0.00 -0.16 0.00 0.00 57.90 57.70 2bxh n TYR 30 Cb 0.42 -1.08 -0.12 0.00 -0.31 0.00 0.00 39.34 38.24 2bxh n TYR 30 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2bxh s LEU 31 N -7.30 4.69 0.54 7.72 2.01 -0.45 -4.87 118.68 121.02 2bxh s LEU 31 Ca -0.30 -3.48 0.33 0.00 0.01 0.00 0.00 54.13 50.68 2bxh s LEU 31 Cb 0.09 -1.67 1.28 0.00 0.01 0.00 0.00 46.19 45.91 2bxh s LEU 31 CO 0.62 -0.16 1.95 1.56 1.01 0.00 0.00 176.35 181.34 2bxh h GLN 32 N 5.93 0.00 0.00 1.70 4.20 -1.80 -3.14 115.11 122.00 2bxh h GLN 32 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2bxh h GLN 32 Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 2bxh h GLN 32 CO 0.72 0.00 -0.87 1.96 -0.67 0.00 0.00 178.83 179.97 2bxh h GLN 33 N 0.00 0.00 -6.89 1.46 7.50 -1.92 -3.48 115.11 111.78 2bxh h GLN 33 Ca 0.00 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.59 2bxh h GLN 33 Cb 0.55 0.00 0.14 0.00 0.05 0.00 0.00 27.48 28.22 2bxh h GLN 33 CO 0.00 0.00 0.46 0.00 -1.50 0.00 0.00 178.83 177.79 2bxh s PRO 35 N -2.49 3.80 0.13 0.00 0.04 -1.26 -4.96 135.00 130.26 2bxh s PRO 35 Ca 0.67 1.08 -0.30 0.00 0.04 0.00 0.00 61.00 62.49 2bxh s PRO 35 Cb -0.47 -2.11 -0.06 0.00 0.04 0.00 0.00 34.50 31.91 2bxh s PRO 35 CO 0.54 -0.40 1.57 0.35 0.04 0.00 0.00 177.00 179.10 2bxh h PHE 36 N 0.97 -1.31 -0.79 0.56 3.57 -2.00 -2.77 116.94 115.17 2bxh h PHE 36 Ca -0.47 0.06 0.15 0.00 3.53 0.00 0.00 57.97 61.24 2bxh h PHE 36 Cb 1.20 0.60 -0.15 0.00 2.79 0.00 0.00 35.95 40.39 2bxh h PHE 36 CO 0.61 -0.48 -0.24 1.05 -2.23 0.00 0.00 178.31 177.02 2bxh h GLU 37 N -0.47 -0.02 -0.77 1.11 9.09 -2.00 -0.39 114.58 121.13 2bxh h GLU 37 Ca 0.08 0.00 0.04 0.00 0.05 0.00 0.00 59.36 59.53 2bxh h GLU 37 Cb 0.63 0.01 -0.05 0.00 -1.65 0.00 0.00 28.75 27.68 2bxh h GLU 37 CO -0.45 -0.02 0.48 -0.44 0.05 0.00 0.00 179.01 178.63 2bxh h ASP 38 N -0.03 0.78 0.10 3.06 5.19 -1.89 -1.98 116.42 121.66 2bxh h ASP 38 Ca 0.36 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.77 2bxh h ASP 38 Cb 0.59 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.93 2bxh h ASP 38 CO -0.82 0.53 -0.05 0.45 -3.12 0.00 0.00 179.24 176.23 2bxh h HIS 39 N 0.93 -0.13 -0.95 4.55 3.86 -0.96 -2.17 115.15 120.27 2bxh h HIS 39 Ca 0.32 -0.00 0.19 0.00 -1.16 0.00 0.00 60.37 59.72 2bxh h HIS 39 Cb 0.06 0.04 -0.08 0.00 1.06 0.00 0.00 27.41 28.49 2bxh h HIS 39 CO -0.04 0.10 0.61 0.28 0.86 0.00 0.00 177.93 179.74 2bxh h VAL 40 N -0.34 0.70 0.71 2.45 2.07 -1.12 0.85 116.25 121.57 2bxh h VAL 40 Ca -0.01 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 2bxh h VAL 40 Cb 0.28 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2bxh h VAL 40 CO 0.02 0.10 -0.42 0.11 0.02 0.00 0.00 177.57 177.41 2bxh h LYS 41 N 0.57 -1.02 -0.86 1.57 1.57 -0.93 -0.89 116.57 116.59 2bxh h LYS 41 Ca 0.51 0.07 0.13 0.00 -1.87 0.00 0.00 60.65 59.48 2bxh h LYS 41 Cb 1.03 0.23 -0.09 0.00 0.08 0.00 0.00 32.23 33.49 2bxh h LYS 41 CO -0.25 -0.68 0.47 -0.07 -0.57 0.00 0.00 179.45 178.35 2bxh h LEU 42 N -1.05 0.63 0.68 2.94 3.38 -0.41 0.34 115.31 121.81 2bxh h LEU 42 Ca -0.09 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2bxh h LEU 42 Cb 0.84 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.56 2bxh h LEU 42 CO 0.10 0.31 -0.33 0.58 0.09 0.00 0.00 178.44 179.19 2bxh h VAL 43 N 0.72 0.29 -0.37 1.22 2.07 -0.63 0.36 116.25 119.91 2bxh h VAL 43 Ca 0.44 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.87 2bxh h VAL 43 Cb 0.53 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 2bxh h VAL 43 CO -0.31 0.01 0.20 0.78 0.02 0.00 0.00 177.57 178.28 2bxh h ASN 44 N -1.00 0.32 -0.06 0.57 2.35 -0.83 0.87 115.58 117.79 2bxh h ASN 44 Ca -0.09 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.68 2bxh h ASN 44 Cb 0.73 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 39.00 2bxh h ASN 44 CO 0.15 0.23 -0.39 -0.33 -1.65 0.00 0.00 177.43 175.44 2bxh h GLU 45 N 0.41 -0.43 -0.90 0.81 5.08 -0.20 0.12 114.58 119.47 2bxh h GLU 45 Ca 0.15 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.63 2bxh h GLU 45 Cb 0.03 0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.30 2bxh h GLU 45 CO -0.08 -0.29 0.55 0.28 -1.00 0.00 0.00 179.01 178.47 2bxh h VAL 46 N -0.45 0.96 -0.89 3.13 2.07 0.17 -0.69 116.25 120.55 2bxh h VAL 46 Ca 0.02 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.23 2bxh h VAL 46 Cb 0.51 -0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.18 2bxh h VAL 46 CO -0.30 0.17 0.59 0.74 0.02 0.00 0.00 177.57 178.79 2bxh h THR 47 N 0.93 1.22 0.54 2.57 2.02 0.15 -0.40 112.91 119.94 2bxh h THR 47 Ca 0.42 -0.41 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 2bxh h THR 47 Cb 0.33 -0.09 0.01 0.00 -1.74 0.00 0.00 68.15 66.66 2bxh h THR 47 CO -0.23 0.22 -0.26 -0.08 0.37 0.00 0.00 175.52 175.54 2bxh h GLU 48 N 1.20 -0.70 -1.36 6.66 4.81 0.32 -1.94 114.58 123.56 2bxh h GLU 48 Ca 0.33 0.05 0.40 0.00 -0.13 0.00 0.00 59.36 60.01 2bxh h GLU 48 Cb -0.12 0.16 -0.08 0.00 0.63 0.00 0.00 28.75 29.35 2bxh h GLU 48 CO -0.08 -0.42 0.95 0.35 -0.73 0.00 0.00 179.01 179.08 2bxh h PHE 49 N -0.83 0.19 -0.43 0.92 3.57 -0.58 1.25 116.94 121.03 2bxh h PHE 49 Ca -0.07 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.35 2bxh h PHE 49 Cb 0.60 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 2bxh h PHE 49 CO -0.02 -0.03 -0.07 0.00 -2.23 0.00 0.00 178.31 175.96 2bxh h ALA 50 N 1.38 0.59 -0.04 2.41 0.00 -0.31 -3.16 119.26 120.13 2bxh h ALA 50 Ca 0.70 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 55.33 2bxh h ALA 50 Cb 2.54 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 20.12 2bxh h ALA 50 CO -0.12 0.44 -0.40 0.87 0.00 0.00 0.00 179.25 180.04 2bxh h LYS 51 N 0.64 -0.51 0.00 0.00 1.79 0.19 -0.23 116.57 118.45 2bxh h LYS 51 Ca 0.11 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 2bxh h LYS 51 Cb 0.59 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 2bxh h LYS 51 CO 0.04 -0.34 0.00 0.25 -1.08 0.00 0.00 179.45 178.32 2bxh n THR 52 N -5.44 1.30 -0.04 -0.16 -2.24 -1.13 -1.03 114.28 105.54 2bxh n THR 52 Ca -0.05 0.33 0.01 0.00 -2.27 0.00 0.00 64.05 62.06 2bxh n THR 52 Cb 0.36 -1.22 -0.15 0.00 -2.10 0.00 0.00 70.33 67.22 2bxh n THR 52 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bxh h VAL 54 N 0.00 0.00 0.00 0.00 2.07 0.54 -3.19 116.25 115.67 2bxh h VAL 54 Ca -0.26 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2bxh h VAL 54 Cb 1.61 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 2bxh h VAL 54 CO 0.02 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.61 2bxh n ALA 55 N -2.03 0.00 -3.21 1.67 0.00 -1.10 -4.84 120.51 111.00 2bxh n ALA 55 Ca 0.01 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 53.00 2bxh n ALA 55 Cb 0.33 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.73 2bxh n ALA 55 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2bxh s ASP 56 N -1.00 6.19 0.00 0.00 -4.77 -1.22 -4.91 116.67 110.96 2bxh s ASP 56 Ca 0.00 -1.63 0.00 0.00 -3.30 0.00 0.00 52.55 47.62 2bxh s ASP 56 Cb 0.00 -2.24 0.00 0.00 -1.09 0.00 0.00 42.92 39.59 2bxh s ASP 56 CO 0.00 -0.94 0.07 -0.62 0.70 0.00 0.00 175.17 174.38 2bxh n GLU 57 N 5.64 0.13 -2.71 2.11 4.71 -1.20 -2.70 120.64 126.62 2bxh n GLU 57 Ca -0.12 0.00 -0.06 0.00 -0.01 0.00 0.00 57.16 56.96 2bxh n GLU 57 Cb 0.41 -1.09 0.04 0.00 -1.01 0.00 0.00 31.44 29.78 2bxh n GLU 57 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2bxh n SER 58 N 0.48 1.62 0.00 1.62 2.88 -1.26 -4.29 113.62 114.67 2bxh n SER 58 Ca 0.00 -2.50 0.00 0.00 -1.33 0.00 0.00 58.87 55.04 2bxh n SER 58 Cb 0.03 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.99 2bxh n SER 58 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bxh n ALA 59 N -0.28 0.00 0.01 -1.46 0.00 -1.10 -4.94 120.51 112.75 2bxh n ALA 59 Ca 0.10 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.36 2bxh n ALA 59 Cb 0.81 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.14 2bxh n ALA 59 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2bxh h GLU 60 N 0.00 0.38 0.00 0.00 5.08 -1.95 -3.42 114.58 114.67 2bxh h GLU 60 Ca 0.00 -0.44 -0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2bxh h GLU 60 Cb 0.00 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2bxh h GLU 60 CO 0.00 1.12 -0.21 0.09 -1.00 0.00 0.00 179.01 179.01 2bxh n ASN 61 N -4.21 -0.00 0.31 1.42 4.13 -1.26 -4.95 115.26 110.69 2bxh n ASN 61 Ca -0.11 -1.42 0.14 0.00 1.68 0.00 0.00 54.58 54.86 2bxh n ASN 61 Cb 0.69 -0.08 0.73 0.00 -1.54 0.00 0.00 39.78 39.58 2bxh n ASN 61 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2bxh n ASP 63 N -2.74 0.54 -4.47 0.00 5.75 -1.26 -3.50 116.55 110.86 2bxh n ASP 63 Ca -0.02 -0.60 -0.28 0.00 -0.01 0.00 0.00 54.79 53.88 2bxh n ASP 63 Cb 0.38 -0.05 0.26 0.00 -1.03 0.00 0.00 41.12 40.68 2bxh n ASP 63 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2bxh s LYS 64 N -2.49 -1.12 0.20 0.11 3.01 0.11 -4.72 119.74 114.84 2bxh s LYS 64 Ca 0.28 0.79 0.00 0.00 -1.01 0.00 0.00 55.97 56.03 2bxh s LYS 64 Cb 0.20 -1.53 -0.04 0.00 -1.01 0.00 0.00 37.83 35.45 2bxh s LYS 64 CO 0.48 -3.84 0.37 -1.54 0.51 0.00 0.00 175.35 171.33 2bxh s SER 65 N -2.50 6.37 0.22 2.83 1.04 -1.26 -4.35 113.70 116.06 2bxh s SER 65 Ca 0.69 0.35 -0.08 0.00 0.48 0.00 0.00 55.95 57.39 2bxh s SER 65 Cb -0.25 -1.99 0.30 0.00 0.10 0.00 0.00 66.02 64.18 2bxh s SER 65 CO 0.65 -0.03 1.80 -0.07 0.98 0.00 0.00 173.24 176.57 2bxh h LEU 66 N 1.98 0.56 0.10 2.42 -0.00 -1.98 -0.29 115.31 118.10 2bxh h LEU 66 Ca -0.48 0.04 0.02 0.00 -0.00 0.00 0.00 57.88 57.46 2bxh h LEU 66 Cb 1.19 -0.07 -0.05 0.00 -0.00 0.00 0.00 40.66 41.74 2bxh h LEU 66 CO 0.68 0.34 -0.44 0.45 -0.00 0.00 0.00 178.44 179.47 2bxh h HIS 67 N 0.69 -1.25 -0.69 1.13 3.86 -1.98 0.71 115.15 117.63 2bxh h HIS 67 Ca 0.33 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.59 2bxh h HIS 67 Cb 0.26 0.54 -0.04 0.00 1.06 0.00 0.00 27.41 29.23 2bxh h HIS 67 CO -0.08 -0.53 0.45 1.15 0.86 0.00 0.00 177.93 179.77 2bxh h THR 68 N -0.66 1.14 0.63 2.45 2.02 -1.88 0.49 112.91 117.09 2bxh h THR 68 Ca 0.02 -0.31 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 2bxh h THR 68 Cb 0.69 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2bxh h THR 68 CO -0.27 0.16 -0.32 -0.07 0.37 0.00 0.00 175.52 175.40 2bxh h LEU 69 N 0.89 -0.76 -1.38 2.58 3.38 -0.39 -0.69 115.31 118.95 2bxh h LEU 69 Ca 0.27 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.30 2bxh h LEU 69 Cb -0.05 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2bxh h LEU 69 CO -0.08 -0.53 0.44 -0.26 0.09 0.00 0.00 178.44 178.10 2bxh h PHE 70 N -0.87 0.78 -0.28 1.13 -1.00 0.48 -2.16 116.94 115.02 2bxh h PHE 70 Ca -0.09 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.71 2bxh h PHE 70 Cb 0.67 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.96 2bxh h PHE 70 CO 0.06 0.46 0.18 0.78 -1.61 0.00 0.00 178.31 178.18 2bxh h GLY 71 N 0.81 0.40 0.85 -1.45 0.00 0.10 -1.86 103.07 101.92 2bxh h GLY 71 Ca 0.26 -0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.44 2bxh h GLY 71 CO -0.07 0.15 -0.16 -0.55 0.00 0.00 0.00 176.54 175.91 2bxh h ASP 72 N 0.38 -0.41 -0.56 0.19 3.32 -0.50 -2.33 116.42 116.51 2bxh h ASP 72 Ca 0.10 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.29 2bxh h ASP 72 Cb -0.03 0.14 -0.08 0.00 0.22 0.00 0.00 39.33 39.57 2bxh h ASP 72 CO -0.02 -0.24 0.08 0.11 -1.72 0.00 0.00 179.24 177.45 2bxh h LYS 73 N -0.36 0.20 -0.49 3.56 1.79 -1.23 -2.29 116.57 117.75 2bxh h LYS 73 Ca -0.01 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.44 2bxh h LYS 73 Cb 0.33 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.91 2bxh h LYS 73 CO -0.02 0.13 0.28 -0.07 -1.08 0.00 0.00 179.45 178.70 2bxh h LEU 74 N 0.21 0.60 0.00 2.94 3.38 -1.20 -2.39 115.31 118.86 2bxh h LEU 74 Ca 0.29 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2bxh h LEU 74 Cb 0.42 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2bxh h LEU 74 CO -0.40 0.51 0.00 0.00 0.09 0.00 0.00 178.44 178.64 2bxh n THR 76 N -1.27 0.13 0.00 0.00 -1.04 -0.90 -3.66 114.28 107.54 2bxh n THR 76 Ca 0.00 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 2bxh n THR 76 Cb 0.00 0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 2bxh n THR 76 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2bxh n VAL 77 N -0.25 0.00 0.04 12.58 0.31 -0.32 -4.86 118.33 125.83 2bxh n VAL 77 Ca 0.08 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.46 2bxh n VAL 77 Cb 0.12 0.00 0.45 0.00 -0.91 0.00 0.00 33.84 33.51 2bxh n VAL 77 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2bxh h ALA 78 N 0.00 1.74 -0.81 3.52 0.00 -1.44 -2.00 119.26 120.27 2bxh h ALA 78 Ca 0.00 -0.03 0.24 0.00 0.00 0.00 0.00 54.91 55.11 2bxh h ALA 78 Cb 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2bxh h ALA 78 CO 0.00 0.24 0.77 1.15 0.00 0.00 0.00 179.25 181.40 2bxh h THR 79 N 0.46 0.29 -0.34 0.00 2.02 -1.84 -3.35 112.91 110.14 2bxh h THR 79 Ca 0.12 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 67.09 2bxh h THR 79 Cb -0.04 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.76 2bxh h THR 79 CO -0.03 0.00 0.68 -0.76 0.37 0.00 0.00 175.52 175.78 2bxh s LEU 80 N -7.47 2.80 0.36 2.58 1.43 -0.75 -4.71 118.68 112.91 2bxh s LEU 80 Ca -0.04 -1.37 0.07 0.00 -1.03 0.00 0.00 54.13 51.76 2bxh s LEU 80 Cb 0.17 -2.59 0.77 0.00 0.03 0.00 0.00 46.19 44.57 2bxh s LEU 80 CO 0.61 -3.71 1.94 0.03 0.23 0.00 0.00 176.35 175.45 2bxh h ARG 81 N 10.49 0.71 -0.97 1.70 3.08 -1.69 0.59 114.38 128.28 2bxh h ARG 81 Ca 0.14 -0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.26 2bxh h ARG 81 Cb 0.96 -0.16 -0.08 0.00 0.08 0.00 0.00 29.97 30.77 2bxh h ARG 81 CO 1.14 0.47 0.62 0.93 -1.07 0.00 0.00 179.97 182.06 2bxh h GLU 82 N 0.73 0.92 0.10 0.04 4.39 -1.93 -1.39 114.58 117.43 2bxh h GLU 82 Ca 0.34 -0.06 -0.28 0.00 0.34 0.00 0.00 59.36 59.71 2bxh h GLU 82 Cb 0.38 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 2bxh h GLU 82 CO -0.12 0.61 -1.46 1.79 -1.16 0.00 0.00 179.01 178.67 2bxh h THR 83 N 0.94 0.96 -3.00 1.13 1.35 -1.46 -3.44 112.91 109.40 2bxh h THR 83 Ca 0.48 -2.36 -0.57 0.00 -0.55 0.00 0.00 66.41 63.40 2bxh h THR 83 Cb 0.50 2.62 -0.40 0.00 -1.73 0.00 0.00 68.15 69.15 2bxh h THR 83 CO -0.24 0.68 -0.77 -0.31 -0.25 0.00 0.00 175.52 174.63 2bxh s TYR 84 N -2.47 1.35 0.00 4.73 1.51 0.19 -5.05 117.35 117.60 2bxh s TYR 84 Ca -0.21 -1.63 0.00 0.00 -1.01 0.00 0.00 57.07 54.22 2bxh s TYR 84 Cb 0.05 -1.48 0.00 0.00 -0.11 0.00 0.00 41.96 40.42 2bxh s TYR 84 CO 0.74 -0.85 0.00 0.41 -1.11 0.00 0.00 175.55 174.74 2bxh n GLY 85 N 4.69 -1.64 0.37 0.71 0.00 -0.56 -3.60 105.19 105.16 2bxh n GLY 85 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2bxh n GLY 85 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2bxh h GLU 86 N 0.00 0.00 0.00 1.61 9.09 -1.98 0.46 114.58 123.76 2bxh h GLU 86 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2bxh h GLU 86 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2bxh h GLU 86 CO 0.00 0.00 0.00 1.98 0.05 0.00 0.00 179.01 181.04 2bxh h MET 87 N 0.00 0.00 -0.02 1.06 -1.53 -1.93 -2.92 114.93 109.60 2bxh h MET 87 Ca 0.10 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.34 2bxh h MET 87 Cb 1.62 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 32.67 2bxh h MET 87 CO -0.00 0.00 -0.05 0.00 0.14 0.00 0.00 176.91 177.00 2bxh h ALA 88 N 2.02 0.03 -1.09 0.39 0.00 -0.13 -2.97 119.26 117.51 2bxh h ALA 88 Ca 0.00 -0.32 0.32 0.00 0.00 0.00 0.00 54.91 54.91 2bxh h ALA 88 Cb 0.34 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2bxh h ALA 88 CO 0.00 -0.12 1.12 -0.44 0.00 0.00 0.00 179.25 179.80 2bxh h ASP 89 N -0.50 0.00 0.48 0.00 3.32 -1.67 0.97 116.42 119.02 2bxh h ASP 89 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2bxh h ASP 89 Cb 0.