#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ux1 n LEU 22 N 0.00 3.88 -0.16 2.46 4.77 -1.26 -4.82 117.00 121.87 2ux1 n LEU 22 Ca 0.00 -4.24 -0.07 0.00 -0.03 0.00 0.00 56.01 51.67 2ux1 n LEU 22 Cb 0.00 -0.48 0.09 0.00 -2.33 0.00 0.00 43.42 40.70 2ux1 n LEU 22 CO 0.00 1.67 0.84 0.00 -1.33 0.00 0.00 177.39 178.57 2ux1 h ALA 23 N 1.49 0.95 -0.15 -1.18 0.00 -2.00 -0.05 119.26 118.33 2ux1 h ALA 23 Ca 0.19 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2ux1 h ALA 23 Cb 1.28 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2ux1 h ALA 23 CO 0.39 0.63 -0.10 -0.44 0.00 0.00 0.00 179.25 179.72 2ux1 h ASP 24 N 0.86 0.34 -0.73 0.00 3.32 -1.96 -0.83 116.42 117.43 2ux1 h ASP 24 Ca 0.16 -0.44 0.01 0.00 0.02 0.00 0.00 57.03 56.78 2ux1 h ASP 24 Cb 0.53 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 2ux1 h ASP 24 CO 0.03 0.72 0.48 0.28 -1.72 0.00 0.00 179.24 179.02 2ux1 h SER 25 N -0.02 0.82 -0.70 6.45 0.02 -1.82 0.51 113.55 118.81 2ux1 h SER 25 Ca 0.03 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 2ux1 h SER 25 Cb 0.60 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 2ux1 h SER 25 CO 0.03 0.58 0.32 0.11 -1.14 0.00 0.00 176.83 176.74 2ux1 h LYS 26 N 0.97 1.03 -0.36 3.45 1.57 -1.00 -1.51 116.57 120.71 2ux1 h LYS 26 Ca 0.27 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2ux1 h LYS 26 Cb -0.08 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.03 2ux1 h LYS 26 CO -0.07 0.81 0.01 0.00 -0.57 0.00 0.00 179.45 179.62 2ux1 h ALA 27 N 1.34 0.49 -0.05 3.86 0.00 -0.00 -2.29 119.26 122.60 2ux1 h ALA 27 Ca 0.25 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 2ux1 h ALA 27 Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2ux1 h ALA 27 CO -0.03 0.25 -0.76 -0.24 0.00 0.00 0.00 179.25 178.47 2ux1 h VAL 28 N 0.46 1.41 -0.51 0.00 3.04 -0.83 -1.18 116.25 118.64 2ux1 h VAL 28 Ca 0.10 -2.24 0.06 0.00 -1.01 0.00 0.00 66.70 63.62 2ux1 h VAL 28 Cb 0.45 2.19 -0.05 0.00 -2.01 0.00 0.00 31.29 31.87 2ux1 h VAL 28 CO 0.02 0.67 0.21 -0.07 -1.01 0.00 0.00 177.57 177.38 2ux1 h LEU 29 N 0.22 0.24 -0.47 3.16 3.38 -1.22 0.43 115.31 121.05 2ux1 h LEU 29 Ca -0.03 0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.83 2ux1 h LEU 29 Cb 1.34 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 2ux1 h LEU 29 CO 0.12 0.17 -0.46 -1.13 0.09 0.00 0.00 178.44 177.23 2ux1 h ASN 30 N 0.40 0.82 -0.30 -0.43 -0.73 -1.22 -1.75 115.58 112.37 2ux1 h ASN 30 Ca 0.24 -0.40 0.06 0.00 1.87 0.00 0.00 56.30 58.07 2ux1 h ASN 30 Cb 0.23 -0.23 -0.06 0.00 0.27 0.00 0.00 38.32 38.53 2ux1 h ASN 30 CO -0.22 1.15 -0.07 -0.61 -0.37 0.00 0.00 177.43 177.31 2ux1 h GLN 31 N 0.60 0.01 -0.74 6.67 