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.21 2bxh h ASP 89 CO 0.01 0.00 -0.23 0.00 -1.72 0.00 0.00 179.24 177.30 2bxh h ALA 92 N 1.15 1.66 -3.05 0.00 0.00 -1.47 -3.40 119.26 114.14 2bxh h ALA 92 Ca 0.25 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2bxh h ALA 92 Cb 0.24 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.05 2bxh h ALA 92 CO -0.02 -0.58 0.02 1.63 0.00 0.00 0.00 179.25 180.30 2bxh n LYS 93 N -2.94 -0.45 -1.16 0.00 4.76 -0.68 -5.10 118.16 112.59 2bxh n LYS 93 Ca 0.01 -0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.32 2bxh n LYS 93 Cb 0.59 -0.10 0.00 0.00 -1.84 0.00 0.00 35.03 33.69 2bxh n LYS 93 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2bxh n GLN 94 N -1.37 2.35 -4.44 1.97 1.13 -1.26 -4.78 117.38 110.97 2bxh n GLN 94 Ca 0.01 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.77 2bxh n GLN 94 Cb 0.04 0.00 -0.12 0.00 0.11 0.00 0.00 30.24 30.27 2bxh n GLN 94 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2bxh s GLU 95 N -0.85 1.96 0.28 -1.09 0.41 -1.26 0.39 118.70 118.53 2bxh s GLU 95 Ca 0.00 -1.07 0.24 0.00 -0.41 0.00 0.00 54.97 53.73 2bxh s GLU 95 Cb 0.00 -2.18 1.01 0.00 -1.78 0.00 0.00 34.13 31.18 2bxh s GLU 95 CO 0.00 0.51 1.72 -2.30 -0.49 0.00 0.00 175.26 174.70 2bxh n PRO 96 N 1.10 0.20 -0.31 0.39 -0.02 -1.26 -4.89 135.00 130.22 2bxh n PRO 96 Ca -0.16 0.44 0.13 0.00 -2.02 0.00 0.00 63.50 61.90 2bxh n PRO 96 Cb 0.52 -1.90 0.26 0.00 -0.02 0.00 0.00 33.50 32.37 2bxh n PRO 96 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2bxh n GLU 97 N -2.28 -0.07 -0.10 -0.52 1.02 -1.18 -0.20 120.64 117.31 2bxh n GLU 97 Ca 0.02 1.33 -0.06 0.00 -0.02 0.00 0.00 57.16 58.43 2bxh n GLU 97 Cb 0.23 -2.11 0.01 0.00 -0.02 0.00 0.00 31.44 29.54 2bxh n GLU 97 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 2bxh h ARG 98 N 0.00 -0.02 -0.01 3.49 -0.00 0.72 0.15 114.38 118.70 2bxh h ARG 98 Ca 0.54 0.00 0.01 0.00 -0.00 0.00 0.00 59.98 60.53 2bxh h ARG 98 Cb 1.11 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.08 2bxh h ARG 98 CO -0.83 -0.01 -0.03 -0.97 -0.00 0.00 0.00 179.97 178.12 2bxh h ASN 99 N -0.02 -0.08 -0.76 0.08 -1.24 -0.82 -1.90 115.58 110.84 2bxh h ASN 99 Ca 0.17 0.02 0.13 0.00 0.71 0.00 0.00 56.30 57.33 2bxh h ASN 99 Cb 0.29 0.04 -0.05 0.00 0.73 0.00 0.00 38.32 39.32 2bxh h ASN 99 CO -0.38 -0.04 0.50 -0.33 -1.29 0.00 0.00 177.43 175.89 2bxh h GLU 100 N -0.04 0.49 -0.26 6.67 4.39 -1.04 0.78 114.58 125.57 2bxh h GLU 100 Ca 0.02 -0.03 -0.13 0.00 0.34 0.00 0.00 59.36 59.55 2bxh h GLU 100 Cb 0.07 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2bxh h GLU 100 CO -0.04 0.32 -0.39 0.00 -1.16 0.00 0.00 179.01 177.74 2bxh h PHE 102 N 0.50 -0.34 -0.66 0.00 0.04 -0.14 -2.98 116.94 113.37 2bxh h PHE 102 Ca 0.05 -0.01 0.14 0.00 2.80 0.00 0.00 57.97 60.94 2bxh h PHE 102 Cb 0.90 0.11 -0.10 0.00 2.20 0.00 0.00 35.95 39.06 2bxh h PHE 102 CO 0.04 -0.03 0.07 -0.07 -0.60 0.00 0.00 178.31 177.72 2bxh h LEU 103 N -0.66 -0.16 -1.81 1.54 3.38 -1.19 0.61 115.31 117.01 2bxh h LEU 103 Ca -0.04 0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.09 2bxh h LEU 103 Cb 0.46 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2bxh h LEU 103 CO 0.06 -0.08 0.15 -0.61 0.09 0.00 0.00 178.44 178.05 2bxh h GLN 104 N 0.18 0.25 -0.02 1.13 5.75 -1.47 -1.74 115.11 119.19 2bxh h GLN 104 Ca 0.35 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.84 2bxh h GLN 104 Cb 0.58 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.07 2bxh h GLN 104 CO -0.51 0.17 0.00 0.72 -2.65 0.00 0.00 178.83 176.55 2bxh n HIS 105 N -4.50 0.02 -1.85 3.99 8.25 0.19 -4.85 115.22 116.47 2bxh n HIS 105 Ca 0.01 -0.01 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 2bxh n HIS 105 Cb 0.11 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 2bxh n HIS 105 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2bxh s LYS 106 N -1.98 4.18 -0.35 -0.41 1.02 -0.66 -4.95 119.74 116.59 2bxh s LYS 106 Ca 0.37 2.46 -0.10 0.00 0.02 0.00 0.00 55.97 58.72 2bxh s LYS 106 Cb 0.18 -3.11 0.02 0.00 -0.52 0.00 0.00 37.83 34.40 2bxh s LYS 106 CO 0.29 -0.64 0.18 0.34 -0.92 0.00 0.00 175.35 174.60 2bxh s ASP 107 N 1.00 5.62 0.27 2.83 -1.08 -1.26 -4.95 116.67 119.10 2bxh s ASP 107 Ca 0.70 -0.90 0.23 0.00 -0.52 0.00 0.00 52.55 52.06 2bxh s ASP 107 Cb -0.46 -1.99 1.01 0.00 -1.46 0.00 0.00 42.92 40.02 2bxh s ASP 107 CO 0.35 -0.33 1.70 0.47 0.52 0.00 0.00 175.17 177.88 2bxh n ASP 108 N 4.97 0.65 -3.11 -0.34 8.00 -1.26 -3.60 116.55 121.87 2bxh n ASP 108 Ca -0.12 0.68 -0.19 0.00 0.71 0.00 0.00 54.79 55.87 2bxh n ASP 108 Cb 0.47 -0.81 -0.03 0.00 -0.02 0.00 0.00 41.12 40.73 2bxh n ASP 108 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2bxh n ASN 109 N -2.24 1.55 -4.69 -2.24 4.05 -1.26 -4.99 115.26 105.44 2bxh n ASN 109 Ca 0.01 -3.12 -0.43 0.00 0.45 0.00 0.00 54.58 51.49 2bxh n ASN 109 Cb 0.20 -0.60 -0.03 0.00 1.23 0.00 0.00 39.78 40.57 2bxh n ASN 109 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 2bxh n PRO 110 N 0.16 2.64 -2.17 1.20 -0.02 -1.24 -4.88 135.00 130.70 2bxh n PRO 110 Ca 0.25 0.96 -0.36 0.00 -2.02 0.00 0.00 63.50 62.33 2bxh n PRO 110 Cb 0.62 -2.82 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 2bxh n PRO 110 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2bxh s ASN 111 N 2.31 5.48 0.05 2.55 2.47 -1.26 -4.92 114.94 121.62 2bxh s ASN 111 Ca 0.81 -0.16 0.02 0.00 0.42 0.00 0.00 52.86 53.95 2bxh s ASN 111 Cb -0.53 -2.54 -0.03 0.00 -1.45 0.00 0.00 41.25 36.69 2bxh s ASN 111 CO 0.38 -2.31 -0.07 -0.76 -3.72 0.00 0.00 177.10 170.62 2bxh s LEU 112 N 8.45 2.33 -0.37 3.21 1.43 -1.26 -5.09 118.68 127.38 2bxh s LEU 112 Ca 0.61 -0.67 -0.27 0.00 -1.03 0.00 0.00 54.13 52.76 2bxh s LEU 112 Cb -0.10 -0.08 -0.05 0.00 0.03 0.00 0.00 46.19 45.99 2bxh s LEU 112 CO 0.12 -0.30 2.19 -2.84 0.23 0.00 0.00 176.35 175.76 2bxh s PRO 113 N -2.22 2.75 -0.03 1.29 0.02 -1.26 -4.86 135.00 130.68 2bxh s PRO 113 Ca -0.05 1.59 -0.40 0.00 0.02 0.00 0.00 61.00 62.16 2bxh s PRO 113 Cb -0.05 -4.42 -0.20 0.00 0.02 0.00 0.00 34.50 29.84 2bxh s PRO 113 CO -0.02 -2.55 1.09 2.89 -0.33 0.00 0.00 177.00 178.09 2bxh n ARG 114 N 8.84 0.00 -1.67 5.54 0.00 -1.26 -4.70 116.66 123.42 2bxh n ARG 114 Ca 0.30 0.00 -0.47 0.00 -0.00 0.00 0.00 57.85 57.68 2bxh n ARG 114 Cb 0.49 -1.48 -0.05 0.00 -0.00 0.00 0.00 32.46 31.43 2bxh n ARG 114 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2bxh n LEU 115 N 1.63 3.02 -4.24 2.89 4.77 -1.26 -4.97 117.00 118.85 2bxh n LEU 115 Ca 0.20 1.06 -0.34 0.00 -0.03 0.00 0.00 56.01 56.91 2bxh n LEU 115 Cb 0.07 -1.38 -0.15 0.00 -2.33 0.00 0.00 43.42 39.63 2bxh n LEU 115 CO 0.62 -0.31 -0.47 0.54 -1.33 0.00 0.00 177.39 176.44 2bxh s VAL 116 N 1.70 2.68 -0.31 4.08 0.11 -1.26 -5.10 120.40 122.30 2bxh s VAL 116 Ca 0.83 -0.75 -0.16 0.00 -2.93 0.00 0.00 61.98 58.97 2bxh s VAL 116 Cb -0.72 -2.15 -0.02 0.00 -1.53 0.00 0.00 36.38 31.96 2bxh s VAL 116 CO 0.43 0.50 0.42 0.00 -3.33 0.00 0.00 175.10 173.12 2bxh s ARG 117 N 1.06 3.81 0.42 1.54 1.70 -1.26 -5.07 118.95 121.15 2bxh s ARG 117 Ca -0.01 -0.10 -0.07 0.00 -0.47 0.00 0.00 55.73 55.09 2bxh s ARG 117 Cb -0.15 -3.73 0.11 0.00 -0.57 0.00 0.00 34.95 30.61 2bxh s ARG 117 CO -0.04 -0.44 0.25 -2.30 -1.08 0.00 0.00 175.30 171.69 2bxh n PRO 118 N 5.47 -2.84 -2.04 3.89 -0.02 -1.26 -4.95 135.00 133.25 2bxh n PRO 118 Ca -0.07 -0.42 -0.36 0.00 -2.02 0.00 0.00 63.50 60.63 2bxh n PRO 118 Cb 0.50 -0.55 0.03 0.00 -0.02 0.00 0.00 33.50 33.46 2bxh n PRO 118 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2bxh s GLU 119 N -3.60 3.03 0.14 -0.52 0.41 -1.26 -4.79 118.70 112.11 2bxh s GLU 119 Ca 0.19 1.76 -0.30 0.00 -0.41 0.00 0.00 54.97 56.22 2bxh s GLU 119 Cb -0.03 -1.94 -0.05 0.00 -1.78 0.00 0.00 34.13 30.32 2bxh s GLU 119 CO 0.16 -1.15 1.57 0.28 -0.49 0.00 0.00 175.26 175.63 2bxh h VAL 120 N 0.90 0.07 -1.07 2.63 2.07 -1.99 0.44 116.25 119.29 2bxh h VAL 120 Ca -0.50 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.33 2bxh h VAL 120 Cb 1.29 0.07 -0.13 0.00 -1.52 0.00 0.00 31.29 31.00 2bxh h VAL 120 CO 0.55 0.00 0.65 0.44 0.02 0.00 0.00 177.57 179.23 2bxh h ASP 121 N -0.40 0.48 0.22 0.57 3.32 -1.98 0.29 116.42 118.91 2bxh h ASP 121 Ca 0.10 0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 2bxh h ASP 121 Cb 0.61 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.24 2bxh h ASP 121 CO -0.54 -0.04 -0.10 0.58 -1.72 0.00 0.00 179.24 177.41 2bxh h VAL 122 N 0.34 0.00 -0.62 -1.35 2.07 -1.28 -2.02 116.25 113.40 2bxh h VAL 122 Ca 0.70 -0.06 0.10 0.00 0.82 0.00 0.00 66.70 68.26 2bxh h VAL 122 Cb 1.71 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.37 2bxh h VAL 122 CO -0.47 0.00 -0.38 0.24 0.02 0.00 0.00 177.57 176.98 2bxh h MET 123 N -0.35 -0.17 -0.98 1.57 2.86 -0.85 0.22 114.93 117.23 2bxh h MET 123 Ca -0.03 0.01 0.21 0.00 -2.06 0.00 0.00 59.70 57.83 2bxh h MET 123 Cb 0.22 0.04 -0.11 0.00 0.06 0.00 0.00 31.60 31.81 2bxh h MET 123 CO 0.05 -0.11 0.56 0.00 1.06 0.00 0.00 176.91 178.47 2bxh h THR 125 N 0.63 0.33 -0.87 0.00 2.02 0.11 -0.69 112.91 114.44 2bxh h THR 125 Ca 0.59 -0.40 0.22 0.00 0.77 0.00 0.00 66.41 67.59 2bxh h THR 125 Cb 1.02 0.46 -0.13 0.00 -1.74 0.00 0.00 68.15 67.77 2bxh h THR 125 CO -0.44 0.05 0.32 0.00 0.37 0.00 0.00 175.52 175.82 2bxh h ALA 126 N -0.73 1.34 -0.86 6.16 0.00 0.54 1.25 119.26 126.96 2bxh h ALA 126 Ca -0.07 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2bxh h ALA 126 Cb 0.62 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 2bxh h ALA 126 CO 0.12 -0.38 0.56 0.35 0.00 0.00 0.00 179.25 179.90 2bxh h PHE 127 N 0.32 1.06 -0.03 0.00 3.57 0.93 -2.62 116.94 120.17 2bxh h PHE 127 Ca 0.54 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.99 2bxh h PHE 127 Cb 1.04 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.44 2bxh h PHE 127 CO -0.19 0.63 -0.27 0.45 -2.23 0.00 0.00 178.31 176.70 2bxh h HIS 128 N 1.11 0.32 0.00 0.41 -0.00 0.26 -3.06 115.15 114.20 2bxh h HIS 128 Ca 0.33 -0.16 0.00 0.00 -0.00 0.00 0.00 60.37 60.55 2bxh h HIS 128 Cb -0.04 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 27.32 2bxh h HIS 128 CO -0.02 0.92 0.00 -0.25 -0.00 0.00 0.00 177.93 178.58 2bxh n ASP 129 N -4.49 0.00 -3.94 2.45 8.00 0.32 -4.39 116.55 114.50 2bxh n ASP 129 Ca -0.09 0.74 -0.31 0.00 0.71 0.00 0.00 54.79 55.85 2bxh n ASP 129 Cb 0.49 -0.24 -0.15 0.00 -0.02 0.00 0.00 41.12 41.20 2bxh n ASP 129 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2bxh s ASN 130 N -2.59 4.09 0.09 -2.24 3.84 -1.00 -5.00 114.94 112.13 2bxh s ASN 130 Ca 0.00 -1.42 -0.15 0.00 0.21 0.00 0.00 52.86 51.50 2bxh s ASN 130 Cb 0.00 -1.26 -0.11 0.00 -0.55 0.00 0.00 41.25 39.33 2bxh s ASN 130 CO 0.00 -0.27 1.37 -0.08 -2.79 0.00 0.00 177.10 175.33 2bxh h GLU 131 N 7.89 0.69 -0.11 0.43 4.81 -1.73 -3.05 114.58 123.51 2bxh h GLU 131 Ca -0.15 -0.42 -0.19 0.00 -0.13 0.00 0.00 59.36 58.47 2bxh h GLU 131 Cb 1.05 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 2bxh h GLU 131 CO 0.44 1.04 -0.71 0.93 -0.73 0.00 0.00 179.01 179.97 2bxh h GLU 132 N 0.41 0.51 0.00 1.92 3.07 -1.94 -2.79 114.58 115.75 2bxh h GLU 132 Ca 0.02 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.48 2bxh h GLU 132 Cb 0.98 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.97 2bxh h GLU 132 CO 0.09 1.03 0.00 1.15 -1.40 0.00 0.00 179.01 179.88 2bxh h THR 133 N 0.35 0.00 0.37 1.13 2.02 -1.96 -2.49 112.91 112.33 2bxh h THR 133 Ca -0.03 -0.54 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 2bxh h THR 133 Cb 1.30 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 2bxh h THR 133 CO 0.13 0.00 -0.18 0.15 0.37 0.00 0.00 175.52 175.99 2bxh h PHE 134 N 0.00 -0.47 -0.23 3.16 3.57 -1.38 -2.14 116.94 119.45 2bxh h PHE 134 Ca 0.00 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 2bxh h PHE 134 Cb 0.61 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 2bxh h PHE 134 CO 0.00 -0.24 0.03 -0.07 -2.23 0.00 0.00 178.31 175.80 2bxh h LEU 135 N -1.10 0.30 -1.10 0.59 3.38 -1.53 -0.33 115.31 115.51 2bxh h LEU 135 Ca -0.05 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2bxh h LEU 135 Cb 0.44 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2bxh h LEU 135 CO 0.08 0.33 -0.20 0.11 0.09 0.00 0.00 178.44 178.85 2bxh h LYS 136 N 0.32 0.40 -0.39 1.13 1.57 -1.50 -2.47 116.57 115.63 2bxh h LYS 136 Ca 0.08 -0.13 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 2bxh h LYS 136 Cb 0.18 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2bxh h LYS 136 CO 0.00 0.58 -0.26 0.87 -0.57 0.00 0.00 179.45 180.08 2bxh h LYS 137 N 0.36 0.80 0.61 3.15 6.56 -0.37 -0.95 116.57 126.73 2bxh h LYS 137 Ca 0.06 -0.34 -0.03 0.00 -1.06 0.00 0.00 60.65 59.28 2bxh h LYS 137 Cb 0.56 -0.03 -0.00 0.00 -0.57 0.00 0.00 32.23 32.19 2bxh h LYS 137 CO 0.04 0.97 -0.37 -0.92 -2.06 0.00 0.00 179.45 177.10 2bxh h TYR 138 N 0.69 -0.99 -0.13 -1.35 3.20 -1.01 -0.82 116.97 116.56 2bxh h TYR 138 Ca 0.09 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.97 2bxh h TYR 138 Cb 0.78 0.35 -0.05 0.00 1.54 0.00 0.00 36.73 39.36 2bxh h TYR 138 CO 0.04 -0.56 -0.39 -0.07 -1.64 0.00 0.00 178.16 175.54 2bxh h LEU 139 N -0.92 -1.26 -0.90 2.82 3.38 -1.41 0.13 115.31 117.15 2bxh h LEU 139 Ca -0.08 0.15 0.25 0.00 0.09 0.00 0.00 57.88 58.29 2bxh h LEU 139 Cb 0.73 0.50 -0.15 0.00 0.09 0.00 0.00 40.66 41.83 2bxh h LEU 139 CO 0.09 -0.34 0.28 0.22 0.09 0.00 0.00 178.44 178.77 2bxh h TYR 140 N -0.40 0.42 -0.28 1.13 3.20 -1.15 0.41 116.97 120.30 2bxh h TYR 140 Ca 0.03 0.05 -0.14 0.00 3.14 0.00 0.00 58.73 61.81 2bxh h TYR 140 Cb 0.48 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 2bxh h TYR 140 CO -0.57 -0.22 -0.39 0.93 -1.64 0.00 0.00 178.16 176.27 2bxh h GLU 141 N 0.21 0.66 0.09 1.82 4.39 0.15 -2.36 114.58 119.54 2bxh h GLU 141 Ca 0.59 -0.33 -0.21 0.00 0.34 0.00 0.00 59.36 59.75 2bxh h GLU 141 Cb 1.22 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.89 2bxh h GLU 141 CO -0.67 0.93 -0.86 0.82 -1.16 0.00 0.00 179.01 178.08 2bxh h ILE 142 N 0.55 1.42 0.00 3.13 1.08 0.11 -3.24 117.51 120.56 2bxh h ILE 142 Ca 0.05 -2.36 -0.04 0.00 -0.39 0.00 0.00 64.86 62.12 2bxh h ILE 142 Cb 0.91 2.86 -0.01 0.00 -3.07 0.00 0.00 36.82 37.51 2bxh h ILE 142 CO 0.08 0.69 -0.21 0.00 -0.69 0.00 0.00 178.15 178.02 2bxh h ALA 143 N 0.22 1.57 0.03 1.87 0.00 -0.29 -2.00 119.26 120.65 2bxh h ALA 143 Ca -0.13 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.35 2bxh h ALA 143 Cb 1.61 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 2bxh h ALA 143 CO 0.17 0.27 -1.10 0.07 0.00 0.00 0.00 179.25 178.65 2bxh h ARG 144 N 0.00 0.06 0.00 0.00 0.11 -1.53 -3.15 114.38 109.86 2bxh h ARG 144 Ca -0.00 -0.10 0.00 0.00 0.10 0.00 0.00 59.98 59.98 2bxh h ARG 144 Cb 0.39 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.51 2bxh h ARG 144 CO 0.03 1.01 -0.44 0.54 0.10 0.00 0.00 179.97 181.21 2bxh n ARG 145 N -3.37 0.27 -3.35 0.08 1.74 -1.09 -4.38 116.66 106.56 2bxh n ARG 145 Ca -0.03 0.12 -0.26 0.00 -0.77 0.00 0.00 57.85 56.91 2bxh n ARG 145 Cb 0.97 -1.71 -0.09 0.00 -1.02 0.00 0.00 32.46 30.61 2bxh n ARG 145 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2bxh n HIS 146 N -2.12 -0.27 0.06 -1.55 8.25 -0.77 -4.85 115.22 113.97 2bxh n HIS 146 Ca 0.04 -3.50 0.01 0.00 -0.26 0.00 0.00 57.72 54.01 2bxh n HIS 146 Cb 0.43 -0.05 0.03 0.00 1.12 0.00 0.00 29.99 31.52 2bxh n HIS 146 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2bxh n PRO 147 N 2.16 0.02 -0.00 -0.41 -0.04 -1.19 -1.57 135.00 133.97 2bxh n PRO 147 Ca 0.26 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 2bxh n PRO 147 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 2bxh n PRO 147 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2bxh n TYR 148 N -1.25 0.00 -1.55 0.54 4.02 -1.26 -4.90 117.16 112.75 2bxh n TYR 148 Ca 0.01 -0.38 -0.47 0.00 -0.01 0.00 0.00 57.90 57.04 2bxh n TYR 148 Cb 0.01 -0.04 -0.03 0.00 -0.02 0.00 0.00 39.34 39.26 2bxh n TYR 148 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2bxh n PHE 149 N -0.37 1.00 -1.88 -0.72 -0.00 -0.61 -4.68 117.46 110.22 2bxh n PHE 149 Ca 0.00 0.74 -0.39 0.00 -0.00 0.00 0.00 57.45 57.80 2bxh n PHE 149 Cb 0.19 -2.21 -0.03 0.00 -0.00 0.00 0.00 39.48 37.43 2bxh n PHE 149 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.76 176.29 2bxh s TYR 150 N -0.65 1.51 0.19 -5.13 5.04 -1.26 -4.87 117.35 112.18 2bxh s TYR 150 Ca 0.67 0.94 -0.22 0.00 -2.44 0.00 0.00 57.07 56.02 2bxh s TYR 150 Cb -0.82 -3.95 0.12 0.00 0.35 0.00 0.00 41.96 37.66 2bxh s TYR 150 CO 0.56 -2.63 1.56 0.00 -1.34 0.00 0.00 175.55 173.70 2bxh h ALA 151 N 15.71 -0.10 -0.76 3.97 0.00 -1.94 -2.00 119.26 134.15 2bxh h ALA 151 Ca -0.28 0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.84 2bxh h ALA 151 Cb 1.20 0.98 -0.04 0.00 0.00 0.00 0.00 17.79 19.92 2bxh h ALA 151 CO 1.14 -0.73 0.50 -1.35 0.00 0.00 0.00 179.25 178.81 2bxh h PRO 152 N -0.11 0.92 0.00 0.00 0.11 -1.92 -0.80 132.00 130.20 2bxh h PRO 152 Ca 0.25 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 2bxh h PRO 152 Cb 0.56 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 2bxh h PRO 152 CO -0.82 0.61 -0.22 0.93 -0.21 0.00 0.00 178.00 178.28 2bxh h GLU 153 N 0.95 0.00 -0.10 1.05 4.39 -1.78 -2.23 114.58 116.85 2bxh h GLU 153 Ca 0.30 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.90 2bxh h GLU 153 Cb 0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 2bxh h GLU 153 CO -0.08 0.22 -0.36 1.25 -1.16 0.00 0.00 179.01 178.88 2bxh h LEU 154 N 0.00 0.20 -0.53 1.33 5.85 -0.52 0.08 115.31 121.72 2bxh h LEU 154 Ca -0.00 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.53 2bxh h LEU 154 Cb 0.78 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 2bxh h LEU 154 CO 0.03 0.55 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.49 2bxh h LEU 155 N 0.17 1.02 -0.87 2.25 3.38 -1.13 -1.13 115.31 118.99 2bxh h LEU 155 Ca 0.02 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.56 2bxh h LEU 155 Cb 0.71 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2bxh h LEU 155 CO 0.05 1.13 -0.01 0.15 0.09 0.00 0.00 178.44 179.86 2bxh h PHE 156 N 0.89 0.88 -0.46 1.13 3.57 -1.26 -1.68 116.94 120.01 2bxh h PHE 156 Ca 0.14 -0.13 -0.07 0.00 3.53 0.00 0.00 57.97 61.44 2bxh h PHE 156 Cb 0.68 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 2bxh h PHE 156 CO 0.05 0.81 0.03 0.74 -2.23 0.00 0.00 178.31 177.71 2bxh h PHE 157 N 0.76 0.86 -0.88 0.41 -1.00 -0.52 -1.89 116.94 114.68 2bxh h PHE 157 Ca 0.15 -0.14 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 2bxh h PHE 157 Cb 0.48 -0.23 -0.04 0.00 3.61 0.00 0.00 35.95 39.77 2bxh h PHE 157 CO 0.03 0.82 0.46 0.00 -1.61 0.00 0.00 178.31 178.00 2bxh h ALA 158 N 0.93 1.15 0.12 2.45 0.00 -0.95 -0.15 119.26 122.81 2bxh h ALA 158 Ca 0.14 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2bxh h ALA 158 Cb 0.45 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2bxh h ALA 158 CO 0.02 0.67 -0.17 -0.22 0.00 0.00 0.00 179.25 179.55 2bxh h LYS 159 N 1.24 -0.33 0.00 0.00 3.11 -1.11 0.12 116.57 119.61 2bxh h LYS 159 Ca 0.31 0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 58.16 2bxh h LYS 159 Cb 0.07 0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 31.37 2bxh h LYS 159 CO -0.04 -0.22 -0.07 0.00 -2.81 0.00 0.00 179.45 176.31 2bxh h ARG 160 N -0.34 0.00 0.45 1.90 3.08 -0.88 -1.05 114.38 117.54 2bxh h ARG 160 Ca 0.02 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2bxh h ARG 160 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2bxh h ARG 160 CO -0.07 0.07 -0.22 -0.92 -1.07 0.00 0.00 179.97 177.76 2bxh h TYR 161 N 0.00 -0.57 0.28 3.04 3.20 0.27 -2.32 116.97 120.87 2bxh h TYR 161 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2bxh h TYR 161 Cb 0.13 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 2bxh h TYR 161 CO 0.00 -0.24 -0.46 0.87 -1.64 0.00 0.00 178.16 176.69 2bxh h LYS 162 N -0.97 -0.77 0.00 1.82 6.56 -0.52 0.24 116.57 122.93 2bxh h LYS 162 Ca -0.06 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 2bxh h LYS 162 Cb 0.58 0.18 0.00 0.00 -0.57 0.00 0.00 32.23 32.41 2bxh h LYS 162 CO 0.10 -0.51 0.04 0.00 -2.06 0.00 0.00 179.45 177.02 2bxh n ALA 163 N -2.82 0.98 -0.05 3.86 0.00 -0.42 -0.05 120.51 122.00 2bxh n ALA 163 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 2bxh n ALA 163 Cb 0.41 -0.73 -0.13 0.00 0.00 0.00 0.00 19.45 19.01 2bxh n ALA 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bxh n ALA 164 N -1.01 0.93 -0.00 0.00 0.00 0.82 -3.98 120.51 117.26 2bxh n ALA 164 Ca 0.00 -0.64 -0.17 0.00 0.00 0.00 0.00 53.44 52.63 2bxh n ALA 164 Cb 0.04 -0.53 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 2bxh n ALA 164 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2bxh h PHE 165 N -0.36 1.00 -0.14 0.00 0.04 -0.14 -2.58 116.94 114.76 2bxh h PHE 165 Ca -0.44 -0.46 0.04 0.00 2.80 0.00 0.00 57.97 59.91 2bxh h PHE 165 Cb 1.76 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 39.76 2bxh h PHE 165 CO 0.07 1.29 0.20 1.15 -0.60 0.00 0.00 178.31 180.41 2bxh h THR 166 N 0.48 0.37 0.03 -1.55 2.02 -1.36 -1.55 112.91 111.35 2bxh h THR 166 Ca -0.06 0.00 -0.38 0.00 0.77 0.00 0.00 66.41 66.74 2bxh h THR 166 Cb 1.45 0.