5.75 -0.84 -2.16 115.11 124.40 2ux1 h GLN 31 Ca 0.04 -0.00 0.12 0.00 -0.15 0.00 0.00 58.65 58.65 2ux1 h GLN 31 Cb 1.03 -0.00 -0.08 0.00 1.07 0.00 0.00 27.48 29.49 2ux1 h GLN 31 CO 0.10 0.01 0.34 0.00 -2.65 0.00 0.00 178.83 176.63 2ux1 h ALA 32 N 1.30 1.04 -0.31 3.38 0.00 -0.59 -1.01 119.26 123.06 2ux1 h ALA 32 Ca 0.14 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.19 2ux1 h ALA 32 Cb 0.22 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2ux1 h ALA 32 CO -0.30 -0.11 -0.05 0.28 0.00 0.00 0.00 179.25 179.07 2ux1 h VAL 33 N 0.54 0.72 -0.06 0.00 2.07 -0.71 0.30 116.25 119.12 2ux1 h VAL 33 Ca 0.39 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.89 2ux1 h VAL 33 Cb 0.49 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2ux1 h VAL 33 CO -0.33 0.01 0.03 0.00 0.02 0.00 0.00 177.57 177.30 2ux1 h ALA 34 N 1.29 0.08 -0.63 1.67 0.00 -0.94 -1.72 119.26 119.01 2ux1 h ALA 34 Ca 0.15 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2ux1 h ALA 34 Cb 0.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2ux1 h ALA 34 CO -0.29 -0.38 0.12 -0.44 0.00 0.00 0.00 179.25 178.26 2ux1 h ASP 35 N -0.01 0.99 0.41 0.00 3.32 -0.97 -1.64 116.42 118.54 2ux1 h ASP 35 Ca 0.02 -0.25 -0.10 0.00 0.02 0.00 0.00 57.03 56.72 2ux1 h ASP 35 Cb 0.09 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 2ux1 h ASP 35 CO -0.00 0.99 -0.45 -0.07 -1.72 0.00 0.00 179.24 177.99 2ux1 h LEU 36 N 0.95 0.05 -0.38 1.55 3.38 -0.38 0.31 115.31 120.79 2ux1 h LEU 36 Ca 0.19 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.02 2ux1 h LEU 36 Cb 0.41 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2ux1 h LEU 36 CO 0.01 0.50 -0.21 0.28 0.09 0.00 0.00 178.44 179.11 2ux1 h SER 37 N 0.04 0.85 -0.22 -0.43 0.02 -0.92 -1.11 113.55 111.79 2ux1 h SER 37 Ca -0.00 -0.42 -0.19 0.00 -0.84 0.00 0.00 61.79 60.35 2ux1 h SER 37 Cb 0.82 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.12 2ux1 h SER 37 CO 0.06 1.08 -0.58 0.58 -1.14 0.00 0.00 176.83 176.83 2ux1 h VAL 38 N 0.62 1.28 -0.91 2.27 2.07 -1.02 -2.77 116.25 117.80 2ux1 h VAL 38 Ca 0.08 -1.78 0.00 0.00 0.82 0.00 0.00 66.70 65.83 2ux1 h VAL 38 Cb 0.77 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 32.20 2ux1 h VAL 38 CO 0.06 0.57 0.57 0.00 0.02 0.00 0.00 177.57 178.80 2ux1 h ALA 39 N 0.71 1.15 -0.60 1.67 0.00 -0.32 -0.68 119.26 121.20 2ux1 h ALA 39 Ca 0.00 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2ux1 h ALA 39 Cb 1.18 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2ux1 h ALA 39 CO 0.12 0.58 0.37 1.25 0.00 0.00 0.00 179.25 181.58 2ux1 h HIS 40 N 1.24 0.70 -0.40 0.00 6.17 -1.15 -0.64 115.15 121.06 2ux1 h HIS 40 Ca 0.33 