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.64 2bxh h THR 166 CO 0.16 0.00 -2.21 1.21 0.37 0.00 0.00 175.52 175.05 2bxh n GLU 167 N -3.63 0.65 0.04 6.66 2.13 -1.19 -4.69 120.64 120.61 2bxh n GLU 167 Ca 0.01 0.27 -0.20 0.00 0.66 0.00 0.00 57.16 57.89 2bxh n GLU 167 Cb 0.30 -1.59 -0.12 0.00 0.27 0.00 0.00 31.44 30.30 2bxh n GLU 167 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2bxh n GLN 170 N -0.77 3.09 -1.93 0.00 3.00 -1.25 -5.08 117.38 114.45 2bxh n GLN 170 Ca 0.02 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.67 2bxh n GLN 170 Cb 0.01 -0.90 0.04 0.00 0.00 0.00 0.00 30.24 29.38 2bxh n GLN 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2bxh s ALA 171 N -1.81 2.51 0.00 -1.58 0.00 -0.96 -4.97 121.76 114.95 2bxh s ALA 171 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.74 2bxh s ALA 171 Cb 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.74 2bxh s ALA 171 CO 0.00 -1.17 0.17 0.00 0.00 0.00 0.00 175.76 174.76 2bxh n ALA 172 N -1.92 0.00 -2.71 0.00 0.00 -1.26 -4.03 120.51 110.59 2bxh n ALA 172 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.16 2bxh n ALA 172 Cb 0.51 0.09 -0.05 0.00 0.00 0.00 0.00 19.45 20.00 2bxh n ALA 172 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2bxh s ASP 173 N -1.36 6.97 -0.03 0.00 -1.08 -1.26 -5.00 116.67 114.92 2bxh s ASP 173 Ca 0.00 1.17 -0.01 0.00 -0.52 0.00 0.00 52.55 53.19 2bxh s ASP 173 Cb 0.00 -2.41 -0.00 0.00 -1.46 0.00 0.00 42.92 39.05 2bxh s ASP 173 CO 0.00 -0.13 -0.03 0.11 0.52 0.00 0.00 175.17 175.64 2bxh h LYS 174 N 6.81 0.00 -0.40 4.34 6.56 -1.80 -3.37 116.57 128.71 2bxh h LYS 174 Ca -0.40 0.00 0.08 0.00 -1.06 0.00 0.00 60.65 59.27 2bxh h LYS 174 Cb 1.19 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 32.76 2bxh h LYS 174 CO 0.76 0.00 -0.28 0.00 -2.06 0.00 0.00 179.45 177.87 2bxh h ALA 175 N -1.80 -0.08 0.00 3.86 0.00 -1.94 0.22 119.26 119.53 2bxh h ALA 175 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2bxh h ALA 175 Cb 0.07 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2bxh h ALA 175 CO 0.00 -0.67 0.29 0.00 0.00 0.00 0.00 179.25 178.88 2bxh h ALA 176 N 0.90 1.28 0.00 0.00 0.00 -2.01 -1.42 119.26 118.02 2bxh h ALA 176 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 2bxh h ALA 176 Cb 0.51 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2bxh h ALA 176 CO -0.52 -0.28 -1.35 0.00 0.00 0.00 0.00 179.25 177.10 2bxh h LEU 178 N -1.00 -0.16 -1.15 0.00 5.85 -0.44 -3.28 115.31 115.13 2bxh h LEU 178 Ca -0.20 -0.10 0.12 0.00 0.84 0.00 0.00 57.88 58.54 2bxh h LEU 178 Cb 1.11 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 2bxh h LEU 178 CO -0.12 0.01 0.60 -0.07 -0.34 0.00 0.00 178.44 178.51 2bxh h LEU 179 N -0.32 0.81 -0.98 2.25 3.38 -1.49 -1.28 115.31 117.69 2bxh h LEU 179 Ca -0.02 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 2bxh h LEU 179 Cb 0.25 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2bxh h LEU 179 CO 0.03 0.44 -0.40 -0.65 0.09 0.00 0.00 178.44 177.95 2bxh h PRO 180 N 0.87 0.22 0.00 1.13 0.11 -1.76 -1.30 132.00 131.28 2bxh h PRO 180 Ca 0.46 -0.10 -0.06 0.00 0.11 0.00 0.00 66.00 66.40 2bxh h PRO 180 Cb 0.53 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 2bxh h PRO 180 CO -0.22 0.59 -0.34 0.87 -0.21 0.00 0.00 178.00 178.69 2bxh h LYS 181 N 0.19 0.00 0.04 1.05 6.56 -1.48 -2.97 116.57 119.97 2bxh h LYS 181 Ca 0.02 0.00 -0.25 0.00 -1.06 0.00 0.00 60.65 59.36 2bxh h LYS 181 Cb 0.79 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.43 2bxh h LYS 181 CO 0.06 0.28 -1.20 -0.07 -2.06 0.00 0.00 179.45 176.46 2bxh h LEU 182 N 0.00 0.15 -0.16 2.94 3.38 -1.00 -2.66 115.31 117.96 2bxh h LEU 182 Ca -0.01 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 2bxh h LEU 182 Cb 1.23 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2bxh h LEU 182 CO 0.04 1.14 0.00 0.44 0.09 0.00 0.00 178.44 180.15 2bxh h ASP 183 N 0.03 0.27 -0.86 -0.43 3.32 -1.26 -1.56 116.42 115.93 2bxh h ASP 183 Ca -0.10 -0.31 0.04 0.00 0.02 0.00 0.00 57.03 56.68 2bxh h ASP 183 Cb 1.87 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 41.30 2bxh h ASP 183 CO 0.15 0.52 0.56 -0.33 -1.72 0.00 0.00 179.24 178.41 2bxh h GLU 184 N 0.03 1.01 -0.13 3.56 5.08 -1.57 -2.51 114.58 120.04 2bxh h GLU 184 Ca 0.05 -0.06 -0.22 0.00 -1.00 0.00 0.00 59.36 58.12 2bxh h GLU 184 Cb 0.38 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 29.41 2bxh h GLU 184 CO 0.01 0.67 -0.80 -0.07 -1.00 0.00 0.00 179.01 177.82 2bxh h LEU 185 N 1.04 0.88 0.25 1.33 3.38 -1.35 -2.75 115.31 118.09 2bxh h LEU 185 Ca 0.35 -0.59 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 2bxh h LEU 185 Cb 0.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2bxh h LEU 185 CO -0.11 1.38 -0.20 -0.09 0.09 0.00 0.00 178.44 179.52 2bxh h ARG 186 N 0.49 -0.41 -0.06 1.13 2.43 -0.90 0.03 114.38 117.08 2bxh h ARG 186 Ca -0.06 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.17 2bxh h ARG 186 Cb 1.42 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 31.01 2bxh h ARG 186 CO 0.16 -0.28 -0.50 -0.44 -1.51 0.00 0.00 179.97 177.41 2bxh h ASP 187 N -0.43 -1.55 -1.02 -3.80 3.32 -1.59 0.78 116.42 112.13 2bxh h ASP 187 Ca -0.03 0.18 0.25 0.00 0.02 0.00 0.00 57.03 57.46 2bxh h ASP 187 Cb 0.36 0.60 -0.11 0.00 0.22 0.00 0.00 39.33 40.40 2bxh h ASP 187 CO 0.01 -0.49 0.63 -0.08 -1.72 0.00 0.00 179.24 177.59 2bxh h GLU 188 N -0.60 0.50 0.00 3.56 4.81 -1.52 0.83 114.58 122.15 2bxh h GLU 188 Ca 0.04 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.13 2bxh h GLU 188 Cb 0.69 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.94 2bxh h GLU 188 CO -0.38 0.33 -0.53 0.78 -0.73 0.00 0.00 179.01 178.47 2bxh h GLY 189 N 0.51 0.00 0.91 1.92 0.00 0.10 -0.59 103.07 105.93 2bxh h GLY 189 Ca 0.63 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.81 2bxh h GLY 189 CO -0.41 0.00 -0.48 0.50 0.00 0.00 0.00 176.54 176.15 2bxh h LYS 190 N 0.00 0.57 -0.31 4.80 6.56 0.27 -1.98 116.57 126.48 2bxh h LYS 190 Ca -0.01 -0.43 -0.02 0.00 -1.06 0.00 0.00 60.65 59.14 2bxh h LYS 190 Cb 1.05 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.78 2bxh h LYS 190 CO 0.07 1.05 0.13 0.00 -2.06 0.00 0.00 179.45 178.64 2bxh h ALA 191 N 0.52 0.40 -0.43 3.86 0.00 -0.57 -2.11 119.26 120.93 2bxh h ALA 191 Ca -0.02 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.83 2bxh h ALA 191 Cb 1.11 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 2bxh h ALA 191 CO 0.10 -0.02 0.12 1.03 0.00 0.00 0.00 179.25 180.49 2bxh h SER 192 N 0.35 0.09 -0.52 0.00 0.87 -1.09 -1.38 113.55 111.86 2bxh h SER 192 Ca 0.10 0.06 0.05 0.00 -1.23 0.00 0.00 61.79 60.78 2bxh h SER 192 Cb 0.16 0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.14 2bxh h SER 192 CO -0.01 0.08 0.25 -1.28 -0.53 0.00 0.00 176.83 175.34 2bxh h SER 193 N 0.27 0.34 -0.57 6.23 0.87 -1.13 -1.25 113.55 118.32 2bxh h SER 193 Ca 0.21 0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 60.73 2bxh h SER 193 Cb 0.23 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 2bxh h SER 193 CO -0.24 0.23 0.05 0.00 -0.53 0.00 0.00 176.83 176.34 2bxh h ALA 194 N 1.30 0.76 0.09 6.23 0.00 -0.68 0.12 119.26 127.07 2bxh h ALA 194 Ca 0.24 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2bxh h ALA 194 Cb 0.17 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2bxh h ALA 194 CO -0.18 0.54 -0.04 -0.22 0.00 0.00 0.00 179.25 179.34 2bxh h LYS 195 N 0.85 -0.12 -0.27 0.00 3.64 -1.08 -1.84 116.57 117.75 2bxh h LYS 195 Ca 0.17 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2bxh h LYS 195 Cb 0.47 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 2bxh h LYS 195 CO 0.02 -0.02 -0.03 0.37 -2.27 0.00 0.00 179.45 177.52 2bxh h GLN 196 N -0.19 0.41 -0.48 1.90 5.75 -1.05 -2.30 115.11 119.15 2bxh h GLN 196 Ca -0.01 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.37 2bxh h GLN 196 Cb 0.15 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.62 2bxh h GLN 196 CO 0.02 0.46 0.17 -0.09 -2.65 0.00 0.00 178.83 176.74 2bxh h ARG 197 N 0.40 0.70 -0.48 1.69 9.65 -0.11 -1.22 114.38 124.99 2bxh h ARG 197 Ca 0.09 -0.11 -0.07 0.00 -1.10 0.00 0.00 59.98 58.79 2bxh h ARG 197 Cb 0.31 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.75 2bxh h ARG 197 CO 0.01 0.59 0.02 1.25 2.80 0.00 0.00 179.97 184.64 2bxh h LEU 198 N 0.69 0.82 -0.74 3.80 5.85 -0.89 -1.10 115.31 123.74 2bxh h LEU 198 Ca 0.16 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 2bxh h LEU 198 Cb 0.18 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 2bxh h LEU 198 CO -0.01 0.91 0.46 0.11 -0.34 0.00 0.00 178.44 179.57 2bxh h LYS 199 N 0.70 1.00 -0.04 1.25 1.57 -0.78 0.35 116.57 120.61 2bxh h LYS 199 Ca 0.14 -0.08 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 2bxh h LYS 199 Cb 0.48 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2bxh h LYS 199 CO 0.02 0.70 -0.59 0.00 -0.57 0.00 0.00 179.45 179.01 2bxh h ALA 201 N 1.29 0.41 -0.08 0.00 0.00 -0.67 -0.30 119.26 119.90 2bxh h ALA 201 Ca -0.00 -0.43 0.04 0.00 0.00 0.00 0.00 54.91 54.51 2bxh h ALA 201 Cb 1.07 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 2bxh h ALA 201 CO 0.09 0.47 -0.18 0.77 0.00 0.00 0.00 179.25 180.40 2bxh h SER 202 N 0.45 -0.53 -0.17 0.00 0.02 -0.87 0.23 113.55 112.67 2bxh h SER 202 Ca 0.03 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2bxh h SER 202 Cb 0.93 0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 2bxh h SER 202 CO 0.08 -0.23 0.06 -0.07 -1.14 0.00 0.00 176.83 175.54 2bxh h LEU 203 N -0.25 0.24 -0.30 5.07 3.38 -1.46 -1.12 115.31 120.86 2bxh h LEU 203 Ca 0.08 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.72 2bxh h LEU 203 Cb 0.36 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2bxh h LEU 203 CO -0.22 0.35 -0.75 1.56 0.09 0.00 0.00 178.44 179.47 2bxh h GLN 204 N 0.12 0.00 0.01 1.13 4.20 -0.82 -2.36 115.11 117.38 2bxh h GLN 204 Ca 0.06 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.38 2bxh h GLN 204 Cb 0.19 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.90 2bxh h GLN 204 CO -0.00 0.75 -2.42 1.63 -0.67 0.00 0.00 178.83 178.12 2bxh n LYS 205 N -3.47 0.66 -0.01 1.46 4.01 0.78 -4.68 118.16 116.91 2bxh n LYS 205 Ca -0.00 0.12 0.09 0.00 -0.51 0.00 0.00 58.31 58.01 2bxh n LYS 205 Cb 0.77 -1.53 -0.14 0.00 -0.51 0.00 0.00 35.03 33.62 2bxh n LYS 205 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2bxh n PHE 206 N -3.15 0.00 0.00 2.13 3.72 -0.53 -5.07 117.46 114.56 2bxh n PHE 206 Ca -0.42 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 56.98 2bxh n PHE 206 Cb 1.03 -0.41 0.00 0.00 -0.94 0.00 0.00 39.48 39.16 2bxh n PHE 206 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bxh n GLY 207 N 1.45 2.36 0.37 1.37 0.00 -0.61 -4.50 105.19 105.63 2bxh n GLY 207 Ca -0.03 -1.93 0.07 0.00 0.00 0.00 0.00 46.02 44.13 2bxh n GLY 207 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bxh h GLU 208 N 0.00 0.91 -0.77 1.61 3.07 -1.85 -2.05 114.58 115.51 2bxh h GLU 208 Ca 0.00 -0.05 0.02 0.00 -0.50 0.00 0.00 59.36 58.83 2bxh h GLU 208 Cb 0.00 -0.21 -0.04 0.00 -0.84 0.00 0.00 28.75 27.66 2bxh h GLU 208 CO 0.00 0.60 0.51 -0.09 -1.40 0.00 0.00 179.01 178.63 2bxh h ARG 209 N 0.94 0.95 -0.24 2.33 9.65 -1.95 -0.64 114.38 125.42 2bxh h ARG 209 Ca 0.45 -0.06 -0.14 0.00 -1.10 0.00 0.00 59.98 59.13 2bxh h ARG 209 Cb 0.45 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 28.82 2bxh h ARG 209 CO -0.22 0.63 -0.41 0.00 2.80 0.00 0.00 179.97 182.77 2bxh h ALA 210 N 1.54 0.37 -0.67 2.80 0.00 -1.60 -2.68 119.26 119.01 2bxh h ALA 210 Ca 0.30 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2bxh h ALA 210 Cb -0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2bxh h ALA 210 CO -0.08 0.48 0.20 0.35 0.00 0.00 0.00 179.25 180.21 2bxh h PHE 211 N 0.42 1.09 -0.71 0.00 3.57 -1.25 -2.16 116.94 117.90 2bxh h PHE 211 Ca 0.02 -0.11 -0.04 0.00 3.53 0.00 0.00 57.97 61.37 2bxh h PHE 211 Cb 1.01 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 2bxh h PHE 211 CO 0.08 0.88 0.30 0.87 -2.23 0.00 0.00 178.31 178.22 2bxh h LYS 212 N 0.99 1.04 -0.55 1.11 1.57 -1.14 -0.24 116.57 119.35 2bxh h LYS 212 Ca 0.22 -0.17 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 2bxh h LYS 212 Cb 0.31 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2bxh h LYS 212 CO -0.01 0.83 0.04 0.00 -0.57 0.00 0.00 179.45 179.74 2bxh h ALA 213 N 1.31 1.03 -0.22 3.86 0.00 -1.17 0.88 119.26 124.94 2bxh h ALA 213 Ca 0.24 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2bxh h ALA 213 Cb 0.17 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2bxh h ALA 213 CO -0.02 0.61 0.01 2.35 0.00 0.00 0.00 179.25 182.20 2bxh h TRP 214 N 0.86 0.41 -0.36 0.00 7.01 -0.76 -2.50 115.95 120.62 2bxh h TRP 214 Ca 0.17 -0.07 0.02 0.00 2.11 0.00 0.00 58.89 61.12 2bxh h TRP 214 Cb 0.45 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 2bxh h TRP 214 CO 0.03 0.55 0.21 0.00 -2.79 0.00 0.00 178.44 176.43 2bxh h ALA 215 N 0.82 0.45 -0.17 2.65 0.00 -0.69 0.29 119.26 122.61 2bxh h ALA 215 Ca 0.06 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.99 2bxh h ALA 215 Cb 0.37 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2bxh h ALA 215 CO 0.01 -0.14 0.05 0.28 0.00 0.00 0.00 179.25 179.44 2bxh h VAL 216 N 0.42 0.94 -0.68 0.00 2.07 -0.81 0.30 116.25 118.50 2bxh h VAL 216 Ca 0.14 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.56 2bxh h VAL 216 Cb 0.01 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2bxh h VAL 216 CO -0.07 0.02 0.18 0.00 0.02 0.00 0.00 177.57 177.72 2bxh h ALA 217 N 1.11 0.89 -0.27 1.67 0.00 -1.21 -1.43 119.26 120.02 2bxh h ALA 217 Ca 0.07 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2bxh h ALA 217 Cb 0.06 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2bxh h ALA 217 CO -0.09 0.60 -0.10 -0.09 0.00 0.00 0.00 179.25 179.57 2bxh h ARG 218 N 1.01 0.55 -0.01 0.00 9.65 -0.50 -2.58 114.38 122.51 2bxh h ARG 218 Ca 0.21 -0.23 -0.11 0.00 -1.10 0.00 0.00 59.98 58.75 2bxh h ARG 218 Cb 0.35 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.89 2bxh h ARG 218 CO -0.00 0.78 -0.53 -0.07 2.80 0.00 0.00 179.97 182.95 2bxh h LEU 219 N 0.30 0.02 -0.49 3.80 3.38 -0.37 -2.48 115.31 119.47 2bxh h LEU 219 Ca 0.06 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 2bxh h LEU 219 Cb 0.60 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2bxh h LEU 219 CO 0.03 0.55 -0.19 0.28 0.09 0.00 0.00 178.44 179.21 2bxh h SER 220 N 0.02 1.01 -0.80 -0.43 0.02 -1.23 0.39 113.55 112.52 2bxh h SER 220 Ca -0.00 -0.39 -0.04 0.00 -0.84 0.00 0.00 61.79 60.52 2bxh h SER 220 Cb 0.95 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.18 2bxh h SER 220 CO 0.07 1.17 0.36 1.56 -1.14 0.00 0.00 176.83 178.85 2bxh h GLN 221 N 0.84 1.17 -0.12 3.45 4.20 -1.30 -2.59 115.11 120.77 2bxh h GLN 221 Ca 0.11 -0.19 -0.14 0.00 0.06 0.00 0.00 58.65 58.49 2bxh h GLN 221 Cb 0.77 -0.20 0.01 0.00 0.30 0.00 0.00 27.48 28.35 2bxh h GLN 221 CO 0.06 0.92 -0.48 -0.09 -0.67 0.00 0.00 178.83 178.58 2bxh h ARG 222 N 1.15 0.53 -2.28 1.46 2.43 -1.10 -3.37 114.38 113.19 2bxh h ARG 222 Ca 0.27 -0.41 -0.62 0.00 -0.81 0.00 0.00 59.98 58.40 2bxh h ARG 222 Cb 0.16 0.08 -0.40 0.00 -0.42 0.00 0.00 29.97 29.39 2bxh h ARG 222 CO -0.03 1.04 -0.42 1.19 -1.51 0.00 0.00 179.97 180.24 2bxh n PHE 223 N -4.24 3.63 0.02 2.20 3.72 0.13 -1.53 117.46 121.38 2bxh n PHE 223 Ca -0.08 -3.91 0.16 0.00 -0.05 0.00 0.00 57.45 53.57 2bxh n PHE 223 Cb 0.58 -0.62 0.63 0.00 -0.94 0.00 0.00 39.48 39.12 2bxh n PHE 223 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 2bxh h PRO 224 N 3.93 0.12 -0.02 -1.08 0.11 -1.62 -2.30 132.00 131.13 2bxh h PRO 224 Ca 0.19 -0.01 -0.26 0.00 0.11 0.00 0.00 66.00 66.04 2bxh h PRO 224 Cb 0.60 -0.03 0.02 0.00 0.11 0.00 0.00 31.00 31.70 2bxh h PRO 224 CO 0.89 0.08 -0.99 -0.22 -0.21 0.00 0.00 178.00 177.55 2bxh h LYS 225 N 0.12 0.71 -6.32 1.05 3.64 -1.81 -3.43 116.57 110.54 2bxh h LYS 225 Ca 0.22 -0.74 -0.58 0.00 -1.27 0.00 0.00 60.65 58.28 2bxh h LYS 225 Cb 0.71 0.20 0.18 0.00 -0.41 0.00 0.00 32.23 32.91 2bxh h LYS 225 CO -0.03 1.31 -0.74 0.00 -2.27 0.00 0.00 179.45 177.73 2bxh n ALA 226 N -2.64 -2.10 -1.92 5.00 0.00 -0.87 -4.94 120.51 113.04 2bxh n ALA 226 Ca -0.10 -0.09 -0.34 0.00 0.00 0.00 0.00 53.44 52.90 2bxh n ALA 226 Cb 0.86 -1.65 -0.07 0.00 0.00 0.00 0.00 19.45 18.59 2bxh n ALA 226 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2bxh s GLU 227 N -1.78 4.27 0.54 0.00 0.41 -1.26 -4.89 118.70 115.99 2bxh s GLU 227 Ca 0.63 1.04 0.30 0.00 -0.41 0.00 0.00 54.97 56.52 2bxh s GLU 227 Cb -0.44 -2.47 1.46 0.00 -1.78 0.00 0.00 34.13 30.90 2bxh s GLU 227 CO 0.60 0.14 1.92 0.35 -0.49 0.00 0.00 175.26 177.78 2bxh h PHE 228 N 2.48 0.00 0.00 1.61 3.57 -1.98 0.40 116.94 123.02 2bxh h PHE 228 Ca -0.48 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 60.95 2bxh h PHE 228 Cb 1.18 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 2bxh h PHE 228 CO 0.62 0.00 -0.45 0.00 -2.23 0.00 0.00 178.31 176.25 2bxh h ALA 229 N 1.60 0.77 0.32 2.41 0.00 -1.98 -2.40 119.26 119.98 2bxh h ALA 229 Ca 0.37 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2bxh h ALA 229 Cb 1.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2bxh h ALA 229 CO -0.00 0.38 -0.15 0.93 0.00 0.00 0.00 179.25 180.40 2bxh h GLU 230 N 0.00 -0.41 -0.48 0.00 4.39 -0.61 -2.77 114.58 114.69 2bxh h GLU 230 Ca -0.02 0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.80 2bxh h GLU 230 Cb 1.24 0.09 -0.08 0.00 -0.10 0.00 0.00 28.75 29.90 2bxh h GLU 230 CO 0.04 -0.10 -0.02 0.28 -1.16 0.00 0.00 179.01 178.05 2bxh h VAL 231 N -0.96 0.60 -0.37 3.13 2.07 -1.37 0.22 116.25 119.57 2bxh h VAL 231 Ca -0.04 -0.03 0.11 0.00 0.82 0.00 0.00 66.70 67.55 2bxh h VAL 231 Cb 0.51 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 2bxh h VAL 231 CO 0.07 0.02 0.33 0.28 0.02 0.00 0.00 177.57 178.29 2bxh h SER 232 N 0.09 0.00 0.00 0.57 0.02 -1.46 0.27 113.55 113.05 2bxh h SER 232 Ca 0.24 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.16 2bxh h SER 232 Cb 0.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.90 2bxh h SER 232 CO -0.42 0.00 -0.12 0.50 -1.14 0.00 0.00 176.83 175.66 2bxh h LYS 233 N 0.00 0.07 -0.27 3.45 3.11 -0.31 -2.44 116.57 120.18 2bxh h LYS 233 Ca 0.18 -0.08 0.04 0.00 -2.81 0.00 0.00 60.65 57.97 2bxh h LYS 233 Cb 0.83 0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 32.05 2bxh h LYS 233 CO -0.00 0.88 0.05 -0.07 -2.81 0.00 0.00 179.45 177.50 2bxh h LEU 234 N -0.70 0.00 -0.54 5.20 3.38 0.06 -2.10 115.31 120.61 2bxh h LEU 234 Ca -0.02 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.05 2bxh h LEU 234 Cb 0.92 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 2bxh h LEU 234 CO 0.02 0.04 0.26 0.58 0.09 0.00 0.00 178.44 179.43 2bxh h VAL 235 N 0.15 0.93 -0.87 1.22 2.07 -0.62 0.28 116.25 119.40 2bxh h VAL 235 Ca 0.12 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2bxh h VAL 235 Cb 0.13 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 2bxh h VAL 235 CO -0.17 0.09 0.56 0.74 0.02 0.00 0.00 177.57 178.81 2bxh h THR 236 N 0.50 1.23 0.12 2.57 2.02 -0.99 -0.03 112.91 118.33 2bxh h THR 236 Ca 0.24 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 2bxh h THR 236 Cb 0.17 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.56 2bxh h THR 236 CO -0.18 0.23 -0.06 0.44 0.37 0.00 0.00 175.52 176.32 2bxh h ASP 237 N 1.19 -0.13 -0.90 4.18 3.32 -0.66 -2.77 116.42 120.64 2bxh h ASP 237 Ca 0.32 -0.35 0.18 0.00 0.02 0.00 0.00 57.03 57.19 2bxh h ASP 237 Cb -0.11 0.03 -0.11 0.00 0.22 0.00 0.00 39.33 39.37 2bxh h ASP 237 CO -0.07 0.31 0.46 0.25 -1.72 0.00 0.00 179.24 178.48 2bxh h LEU 238 N -0.61 0.52 -1.60 1.55 5.85 -0.35 0.32 115.31 120.98 2bxh h LEU 238 Ca -0.02 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 2bxh h LEU 238 Cb 0.48 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2bxh h LEU 238 CO 0.03 0.16 -0.15 0.74 -0.34 0.00 0.00 178.44 178.88 2bxh h THR 239 N 0.58 1.13 -0.08 1.05 2.02 -0.93 -1.84 112.91 114.85 2bxh h THR 239 Ca 0.52 -0.61 -0.07 0.00 0.77 0.00 0.00 66.41 67.02 2bxh h THR 239 Cb 0.84 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 2bxh h THR 239 CO -0.42 0.18 -0.22 0.50 0.37 0.00 0.00 175.52 175.93 2bxh h LYS 240 N 0.07 0.29 0.47 6.66 3.11 -0.13 -1.46 116.57 125.58 2bxh h LYS 240 Ca 0.01 -0.21 -0.01 0.00 -2.81 0.00 0.00 60.65 57.64 2bxh h LYS 240 Cb 0.30 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.55 2bxh h LYS 240 CO 0.02 0.82 -0.39 0.28 -2.81 0.00 0.00 179.45 177.37 2bxh h VAL 241 N -0.18 0.21 -0.37 2.00 2.07 -0.93 -1.55 116.25 117.50 2bxh h VAL 241 Ca -0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2bxh h VAL 241 Cb 0.83 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2bxh h VAL 241 CO 0.05 0.00 0.10 0.45 0.02 0.00 0.00 177.57 178.19 2bxh h HIS 242 N -0.85 0.54 -0.51 1.57 3.86 -1.43 -0.36 115.15 117.97 2bxh h HIS 242 Ca -0.05 -0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.09 2bxh h HIS 242 Cb 0.73 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 29.01 2bxh h HIS 242 CO -0.18 0.46 0.12 1.15 0.86 0.00 0.00 177.93 180.35 2bxh h THR 243 N 0.53 1.22 -0.01 2.45 2.02 -1.05 0.26 112.91 118.33 2bxh h THR 243 Ca 0.13 -0.79 -0.09 0.00 0.77 0.00 0.00 66.41 66.43 2bxh h THR 243 Cb 0.18 0.70 0.01 0.00 -1.74 0.00 0.00 68.15 67.30 2bxh h THR 243 CO -0.01 0.29 -0.34 -0.33 0.37 0.00 0.00 175.52 175.51 2bxh h GLU 244 N 0.76 0.25 0.05 6.66 5.08 -0.23 -1.86 114.58 125.29 2bxh h GLU 244 Ca 0.17 -0.25 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2bxh h GLU 244 Cb 0.29 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2bxh h GLU 244 CO -0.00 0.95 -0.06 0.00 -1.00 0.00 0.00 179.01 178.90 2bxh n HIS 247 N -4.07 0.00 -0.14 0.00 -0.00 -0.70 -4.94 115.22 105.38 2bxh n HIS 247 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.69 2bxh n HIS 247 Cb 0.16 -0.30 0.00 0.00 -0.00 0.00 0.00 29.99 29.86 2bxh n HIS 247 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2bxh n GLY 248 N 1.46 0.74 2.90 1.57 0.00 -0.24 -4.99 105.19 106.63 2bxh n GLY 248 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 2bxh n GLY 248 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bxh n ASP 249 N 0.00 5.27 -0.09 1.61 8.00 0.12 -4.79 116.55 126.67 2bxh n ASP 249 Ca 0.00 -3.15 -0.02 0.00 0.71 0.00 0.00 54.79 52.34 2bxh n ASP 249 Cb 0.00 -1.45 0.23 0.00 -0.02 0.00 0.00 41.12 39.88 2bxh n ASP 249 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2bxh h LEU 250 N 7.60 0.68 -0.16 0.64 3.38 -1.86 -2.12 115.31 123.47 2bxh h LEU 250 Ca 0.37 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 2bxh h LEU 250 Cb 0.63 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2bxh h LEU 250 CO 1.58 0.69 0.08 -0.07 0.09 0.00 0.00 178.44 180.80 2bxh h LEU 251 N 0.70 0.22 -0.64 1.67 3.38 -1.91 0.17 115.31 118.90 2bxh h LEU 251 Ca 0.16 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 2bxh h LEU 251 Cb 0.29 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2bxh h LEU 251 CO 0.00 0.28 -0.65 1.05 0.09 0.00 0.00 178.44 179.21 2bxh h GLU 252 N 0.14 0.14 0.03 1.13 9.09 -1.96 -1.08 114.58 122.06 2bxh h GLU 252 Ca 0.06 -0.10 -0.00 0.00 0.05 0.00 0.00 59.36 59.36 2bxh h GLU 252 Cb 0.12 0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.24 2bxh h GLU 252 CO -0.01 0.74 -0.01 0.00 0.05 0.00 0.00 179.01 179.78 2bxh h ALA 254 N 0.90 0.06 -0.04 0.00 0.00 -0.52 0.30 119.26 119.96 2bxh h ALA 254 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2bxh h ALA 254 Cb 0.07 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2bxh h ALA 254 CO 0.01 -0.50 -0.01 0.22 0.00 0.00 0.00 179.25 178.97 2bxh h ASP 255 N -0.02 0.07 -0.36 0.00 3.58 -1.03 -2.42 116.42 116.24 2bxh h ASP 255 Ca 0.06 -0.36 0.03 0.00 0.42 0.00 0.00 57.03 57.18 2bxh h ASP 255 Cb 0.11 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.12 2bxh h ASP 255 CO -0.13 0.41 0.24 0.44 -2.88 0.00 0.00 179.24 177.32 2bxh h ASP 256 N -0.27 0.30 -0.23 2.28 3.32 0.83 0.13 116.42 122.77 2bxh h ASP 256 Ca 0.01 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 2bxh h ASP 256 Cb 0.38 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 2bxh h ASP 256 CO 0.00 0.21 -0.19 -0.09 -1.72 0.00 0.00 179.24 177.46 2bxh h ARG 257 N 0.35 0.68 0.08 3.56 2.43 -0.19 -1.58 114.38 119.71 2bxh h ARG 257 Ca 0.15 -0.25 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2bxh h ARG 257 Cb 0.15 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2bxh h ARG 257 CO -0.03 0.82 -0.04 0.00 -1.51 0.00 0.00 179.97 179.21 2bxh h ALA 258 N 1.19 -0.11 -0.32 2.80 0.00 -0.31 -0.47 119.26 122.05 2bxh h ALA 258 Ca 0.09 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2bxh h ALA 258 Cb 0.65 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 2bxh h ALA 258 CO 0.05 -0.47 -0.12 -0.44 0.00 0.00 0.00 179.25 178.26 2bxh h ASP 259 N -0.28 -0.43 -0.57 0.00 3.32 -0.99 0.74 116.42 118.21 2bxh h ASP 259 Ca -0.01 0.11 0.08 0.00 0.02 0.00 0.00 57.03 57.23 2bxh h ASP 259 Cb 0.24 0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 2bxh h ASP 259 CO 0.02 -0.16 0.38 0.25 -1.72 0.00 0.00 179.24 178.01 2bxh h LEU 260 N -0.06 0.40 -0.10 1.55 5.85 -1.08 1.19 115.31 123.05 2bxh h LEU 260 Ca 0.16 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 2bxh h LEU 260 Cb 0.31 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.26 2bxh h LEU 260 CO -0.37 0.25 -0.24 0.00 -0.34 0.00 0.00 178.44 177.75 2bxh h ALA 261 N 1.70 0.17 -0.58 1.25 0.00 0.65 -1.09 119.26 121.36 2bxh h ALA 261 Ca 0.25 -0.39 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2bxh h ALA 261 Cb 0.41 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2bxh h ALA 261 CO -0.07 0.15 0.33 1.57 0.00 0.00 0.00 179.25 181.23 2bxh h LYS 262 N -0.10 0.63 0.55 0.00 5.09 0.26 -2.70 116.57 120.29 2bxh h LYS 262 Ca -0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 60.65 60.67 2bxh h LYS 262 Cb 0.84 -0.14 0.01 0.00 0.10 0.00 0.00 32.23 33.04 2bxh h LYS 262 CO 0.05 0.41 -0.26 -0.92 -2.09 0.00 0.00 179.45 176.64 2bxh h TYR 263 N 0.64 -0.68 -0.91 0.07 3.20 0.14 -3.24 116.97 116.19 2bxh h TYR 263 Ca 0.24 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.21 2bxh h TYR 263 Cb 0.09 0.23 -0.13 0.00 1.54 0.00 0.00 36.73 38.45 2bxh h TYR 263 CO -0.07 -0.43 -0.48 0.82 -1.64 0.00 0.00 178.16 176.36 2bxh h ILE 264 N -0.78 0.02 -0.57 1.81 2.04 -1.12 0.10 117.51 119.01 2bxh h ILE 264 Ca -0.08 0.00 0.17 0.00 1.00 0.00 0.00 64.86 65.95 2bxh h ILE 264 Cb 0.57 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 2bxh h ILE 264 CO 0.12 0.00 0.46 0.00 0.00 0.00 0.00 178.15 178.73 2bxh h GLU 266 N 0.00 -0.28 -0.56 0.00 5.08 -0.99 -3.19 114.58 114.63 2bxh h GLU 266 Ca 0.27 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2bxh h GLU 266 Cb 1.19 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2bxh h GLU 266 CO -0.00 -0.19 0.00 0.09 -1.00 0.00 0.00 179.01 177.91 2bxh n ASN 267 N -3.77 0.56 -0.37 1.42 4.13 -1.06 -4.29 115.26 111.88 2bxh n ASN 267 Ca -0.04 -1.00 0.31 0.00 1.68 0.00 0.00 54.58 55.54 2bxh n ASN 267 Cb 0.12 -0.25 0.62 0.00 -1.54 0.00 0.00 39.78 38.73 2bxh n ASN 267 CO 0.00 0.00 0.00 -0.61 0.28 0.00 0.00 177.26 176.93 2bxh h GLN 268 N 0.53 0.19 0.00 3.52 4.15 -1.32 -1.77 115.11 120.41 2bxh h GLN 268 Ca 0.00 -0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.28 2bxh h GLN 268 Cb 0.27 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 2bxh h GLN 268 CO 0.00 0.12 -0.60 -0.44 -1.93 0.00 0.00 178.83 175.98 2bxh h ASP 269 N 0.19 0.00 -1.06 -0.69 3.32 -1.82 -2.99 116.42 113.37 2bxh h ASP 269 Ca 0.66 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 57.05 2bxh h ASP 269 Cb 2.09 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 41.32 2bxh h ASP 269 CO -0.24 0.60 0.50 -1.54 -1.72 0.00 0.00 179.24 176.85 2bxh n SER 270 N -3.55 7.04 0.08 6.45 3.41 -0.67 -4.62 113.62 121.75 2bxh n SER 270 Ca -0.00 -3.78 0.00 0.00 -0.26 0.00 0.00 58.87 54.82 2bxh n SER 270 Cb 0.66 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 2bxh n SER 270 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2bxh n ILE 271 N -0.83 0.00 -3.66 -1.33 5.41 -1.20 -4.58 119.36 113.17 2bxh n ILE 271 Ca 0.58 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 64.18 2bxh n ILE 271 Cb 0.68 -0.14 -0.07 0.00 -0.71 0.00 0.00 39.64 39.40 2bxh n ILE 271 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2bxh s SER 272 N -3.44 -0.34 -0.13 4.38 0.15 -1.13 -3.55 113.70 109.64 2bxh s SER 272 Ca 0.00 0.19 0.16 0.00 0.70 0.00 0.00 55.95 57.00 2bxh s SER 272 Cb 0.00 0.41 0.63 0.00 -1.71 0.00 0.00 66.02 65.36 2bxh s SER 272 CO 0.00 -0.58 1.55 -1.54 1.20 0.00 0.00 173.24 173.87 2bxh n SER 273 N 0.85 4.46 -0.13 5.45 3.41 -1.26 -4.21 113.62 122.18 2bxh n SER 273 Ca -0.20 -2.59 0.04 0.00 -0.26 0.00 0.00 58.87 55.87 2bxh n SER 273 Cb 0.58 -0.54 -0.01 0.00 -0.26 0.00 0.00 64.21 63.98 2bxh n SER 273 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2bxh n LYS 274 N 0.59 2.86 -0.02 4.33 4.76 -1.26 -4.46 118.16 124.96 2bxh n LYS 274 Ca 0.23 -0.39 0.05 0.00 -2.87 0.00 0.00 58.31 55.33 2bxh n LYS 274 Cb 0.87 -0.97 0.25 0.00 -1.84 0.00 0.00 35.03 33.34 2bxh n LYS 274 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2bxh n LEU 275 N -0.54 0.33 0.00 -0.35 4.77 -1.26 -4.29 117.00 115.66 2bxh n LEU 275 Ca 0.03 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 2bxh n LEU 275 Cb 0.15 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2bxh n LEU 275 CO 0.11 0.08 0.44 0.29 -1.33 0.00 0.00 177.39 176.98 2bxh n LYS 276 N -0.44 0.00 -0.11 3.23 4.76 -1.26 -1.93 118.16 122.41 2bxh n LYS 276 Ca 0.08 0.56 -0.08 0.00 -2.87 0.00 0.00 58.31 55.99 2bxh n LYS 276 Cb 0.08 -1.38 -0.02 0.00 -1.84 0.00 0.00 35.03 31.87 2bxh n LYS 276 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 2bxh h GLU 277 N 0.00 -0.26 -0.18 1.97 -0.00 -1.95 -3.08 114.58 111.07 2bxh h GLU 277 Ca 0.00 0.02 0.02 0.00 -0.00 0.00 0.00 59.36 59.40 2bxh h GLU 277 Cb 0.00 0.06 -0.03 0.00 -0.00 0.00 0.00 28.75 28.78 2bxh h GLU 277 CO 0.00 -0.18 -0.18 0.00 -0.00 0.00 0.00 179.01 178.66 2bxh n GLU 280 N -2.79 1.98 -4.45 0.00 1.02 -0.87 -4.94 120.64 110.60 2bxh n GLU 280 Ca 0.00 -2.10 -0.22 0.00 -0.02 0.00 0.00 57.16 54.82 2bxh n GLU 280 Cb 0.68 -1.82 -0.09 0.00 -0.02 0.00 0.00 31.44 30.18 2bxh n GLU 280 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2bxh s LYS 281 N -2.38 1.73 0.85 3.49 1.02 -0.57 -5.10 119.74 118.78 2bxh s LYS 281 Ca 0.41 -2.00 -0.11 0.00 0.02 0.00 0.00 55.97 54.29 2bxh s LYS 281 Cb 0.33 -0.64 0.10 0.00 -0.52 0.00 0.00 37.83 37.11 2bxh s LYS 281 CO 0.03 -0.33 1.10 -2.14 -0.92 0.00 0.00 175.35 173.09 2bxh s PRO 282 N -3.84 1.61 0.07 -1.68 0.02 -1.26 -4.62 135.00 125.31 2bxh s PRO 282 Ca 0.31 1.20 -0.14 0.00 0.02 0.00 0.00 61.00 62.39 2bxh s PRO 282 Cb 0.06 -1.82 -0.03 0.00 0.02 0.00 0.00 34.50 32.73 2bxh s PRO 282 CO 0.15 -2.10 1.23 -0.11 -0.33 0.00 0.00 177.00 175.84 2bxh n LEU 283 N -3.84 -0.47 0.07 -5.54 7.94 -1.26 0.47 117.00 114.38 2bxh n LEU 283 Ca 0.09 1.34 -0.12 0.00 -1.11 0.00 0.00 56.01 56.21 2bxh n LEU 283 Cb 0.53 -0.38 -0.06 0.00 0.53 0.00 0.00 43.42 44.05 2bxh n LEU 283 CO 0.53 -0.92 0.79 -0.07 -1.11 0.00 0.00 177.39 176.61 2bxh h LEU 284 N 0.00 -0.32 -2.12 -1.96 3.38 -1.96 -1.45 115.31 110.88 2bxh h LEU 284 Ca 0.07 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2bxh h LEU 284 Cb 0.18 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2bxh h LEU 284 CO -0.42 -0.17 -0.07 -0.08 0.09 0.00 0.00 178.44 177.79 2bxh h GLU 285 N -0.22 0.00 0.31 1.13 4.57 -1.85 -1.64 114.58 116.88 2bxh h GLU 285 Ca 0.02 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.19 2bxh h GLU 285 Cb 0.24 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 2bxh h GLU 285 CO -0.08 0.07 -0.15 0.87 -1.18 0.00 0.00 179.01 178.55 2bxh h LYS 286 N 0.00 -0.40 -0.55 1.92 6.56 0.98 -2.26 116.57 122.82 2bxh h LYS 286 Ca -0.00 0.03 0.01 0.00 -1.06 0.00 0.00 60.65 59.63 2bxh h LYS 286 Cb 0.25 0.09 -0.03 0.00 -0.57 0.00 0.00 32.23 31.97 2bxh h LYS 286 CO 0.01 -0.07 0.36 0.77 -2.06 0.00 0.00 179.45 178.46 2bxh h SER 287 N -0.92 0.61 -0.51 0.86 0.02 -1.07 -2.22 113.55 110.33 2bxh h SER 287 Ca -0.04 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2bxh h SER 287 Cb 0.51 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 2bxh h SER 287 CO 0.07 0.44 0.33 -0.74 -1.14 0.00 0.00 176.83 175.79 2bxh h HIS 288 N 0.73 0.64 -0.52 3.45 6.17 -1.39 -2.02 115.15 122.21 2bxh h HIS 288 Ca 0.21 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.30 2bxh h HIS 288 Cb -0.06 -0.22 -0.03 0.00 2.52 0.00 0.00 27.41 29.62 2bxh h HIS 288 CO -0.04 0.41 0.33 0.00 0.71 0.00 0.00 177.93 179.34 2bxh h ILE 290 N 0.70 0.83 -0.54 0.00 2.04 -1.10 0.33 117.51 119.77 2bxh h ILE 290 Ca 0.19 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.18 2bxh h ILE 290 Cb -0.04 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2bxh h ILE 290 CO -0.04 0.00 0.38 0.00 0.00 0.00 0.00 178.15 178.49 2bxh h ALA 291 N 0.69 2.33 -0.37 1.87 0.00 -1.31 -2.00 119.26 120.46 2bxh h ALA 291 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2bxh h ALA 291 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2bxh h ALA 291 CO 0.00 -0.48 0.00 -0.85 0.00 0.00 0.00 179.25 177.92 2bxh n GLU 292 N -4.42 2.93 -2.10 0.00 0.00 -0.91 -5.01 120.64 111.14 2bxh n GLU 292 Ca 0.10 -2.29 -0.40 0.00 0.00 0.00 0.00 57.16 54.57 2bxh n GLU 292 Cb 0.52 -1.44 -0.01 0.00 0.00 0.00 0.00 31.44 30.52 2bxh n GLU 292 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2bxh s VAL 293 N -1.40 2.70 0.74 3.84 0.11 0.06 -4.98 120.40 121.47 2bxh s VAL 293 Ca 0.30 0.66 -0.11 0.00 -2.93 0.00 0.00 61.98 59.90 2bxh s VAL 293 Cb 0.18 -3.40 0.03 0.00 -1.53 0.00 0.00 36.38 31.67 2bxh s VAL 293 CO 0.16 0.12 1.08 -1.83 -3.33 0.00 0.00 175.10 171.30 2bxh s GLU 294 N -2.06 2.56 0.40 1.54 -1.05 -1.26 -4.97 118.70 113.86 2bxh s GLU 294 Ca 0.53 1.08 -0.27 0.00 -0.15 0.00 0.00 54.97 56.17 2bxh s GLU 294 Cb -0.38 -1.94 -0.10 0.00 -0.44 0.00 0.00 34.13 31.27 2bxh s GLU 294 CO 0.50 -1.40 1.41 0.09 0.95 0.00 0.00 175.26 176.80 2bxh n ASN 295 N -3.33 3.29 -4.85 0.83 3.02 -1.26 -4.90 115.26 108.06 2bxh n ASN 295 Ca 0.08 1.17 -0.30 0.00 -0.03 0.00 0.00 54.58 55.50 2bxh n ASN 295 Cb 0.53 -1.58 0.06 0.00 -0.61 0.00 0.00 39.78 38.18 2bxh n ASN 295 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2bxh s ASP 296 N -0.33 5.24 0.82 6.41 2.15 -0.58 -5.01 116.67 125.35 2bxh s ASP 296 Ca 0.57 1.31 -0.12 0.00 0.43 0.00 0.00 52.55 54.75 2bxh s ASP 296 Cb -0.48 -2.14 0.09 0.00 -0.30 0.00 0.00 42.92 40.08 2bxh s ASP 296 CO 0.61 -1.49 1.15 -1.61 -0.17 0.00 0.00 175.17 173.65 2bxh s GLU 297 N -5.21 1.71 -0.03 4.34 0.41 -1.26 -4.78 118.70 113.87 2bxh s GLU 297 Ca 0.59 1.52 -0.20 0.00 -0.41 0.00 0.00 54.97 56.46 2bxh s GLU 297 Cb -0.13 -1.81 -0.05 0.00 -1.78 0.00 0.00 34.13 30.37 2bxh s GLU 297 CO 0.53 -2.11 0.59 1.41 -0.49 0.00 0.00 175.26 175.19 2bxh s MET 298 N -4.46 4.33 