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.43 2ux1 h HIS 40 Cb -0.10 -0.23 -0.02 0.00 2.52 0.00 0.00 27.41 29.58 2ux1 h HIS 40 CO -0.00 0.41 0.27 1.03 0.71 0.00 0.00 177.93 180.34 2ux1 h SER 41 N 0.74 0.46 -0.39 3.26 0.87 -1.06 -0.60 113.55 116.83 2ux1 h SER 41 Ca 0.24 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 2ux1 h SER 41 Cb -0.00 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 2ux1 h SER 41 CO -0.09 0.34 0.23 0.40 -0.53 0.00 0.00 176.83 177.17 2ux1 h ILE 42 N 0.55 1.14 -0.91 2.23 2.04 -0.74 -1.57 117.51 120.25 2ux1 h ILE 42 Ca 0.15 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.70 2ux1 h ILE 42 Cb -0.06 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 2ux1 h ILE 42 CO -0.03 0.14 0.59 -0.07 0.00 0.00 0.00 178.15 178.78 2ux1 h LEU 43 N 0.50 1.01 -0.93 1.44 3.38 -0.90 -0.96 115.31 118.84 2ux1 h LEU 43 Ca 0.14 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2ux1 h LEU 43 Cb 0.03 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2ux1 h LEU 43 CO -0.02 0.71 -0.26 -0.74 0.09 0.00 0.00 178.44 178.21 2ux1 h HIS 44 N 1.18 0.53 -0.12 1.13 2.76 -0.83 -0.97 115.15 118.84 2ux1 h HIS 44 Ca 0.35 -0.12 -0.00 0.00 -2.20 0.00 0.00 60.37 58.40 2ux1 h HIS 44 Cb -0.07 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 28.76 2ux1 h HIS 44 CO -0.01 0.70 0.06 0.37 -1.30 0.00 0.00 177.93 177.75 2ux1 h GLN 45 N 0.42 0.17 -0.58 5.26 4.15 -0.61 -2.01 115.11 121.91 2ux1 h GLN 45 Ca 0.06 -0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.54 2ux1 h GLN 45 Cb 0.68 -0.03 -0.06 0.00 0.21 0.00 0.00 27.48 28.28 2ux1 h GLN 45 CO 0.05 0.19 0.24 0.28 -1.93 0.00 0.00 178.83 177.66 2ux1 h VAL 46 N 0.09 0.82 -0.77 2.39 2.07 -0.86 0.73 116.25 120.73 2ux1 h VAL 46 Ca 0.04 -0.15 0.11 0.00 0.82 0.00 0.00 66.70 67.52 2ux1 h VAL 46 Cb 0.08 0.35 -0.08 0.00 -1.52 0.00 0.00 31.29 30.11 2ux1 h VAL 46 CO -0.01 0.08 0.39 -0.74 0.02 0.00 0.00 177.57 177.31 2ux1 h HIS 47 N 0.44 0.69 0.14 1.57 -0.00 -0.96 -1.83 115.15 115.19 2ux1 h HIS 47 Ca 0.29 0.03 -0.34 0.00 -0.00 0.00 0.00 60.37 60.35 2ux1 h HIS 47 Cb 0.31 -0.19 -0.00 0.00 -0.00 0.00 0.00 27.41 27.53 2ux1 h HIS 47 CO -0.15 0.22 -1.75 -1.49 -0.00 0.00 0.00 177.93 174.75 2ux1 h TRP 48 N 0.62 0.55 -0.01 5.26 6.55 -0.80 -3.38 115.95 124.73 2ux1 h TRP 48 Ca 0.39 -0.40 0.00 0.00 0.95 0.00 0.00 58.89 59.83 2ux1 h TRP 48 Cb 0.47 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.75 2ux1 h TRP 48 CO -0.10 1.58 -0.28 0.66 -1.05 0.00 0.00 178.44 179.25 2ux1 n TYR 49 N -3.49 0.00 -1.79 0.49 4.01 0.20 -4.95 117.16 111.63 2ux1 n TYR 49 Ca -0.24 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.09 2ux1 n TYR 49 Cb 1.06 -0.08 -0.01 