0.06 1.61 1.75 -1.26 -4.59 119.30 116.75 2bxh s MET 298 Ca 0.68 0.70 -0.37 0.00 -1.25 0.00 0.00 55.69 55.45 2bxh s MET 298 Cb -0.23 -3.37 -0.18 0.00 2.84 0.00 0.00 34.83 33.88 2bxh s MET 298 CO 0.53 0.29 1.07 -2.30 -0.65 0.00 0.00 175.02 173.95 2bxh n PRO 299 N 3.05 0.37 0.00 4.11 -0.02 -1.26 -4.90 135.00 136.36 2bxh n PRO 299 Ca -0.06 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2bxh n PRO 299 Cb 0.51 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 2bxh n PRO 299 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bxh n ALA 300 N 1.52 -0.03 -2.50 3.55 0.00 -1.26 -4.42 120.51 117.37 2bxh n ALA 300 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.20 2bxh n ALA 300 Cb 0.14 0.27 -0.08 0.00 0.00 0.00 0.00 19.45 19.78 2bxh n ALA 300 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bxh s ASP 301 N -2.83 6.23 -0.18 0.00 1.01 -1.26 -5.05 116.67 114.59 2bxh s ASP 301 Ca 0.00 -0.56 0.01 0.00 0.71 0.00 0.00 52.55 52.71 2bxh s ASP 301 Cb 0.00 -2.25 0.02 0.00 1.01 0.00 0.00 42.92 41.70 2bxh s ASP 301 CO 0.00 -0.62 -0.19 -0.76 0.21 0.00 0.00 175.17 173.81 2bxh s LEU 302 N 2.31 2.11 0.77 1.23 1.43 -1.26 -5.11 118.68 120.16 2bxh s LEU 302 Ca 0.15 -0.66 -0.15 0.00 -1.03 0.00 0.00 54.13 52.45 2bxh s LEU 302 Cb -0.16 -1.43 0.05 0.00 0.03 0.00 0.00 46.19 44.68 2bxh s LEU 302 CO 0.15 -0.02 1.15 -0.81 0.23 0.00 0.00 176.35 177.05 2bxh n PRO 303 N 4.64 0.37 -0.75 1.29 -0.04 -1.26 -4.95 135.00 134.30 2bxh n PRO 303 Ca -0.20 0.20 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 2bxh n PRO 303 Cb 0.50 -2.40 0.19 0.00 -0.04 0.00 0.00 33.50 31.75 2bxh n PRO 303 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2bxh s SER 304 N -1.91 2.33 -0.04 3.54 0.15 -1.26 -4.96 113.70 111.56 2bxh s SER 304 Ca 0.74 1.80 0.02 0.00 0.70 0.00 0.00 55.95 59.21 2bxh s SER 304 Cb -0.31 -2.40 -0.26 0.00 -1.71 0.00 0.00 66.02 61.34 2bxh s SER 304 CO 0.49 -3.41 0.69 -0.07 1.20 0.00 0.00 173.24 172.15 2bxh h LEU 305 N -2.08 0.25 -1.98 3.45 3.38 -1.99 -3.30 115.31 113.05 2bxh h LEU 305 Ca -0.51 -0.45 0.01 0.00 0.09 0.00 0.00 57.88 57.02 2bxh h LEU 305 Cb 1.29 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 2bxh h LEU 305 CO 0.47 1.39 0.35 0.00 0.09 0.00 0.00 178.44 180.74 2bxh h ALA 306 N 0.57 1.41 0.00 1.53 0.00 -1.95 -2.74 119.26 118.09 2bxh h ALA 306 Ca -0.29 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2bxh h ALA 306 Cb 2.01 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.80 2bxh h ALA 306 CO 0.12 -0.37 -0.00 0.00 0.00 0.00 0.00 179.25 179.00 2bxh h ALA 307 N 1.34 -0.74 -0.02 0.00 0.00 -1.95 0.83 119.26 118.72 2bxh h ALA 307 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bxh h ALA 307 Cb 0.71 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2bxh h ALA 307 CO -0.00 -0.74 -0.22 -0.25 0.00 0.00 0.00 179.25 178.04 2bxh n ASP 308 N -2.27 1.86 -0.01 0.00 10.43 -1.17 -1.82 116.55 123.57 2bxh n ASP 308 Ca -0.00 -1.45 0.02 0.00 2.57 0.00 0.00 54.79 55.93 2bxh n ASP 308 Cb 0.00 0.18 -0.05 0.00 1.84 0.00 0.00 41.12 43.10 2bxh n ASP 308 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 2bxh n PHE 309 N 0.14 0.00 -0.01 1.24 3.72 -1.04 -4.68 117.46 116.83 2bxh n PHE 309 Ca 0.13 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.51 2bxh n PHE 309 Cb 0.44 -0.17 -0.01 0.00 -0.94 0.00 0.00 39.48 38.81 2bxh n PHE 309 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2bxh n VAL 310 N -1.80 0.14 0.07 -4.37 0.31 -0.53 -4.88 118.33 107.26 2bxh n VAL 310 Ca -0.03 -0.02 -0.21 0.00 -0.01 0.00 0.00 64.34 64.07 2bxh n VAL 310 Cb 0.25 -1.53 -0.14 0.00 -0.91 0.00 0.00 33.84 31.51 2bxh n VAL 310 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2bxh h GLU 311 N -0.07 0.42 -6.10 5.55 5.08 0.52 -3.46 114.58 116.52 2bxh h GLU 311 Ca -0.05 -0.65 -0.49 0.00 -1.00 0.00 0.00 59.36 57.16 2bxh h GLU 311 Cb 1.02 0.23 0.25 0.00 0.50 0.00 0.00 28.75 30.76 2bxh h GLU 311 CO -0.03 1.30 -2.39 0.45 -1.00 0.00 0.00 179.01 177.34 2bxh n SER 312 N -3.99 -3.30 -0.04 1.42 2.88 -0.76 -4.92 113.62 104.91 2bxh n SER 312 Ca -0.14 0.01 0.05 0.00 -1.33 0.00 0.00 58.87 57.46 2bxh n SER 312 Cb 0.89 -0.60 -0.05 0.00 -0.75 0.00 0.00 64.21 63.71 2bxh n SER 312 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2bxh n LYS 313 N 1.85 3.51 -0.26 -1.46 0.00 -1.26 -4.50 118.16 116.05 2bxh n LYS 313 Ca -0.02 -0.11 0.07 0.00 -0.00 0.00 0.00 58.31 58.26 2bxh n LYS 313 Cb 0.71 -0.98 0.21 0.00 -0.00 0.00 0.00 35.03 34.98 2bxh n LYS 313 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2bxh n ASP 314 N -1.06 2.61 0.04 -5.58 9.92 -1.26 -4.57 116.55 116.65 2bxh n ASP 314 Ca 0.02 -2.03 -0.08 0.00 -0.53 0.00 0.00 54.79 52.17 2bxh n ASP 314 Cb 0.16 -0.33 -0.05 0.00 -0.64 0.00 0.00 41.12 40.26 2bxh n ASP 314 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2bxh h VAL 315 N 2.77 0.00 -0.03 2.53 2.07 -1.88 0.41 116.25 122.12 2bxh h VAL 315 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2bxh h VAL 315 Cb 0.67 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2bxh h VAL 315 CO 0.01 0.00 0.03 0.00 0.02 0.00 0.00 177.57 177.64 2bxh h LYS 317 N 0.00 0.04 -0.59 0.00 2.10 -1.61 -1.99 116.57 114.51 2bxh h LYS 317 Ca 0.01 -0.04 -0.08 0.00 -2.00 0.00 0.00 60.65 58.54 2bxh h LYS 317 Cb 0.08 0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.39 2bxh h LYS 317 CO -0.00 0.85 0.07 -0.91 -2.00 0.00 0.00 179.45 177.46 2bxh h ASN 318 N -0.76 0.94 -0.81 7.07 2.35 0.23 0.16 115.58 124.76 2bxh h ASN 318 Ca -0.01 -0.23 0.01 0.00 -0.55 0.00 0.00 56.30 55.52 2bxh h ASN 318 Cb 0.87 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.95 2bxh h ASN 318 CO 0.01 0.96 0.53 0.22 -1.65 0.00 0.00 177.43 177.51 2bxh h TYR 319 N 0.92 1.02 -0.03 1.19 3.20 -0.54 -1.91 116.97 120.81 2bxh h TYR 319 Ca 0.18 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 61.88 2bxh h TYR 319 Cb 0.44 -0.34 0.01 0.00 1.54 0.00 0.00 36.73 38.38 2bxh h TYR 319 CO 0.03 0.64 -0.74 0.00 -1.64 0.00 0.00 178.16 176.45 2bxh h ALA 320 N 1.49 0.13 -0.52 1.82 0.00 -0.53 -1.77 119.26 119.89 2bxh h ALA 320 Ca 0.30 -0.60 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 2bxh h ALA 320 Cb -0.12 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2bxh h ALA 320 CO -0.06 0.49 -0.05 1.05 0.00 0.00 0.00 179.25 180.68 2bxh h GLU 321 N 0.16 0.91 -1.20 0.00 -0.00 -0.52 -3.38 114.58 110.55 2bxh h GLU 321 Ca -0.08 -0.29 -0.37 0.00 -0.00 0.00 0.00 59.36 58.62 2bxh h GLU 321 Cb 1.42 -0.08 -0.26 0.00 -0.00 0.00 0.00 28.75 29.82 2bxh h GLU 321 CO 0.15 0.94 -0.76 0.00 -0.00 0.00 0.00 179.01 179.34 2bxh n ALA 322 N -2.48 0.35 -0.10 1.06 0.00 -0.74 -5.03 120.51 113.57 2bxh n ALA 322 Ca 0.02 -2.20 -0.11 0.00 0.00 0.00 0.00 53.44 51.15 2bxh n ALA 322 Cb 0.35 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.63 2bxh n ALA 322 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2bxh h LYS 323 N 4.49 -0.36 -0.14 0.00 3.64 -1.48 0.20 116.57 122.92 2bxh h LYS 323 Ca 0.03 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.47 2bxh h LYS 323 Cb 0.98 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.84 2bxh h LYS 323 CO 0.31 -0.24 -0.11 -0.44 -2.27 0.00 0.00 179.45 176.71 2bxh h ASP 324 N -0.37 -0.34 -0.46 4.20 5.19 -1.94 0.85 116.42 123.54 2bxh h ASP 324 Ca 0.12 0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 56.60 2bxh h ASP 324 Cb 0.59 0.18 -0.02 0.00 0.18 0.00 0.00 39.33 40.26 2bxh h ASP 324 CO -0.54 -0.14 0.28 0.58 -3.12 0.00 0.00 179.24 176.29 2bxh h VAL 325 N -0.12 1.15 -0.66 -1.35 2.07 -1.85 0.10 116.25 115.59 2bxh h VAL 325 Ca 0.09 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 2bxh h VAL 325 Cb 0.25 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2bxh h VAL 325 CO -0.21 0.15 0.36 0.15 0.02 0.00 0.00 177.57 178.03 2bxh h PHE 326 N 0.61 0.92 -0.07 1.57 3.04 -0.04 -0.85 116.94 122.11 2bxh h PHE 326 Ca 0.16 -0.03 -0.12 0.00 3.98 0.00 0.00 57.97 61.97 2bxh h PHE 326 Cb -0.00 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 38.20 2bxh h PHE 326 CO -0.03 0.66 -0.48 -0.07 -2.02 0.00 0.00 178.31 176.37 2bxh h LEU 327 N 0.91 0.20 -0.48 0.59 3.38 -0.64 -2.12 115.31 117.14 2bxh h LEU 327 Ca 0.23 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 2bxh h LEU 327 Cb 0.05 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2bxh h LEU 327 CO -0.04 0.65 0.05 1.23 0.09 0.00 0.00 178.44 180.42 2bxh h GLY 328 N 1.35 0.88 1.99 0.83 0.00 -0.18 -1.62 103.07 106.32 2bxh h GLY 328 Ca 0.01 -0.62 -0.10 0.00 0.00 0.00 0.00 47.33 46.63 2bxh h GLY 328 CO 0.07 0.57 -0.45 -0.33 0.00 0.00 0.00 176.54 176.40 2bxh h MET 329 N 0.69 0.01 -0.28 4.80 2.86 -0.97 -0.33 114.93 121.70 2bxh h MET 329 Ca 0.14 -0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.65 2bxh h MET 329 Cb 0.44 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 2bxh h MET 329 CO 0.02 0.46 -0.35 0.35 1.06 0.00 0.00 176.91 178.45 2bxh h PHE 330 N 0.01 0.89 0.36 -0.22 3.57 -1.12 -0.53 116.94 119.90 2bxh h PHE 330 Ca -0.00 -0.28 -0.02 0.00 3.53 0.00 0.00 57.97 61.20 2bxh h PHE 330 Cb 0.80 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.36 2bxh h PHE 330 CO 0.00 1.05 -0.17 1.25 -2.23 0.00 0.00 178.31 178.21 2bxh h LEU 331 N 0.47 -0.41 -0.64 0.59 5.85 -1.04 0.13 115.31 120.25 2bxh h LEU 331 Ca 0.04 -0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.79 2bxh h LEU 331 Cb 0.93 0.11 -0.12 0.00 0.37 0.00 0.00 40.66 41.95 2bxh h LEU 331 CO 0.08 -0.13 -0.13 0.22 -0.34 0.00 0.00 178.44 178.14 2bxh h TYR 332 N -0.69 -0.29 -0.38 1.25 3.20 -1.07 1.10 116.97 120.10 2bxh h TYR 332 Ca -0.05 0.06 -0.14 0.00 3.14 0.00 0.00 58.73 61.74 2bxh h TYR 332 Cb 0.48 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 2bxh h TYR 332 CO -0.00 -0.26 -0.32 0.93 -1.64 0.00 0.00 178.16 176.86 2bxh h GLU 333 N 0.02 0.85 -0.12 1.82 4.39 -0.98 -0.27 114.58 120.28 2bxh h GLU 333 Ca 0.31 -0.40 -0.23 0.00 0.34 0.00 0.00 59.36 59.38 2bxh h GLU 333 Cb 0.49 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2bxh h GLU 333 CO -0.64 1.04 -0.84 -0.92 -1.16 0.00 0.00 179.01 176.49 2bxh h TYR 334 N 0.71 1.07 0.22 4.33 5.03 -0.09 -3.25 116.97 124.98 2bxh h TYR 334 Ca 0.07 -0.50 -0.01 0.00 2.58 0.00 0.00 58.73 60.87 2bxh h TYR 334 Cb 0.88 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 39.01 2bxh h TYR 334 CO 0.05 1.34 -0.10 0.00 -1.32 0.00 0.00 178.16 178.12 2bxh h ALA 335 N 0.51 -0.29 -0.48 1.82 0.00 0.13 -2.99 119.26 117.95 2bxh h ALA 335 Ca -0.07 -0.13 0.14 0.00 0.00 0.00 0.00 54.91 54.85 2bxh h ALA 335 Cb 1.47 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 2bxh h ALA 335 CO 0.17 -0.58 0.45 0.07 0.00 0.00 0.00 179.25 179.37 2bxh h ARG 336 N -0.47 0.00 -0.49 0.00 0.11 -1.13 -0.86 114.38 111.55 2bxh h ARG 336 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2bxh h ARG 336 Cb 0.35 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.43 2bxh h ARG 336 CO 0.05 0.00 0.00 2.89 0.10 0.00 0.00 179.97 183.01 2bxh n ARG 337 N -3.88 3.24 -3.19 0.08 1.85 -1.14 -4.62 116.66 109.00 2bxh n ARG 337 Ca 0.09 -2.61 -0.21 0.00 -1.00 0.00 0.00 57.85 54.12 2bxh n ARG 337 Cb 0.65 -1.67 -0.05 0.00 -1.05 0.00 0.00 32.46 30.35 2bxh n ARG 337 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2bxh n HIS 338 N 0.65 0.25 0.63 2.89 8.25 -0.33 -4.88 115.22 122.69 2bxh n HIS 338 Ca 0.20 -3.75 0.06 0.00 -0.26 0.00 0.00 57.72 53.98 2bxh n HIS 338 Cb 0.73 -0.40 0.32 0.00 1.12 0.00 0.00 29.99 31.76 2bxh n HIS 338 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2bxh n PRO 339 N 0.67 0.22 0.00 -0.41 -0.04 -1.26 -1.41 135.00 132.77 2bxh n PRO 339 Ca 0.24 0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.96 2bxh n PRO 339 Cb 0.60 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.91 2bxh n PRO 339 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2bxh n ASP 340 N -1.22 1.32 -4.95 3.54 5.75 -1.26 -4.82 116.55 114.91 2bxh n ASP 340 Ca 0.07 -1.13 -0.21 0.00 -0.01 0.00 0.00 54.79 53.50 2bxh n ASP 340 Cb 0.09 0.14 -0.02 0.00 -1.03 0.00 0.00 41.12 40.29 2bxh n ASP 340 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2bxh s TYR 341 N -2.37 3.40 0.42 2.11 1.51 -0.50 -4.34 117.35 117.56 2bxh s TYR 341 Ca 0.27 -0.03 -0.10 0.00 -1.01 0.00 0.00 57.07 56.20 2bxh s TYR 341 Cb 0.20 -1.54 -0.06 0.00 -0.11 0.00 0.00 41.96 40.44 2bxh s TYR 341 CO 0.48 0.45 0.77 -1.54 -1.11 0.00 0.00 175.55 174.61 2bxh s SER 342 N -3.94 6.48 0.19 2.29 1.04 -1.26 -4.38 113.70 114.12 2bxh s SER 342 Ca 0.34 1.11 -0.11 0.00 0.48 0.00 0.00 55.95 57.77 2bxh s SER 342 Cb -0.09 -2.32 0.12 0.00 0.10 0.00 0.00 66.02 63.84 2bxh s SER 342 CO 0.28 -0.43 1.82 0.58 0.98 0.00 0.00 173.24 176.48 2bxh h VAL 343 N 0.97 1.20 -0.46 5.02 2.07 -1.90 -1.51 116.25 121.63 2bxh h VAL 343 Ca -0.47 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 2bxh h VAL 343 Cb 1.19 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 2bxh h VAL 343 CO 0.64 0.22 0.14 -0.37 0.02 0.00 0.00 177.57 178.21 2bxh h VAL 344 N 0.93 1.19 -0.36 2.57 -1.51 -1.93 -0.78 116.25 116.36 2bxh h VAL 344 Ca 0.24 -0.65 -0.01 0.00 -1.23 0.00 0.00 66.70 65.05 2bxh h VAL 344 Cb -0.00 0.69 -0.02 0.00 -2.13 0.00 0.00 31.29 29.84 2bxh h VAL 344 CO -0.04 0.24 0.17 0.25 -1.23 0.00 0.00 177.57 176.96 2bxh h LEU 345 N 0.66 0.47 -0.39 4.19 5.85 -1.76 -0.84 115.31 123.50 2bxh h LEU 345 Ca 0.15 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2bxh h LEU 345 Cb 0.21 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2bxh h LEU 345 CO -0.01 0.46 0.20 -0.07 -0.34 0.00 0.00 178.44 178.69 2bxh h LEU 346 N 0.44 0.30 -1.51 2.25 3.38 -0.76 0.21 115.31 119.62 2bxh h LEU 346 Ca 0.12 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 2bxh h LEU 346 Cb 0.12 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2bxh h LEU 346 CO -0.02 0.22 -0.25 -0.07 0.09 0.00 0.00 178.44 178.42 2bxh h LEU 347 N 0.41 0.00 -0.17 1.67 3.38 -0.95 -0.50 115.31 119.14 2bxh h LEU 347 Ca 0.16 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 2bxh h LEU 347 Cb 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2bxh h LEU 347 CO -0.11 0.25 -0.16 -0.09 0.09 0.00 0.00 178.44 178.42 2bxh h ARG 348 N 0.00 0.41 -0.40 1.13 2.43 -0.17 -1.72 114.38 116.07 2bxh h ARG 348 Ca -0.00 -0.21 0.03 0.00 -0.81 0.00 0.00 59.98 58.99 2bxh h ARG 348 Cb 0.44 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 2bxh h ARG 348 CO 0.03 0.77 0.18 -0.07 -1.51 0.00 0.00 179.97 179.38 2bxh h LEU 349 N 0.07 0.25 -1.73 3.80 3.38 -0.48 -1.46 115.31 119.14 2bxh h LEU 349 Ca 0.03 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2bxh h LEU 349 Cb 0.69 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2bxh h LEU 349 CO 0.04 0.19 0.11 0.00 0.09 0.00 0.00 178.44 178.87 2bxh h ALA 350 N 1.22 1.79 -0.10 1.53 0.00 -1.00 -1.40 119.26 121.31 2bxh h ALA 350 Ca 0.17 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 2bxh h ALA 350 Cb 0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2bxh h ALA 350 CO -0.14 0.18 -0.73 -0.22 0.00 0.00 0.00 179.25 178.35 2bxh h LYS 351 N 0.29 0.48 -0.37 0.00 1.63 -0.35 -1.68 116.57 116.57 2bxh h LYS 351 Ca 0.08 -0.38 -0.10 0.00 -0.85 0.00 0.00 60.65 59.39 2bxh h LYS 351 Cb 0.02 0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.71 2bxh h LYS 351 CO -0.01 1.02 -0.18 1.15 -3.45 0.00 0.00 179.45 177.98 2bxh h THR 352 N 0.33 1.26 0.20 1.00 2.02 -0.55 -1.28 112.91 115.89 2bxh h THR 352 Ca -0.03 -1.23 -0.01 0.00 0.77 0.00 0.00 66.41 65.90 2bxh h THR 352 Cb 1.31 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 68.89 2bxh h THR 352 CO 0.13 0.41 -0.10 0.22 0.37 0.00 0.00 175.52 176.55 2bxh h TYR 353 N 0.61 -0.25 -0.63 3.16 3.20 -1.22 -1.36 116.97 120.49 2bxh h TYR 353 Ca 0.10 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.09 2bxh h TYR 353 Cb 0.65 0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.90 2bxh h TYR 353 CO 0.03 0.11 0.08 1.49 -1.64 0.00 0.00 178.16 178.23 2bxh h GLU 354 N -0.67 0.18 -0.93 1.82 4.81 -1.20 -0.65 114.58 117.95 2bxh h GLU 354 Ca -0.03 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2bxh h GLU 354 Cb 0.47 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.77 2bxh h GLU 354 CO 0.04 0.12 0.53 1.15 -0.73 0.00 0.00 179.01 180.13 2bxh h THR 355 N 0.19 1.26 -0.31 0.32 2.02 -1.11 -1.23 112.91 114.04 2bxh h THR 355 Ca 0.34 -0.60 -0.10 0.00 0.77 0.00 0.00 66.41 66.81 2bxh h THR 355 Cb 0.54 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 2bxh h THR 355 CO -0.48 0.28 -0.24 0.74 0.37 0.00 0.00 175.52 176.19 2bxh h THR 356 N 1.29 1.27 -0.33 3.16 2.02 -0.02 -2.88 112.91 117.41 2bxh h THR 356 Ca 0.33 -1.30 -0.08 0.00 0.77 0.00 0.00 66.41 66.14 2bxh h THR 356 Cb -0.02 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 2bxh h THR 356 CO -0.06 0.42 -0.09 -0.07 0.37 0.00 0.00 175.52 176.09 2bxh h LEU 357 N 0.53 0.65 -0.16 2.58 3.38 -0.52 0.14 115.31 121.90 2bxh h LEU 357 Ca 0.08 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.72 2bxh h LEU 357 Cb 0.69 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 2bxh h LEU 357 CO 0.05 0.87 -0.24 -0.33 0.09 0.00 0.00 178.44 178.88 2bxh h GLU 358 N 0.42 -0.28 0.49 1.13 4.39 -1.13 0.15 114.58 119.75 2bxh h GLU 358 Ca 0.08 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.78 2bxh h GLU 358 Cb 0.59 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 2bxh h GLU 358 CO 0.03 -0.19 -0.23 1.57 -1.16 0.00 0.00 179.01 179.03 2bxh h LYS 359 N -0.29 -0.63 -0.82 2.33 -0.00 -1.46 -3.31 116.57 112.39 2bxh h LYS 359 Ca 0.11 0.04 0.17 0.00 -0.00 0.00 0.00 60.65 60.98 2bxh h LYS 359 Cb 0.46 0.14 -0.11 0.00 -0.00 0.00 0.00 32.23 32.72 2bxh h LYS 359 CO -0.33 -0.36 0.33 0.00 -0.00 0.00 0.00 179.45 179.10 2bxh n ALA 362 N -1.53 2.61 -1.00 0.00 0.00 -0.55 -4.94 120.51 115.10 2bxh n ALA 362 Ca 0.02 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2bxh n ALA 362 Cb 0.13 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.69 2bxh n ALA 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bxh n ALA 363 N -2.25 