0.00 -0.31 0.00 0.00 39.34 40.00 2ux1 n TYR 49 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 2ux1 s MET 50 N -2.44 4.12 -0.08 -0.72 -1.94 -0.70 -4.40 119.30 113.15 2ux1 s MET 50 Ca 0.24 2.57 -0.04 0.00 -1.71 0.00 0.00 55.69 56.75 2ux1 s MET 50 Cb 0.19 -3.02 0.04 0.00 2.01 0.00 0.00 34.83 34.05 2ux1 s MET 50 CO 0.51 -0.62 0.19 1.03 -0.01 0.00 0.00 175.02 176.12 2ux1 s ARG 51 N -0.67 0.15 0.00 2.03 0.52 -1.26 -5.03 118.95 114.69 2ux1 s ARG 51 Ca 0.62 0.43 0.00 0.00 -0.52 0.00 0.00 55.73 56.26 2ux1 s ARG 51 Cb -0.48 -0.13 0.00 0.00 0.52 0.00 0.00 34.95 34.86 2ux1 s ARG 51 CO 0.49 -0.15 0.00 0.41 0.02 0.00 0.00 175.30 176.07 2ux1 n GLY 52 N 4.12 2.33 3.68 -3.53 0.00 -1.26 -3.85 105.19 106.68 2ux1 n GLY 52 Ca -0.25 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.38 2ux1 n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ux1 s ARG 53 N -1.69 4.20 0.00 1.61 1.81 -1.26 -1.64 118.95 121.97 2ux1 s ARG 53 Ca 0.00 2.30 0.00 0.00 -1.72 0.00 0.00 55.73 56.31 2ux1 s ARG 53 Cb 0.00 -3.71 0.00 0.00 -0.45 0.00 0.00 34.95 30.79 2ux1 s ARG 53 CO 0.00 -0.76 0.00 0.41 -0.68 0.00 0.00 175.30 174.27 2ux1 n GLY 54 N 4.03 1.38 0.28 -3.53 0.00 -1.26 -4.93 105.19 101.15 2ux1 n GLY 54 Ca 0.16 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.20 2ux1 n GLY 54 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2ux1 h PHE 55 N 0.00 -0.37 0.00 1.61 3.57 -1.69 -0.02 116.94 120.04 2ux1 h PHE 55 Ca 0.00 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2ux1 h PHE 55 Cb 0.00 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.01 2ux1 h PHE 55 CO 0.00 -0.31 -0.11 1.98 -2.23 0.00 0.00 178.31 177.63 2ux1 h MET 56 N 0.01 0.00 0.12 1.11 4.05 -1.95 0.24 114.93 118.51 2ux1 h MET 56 Ca 0.36 0.00 -0.33 0.00 -0.28 0.00 0.00 59.70 59.44 2ux1 h MET 56 Cb 0.55 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.34 2ux1 h MET 56 CO -0.75 0.11 -1.79 0.97 0.23 0.00 0.00 176.91 175.68 2ux1 h ILE 57 N 0.00 0.75 0.00 1.77 6.09 -1.76 -3.41 117.51 120.95 2ux1 h ILE 57 Ca -0.00 -2.35 -0.16 0.00 -1.37 0.00 0.00 64.86 60.98 2ux1 h ILE 57 Cb 0.49 2.53 -0.02 0.00 0.47 0.00 0.00 36.82 40.29 2ux1 h ILE 57 CO 0.01 0.79 -0.87 -0.50 -3.07 0.00 0.00 178.15 174.52 2ux1 h TRP 58 N -0.12 0.00 0.20 2.19 4.06 -0.52 -3.11 115.95 118.66 2ux1 h TRP 58 Ca -0.39 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.55 2ux1 h TRP 58 Cb 1.91 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 30.07 2ux1 h TRP 58 CO 0.09 0.72 -0.10 1.25 -3.56 0.00 0.00 178.44 176.85 2ux1 h HIS 59 N 0.00 -0.25 0.00 0.49 2.76 -0.75 -1.85 115.15 115.55 2ux1 h HIS 59 Ca -0.04 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.10 2ux1 h HIS 59 Cb 1.59 0.08 -0.00 0.00 1.55 0.00 0.00 27.41 30.63 2ux1 h HIS 59 CO 0.00 -0.11 -0.11 -1.00 -1.30 0.00 0.00 177.93 175.40 2ux1 h PRO 60 N -0.33 0.00 -0.25 5.26 0.13 -1.79 -3.03 132.00 131.98 2ux1 h PRO 60 Ca -0.03 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 2ux1 h PRO 60 Cb 0.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.37 2ux1 h PRO 60 CO 0.05 0.11 -0.25 -0.22 -0.23 0.00 0.00 178.00 177.45 2ux1 h LYS 61 N 0.00 0.48 -0.37 0.86 1.63 -1.40 -2.01 116.57 115.76 2ux1 h LYS 61 Ca -0.00 -0.18 -0.00 0.00 -0.85 0.00 0.00 60.65 59.61 2ux1 h LYS 61 Cb 0.71 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.30 2ux1 h LYS 61 CO 0.01 0.70 0.22 0.52 -3.45 0.00 0.00 179.45 177.45 2ux1 h MET 62 N 0.43 0.50 -0.51 1.90 2.86 -1.22 -0.54 114.93 118.35 2ux1 h MET 62 Ca 0.06 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2ux1 h MET 62 Cb 0.67 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 2ux1 h MET 62 CO 0.05 0.36 0.27 -0.44 1.06 0.00 0.00 176.91 178.21 2ux1 h ASP 63 N 0.51 0.65 -0.22 1.22 3.32 -1.46 0.17 116.42 120.61 2ux1 h ASP 63 Ca 0.14 -0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.12 2ux1 h ASP 63 Cb -0.00 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 2ux1 h ASP 63 CO -0.02 0.57 0.00 -0.33 -1.72 0.00 0.00 179.24 177.74 2ux1 h GLU 64 N 0.69 0.07 -0.42 3.56 5.08 -1.00 -1.54 114.58 121.02 2ux1 h GLU 64 Ca 0.18 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 2ux1 h GLU 64 Cb 0.07 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2ux1 h GLU 64 CO -0.03 0.05 0.25 1.88 -1.00 0.00 0.00 179.01 180.16 2ux1 h TYR 65 N 0.08 0.47 -0.67 4.33 0.05 -0.93 -2.32 116.97 117.97 2ux1 h TYR 65 Ca 0.11 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.85 2ux1 h TYR 65 Cb 0.13 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 37.69 2ux1 h TYR 65 CO -0.18 0.27 0.24 0.52 -1.05 0.00 0.00 178.16 177.96 2ux1 h MET 66 N 0.51 1.01 -0.44 4.88 2.86 -0.42 -0.82 114.93 122.50 2ux1 h MET 66 Ca 0.17 -0.19 -0.12 0.00 -2.06 0.00 0.00 59.70 57.50 2ux1 h MET 66 Cb 0.01 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 2ux1 h MET 66 CO -0.08 0.85 -0.21 0.93 1.06 0.00 0.00 176.91 179.46 2ux1 h GLU 67 N 0.98 0.89 0.15 1.72 4.39 -1.20 0.70 114.58 122.22 2ux1 h GLU 67 Ca 0.22 -0.37 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 2ux1 h GLU 67 Cb 0.24 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2ux1 h GLU 67 CO -0.01 1.02 -0.07 1.49 -1.16 0.00 0.00 179.01 180.27 2ux1 h GLU 68 N 0.78 -0.20 -0.56 2.33 4.81 -1.17 -1.84 114.58 118.73 2ux1 h GLU 68 Ca 0.11 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.46 2ux1 h GLU 68 Cb 0.76 0.05 -0.09 0.00 0.63 0.00 0.00 28.75 30.09 2ux1 h GLU 68 CO 0.06 0.02 0.03 0.82 -0.73 0.00 0.00 179.01 179.21 2ux1 h ILE 69 N -0.40 0.58 -0.53 2.32 1.08 -1.06 -2.00 117.51 117.50 2ux1 h ILE 69 Ca -0.02 -0.05 -0.02 0.00 -0.39 0.00 0.00 64.86 64.38 2ux1 h ILE 69 Cb 0.31 0.42 -0.03 0.00 -3.07 0.00 0.00 36.82 34.46 2ux1 h ILE 69 CO 0.03 0.03 0.26 0.44 -0.69 0.00 0.00 178.15 178.22 2ux1 h ASP 70 N 0.15 0.67 -0.43 1.72 3.32 -0.77 -0.08 116.42 120.99 2ux1 h ASP 70 Ca 0.29 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 2ux1 h ASP 70 Cb 0.45 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2ux1 h ASP 70 CO -0.45 0.57 0.19 1.23 -1.72 0.00 0.00 179.24 179.05 2ux1 h GLY 71 N 0.84 0.69 1.06 2.75 0.00 -0.64 -1.20 103.07 106.57 2ux1 h GLY 71 Ca 0.19 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.07 2ux1 h GLY 71 CO -0.03 0.34 0.02 -0.97 0.00 0.00 0.00 176.54 175.91 2ux1 h TYR 72 N 0.56 1.12 -0.38 5.60 0.05 -0.92 -2.23 116.97 120.77 2ux1 h TYR 72 Ca 0.15 -0.19 0.02 0.00 0.05 0.00 0.00 58.73 58.76 2ux1 h TYR 72 Cb 0.16 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 37.58 2ux1 h TYR 72 CO -0.00 0.99 0.21 1.25 -1.05 0.00 0.00 178.16 179.56 2ux1 h LEU 73 N 0.93 0.34 -0.26 3.88 5.85 -0.68 -0.07 115.31 125.29 2ux1 h LEU 73 Ca 0.17 0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.70 2ux1 h LEU 73 Cb 0.53 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.50 2ux1 h LEU 73 CO 0.03 0.25 -0.68 -0.78 -0.34 0.00 0.00 178.44 176.91 2ux1 h ASP 74 N 0.44 0.88 -0.25 1.25 3.58 -1.17 -1.81 116.42 119.33 2ux1 h ASP 74 Ca 0.15 -0.53 -0.05 0.00 0.42 0.00 0.00 57.03 57.02 2ux1 h ASP 74 Cb 0.02 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.80 2ux1 h ASP 74 CO -0.08 1.32 -0.02 -0.08 -2.88 0.00 0.00 179.24 177.50 2ux1 h GLU 75 N 0.54 0.46 -0.49 0.28 4.81 -1.21 -1.07 114.58 117.90 2ux1 h GLU 75 Ca -0.02 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 58.92 2ux1 h GLU 75 Cb 1.29 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 2ux1 h GLU 75 CO 0.14 0.65 -0.22 0.52 -0.73 0.00 0.00 179.01 179.37 2ux1 h MET 76 N 0.22 1.01 -0.61 1.92 2.86 -1.04 -0.71 114.93 118.58 2ux1 h MET 76 Ca 0.07 -0.43 -0.04 0.00 -2.06 0.00 0.00 59.70 57.23 2ux1 h MET 76 Cb 0.45 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 2ux1 h MET 76 CO 0.02 1.11 0.21 1.03 1.06 0.00 0.00 176.91 180.34 2ux1 h SER 77 N 0.86 0.87 0.72 1.22 0.87 -1.31 -1.11 113.55 115.66 2ux1 h SER 77 Ca 0.11 -0.19 -0.10 0.00 -1.23 0.00 0.00 61.79 60.38 2ux1 h SER 77 Cb 0.80 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 2ux1 h SER 77 CO 0.07 0.83 -0.47 -0.33 -0.53 0.00 0.00 176.83 176.40 2ux1 h GLU 78 N 0.86 