0.00 -0.09 0.00 0.00 -0.60 -5.00 120.51 112.58 2bxh n ALA 363 Ca -0.04 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.17 2bxh n ALA 363 Cb 0.59 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.92 2bxh n ALA 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bxh n ALA 364 N -3.00 0.99 -3.71 0.00 0.00 -1.26 -4.67 120.51 108.87 2bxh n ALA 364 Ca 0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 53.44 52.43 2bxh n ALA 364 Cb 0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 19.45 18.97 2bxh n ALA 364 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2bxh n ASP 365 N -3.99 3.36 -0.12 0.00 5.68 -1.26 -4.99 116.55 115.23 2bxh n ASP 365 Ca -0.39 -3.31 -0.04 0.00 -0.50 0.00 0.00 54.79 50.55 2bxh n ASP 365 Cb 0.86 -0.73 -0.03 0.00 -1.14 0.00 0.00 41.12 40.08 2bxh n ASP 365 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 2bxh h PRO 366 N 4.91 -0.02 -1.40 0.11 0.11 -1.83 -1.08 132.00 132.81 2bxh h PRO 366 Ca 0.17 0.00 0.47 0.00 0.11 0.00 0.00 66.00 66.75 2bxh h PRO 366 Cb 0.72 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 31.70 2bxh h PRO 366 CO 0.77 -0.01 0.91 1.25 -0.21 0.00 0.00 178.00 180.71 2bxh h HIS 367 N -0.02 0.48 0.00 0.65 2.76 -1.94 0.67 115.15 117.76 2bxh h HIS 367 Ca 0.05 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 2bxh h HIS 367 Cb 0.14 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 28.99 2bxh h HIS 367 CO -0.93 -0.24 -0.38 1.49 -1.30 0.00 0.00 177.93 176.58 2bxh h GLU 368 N 0.04 0.00 0.06 5.26 4.81 -1.63 -2.93 114.58 120.20 2bxh h GLU 368 Ca 0.86 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.86 2bxh h GLU 368 Cb 2.80 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 32.16 2bxh h GLU 368 CO -0.42 0.00 -1.25 0.00 -0.73 0.00 0.00 179.01 176.61 2bxh n TYR 370 N -4.14 1.10 0.20 0.00 0.18 -0.76 -4.31 117.16 109.43 2bxh n TYR 370 Ca -0.26 -0.41 0.06 0.00 1.88 0.00 0.00 57.90 59.16 2bxh n TYR 370 Cb 0.79 -0.25 0.39 0.00 -0.38 0.00 0.00 39.34 39.89 2bxh n TYR 370 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2bxh h ALA 371 N 3.47 1.10 -0.50 -3.48 0.00 -1.66 -3.23 119.26 114.96 2bxh h ALA 371 Ca 0.00 -0.32 -0.34 0.00 0.00 0.00 0.00 54.91 54.25 2bxh h ALA 371 Cb 1.18 -0.06 -0.24 0.00 0.00 0.00 0.00 17.79 18.68 2bxh h ALA 371 CO 0.21 0.44 -0.43 1.63 0.00 0.00 0.00 179.25 181.10 2bxh n LYS 372 N -3.66 2.64 0.13 0.00 5.02 -1.26 -4.77 118.16 116.25 2bxh n LYS 372 Ca -0.01 -3.67 0.03 0.00 -2.02 0.00 0.00 58.31 52.64 2bxh n LYS 372 Cb 0.46 -2.01 0.41 0.00 -0.02 0.00 0.00 35.03 33.86 2bxh n LYS 372 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 2bxh h VAL 373 N 1.52 1.17 0.00 -0.18 3.04 -1.86 -1.99 116.25 117.95 2bxh h VAL 373 Ca 0.27 -0.76 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 2bxh h VAL 373 Cb 1.37 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 31.88 2bxh h VAL 373 CO 0.56 0.23 0.00 -0.26 -1.01 0.00 0.00 177.57 177.10 2bxh h PHE 374 N 0.19 0.00 0.00 3.17 -1.00 -1.89 -1.49 116.94 115.93 2bxh h PHE 374 Ca 0.04 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.73 2bxh h PHE 374 Cb 0.37 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 2bxh h PHE 374 CO 0.00 0.00 -0.44 -0.44 -1.61 0.00 0.00 178.31 175.82 2bxh h ASP 375 N 0.00 0.00 1.64 2.17 5.19 -1.74 -2.78 116.42 120.91 2bxh h ASP 375 Ca 0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2bxh h ASP 375 Cb 0.42 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.93 2bxh h ASP 375 CO 0.00 0.44 -0.02 -0.33 -3.12 0.00 0.00 179.24 176.21 2bxh h GLU 376 N 0.00 0.00 0.00 3.56 5.08 -1.37 -2.81 114.58 119.05 2bxh h GLU 376 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bxh h GLU 376 Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2bxh h GLU 376 CO 0.06 0.02 0.00 0.74 -1.00 0.00 0.00 179.01 178.83 2bxh h PHE 377 N 0.00 0.00 0.56 4.33 0.04 -1.49 -3.31 116.94 117.06 2bxh h PHE 377 Ca -0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2bxh h PHE 377 Cb 0.85 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.98 2bxh h PHE 377 CO 0.00 0.00 -0.51 0.87 -0.60 0.00 0.00 178.31 178.07 2bxh h LYS 378 N 0.00 -1.01 -0.81 1.51 6.56 -1.55 -1.61 116.57 119.66 2bxh h LYS 378 Ca 0.00 0.07 0.01 0.00 -1.06 0.00 0.00 60.65 59.66 2bxh h LYS 378 Cb 0.61 0.23 -0.04 0.00 -0.57 0.00 0.00 32.23 32.46 2bxh h LYS 378 CO 0.00 -0.68 0.53 -1.35 -2.06 0.00 0.00 179.45 175.89 2bxh h PRO 379 N -1.05 1.07 -0.46 3.15 0.11 -1.77 -2.72 132.00 130.34 2bxh h PRO 379 Ca -0.07 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.90 2bxh h PRO 379 Cb 0.90 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 2bxh h PRO 379 CO -0.03 0.72 -0.02 -0.07 -0.21 0.00 0.00 178.00 178.39 2bxh h LEU 380 N 1.10 0.73 -0.33 2.35 3.38 -1.65 -2.74 115.31 118.16 2bxh h LEU 380 Ca 0.30 -0.18 -0.19 0.00 0.09 0.00 0.00 57.88 57.90 2bxh h LEU 380 Cb -0.11 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2bxh h LEU 380 CO -0.06 0.81 -0.84 0.58 0.09 0.00 0.00 178.44 179.02 2bxh h VAL 381 N 0.71 1.49 0.00 1.22 2.07 -1.02 -3.35 116.25 117.37 2bxh h VAL 381 Ca 0.14 -2.56 -0.03 0.00 0.82 0.00 0.00 66.70 65.06 2bxh h VAL 381 Cb 0.46 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 2bxh h VAL 381 CO 0.02 0.75 -0.79 1.05 0.02 0.00 0.00 177.57 178.61 2bxh h GLU 382 N 0.11 0.00 0.13 1.57 4.11 -1.36 -3.21 114.58 115.93 2bxh h GLU 382 Ca -0.04 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.39 2bxh h GLU 382 Cb 1.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.71 2bxh h GLU 382 CO 0.13 0.09 -0.06 1.49 0.07 0.00 0.00 179.01 180.72 2bxh h GLU 383 N 0.00 -0.17 -0.40 1.06 4.22 -1.62 0.22 114.58 117.89 2bxh h GLU 383 Ca -0.03 0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.41 2bxh h GLU 383 Cb 1.12 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 2bxh h GLU 383 CO 0.01 -0.11 0.18 -1.35 -2.18 0.00 0.00 179.01 175.56 2bxh h PRO 384 N -0.18 0.55 -0.06 0.92 0.11 -1.74 0.10 132.00 131.72 2bxh h PRO 384 Ca -0.02 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 2bxh h PRO 384 Cb 0.14 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 2bxh h PRO 384 CO 0.03 0.44 0.01 1.96 -0.21 0.00 0.00 178.00 180.23 2bxh h GLN 385 N 0.56 0.09 -0.17 1.05 4.20 -1.36 -1.92 115.11 117.56 2bxh h GLN 385 Ca 0.14 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.75 2bxh h GLN 385 Cb 0.08 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2bxh h GLN 385 CO -0.02 0.31 -0.22 -0.91 -0.67 0.00 0.00 178.83 177.32 2bxh h ASN 386 N -0.14 0.28 0.02 1.46 2.35 0.03 -1.54 115.58 118.04 2bxh h ASN 386 Ca 0.02 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2bxh h ASN 386 Cb 0.26 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2bxh h ASN 386 CO 0.00 0.52 -0.01 0.25 -1.65 0.00 0.00 177.43 176.54 2bxh h LEU 387 N 0.27 -0.02 -0.72 1.61 5.85 -0.85 -0.75 115.31 120.70 2bxh h LEU 387 Ca 0.04 -0.24 -0.08 0.00 0.84 0.00 0.00 57.88 58.45 2bxh h LEU 387 Cb 0.55 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 2bxh h LEU 387 CO 0.04 0.23 0.10 0.40 -0.34 0.00 0.00 178.44 178.86 2bxh h ILE 388 N -0.27 1.26 0.27 4.05 1.08 -1.24 -1.46 117.51 121.20 2bxh h ILE 388 Ca -0.00 -1.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.42 2bxh h ILE 388 Cb 0.26 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 34.67 2bxh h ILE 388 CO 0.00 0.39 -0.13 0.50 -0.69 0.00 0.00 178.15 178.22 2bxh h LYS 389 N 1.01 -0.35 -0.92 2.37 1.63 -1.25 -1.15 116.57 117.90 2bxh h LYS 389 Ca 0.20 0.02 0.01 0.00 -0.85 0.00 0.00 60.65 60.03 2bxh h LYS 389 Cb 0.44 0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 32.11 2bxh h LYS 389 CO 0.01 -0.14 0.60 0.37 -3.45 0.00 0.00 179.45 176.84 2bxh h GLN 390 N -0.50 1.22 0.00 1.90 4.15 -1.05 -2.03 115.11 118.81 2bxh h GLN 390 Ca -0.04 -0.08 -0.09 0.00 0.77 0.00 0.00 58.65 59.21 2bxh h GLN 390 Cb 0.37 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 2bxh h GLN 390 CO 0.06 0.82 -0.58 -0.91 -1.93 0.00 0.00 178.83 176.29 2bxh h ASN 391 N 1.26 0.00 0.67 -0.69 2.35 -1.26 -3.01 115.58 114.89 2bxh h ASN 391 Ca 0.34 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.87 2bxh h ASN 391 Cb -0.13 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 2bxh h ASN 391 CO -0.07 0.42 -0.97 0.00 -1.65 0.00 0.00 177.43 175.16 2bxh h GLU 393 N 0.08 -0.86 -0.67 0.00 -0.00 -1.43 0.35 114.58 112.05 2bxh h GLU 393 Ca -0.06 0.06 0.14 0.00 -0.00 0.00 0.00 59.36 59.50 2bxh h GLU 393 Cb 1.65 0.20 -0.10 0.00 -0.00 0.00 0.00 28.75 30.49 2bxh h GLU 393 CO 0.15 -0.55 0.11 1.25 -0.00 0.00 0.00 179.01 179.97 2bxh h LEU 394 N -1.00 -0.08 -0.47 3.06 5.85 -1.53 -1.04 115.31 120.10 2bxh h LEU 394 Ca -0.09 0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.78 2bxh h LEU 394 Cb 0.71 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 2bxh h LEU 394 CO 0.15 -0.05 0.30 0.15 -0.34 0.00 0.00 178.44 178.65 2bxh h PHE 395 N 0.22 0.57 -0.06 1.25 3.57 -0.87 -2.44 116.94 119.18 2bxh h PHE 395 Ca 0.36 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.87 2bxh h PHE 395 Cb 0.59 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.14 2bxh h PHE 395 CO -0.29 0.35 0.02 0.93 -2.23 0.00 0.00 178.31 177.08 2bxh h GLU 396 N 0.61 0.08 -0.54 1.11 5.08 0.40 -0.07 114.58 121.24 2bxh h GLU 396 Ca 0.18 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2bxh h GLU 396 Cb -0.05 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2bxh h GLU 396 CO -0.05 0.08 0.00 0.00 -1.00 0.00 0.00 179.01 178.03 2bxh n GLN 397 N -4.50 2.60 0.00 2.33 10.64 -0.95 -4.45 117.38 123.05 2bxh n GLN 397 Ca -0.02 -2.41 0.00 0.00 -1.83 0.00 0.00 57.00 52.74 2bxh n GLN 397 Cb 0.11 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 27.99 2bxh n GLN 397 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2bxh n LEU 398 N 1.41 0.21 0.00 2.61 4.77 -0.95 -5.09 117.00 119.96 2bxh n LEU 398 Ca 0.20 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2bxh n LEU 398 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2bxh n LEU 398 CO 0.15 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 2bxh n GLY 399 N 2.46 -0.32 0.28 -0.72 0.00 -0.07 -3.88 105.19 102.94 2bxh n GLY 399 Ca 0.00 -1.66 0.07 0.00 0.00 0.00 0.00 46.02 44.43 2bxh n GLY 399 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2bxh h GLU 400 N 0.00 0.33 0.05 1.61 4.81 -1.93 -1.18 114.58 118.28 2bxh h GLU 400 Ca 0.00 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2bxh h GLU 400 Cb 0.00 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.31 2bxh h GLU 400 CO 0.00 0.22 -0.02 -0.92 -0.73 0.00 0.00 179.01 177.55 2bxh h TYR 401 N 0.34 -0.06 0.00 0.92 3.20 -1.96 -1.43 116.97 117.97 2bxh h TYR 401 Ca 0.44 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.25 2bxh h TYR 401 Cb 0.73 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.02 2bxh h TYR 401 CO -0.22 0.25 -0.24 0.87 -1.64 0.00 0.00 178.16 177.19 2bxh h LYS 402 N -0.38 0.00 -0.23 1.82 6.56 -1.63 -2.47 116.57 120.23 2bxh h LYS 402 Ca -0.01 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.48 2bxh h LYS 402 Cb 0.34 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.00 2bxh h LYS 402 CO 0.01 0.24 -0.26 0.35 -2.06 0.00 0.00 179.45 177.73 2bxh h PHE 403 N 0.00 0.71 -0.80 -1.35 3.57 -1.10 -2.04 116.94 115.93 2bxh h PHE 403 Ca -0.00 -0.22 0.03 0.00 3.53 0.00 0.00 57.97 61.31 2bxh h PHE 403 Cb 0.55 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 2bxh h PHE 403 CO 0.00 0.93 0.51 1.96 -2.23 0.00 0.00 178.31 179.48 2bxh h GLN 404 N 0.29 0.98 -0.73 1.11 4.20 -0.94 -0.66 115.11 119.36 2bxh h GLN 404 Ca 0.03 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 2bxh h GLN 404 Cb 0.82 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 2bxh h GLN 404 CO 0.06 0.65 0.30 -0.91 -0.67 0.00 0.00 178.83 178.26 2bxh h ASN 405 N 1.01 1.00 -0.07 1.46 2.35 -1.36 0.23 115.58 120.21 2bxh h ASN 405 Ca 0.31 -0.17 -0.07 0.00 -0.55 0.00 0.00 56.30 55.83 2bxh h ASN 405 Cb -0.02 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.08 2bxh h ASN 405 CO -0.10 0.89 -0.15 0.00 -1.65 0.00 0.00 177.43 176.42 2bxh h ALA 406 N 1.14 1.30 0.00 -0.83 0.00 -0.71 -2.39 119.26 117.78 2bxh h ALA 406 Ca 0.24 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 2bxh h ALA 406 Cb 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2bxh h ALA 406 CO -0.02 0.47 -0.66 -0.07 0.00 0.00 0.00 179.25 178.97 2bxh h LEU 407 N 0.38 0.00 -0.54 0.00 3.38 -0.28 -1.93 115.31 116.31 2bxh h LEU 407 Ca 0.07 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 2bxh h LEU 407 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2bxh h LEU 407 CO 0.03 0.66 -0.31 -0.07 0.09 0.00 0.00 178.44 178.84 2bxh h LEU 408 N 0.00 0.88 -0.23 1.67 3.38 -0.09 -0.98 115.31 119.93 2bxh h LEU 408 Ca -0.01 -0.36 -0.19 0.00 0.09 0.00 0.00 57.88 57.41 2bxh h LEU 408 Cb 1.26 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2bxh h LEU 408 CO 0.09 1.12 -0.58 0.58 0.09 0.00 0.00 178.44 179.73 2bxh h VAL 409 N 0.71 1.29 0.03 1.22 2.07 -1.43 -2.16 116.25 117.97 2bxh h VAL 409 Ca 0.08 -1.78 0.01 0.00 0.82 0.00 0.00 66.70 65.83 2bxh h VAL 409 Cb 0.87 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 2bxh h VAL 409 CO 0.08 0.57 -0.06 -0.09 0.02 0.00 0.00 177.57 178.09 2bxh h ARG 410 N 0.56 -0.11 0.00 1.57 2.43 -1.19 -2.67 114.38 114.97 2bxh h ARG 410 Ca -0.01 0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 59.00 2bxh h ARG 410 Cb 1.20 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 2bxh h ARG 410 CO 0.13 -0.08 -0.80 1.88 -1.51 0.00 0.00 179.97 179.59 2bxh h TYR 411 N -0.12 0.00 -0.33 2.20 -1.99 -1.22 -2.93 116.97 112.59 2bxh h TYR 411 Ca 0.02 -0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.62 2bxh h TYR 411 Cb 0.13 -0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.85 2bxh h TYR 411 CO -0.12 0.80 -0.30 1.15 -0.00 0.00 0.00 178.16 179.69 2bxh h THR 412 N 0.00 1.28 -0.36 -2.88 2.02 -1.38 -1.04 112.91 110.55 2bxh h THR 412 Ca -0.01 -1.43 -0.08 0.00 0.77 0.00 0.00 66.41 65.66 2bxh h THR 412 Cb 1.41 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 69.16 2bxh h THR 412 CO 0.10 0.47 -0.11 0.11 0.37 0.00 0.00 175.52 176.46 2bxh h LYS 413 N 0.59 0.62 -0.18 6.66 1.57 -1.48 0.55 116.57 124.91 2bxh h LYS 413 Ca 0.07 -0.19 -0.12 0.00 -1.87 0.00 0.00 60.65 58.54 2bxh h LYS 413 Cb 0.81 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.06 2bxh h LYS 413 CO 0.07 0.72 -0.35 0.87 -0.57 0.00 0.00 179.45 180.19 2bxh h LYS 414 N 0.57 0.55 -2.06 3.15 1.57 -1.25 -1.91 116.57 117.19 2bxh h LYS 414 Ca 0.10 -0.35 -0.54 0.00 -1.87 0.00 0.00 60.65 57.99 2bxh h LYS 414 Cb 0.53 0.04 -0.40 0.00 0.08 0.00 0.00 32.23 32.48 2bxh h LYS 414 CO 0.03 0.96 -1.02 1.33 -0.57 0.00 0.00 179.45 180.19 2bxh n VAL 415 N -4.31 0.30 -0.32 0.50 0.24 -0.43 -3.97 118.33 110.33 2bxh n VAL 415 Ca -0.06 -4.53 0.34 0.00 -2.04 0.00 0.00 64.34 58.05 2bxh n VAL 415 Cb 0.50 -1.37 0.73 0.00 -1.47 0.00 0.00 33.84 32.24 2bxh n VAL 415 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2bxh h PRO 416 N 3.59 0.03 0.00 7.34 0.11 -1.08 -1.91 132.00 140.08 2bxh h PRO 416 Ca 0.10 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 2bxh h PRO 416 Cb 0.84 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2bxh h PRO 416 CO 0.56 0.02 0.00 1.96 -0.21 0.00 0.00 178.00 180.33 2bxh h GLN 417 N 0.03 0.00 -6.76 1.05 7.50 -1.91 -3.46 115.11 111.56 2bxh h GLN 417 Ca 0.56 0.00 -0.53 0.00 0.50 0.00 0.00 58.65 59.19 2bxh h GLN 417 Cb 2.19 0.00 0.06 0.00 0.05 0.00 0.00 27.48 29.78 2bxh h GLN 417 CO -0.03 0.00 0.76 0.08 -1.50 0.00 0.00 178.83 178.13 2bxh s VAL 418 N -3.31 2.64 0.24 -0.54 1.01 -0.72 -4.87 120.40 114.85 2bxh s VAL 418 Ca 0.06 0.54 -0.30 0.00 0.00 0.00 0.00 61.98 62.28 2bxh s VAL 418 Cb 0.09 -3.35 -0.15 0.00 0.00 0.00 0.00 36.38 32.98 2bxh s VAL 418 CO 0.52 0.09 1.05 -1.54 0.00 0.00 0.00 175.10 175.22 2bxh n SER 419 N 2.21 1.22 -0.31 3.32 3.41 -1.26 -4.71 113.62 117.49 2bxh n SER 419 Ca 0.06 1.16 0.07 0.00 -0.26 0.00 0.00 58.87 59.90 2bxh n SER 419 Cb 0.40 -1.25 0.27 0.00 -0.26 0.00 0.00 64.21 63.37 2bxh n SER 419 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2bxh h THR 420 N 2.20 0.97 -0.55 6.66 2.02 -1.94 -1.01 112.91 121.27 2bxh h THR 420 Ca -0.40 -0.33 -0.09 0.00 0.77 0.00 0.00 66.41 66.36 2bxh h THR 420 Cb 1.34 -0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 2bxh h THR 420 CO 0.64 0.17 -0.03 -0.65 0.37 0.00 0.00 175.52 176.03 2bxh h PRO 421 N 0.95 0.97 -0.53 6.66 0.11 -1.98 -0.43 132.00 137.75 2bxh h PRO 421 Ca 0.43 -0.31 -0.05 0.00 0.11 0.00 0.00 66.00 66.19 2bxh h PRO 421 Cb 0.39 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.39 2bxh h PRO 421 CO -0.19 0.97 0.14 1.15 -0.21 0.00 0.00 178.00 179.86 2bxh h THR 422 N 0.89 1.24 -0.51 -1.15 2.02 -1.71 -0.56 112.91 113.13 2bxh h THR 422 Ca 0.16 -0.85 -0.10 0.00 0.77 0.00 0.00 66.41 66.39 2bxh h THR 422 Cb 0.56 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2bxh h THR 422 CO 0.03 0.31 -0.09 -0.07 0.37 0.00 0.00 175.52 176.07 2bxh h LEU 423 N 0.74 0.92 -0.21 2.58 3.38 -1.01 -0.19 115.31 121.51 2bxh h LEU 423 Ca 0.17 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2bxh h LEU 423 Cb 0.32 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2bxh h LEU 423 CO 0.00 1.03 0.02 0.58 0.09 0.00 0.00 178.44 180.15 2bxh h VAL 424 N 0.83 1.24 0.01 1.22 2.07 -0.84 -1.14 116.25 119.65 2bxh h VAL 424 Ca 0.14 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 2bxh h VAL 424 Cb 0.62 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2bxh h VAL 424 CO 0.04 0.25 -0.01 -0.08 0.02 0.00 0.00 177.57 177.80 2bxh h GLU 425 N 0.14 -0.02 -0.65 1.57 4.57 -1.02 -2.39 114.58 116.78 2bxh h GLU 425 Ca 0.06 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.28 2bxh h GLU 425 Cb 0.36 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.91 2bxh h GLU 425 CO 0.01 0.23 0.40 0.28 -1.18 0.00 0.00 179.01 178.75 2bxh h VAL 426 N -0.26 1.06 -0.42 0.32 2.07 -1.05 -1.84 116.25 116.13 2bxh