0.00 -0.34 2.24 5.08 -1.09 -0.46 114.58 120.86 2ux1 h GLU 78 Ca 0.20 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.44 2ux1 h GLU 78 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2ux1 h GLU 78 CO -0.01 0.47 -0.24 -0.09 -1.00 0.00 0.00 179.01 178.13 2ux1 h ARG 79 N 0.00 0.77 0.04 2.33 9.65 -0.86 -0.67 114.38 125.63 2ux1 h ARG 79 Ca -0.00 -0.37 0.03 0.00 -1.10 0.00 0.00 59.98 58.53 2ux1 h ARG 79 Cb 0.95 -0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.49 2ux1 h ARG 79 CO 0.06 1.00 -0.22 1.25 2.80 0.00 0.00 179.97 184.85 2ux1 h LEU 80 N 0.55 -0.65 -0.66 3.80 5.85 -0.71 -1.08 115.31 122.42 2ux1 h LEU 80 Ca 0.07 0.09 0.14 0.00 0.84 0.00 0.00 57.88 59.01 2ux1 h LEU 80 Cb 0.81 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 42.00 2ux1 h LEU 80 CO 0.07 -0.30 0.08 0.40 -0.34 0.00 0.00 178.44 178.35 2ux1 h ILE 81 N -0.37 0.52 -0.51 4.05 2.04 -1.03 -1.05 117.51 121.16 2ux1 h ILE 81 Ca 0.05 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 2ux1 h ILE 81 Cb 0.43 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 2ux1 h ILE 81 CO -0.18 0.03 0.31 0.74 0.00 0.00 0.00 178.15 179.05 2ux1 h THR 82 N 0.19 1.15 -0.05 -0.27 2.02 -0.60 -1.38 112.91 113.97 2ux1 h THR 82 Ca 0.35 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.21 2ux1 h THR 82 Cb 0.58 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2ux1 h THR 82 CO -0.51 0.15 0.00 0.18 0.37 0.00 0.00 175.52 175.72 2ux1 n LEU 83 N -4.43 0.78 0.00 2.58 4.77 -0.45 -4.90 117.00 115.35 2ux1 n LEU 83 Ca 0.05 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 2ux1 n LEU 83 Cb 0.08 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2ux1 n LEU 83 CO 0.36 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 2ux1 n GLY 84 N 1.02 0.89 3.28 -0.72 0.00 -0.52 -5.07 105.19 104.07 2ux1 n GLY 84 Ca 0.18 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 2ux1 n GLY 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ux1 n GLY 85 N -2.21 0.71 2.70 -0.02 0.00 -0.46 -5.00 105.19 100.92 2ux1 n GLY 85 Ca 0.00 -2.03 -0.30 0.00 0.00 0.00 0.00 46.02 43.70 2ux1 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ux1 s ALA 86 N -3.10 1.37 0.40 4.61 0.00 -1.26 -4.26 121.76 119.51 2ux1 s ALA 86 Ca 0.56 -1.54 -0.25 0.00 0.00 0.00 0.00 51.96 50.73 2ux1 s ALA 86 Cb -0.03 -1.57 -0.09 0.00 0.00 0.00 0.00 23.12 21.44 2ux1 s ALA 86 CO 0.37 -1.64 1.18 -1.25 0.00 0.00 0.00 175.76 174.41 2ux1 s PRO 87 N 1.71 4.07 0.23 0.00 0.04 -1.26 -4.94 135.00 134.84 2ux1 s PRO 87 Ca 0.09 1.86 -0.30 0.00 0.04 0.00 0.00 61.00 62.69 2ux1 s PRO 87 Cb -0.17 -2.70 -0.15 0.00 0.04 0.00 0.00 34.50 31.52 2ux1 s PRO 87 CO -0.26 -0.31 0.99 1.19 0.04 