h VAL 426 Ca -0.00 -0.27 -0.14 0.00 0.82 0.00 0.00 66.70 67.11 2bxh h VAL 426 Cb 0.26 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2bxh h VAL 426 CO 0.00 0.14 -0.28 0.28 0.02 0.00 0.00 177.57 177.73 2bxh h SER 427 N 0.77 0.95 -0.33 0.57 0.02 -1.20 0.69 113.55 115.02 2bxh h SER 427 Ca 0.27 -0.38 -0.05 0.00 -0.84 0.00 0.00 61.79 60.78 2bxh h SER 427 Cb 0.05 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 2bxh h SER 427 CO -0.12 1.16 0.03 0.03 -1.14 0.00 0.00 176.83 176.79 2bxh h ARG 428 N 0.77 0.66 -0.39 3.45 3.08 -1.22 0.48 114.38 121.21 2bxh h ARG 428 Ca 0.09 -0.15 -0.14 0.00 0.07 0.00 0.00 59.98 59.85 2bxh h ARG 428 Cb 0.85 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 2bxh h ARG 428 CO 0.08 0.66 -0.33 -0.91 -1.07 0.00 0.00 179.97 178.39 2bxh h ASN 429 N 0.63 0.92 0.22 7.04 2.35 -0.84 -1.98 115.58 123.93 2bxh h ASN 429 Ca 0.13 -0.39 -0.02 0.00 -0.55 0.00 0.00 56.30 55.47 2bxh h ASN 429 Cb 0.35 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 2bxh h ASN 429 CO 0.01 1.17 -0.11 -0.07 -1.65 0.00 0.00 177.43 176.78 2bxh h LEU 430 N 0.73 0.00 -0.37 1.61 3.38 -0.18 -1.82 115.31 118.66 2bxh h LEU 430 Ca 0.07 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.86 2bxh h LEU 430 Cb 0.90 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2bxh h LEU 430 CO 0.08 0.11 -0.81 1.23 0.09 0.00 0.00 178.44 179.14 2bxh h GLY 431 N 0.55 0.19 2.00 0.83 0.00 -0.31 -3.09 103.07 103.24 2bxh h GLY 431 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2bxh h GLY 431 CO 0.01 0.28 0.00 0.50 0.00 0.00 0.00 176.54 177.33 2bxh h LYS 432 N 0.10 0.00 -0.33 4.80 1.57 -0.62 -2.44 116.57 119.65 2bxh h LYS 432 Ca -0.03 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2bxh h LYS 432 Cb 1.41 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.71 2bxh h LYS 432 CO 0.12 0.00 0.07 0.28 -0.57 0.00 0.00 179.45 179.35 2bxh h VAL 433 N 0.00 1.16 -0.27 0.50 2.07 -1.45 -0.27 116.25 118.00 2bxh h VAL 433 Ca 0.00 -0.59 -0.08 0.00 0.82 0.00 0.00 66.70 66.84 2bxh h VAL 433 Cb 0.51 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2bxh h VAL 433 CO 0.00 0.21 -0.19 1.23 0.02 0.00 0.00 177.57 178.84 2bxh h GLY 434 N 0.73 0.52 0.24 2.17 0.00 -1.58 -0.73 103.07 104.42 2bxh h GLY 434 Ca 0.11 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 2bxh h GLY 434 CO -0.00 0.36 -0.02 1.76 0.00 0.00 0.00 176.54 178.64 2bxh h SER 435 N 0.44 -0.04 0.09 0.19 0.02 -1.40 -1.72 113.55 111.13 2bxh h SER 435 Ca 0.07 -0.66 -0.01 0.00 -0.84 0.00 0.00 61.79 60.35 2bxh h SER 435 Cb 0.58 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 2bxh h SER 435 CO 0.04 0.68 -0.05 0.50 -1.14 0.00 0.00 176.83 176.86 2bxh h LYS 436 N -0.80 0.00 0.00 3.45 3.64 -1.07 -3.39 116.57 118.39 2bxh h LYS 436 Ca -0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2bxh h LYS 436 Cb 0.69 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.51 2bxh h LYS 436 CO 0.01 0.05 -1.11 0.00 -2.27 0.00 0.00 179.45 176.13 2bxh h LYS 439 N 0.00 0.75 -6.69 0.00 1.57 -1.78 -3.45 116.57 106.96 2bxh h LYS 439 Ca 0.00 -0.53 -0.54 0.00 -1.87 0.00 0.00 60.65 57.70 2bxh h LYS 439 Cb 0.05 0.09 0.21 0.00 0.08 0.00 0.00 32.23 32.66 2bxh h LYS 439 CO 0.00 1.16 -0.62 0.72 -0.57 0.00 0.00 179.45 180.14 2bxh n HIS 440 N -4.07 -1.54 -2.98 -1.35 8.25 -0.76 -4.96 115.22 107.79 2bxh n HIS 440 Ca -0.06 0.25 -0.36 0.00 -0.26 0.00 0.00 57.72 57.29 2bxh n HIS 440 Cb 0.64 -1.80 -0.06 0.00 1.12 0.00 0.00 29.99 29.89 2bxh n HIS 440 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 2bxh s PRO 441 N -3.25 4.33 0.11 -0.41 0.02 -1.26 -4.69 135.00 129.85 2bxh s PRO 441 Ca 0.58 1.01 0.06 0.00 0.02 0.00 0.00 61.00 62.67 2bxh s PRO 441 Cb -0.25 -2.77 0.39 0.00 0.02 0.00 0.00 34.50 31.89 2bxh s PRO 441 CO 0.66 0.31 0.47 0.39 -0.33 0.00 0.00 177.00 178.49 2bxh n GLU 442 N 0.49 -0.02 0.27 5.54 1.02 -1.26 0.20 120.64 126.88 2bxh n GLU 442 Ca 0.00 0.41 0.09 0.00 -0.02 0.00 0.00 57.16 57.65 2bxh n GLU 442 Cb 0.51 -0.73 0.69 0.00 -0.02 0.00 0.00 31.44 31.89 2bxh n GLU 442 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bxh h ALA 443 N 0.59 1.87 -0.00 0.62 0.00 -1.94 -3.08 119.26 117.31 2bxh h ALA 443 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2bxh h ALA 443 Cb 0.65 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2bxh h ALA 443 CO -0.23 0.02 -0.24 1.63 0.00 0.00 0.00 179.25 180.43 2bxh n LYS 444 N -4.37 2.62 -0.05 0.00 4.01 0.55 -4.43 118.16 116.49 2bxh n LYS 444 Ca -0.03 -0.44 -0.10 0.00 -0.51 0.00 0.00 58.31 57.23 2bxh n LYS 444 Cb 0.10 -1.02 -0.04 0.00 -0.51 0.00 0.00 35.03 33.57 2bxh n LYS 444 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2bxh h ARG 445 N 0.77 0.28 -0.61 1.97 3.08 -1.42 -3.02 114.38 115.43 2bxh h ARG 445 Ca 0.00 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2bxh h ARG 445 Cb 0.28 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2bxh h ARG 445 CO 0.00 0.26 0.32 1.98 -1.07 0.00 0.00 179.97 181.45 2bxh h MET 446 N 0.22 0.86 -0.02 0.04 4.05 -1.81 0.34 114.93 118.62 2bxh h MET 446 Ca 0.07 -0.11 -0.15 0.00 -0.28 0.00 0.00 59.70 59.22 2bxh h MET 446 Cb 0.06 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 30.68 2bxh h MET 446 CO -0.01 0.67 -0.70 -1.00 0.23 0.00 0.00 176.91 176.11 2bxh h PRO 447 N 0.83 0.09 0.81 0.39 0.13 -1.76 -2.05 132.00 130.44 2bxh h PRO 447 Ca 0.21 -0.07 -0.04 0.00 -0.87 0.00 0.00 66.00 65.23 2bxh h PRO 447 Cb 0.08 0.02 0.01 0.00 0.13 0.00 0.00 31.00 31.23 2bxh h PRO 447 CO -0.03 0.75 -0.39 0.00 -0.23 0.00 0.00 178.00 178.10 2bxh h ALA 449 N -1.36 -1.05 -0.45 0.00 0.00 -0.36 -2.61 119.26 113.44 2bxh h ALA 449 Ca -0.11 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 2bxh h ALA 449 Cb 0.83 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2bxh h ALA 449 CO 0.18 -1.04 -0.00 1.49 0.00 0.00 0.00 179.25 179.88 2bxh h GLU 450 N -1.14 0.75 -0.04 0.00 4.81 -1.55 0.23 114.58 117.63 2bxh h GLU 450 Ca -0.11 -0.20 -0.14 0.00 -0.13 0.00 0.00 59.36 58.78 2bxh h GLU 450 Cb 0.82 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2bxh h GLU 450 CO 0.18 0.76 -0.63 -0.44 -0.73 0.00 0.00 179.01 178.14 2bxh h ASP 451 N 0.70 0.16 -0.23 1.04 3.32 -1.66 -0.56 116.42 119.20 2bxh h ASP 451 Ca 0.14 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 2bxh h ASP 451 Cb 0.44 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 2bxh h ASP 451 CO 0.02 0.75 -0.21 0.22 -1.72 0.00 0.00 179.24 178.29 2bxh h TYR 452 N 0.10 0.65 -0.45 4.55 -0.00 -1.04 -2.42 116.97 118.36 2bxh h TYR 452 Ca -0.01 -0.19 0.08 0.00 -0.00 0.00 0.00 58.73 58.61 2bxh h TYR 452 Cb 1.14 -0.14 -0.02 0.00 -0.00 0.00 0.00 36.73 37.70 2bxh h TYR 452 CO 0.01 0.88 0.31 -0.07 -0.00 0.00 0.00 178.16 179.29 2bxh h LEU 453 N 0.24 0.24 -0.62 2.82 3.38 -0.29 -0.77 115.31 120.31 2bxh h LEU 453 Ca 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2bxh h LEU 453 Cb 0.76 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 2bxh h LEU 453 CO 0.05 0.15 0.12 0.28 0.09 0.00 0.00 178.44 179.14 2bxh h SER 454 N 0.27 0.97 0.03 -0.43 0.02 -0.64 -0.65 113.55 113.12 2bxh h SER 454 Ca 0.20 -0.25 -0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2bxh h SER 454 Cb 0.45 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2bxh h SER 454 CO -0.04 0.97 -0.01 0.58 -1.14 0.00 0.00 176.83 177.19 2bxh h VAL 455 N 0.93 1.11 -0.60 2.27 2.07 -0.75 -1.61 116.25 119.66 2bxh h VAL 455 Ca 0.19 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 2bxh h VAL 455 Cb 0.40 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 2bxh h VAL 455 CO 0.01 0.10 0.24 0.58 0.02 0.00 0.00 177.57 178.53 2bxh h VAL 456 N -0.21 1.23 0.00 2.57 2.07 -1.23 -2.34 116.25 118.34 2bxh h VAL 456 Ca -0.00 -0.71 -0.07 0.00 0.82 0.00 0.00 66.70 66.74 2bxh h VAL 456 Cb 0.20 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2bxh h VAL 456 CO 0.01 0.28 -0.32 -0.07 0.02 0.00 0.00 177.57 177.49 2bxh h LEU 457 N 0.83 0.00 -1.16 2.57 3.38 -1.12 -1.10 115.31 118.72 2bxh h LEU 457 Ca 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2bxh h LEU 457 Cb 0.20 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2bxh h LEU 457 CO -0.02 0.32 0.29 -1.13 0.09 0.00 0.00 178.44 177.99 2bxh h ASN 458 N 0.00 0.79 0.26 -0.43 -1.24 -0.75 0.03 115.58 114.24 2bxh h ASN 458 Ca -0.00 -0.08 0.01 0.00 0.71 0.00 0.00 56.30 56.93 2bxh h ASN 458 Cb 0.56 -0.20 -0.03 0.00 0.73 0.00 0.00 38.32 39.38 2bxh h ASN 458 CO 0.04 0.68 -0.33 1.56 -1.29 0.00 0.00 177.43 178.09 2bxh h GLN 459 N 0.88 -0.62 -0.95 6.67 4.20 -0.92 0.95 115.11 125.32 2bxh h GLN 459 Ca 0.22 0.04 0.15 0.00 0.06 0.00 0.00 58.65 59.12 2bxh h GLN 459 Cb 0.10 0.14 -0.10 0.00 0.30 0.00 0.00 27.48 27.92 2bxh h GLN 459 CO -0.03 -0.41 0.56 1.25 -0.67 0.00 0.00 178.83 179.53 2bxh h LEU 460 N -0.64 0.75 -0.47 1.46 5.85 -1.19 0.20 115.31 121.27 2bxh h LEU 460 Ca -0.00 0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.67 2bxh h LEU 460 Cb 0.61 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 2bxh h LEU 460 CO -0.10 0.33 -0.21 0.00 -0.34 0.00 0.00 178.44 178.12 2bxh h VAL 462 N 0.82 1.35 0.32 0.00 -1.51 0.02 -2.05 116.25 115.20 2bxh h VAL 462 Ca 0.11 -2.09 -0.02 0.00 -1.23 0.00 0.00 66.70 63.47 2bxh h VAL 462 Cb 0.78 2.41 0.00 0.00 -2.13 0.00 0.00 31.29 32.35 2bxh h VAL 462 CO 0.07 0.63 -0.15 -0.07 -1.23 0.00 0.00 177.57 176.81 2bxh h LEU 463 N 0.17 -0.36 -1.37 4.19 3.38 -0.65 -2.48 115.31 118.19 2bxh h LEU 463 Ca -0.09 0.01 0.17 0.00 0.09 0.00 0.00 57.88 58.07 2bxh h LEU 463 Cb 1.44 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 42.21 2bxh h LEU 463 CO 0.15 -0.26 0.58 -0.74 0.09 0.00 0.00 178.44 178.27 2bxh h HIS 464 N -0.43 0.71 0.00 1.13 2.76 -1.26 -1.12 115.15 116.94 2bxh h HIS 464 Ca -0.04 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 2bxh h HIS 464 Cb 0.33 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 29.07 2bxh h HIS 464 CO -0.05 0.22 -0.04 1.49 -1.30 0.00 0.00 177.93 178.25 2bxh h GLU 465 N 0.56 0.00 -0.36 5.26 4.81 -0.88 -2.10 114.58 121.87 2bxh h GLU 465 Ca 0.46 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.60 2bxh h GLU 465 Cb 0.93 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 2bxh h GLU 465 CO -0.21 0.04 -0.17 0.87 -0.73 0.00 0.00 179.01 178.81 2bxh h LYS 466 N 0.00 0.67 -1.92 1.92 1.57 -1.17 -3.38 116.57 114.25 2bxh h LYS 466 Ca -0.00 -0.24 -0.41 0.00 -1.87 0.00 0.00 60.65 58.14 2bxh h LYS 466 Cb 0.09 -0.05 -0.31 0.00 0.08 0.00 0.00 32.23 32.05 2bxh h LYS 466 CO 0.00 0.80 -0.75 0.95 -0.57 0.00 0.00 179.45 179.89 2bxh s THR 467 N -4.67 -0.22 0.07 -0.16 -4.23 -0.85 -5.14 115.64 100.45 2bxh s THR 467 Ca -0.08 -1.57 -0.31 0.00 -1.18 0.00 0.00 61.69 58.54 2bxh s THR 467 Cb 0.14 -0.74 -0.07 0.00 1.34 0.00 0.00 72.50 73.16 2bxh s THR 467 CO 0.81 -0.71 1.48 -2.16 -0.54 0.00 0.00 174.62 173.51 2bxh s PRO 468 N 0.84 4.26 0.00 3.99 0.04 -0.86 -4.85 135.00 138.42 2bxh s PRO 468 Ca 0.25 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2bxh s PRO 468 Cb -0.06 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.04 2bxh s PRO 468 CO -0.08 -0.58 0.00 1.33 0.04 0.00 0.00 177.00 177.71 2bxh n VAL 469 N 4.39 0.00 -4.09 -0.36 0.24 -1.26 -5.04 118.33 112.20 2bxh n VAL 469 Ca 0.13 -0.08 -0.32 0.00 -2.04 0.00 0.00 64.34 62.03 2bxh n VAL 469 Cb 0.42 0.62 -0.16 0.00 -1.47 0.00 0.00 33.84 33.25 2bxh n VAL 469 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2bxh s SER 470 N -0.40 3.16 0.37 -1.34 0.15 -1.26 -4.92 113.70 109.46 2bxh s SER 470 Ca 0.00 -0.69 0.17 0.00 0.70 0.00 0.00 55.95 56.13 2bxh s SER 470 Cb 0.00 -1.42 0.71 0.00 -1.71 0.00 0.00 66.02 63.59 2bxh s SER 470 CO 0.00 -0.03 1.77 0.44 1.20 0.00 0.00 173.24 176.62 2bxh h ASP 471 N 7.95 0.00 -0.25 5.45 5.19 -1.99 -2.20 116.42 130.57 2bxh h ASP 471 Ca -0.42 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 55.86 2bxh h ASP 471 Cb 1.13 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.63 2bxh h ASP 471 CO 0.60 0.40 -0.33 0.03 -3.12 0.00 0.00 179.24 176.82 2bxh h ARG 472 N 0.00 0.77 -0.03 3.56 3.08 -1.96 -1.10 114.38 118.71 2bxh h ARG 472 Ca -0.00 -0.36 -0.01 0.00 0.07 0.00 0.00 59.98 59.67 2bxh h ARG 472 Cb 0.82 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.87 2bxh h ARG 472 CO 0.05 0.99 -0.02 0.28 -1.07 0.00 0.00 179.97 180.20 2bxh h VAL 473 N 0.65 1.35 -0.02 2.04 2.07 -1.90 -2.49 116.25 117.94 2bxh h VAL 473 Ca 0.07 -1.05 0.03 0.00 0.82 0.00 0.00 66.70 66.57 2bxh h VAL 473 Cb 0.86 2.00 -0.06 0.00 -1.52 0.00 0.00 31.29 32.58 2bxh h VAL 473 CO 0.08 0.28 -0.40 0.74 0.02 0.00 0.00 177.57 178.29 2bxh h THR 474 N -0.36 0.18 -0.20 2.57 2.02 -1.38 0.20 112.91 115.94 2bxh h THR 474 Ca 0.01 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.24 2bxh h THR 474 Cb 0.46 0.18 -0.06 0.00 -1.74 0.00 0.00 68.15 66.99 2bxh h THR 474 CO 0.00 0.00 -0.18 0.50 0.37 0.00 0.00 175.52 176.22 2bxh h LYS 475 N -0.54 -0.18 0.00 6.66 3.11 -1.26 0.20 116.57 124.55 2bxh h LYS 475 Ca 0.05 0.01 -0.04 0.00 -2.81 0.00 0.00 60.65 57.87 2bxh h LYS 475 Cb 0.63 0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.90 2bxh h LYS 475 CO -0.32 -0.12 -0.19 0.00 -2.81 0.00 0.00 179.45 176.01 2bxh n THR 478 N -3.42 0.00 -0.03 0.00 -2.24 0.62 -4.58 114.28 104.62 2bxh n THR 478 Ca -0.11 -0.47 -0.08 0.00 -2.27 0.00 0.00 64.05 61.11 2bxh n THR 478 Cb 1.02 0.04 0.09 0.00 -2.10 0.00 0.00 70.33 69.38 2bxh n THR 478 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2bxh h GLU 479 N 0.00 0.64 -1.83 -0.78 4.81 -1.48 -3.45 114.58 112.49 2bxh h GLU 479 Ca 0.00 -0.31 0.03 0.00 -0.13 0.00 0.00 59.36 58.95 2bxh h GLU 479 Cb 0.97 -0.00 -0.23 0.00 0.63 0.00 0.00 28.75 30.11 2bxh h GLU 479 CO 0.00 0.91 0.20 0.45 -0.73 0.00 0.00 179.01 179.83 2bxh s SER 480 N -6.83 -0.72 0.01 1.04 0.15 -1.26 -5.05 113.70 101.03 2bxh s SER 480 Ca -0.08 1.24 -0.22 0.00 0.70 0.00 0.00 55.95 57.60 2bxh s SER 480 Cb 0.12 1.29 -0.18 0.00 -1.71 0.00 0.00 66.02 65.54 2bxh s SER 480 CO 0.83 -0.20 1.23 0.25 1.20 0.00 0.00 173.24 176.55 2bxh h LEU 481 N 5.85 0.32 -1.20 3.45 5.85 -1.87 -3.20 115.31 124.51 2bxh h LEU 481 Ca -0.29 -0.58 -0.00 0.00 0.84 0.00 0.00 57.88 57.84 2bxh h LEU 481 Cb 1.20 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 2bxh h LEU 481 CO 0.13 0.85 -0.02 0.58 -0.34 0.00 0.00 178.44 179.64 2bxh h VAL 482 N -0.19 0.05 -0.68 1.05 2.07 -1.96 -2.92 116.25 113.66 2bxh h VAL 482 Ca -0.00 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2bxh h VAL 482 Cb 0.81 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 2bxh h VAL 482 CO 0.04 0.02 0.00 0.59 0.02 0.00 0.00 177.57 178.24 2bxh n ASN 483 N -3.12 3.85 -0.01 0.57 5.03 -1.24 -4.57 115.26 115.78 2bxh n ASN 483 Ca 0.01 -2.00 -0.09 0.00 0.87 0.00 0.00 54.58 53.37 2bxh n ASN 483 Cb 0.35 -0.45 -0.03 0.00 -1.02 0.00 0.00 39.78 38.64 2bxh n ASN 483 CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 2bxh h ARG 484 N 4.18 -0.25 0.25 3.52 3.08 -1.51 0.61 114.38 124.25 2bxh h ARG 484 Ca 0.00 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2bxh h ARG 484 Cb 0.97 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.07 2bxh h ARG 484 CO 0.00 -0.17 -0.17 -0.09 -1.07 0.00 0.00 179.97 178.47 2bxh h ARG 485 N -0.26 -0.40 -0.62 0.04 1.12 -1.84 -1.34 114.38 111.08 2bxh h ARG 485 Ca 0.11 0.03 0.03 0.00 -1.11 0.00 0.00 59.98 59.03 2bxh h ARG 485 Cb 0.42 0.09 -0.03 0.00 -0.01 0.00 0.00 29.97 30.43 2bxh h ARG 485 CO -0.30 -0.27 0.41 -1.35 -3.11 0.00 0.00 179.97 175.36 2bxh h PRO 486 N -0.42 0.72 0.08 0.20 0.11 -1.79 -0.63 132.00 130.26 2bxh h PRO 486 Ca -0.02 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 2bxh h PRO 486 Cb 0.36 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.31 2bxh h PRO 486 CO 0.01 0.47 -0.04 0.00 -0.21 0.00 0.00 178.00 178.23 2bxh h PHE 488 N -0.16 1.03 0.00 0.00 0.04 -0.94 -2.37 116.94 114.54 2bxh h PHE 488 Ca -0.01 -0.08 -0.02 0.00 2.80 0.00 0.00 57.97 60.65 2bxh h PHE 488 Cb 0.13 -0.30 -0.00 0.00 2.20 0.00 0.00 35.95 37.97 2bxh h PHE 488 CO -0.06 0.81 -0.11 0.77 -0.60 0.00 0.00 178.31 179.12 2bxh h SER 489 N 0.95 0.00 1.30 2.17 0.02 -1.00 -2.54 113.55 114.45 2bxh h SER 489 Ca 0.22 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 2bxh h SER 489 Cb 0.23 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2bxh h SER 489 CO -0.02 0.11 -0.33 0.00 -1.14 0.00 0.00 176.83 175.45 2bxh h ALA 490 N 1.89 0.86 -2.83 3.77 0.00 -0.72 -3.45 119.26 118.78 2bxh h ALA 490 Ca -0.00 -0.30 -0.52 0.00 0.00 0.00 0.00 54.91 54.08 2bxh h ALA 490 Cb 0.21 -0.05 0.06 0.00 0.00 0.00 0.00 17.79 18.00 2bxh h ALA 490 CO 0.01 0.42 0.64 -0.51 0.00 0.00 0.00 179.25 179.82 2bxh s LEU 491 N -6.58 4.43 0.00 0.00 1.43 -0.96 -4.99 118.68 112.01 2bxh s LEU 491 Ca 0.03 2.61 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 2bxh s LEU 491 Cb 0.08 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.67 2bxh s LEU 491 CO 0.69 -0.52 0.00 1.21 0.23 0.00 0.00 176.35 177.96 2bxh n GLU 492 N 1.30 0.00 -4.20 1.70 4.07 -1.26 -4.90 120.64 117.35 2bxh n GLU 492 Ca 0.02 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 56.96 2bxh n GLU 492 Cb 0.42 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.66 2bxh n GLU 492 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2bxh s VAL 493 N 0.00 0.55 -0.43 6.31 -7.23 -1.26 -3.43 120.40 114.91 2bxh s VAL 493 Ca 0.00 -0.49 -0.29 0.00 -1.81 0.00 0.00 61.98 59.39 2bxh s VAL 493 Cb 0.00 -0.50 0.01 0.00 0.56 0.00 0.00 36.38 36.45 2bxh s VAL 493 CO 0.00 0.02 1.36 -0.62 -0.31 0.00 0.00 175.10 175.56 2bxh s ASP 494 N -0.52 6.38 0.33 4.85 -1.08 -0.72 -4.87 116.67 121.05 2bxh s ASP 494 Ca -0.00 0.73 0.26 0.00 -0.52 0.00 0.00 52.55 53.02 2bxh s ASP 494 Cb -0.04 -2.54 0.90 0.00 -1.46 0.00 0.00 42.92 39.77 2bxh s ASP 494 CO 0.00 -1.42 1.77 -0.33 0.52 0.00 0.00 175.17 175.71 2bxh h GLU 495 N 10.46 0.00 -0.02 4.34 5.08 -1.95 -3.13 114.58 129.36 2bxh h GLU 495 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2bxh h GLU 495 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2bxh h GLU 495 CO 1.10 0.00 -0.13 0.25 -1.00 0.00 0.00 179.01 179.23 2bxh n THR 496 N -2.55 0.00 -2.56 1.13 -2.24 -1.26 -4.93 114.28 101.87 2bxh n THR 496 Ca 0.03 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 2bxh n THR 496 Cb 0.36 0.80 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 2bxh n THR 496 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2bxh s TYR 497 N -2.19 3.50 -0.23 4.78 5.04 -1.18 -5.04 117.35 122.03 2bxh s TYR 497 Ca 0.30 1.47 -0.08 0.00 -2.44 0.00 0.00 57.07 56.31 2bxh s TYR 497 Cb 0.20 -3.28 -0.04 0.00 0.35 0.00 0.00 41.96 39.19 2bxh s TYR 497 CO 0.40 -0.70 0.10 0.54 -1.34 0.00 0.00 175.55 174.56 2bxh s VAL 498 N 1.27 4.83 0.99 3.14 0.11 -1.26 -5.08 120.40 124.40 2bxh s VAL 498 Ca 0.55 -0.01 -0.15 0.00 -2.93 0.00 0.00 61.98 59.44 2bxh s VAL 498 Cb -0.25 -3.23 -0.01 0.00 -1.53 0.00 0.00 36.38 31.37 2bxh s VAL 498 CO 0.27 0.37 -0.04 -2.65 -3.33 0.00 0.00 175.10 169.72 2bxh n PRO 499 N 4.32 -0.44 -4.28 1.54 -0.02 -1.26 -5.03 135.00 129.83 2bxh n PRO 499 Ca -0.16 -0.10 -0.34 0.00 -2.02 0.00 0.00 63.50 60.88 2bxh n PRO 499 Cb 0.52 -1.60 -0.09 0.00 -0.02 0.00 0.00 33.50 32.32 2bxh n PRO 499 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2bxh s LYS 500 N -3.16 2.95 0.28 -0.52 1.02 -1.12 -5.02 119.74 114.17 2bxh s LYS 500 Ca 0.52 -0.48 -0.16 0.00 0.02 0.00 0.00 55.97 55.87 2bxh s LYS 500 Cb -0.17 -2.78 -0.09 0.00 -0.52 0.00 0.00 37.83 34.27 2bxh s LYS 500 CO 0.70 0.67 0.72 -1.21 -0.92 0.00 0.00 175.35 175.32 2bxh s GLU 501 N -1.26 4.08 0.48 1.68 2.02 -1.26 -4.49 118.70 119.95 2bxh s GLU 501 Ca 0.17 0.72 -0.20 0.00 0.02 0.00 0.00 54.97 55.68 2bxh s GLU 501 Cb -0.12 -2.60 -0.12 0.00 0.10 0.00 0.00 34.13 31.39 2bxh s GLU 501 CO 0.07 0.25 0.38 0.34 0.02 0.00 0.00 175.26 176.32 2bxh n PHE 502 N 0.04 -1.14 -3.14 1.61 7.35 -1.26 -5.01 117.46 115.90 2bxh n PHE 502 Ca 0.01 0.52 0.04 0.00 -0.76 0.00 0.00 57.45 57.27 2bxh n PHE 502 Cb 0.52 -1.90 -0.00 0.00 0.35 0.00 0.00 39.48 38.45 2bxh n PHE 502 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 2bxh s ASN 503 N -1.04 -1.29 0.65 -2.13 3.04 -1.26 -5.02 114.94 107.89 2bxh s ASN 503 Ca 0.64 0.08 0.36 0.00 0.04 0.00 0.00 52.86 53.97 2bxh s ASN 503 Cb -0.53 1.80 1.98 0.00 -1.54 0.00 0.00 41.25 42.96 2bxh s ASN 503 CO 0.59 -0.23 2.16 0.00 -3.04 0.00 0.00 177.10 176.58 2bxh h ALA 504 N 7.68 1.31 0.00 1.71 0.00 -1.95 0.29 119.26 128.30 2bxh h ALA 504 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2bxh h ALA 504 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2bxh h ALA 504 CO 0.08 -0.18 0.00 1.05 0.00 0.00 0.00 179.25 180.20 2bxh h GLU 505 N 0.00 0.00 0.00 0.00 4.11 -2.01 -2.84 114.58 113.84 2bxh h GLU 505 Ca 0.02 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.35 2bxh h GLU 505 Cb 0.33 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2bxh h GLU 505 CO -0.00 0.00 -0.47 1.15 0.07 0.00 0.00 179.01 179.76 2bxh h THR 506 N 0.00 1.14 -2.29 -1.06 2.02 -0.83 -3.41 112.91 108.48 2bxh h THR 506 Ca 0.00 -1.71 -0.27 0.00 0.77 0.00 0.00 66.41 65.20 2bxh h THR 506 Cb 0.78 1.97 -0.34 0.00 -1.74 0.00 0.00 68.15 68.82 2bxh h THR 506 CO 0.00 0.46 -0.59 0.72 0.37 0.00 0.00 175.52 176.48 2bxh s PHE 507 N -3.69 -0.45 0.72 3.16 -0.12 -1.07 -5.13 117.98 111.39 2bxh s PHE 507 Ca -0.01 0.33 -0.08 0.00 -0.05 0.00 0.00 56.93 57.11 2bxh s PHE 507 Cb 0.12 -0.27 0.05 0.00 -0.63 0.00 0.00 43.02 42.29 2bxh s PHE 507 CO 0.72 -0.68 1.05 0.99 -0.05 0.00 0.00 175.22 177.25 2bxh s THR 508 N 2.39 2.50 -0.45 -4.49 2.01 -1.23 -4.77 115.64 111.60 2bxh s THR 508 Ca 0.09 -0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.05 2bxh s THR 508 Cb -0.15 -3.10 0.20 0.00 0.01 0.00 0.00 72.50 69.45 2bxh s THR 508 CO -0.16 -0.12 0.43 0.49 -0.69 0.00 0.00 174.62 174.57 2bxh n PHE 509 N -2.99 -0.07 -1.69 4.92 3.01 -1.26 -5.12 117.46 114.26 2bxh n PHE 509 Ca 0.07 -3.53 -0.32 0.00 1.01 0.00 0.00 57.45 54.68 2bxh n PHE 509 Cb 0.60 -0.04 0.05 0.00 -0.01 0.00 0.00 39.48 40.08 2bxh n PHE 509 CO 0.00 0.00 0.00 -3.38 1.01 0.00 0.00 176.76 174.39 2bxh s HIS 510 N -0.58 2.70 -0.67 1.38 -3.43 -1.26 -4.89 115.29 108.55 2bxh s HIS 510 Ca 0.33 1.54 0.20 0.00 -0.80 0.00 0.00 55.06 56.33 2bxh s HIS 510 Cb 0.07 -3.10 0.85 0.00 -1.43 0.00 0.00 32.58 28.98 2bxh s HIS 510 CO -0.16 -1.59 1.63 0.00 -2.00 0.00 0.00 174.74 172.62 2bxh n ALA 511 N -2.62 1.68 0.40 -1.38 0.00 -1.26 -3.39 120.51 113.94 2bxh n ALA 511 Ca 0.10 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2bxh n ALA 511 Cb 0.52 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2bxh n ALA 511 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2bxh n ASP 512 N -1.98 1.00 0.00 0.00 5.68 -1.26 -2.88 116.55 117.12 2bxh n ASP 512 Ca 0.03 -0.80 0.11 0.00 -0.50 0.00 0.00 54.79 53.62 2bxh n ASP 512 Cb 0.21 -0.20 -0.00 0.00 -1.14 0.00 0.00 41.12 39.99 2bxh n ASP 512 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 2bxh n ILE 513 N 0.68 0.02 0.26 2.12 -6.64 -1.22 -3.81 119.36 110.76 2bxh n ILE 513 Ca 0.00 -0.04 0.07 0.00 -1.77 0.00 0.00 62.75 61.01 2bxh n ILE 513 Cb 0.18 0.67 0.11 0.00 -1.44 0.00 0.00 39.64 39.15 2bxh n ILE 513 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2bxh n THR 515 N 0.78 0.66 -4.15 0.00 5.66 -1.25 -5.02 114.28 110.96 2bxh n THR 515 Ca 0.11 -0.83 -0.24 0.00 -3.05 0.00 0.00 64.05 60.04 2bxh n THR 515 Cb 0.40 0.76 -0.06 0.00 -1.55 0.00 0.00 70.33 69.89 2bxh n THR 515 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2bxh s LEU 516 N -1.05 3.63 0.24 1.09 1.43 -1.26 -5.08 118.68 117.68 2bxh s LEU 516 Ca 0.24 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 52.73 2bxh s LEU 516 Cb 0.14 -2.20 -0.14 0.00 0.03 0.00 0.00 46.19 44.02 2bxh s LEU 516 CO 0.19 0.02 1.13 -0.24 0.23 0.00 0.00 176.35 177.68 2bxh n SER 517 N -0.74 1.58 0.03 2.29 2.88 -1.26 -4.70 113.62 113.69 2bxh n SER 517 Ca -0.08 1.16 0.22 0.00 -1.33 0.00 0.00 58.87 58.84 2bxh n SER 517 Cb 0.57 -1.29 0.62 0.00 -0.75 0.00 0.00 64.21 63.36 2bxh n SER 517 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2bxh h GLU 518 N 2.83 0.00 0.13 -1.46 3.07 -1.99 1.38 114.58 118.54 2bxh h GLU 518 Ca -0.42 0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 58.15 2bxh h GLU 518 Cb 1.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 2bxh h GLU 518 CO 0.66 0.00 -1.36 0.87 -1.40 0.00 0.00 179.01 177.78 2bxh h LYS 519 N 0.00 0.27 0.00 2.33 1.57 -2.01 -3.27 116.57 115.45 2bxh h LYS 519 Ca 0.26 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2bxh h LYS 519 Cb 1.68 0.17 0.00 0.00 0.08 0.00 0.00 32.23 34.15 2bxh h LYS 519 CO -0.00 1.18 0.00 0.39 -0.57 0.00 0.00 179.45 180.44 2bxh n GLU 520 N -3.50 0.18 -0.03 3.15 1.02 0.46 -2.33 120.64 119.59 2bxh n GLU 520 Ca -0.12 0.30 -0.11 0.00 -0.02 0.00 0.00 57.16 57.21 2bxh n GLU 520 Cb 1.03 -1.78 -0.10 0.00 -0.02 0.00 0.00 31.44 30.58 2bxh n GLU 520 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bxh h ARG 521 N 0.00 -0.05 -0.82 3.49 3.08 -1.37 -3.11 114.38 115.59 2bxh h ARG 521 Ca 0.00 0.00 0.17 0.00 0.07 0.00 0.00 59.98 60.22 2bxh h ARG 521 Cb 0.48 0.01 -0.11 0.00 0.08 0.00 0.00 29.97 30.44 2bxh h ARG 521 CO 0.00 0.61 0.35 1.96 -1.07 0.00 0.00 179.97 181.82 2bxh h GLN 522 N -0.88 0.45 0.00 0.04 4.20 -1.58 0.37 115.11 117.71 2bxh h GLN 522 Ca -0.01 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 2bxh h GLN 522 Cb 0.68 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 2bxh h GLN 522 CO 0.01 0.30 -0.08 0.82 -0.67 0.00 0.00 178.83 179.20 2bxh h ILE 523 N 0.46 0.67 0.20 2.54 2.04 -1.54 0.30 117.51 122.19 2bxh h ILE 523 Ca 0.47 -0.33 -0.34 0.00 1.00 0.00 0.00 64.86 65.66 2bxh h ILE 523 Cb 0.77 1.20 0.02 0.00 -0.74 0.00 0.00 36.82 38.07 2bxh h ILE 523 CO -0.44 0.08 -1.59 0.11 0.00 0.00 0.00 178.15 176.31 2bxh h LYS 524 N 0.00 0.43 -0.44 2.37 1.79 -0.29 -2.49 116.57 117.95 2bxh h LYS 524 Ca -0.00 -0.74 -0.09 0.00 -2.18 0.00 0.00 60.65 57.64 2bxh h LYS 524 Cb 0.20 0.28 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 2bxh h LYS 524 CO 0.01 1.34 -0.07 0.87 -1.08 0.00 0.00 179.45 180.52 2bxh h LYS 525 N 0.12 0.82 -0.35 3.15 1.57 -0.33 -1.87 116.57 119.67 2bxh h LYS 525 Ca -0.28 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.15 2bxh h LYS 525 Cb 2.11 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 34.35 2bxh h LYS 525 CO 0.22 0.92 0.01 1.96 -0.57 0.00 0.00 179.45 181.99 2bxh h GLN 526 N 0.65 0.54 -0.32 3.15 4.20 -0.51 0.35 115.11 123.16 2bxh h GLN 526 Ca 0.11 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 2bxh h GLN 526 Cb 0.60 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 2bxh h GLN 526 CO 0.04 0.55 -0.11 1.15 -0.67 0.00 0.00 178.83 179.79 2bxh h THR 527 N 0.52 1.23 -0.19 -0.54 2.02 -1.12 -2.03 112.91 112.79 2bxh h THR 527 Ca 0.11 -1.03 -0.13 0.00 0.77 0.00 0.00 66.41 66.14 2bxh h THR 527 Cb 0.31 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2bxh h THR 527 CO 0.01 0.34 -0.37 0.00 0.37 0.00 0.00 175.52 175.87 2bxh h ALA 528 N 1.38 0.31 -0.80 6.16 0.00 -0.35 -2.98 119.26 122.97 2bxh h ALA 528 Ca 0.09 -0.44 0.11 0.00 0.00 0.00 0.00 54.91 54.68 2bxh h ALA 528 Cb 0.50 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.15 2bxh h ALA 528 CO 0.03 0.39 0.42 1.25 0.00 0.00 0.00 179.25 181.34 2bxh h LEU 529 N 0.27 0.56 0.36 0.00 5.85 -0.64 0.19 115.31 121.90 2bxh h LEU 529 Ca 0.01 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2bxh h LEU 529 Cb 0.97 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.97 2bxh h LEU 529 CO 0.08 0.29 -0.22 0.58 -0.34 0.00 0.00 178.44 178.83 2bxh h VAL 530 N 0.67 0.54 -0.63 1.05 2.07 -1.31 -0.74 116.25 117.91 2bxh h VAL 530 Ca 0.41 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.97 2bxh h VAL 530 Cb 0.48 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 2bxh h VAL 530 CO -0.30 0.00 0.41 -0.33 0.02 0.00 0.00 177.57 177.38 2bxh h GLU 531 N -0.55 0.70 0.68 1.57 4.39 -1.21 0.11 114.58 120.28 2bxh h GLU 531 Ca -0.04 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 2bxh h GLU 531 Cb 0.46 -0.16 0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2bxh h GLU 531 CO 0.04 0.47 -0.34 1.25 -1.16 0.00 0.00 179.01 179.26 2bxh h LEU 532 N 0.73 -0.82 -1.08 1.33 6.46 -0.21 -1.90 115.31 119.81 2bxh h LEU 532 Ca 0.25 0.03 0.19 0.00 -0.12 0.00 0.00 57.88 58.24 2bxh h LEU 532 Cb 0.10 0.22 -0.10 0.00 -0.73 0.00 0.00 40.66 40.15 2bxh h LEU 532 CO -0.07 -0.57 0.61 0.58 -0.62 0.00 0.00 178.44 178.38 2bxh h VAL 533 N -0.93 0.71 0.00 1.05 2.07 -0.60 0.89 116.25 119.43 2bxh h VAL 533 Ca -0.09 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2bxh h VAL 533 Cb 0.72 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 2bxh h VAL 533 CO 0.14 0.13 -0.07 0.11 0.02 0.00 0.00 177.57 177.91 2bxh h LYS 534 N 0.72 0.00 0.14 1.57 1.57 -0.63 -1.32 116.57 118.63 2bxh h LYS 534 Ca 0.56 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 59.00 2bxh h LYS 534 Cb 0.93 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 2bxh h LYS 534 CO -0.35 0.07 -1.79 1.25 -0.57 0.00 0.00 179.45 178.06 2bxh h HIS 535 N 0.00 0.56 -2.15 -1.35 2.76 0.15 -2.97 115.15 112.14 2bxh h HIS 535 Ca -0.00 -0.41 -0.59 0.00 -2.20 0.00 0.00 60.37 57.18 2bxh h HIS 535 Cb 0.33 -0.02 -0.41 0.00 1.55 0.00 0.00 27.41 28.85 2bxh h HIS 535 CO 0.00 1.62 -0.72 1.63 -1.30 0.00 0.00 177.93 179.16 2bxh n LYS 536 N -3.50 2.15 -0.34 5.26 4.01 0.68 -4.39 118.16 122.03 2bxh n LYS 536 Ca -0.25 -4.34 0.16 0.00 -0.51 0.00 0.00 58.31 53.38 2bxh n LYS 536 Cb 1.06 -2.01 0.37 0.00 -0.51 0.00 0.00 35.03 33.94 2bxh n LYS 536 CO 0.00 0.00 0.00 -1.35 -1.11 0.00 0.00 177.40 174.94 2bxh h PRO 537 N 4.02 0.55 -0.69 1.97 0.11 -1.49 0.25 132.00 136.71 2bxh h PRO 537 Ca 0.16 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2bxh h PRO 537 Cb 0.70 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.69 2bxh h PRO 537 CO 0.75 0.37 0.00 1.63 -0.21 0.00 0.00 178.00 180.53 2bxh n LYS 538 N -4.90 2.96 0.00 1.05 4.01 -1.26 -4.91 118.16 115.11 2bxh n LYS 538 Ca 0.26 -1.73 0.00 0.00 -0.51 0.00 0.00 58.31 56.33 2bxh n LYS 538 Cb 0.72 -1.81 0.00 0.00 -0.51 0.00 0.00 35.03 33.42 2bxh n LYS 538 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2bxh n ALA 539 N 0.43 0.00 -3.43 7.82 0.00 0.87 -5.06 120.51 121.14 2bxh n ALA 539 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.46 2bxh n ALA 539 Cb 0.70 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.06 2bxh n ALA 539 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2bxh s THR 540 N 0.00 0.00 0.16 0.00 2.01 -1.26 -5.01 115.64 111.55 2bxh s THR 540 Ca 0.00 -0.03 -0.20 0.00 0.31 0.00 0.00 61.69 61.77 2bxh s THR 540 Cb 0.00 -0.75 0.07 0.00 0.01 0.00 0.00 72.50 71.83 2bxh s THR 540 CO 0.00 -0.02 1.27 2.29 -0.69 0.00 0.00 174.62 177.47 2bxh n LYS 541 N 2.57 -0.28 0.07 4.92 0.00 -1.26 0.17 118.16 124.35 2bxh n LYS 541 Ca -0.14 1.25 -0.14 0.00 -0.00 0.00 0.00 58.31 59.27 2bxh n LYS 541 Cb 0.56 -1.85 -0.09 0.00 -0.00 0.00 0.00 35.03 33.65 2bxh n LYS 541 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 2bxh h GLU 542 N 0.00 -0.60 0.00 -1.58 4.22 -2.00 0.48 114.58 115.10 2bxh h GLU 542 Ca 0.21 0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.69 2bxh h GLU 542 Cb 0.42 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2bxh h GLU 542 CO -0.79 -0.40 0.00 0.00 -2.18 0.00 0.00 179.01 175.63 2bxh n GLN 543 N -5.14 0.58 -0.14 1.92 10.64 0.14 -2.51 117.38 122.88 2bxh n GLN 543 Ca -0.07 0.00 -0.27 0.00 -1.83 0.00 0.00 57.00 54.83 2bxh n GLN 543 Cb 0.36 -1.35 -0.10 0.00 -0.86 0.00 0.00 30.24 28.29 2bxh n GLN 543 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2bxh n LEU 544 N -0.85 2.22 -0.24 2.61 4.77 0.46 -4.15 117.00 121.83 2bxh n LEU 544 Ca 0.10 0.21 0.01 0.00 -0.03 0.00 0.00 56.01 56.30 2bxh n LEU 544 Cb 0.04 -0.84 0.14 0.00 -2.33 0.00 0.00 43.42 40.43 2bxh n LEU 544 CO 0.07 0.67 1.06 0.11 -1.33 0.00 0.00 177.39 177.97 2bxh h LYS 545 N -0.73 0.56 -0.19 3.23 1.57 0.02 0.90 116.57 121.93 2bxh h LYS 545 Ca -0.67 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.13 2bxh h LYS 545 Cb 1.69 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.87 2bxh h LYS 545 CO -0.34 0.37 0.37 0.00 -0.57 0.00 0.00 179.45 179.28 2bxh h ALA 546 N 1.43 1.70 -0.76 3.86 0.00 -1.69 0.19 119.26 123.99 2bxh h ALA 546 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2bxh h ALA 546 Cb 0.38 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2bxh h ALA 546 CO -0.28 -0.47 0.00 0.28 0.00 0.00 0.00 179.25 178.78 2bxh n VAL 547 N -3.30 0.00 -0.60 0.00 0.31 0.28 -2.57 118.33 112.45 2bxh n VAL 547 Ca 0.02 0.37 0.48 0.00 -0.01 0.00 0.00 64.34 65.20 2bxh n VAL 547 Cb 0.48 -1.29 0.77 0.00 -0.91 0.00 0.00 33.84 32.89 2bxh n VAL 547 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 2bxh h MET 548 N 0.00 0.01 0.00 5.55 2.86 -0.57 0.36 114.93 123.14 2bxh h MET 548 Ca 0.00 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2bxh h MET 548 Cb 0.00 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 2bxh h MET 548 CO 0.00 0.01 -0.07 0.22 1.06 0.00 0.00 176.91 178.13 2bxh h ASP 549 N 0.01 0.00 -0.89 1.22 3.58 -0.82 -2.66 116.42 116.86 2bxh h ASP 549 Ca 0.89 -0.19 0.19 0.00 0.42 0.00 0.00 57.03 58.34 2bxh h ASP 549 Cb 3.34 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 44.28 2bxh h ASP 549 CO -0.15 0.63 0.43 0.44 -2.88 0.00 0.00 179.24 177.72 2bxh h ASP 550 N -1.00 0.45 0.27 2.28 5.19 -0.55 0.88 116.42 123.94 2bxh h ASP 550 Ca -0.01 0.13 -0.08 0.00 -0.62 0.00 0.00 57.03 56.45 2bxh h ASP 550 Cb 0.25 0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.82 2bxh h ASP 550 CO -0.00 0.10 -0.34 2.19 -3.12 0.00 0.00 179.24 178.06 2bxh h PHE 551 N 0.51 0.12 0.20 4.55 -0.00 -0.56 0.71 116.94 122.47 2bxh h PHE 551 Ca 0.53 -0.03 -0.01 0.00 -0.00 0.00 0.00 57.97 58.47 2bxh h PHE 551 Cb 0.92 -0.03 0.00 0.00 -0.00 0.00 0.00 35.95 36.85 2bxh h PHE 551 CO -0.10 0.44 -0.10 0.00 -0.00 0.00 0.00 178.31 178.55 2bxh h ALA 552 N 1.56 -0.28 -0.53 12.09 0.00 0.10 -0.66 119.26 131.55 2bxh h ALA 552 Ca 0.01 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.78 2bxh h ALA 552 Cb 0.65 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2bxh h ALA 552 CO 0.05 -0.49 0.31 0.00 0.00 0.00 0.00 179.25 179.11 2bxh h ALA 553 N 0.11 0.68 -0.56 0.00 0.00 -0.63 -1.98 119.26 116.88 2bxh h ALA 553 Ca -0.03 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.97 2bxh h ALA 553 Cb 0.44 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 2bxh h ALA 553 CO 0.05 0.01 0.14 0.35 0.00 0.00 0.00 179.25 179.80 2bxh h PHE 554 N 0.61 0.24 0.00 0.00 3.04 -0.72 -0.66 116.94 119.44 2bxh h PHE 554 Ca 0.21 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 62.14 2bxh h PHE 554 Cb 0.04 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.52 2bxh h PHE 554 CO -0.07 0.02 -0.24 -0.24 -2.02 0.00 0.00 178.31 175.75 2bxh h VAL 555 N 0.29 0.66 0.00 1.41 3.04 -0.69 -2.91 116.25 118.06 2bxh h VAL 555 Ca 0.28 -1.09 0.00 0.00 -1.01 0.00 0.00 66.70 64.88 2bxh h VAL 555 Cb 0.38 1.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.37 2bxh h VAL 555 CO -0.34 0.24 0.00 1.21 -1.01 0.00 0.00 177.57 177.67 2bxh n GLU 556 N -3.51 0.00 -0.35 4.17 2.13 -0.30 -4.00 120.64 118.78 2bxh n GLU 556 Ca -0.00 0.15 -0.08 0.00 0.66 0.00 0.00 57.16 57.88 2bxh n GLU 556 Cb 0.40 -0.96 -0.07 0.00 0.27 0.00 0.00 31.44 31.08 2bxh n GLU 556 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2bxh n LYS 557 N -0.94 -0.35 -0.30 5.31 5.02 -0.91 -1.33 118.16 124.65 2bxh n LYS 557 Ca 0.00 1.28 -0.02 0.00 -2.02 0.00 0.00 58.31 57.55 2bxh n LYS 557 Cb 0.00 -1.89 -0.03 0.00 -0.02 0.00 0.00 35.03 33.08 2bxh n LYS 557 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bxh n LYS 560 N -1.02 3.75 0.00 0.00 2.85 -0.64 -5.05 118.16 118.06 2bxh n LYS 560 Ca 0.00 -4.58 0.00 0.00 -1.05 0.00 0.00 58.31 52.68 2bxh n LYS 560 Cb 0.00 -2.44 0.00 0.00 -0.65 0.00 0.00 35.03 31.94 2bxh n LYS 560 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35