0.00 0.00 177.00 178.65 2ux1 n PHE 88 N 0.12 0.99 -2.09 0.56 3.72 -1.26 -4.88 117.46 114.61 2ux1 n PHE 88 Ca 0.04 0.75 -0.01 0.00 -0.05 0.00 0.00 57.45 58.18 2ux1 n PHE 88 Cb 0.46 -2.21 -0.01 0.00 -0.94 0.00 0.00 39.48 36.78 2ux1 n PHE 88 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2ux1 n SER 89 N 1.64 0.00 -4.05 4.37 3.41 -1.26 -4.94 113.62 112.78 2ux1 n SER 89 Ca 0.13 -1.68 -0.10 0.00 -0.26 0.00 0.00 58.87 56.96 2ux1 n SER 89 Cb 0.28 -0.06 -0.11 0.00 -0.26 0.00 0.00 64.21 64.05 2ux1 n SER 89 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2ux1 s THR 90 N 0.00 0.34 0.29 6.66 -4.23 -1.26 -5.05 115.64 112.39 2ux1 s THR 90 Ca 0.06 -1.27 -0.01 0.00 -1.18 0.00 0.00 61.69 59.28 2ux1 s THR 90 Cb 0.07 -0.80 0.20 0.00 1.34 0.00 0.00 72.50 73.31 2ux1 s THR 90 CO -0.03 -0.61 1.89 -0.07 -0.54 0.00 0.00 174.62 175.26 2ux1 h LEU 91 N 4.08 0.83 -0.09 4.79 3.38 -1.99 -0.95 115.31 125.36 2ux1 h LEU 91 Ca -0.34 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.56 2ux1 h LEU 91 Cb 1.19 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 2ux1 h LEU 91 CO 0.49 0.71 -0.03 0.50 0.09 0.00 0.00 178.44 180.20 2ux1 h LYS 92 N 0.91 -0.01 -0.55 1.13 3.64 -1.99 -0.98 116.57 118.71 2ux1 h LYS 92 Ca 0.22 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2ux1 h LYS 92 Cb 0.12 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2ux1 h LYS 92 CO -0.03 -0.01 0.37 0.93 -2.27 0.00 0.00 179.45 178.44 2ux1 h GLU 93 N -0.01 0.73 0.14 1.90 5.08 -1.87 -1.12 114.58 119.42 2ux1 h GLU 93 Ca 0.05 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2ux1 h GLU 93 Cb 0.08 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2ux1 h GLU 93 CO -0.10 0.48 -0.13 0.74 -1.00 0.00 0.00 179.01 179.00 2ux1 h PHE 94 N 0.75 -0.34 -0.64 4.33 0.04 -0.91 -2.15 116.94 118.02 2ux1 h PHE 94 Ca 0.20 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.92 2ux1 h PHE 94 Cb -0.09 0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.17 2ux1 h PHE 94 CO -0.04 -0.20 0.19 1.03 -0.60 0.00 0.00 178.31 178.69 2ux1 h SER 95 N -0.29 0.92 1.04 2.17 0.87 -1.01 -0.39 113.55 116.85 2ux1 h SER 95 Ca 0.00 -0.16 -0.17 0.00 -1.23 0.00 0.00 61.79 60.23 2ux1 h SER 95 Cb 0.28 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 2ux1 h SER 95 CO -0.03 0.86 -0.79 -0.33 -0.53 0.00 0.00 176.83 176.01 2ux1 h GLU 96 N 0.95 0.00 0.00 2.24 5.08 -1.13 -3.31 114.58 118.40 2ux1 h GLU 96 Ca 0.21 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.43 2ux1 h GLU 96 Cb 0.29 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 2ux1 h GLU 96 CO -0.01 0.79 -1.84 0.09 -1.00 0.00 0.00 179.01 177.04 2ux1 n ASN 97 N -3.40 0.31 -4.76 1.42 3.02 -0.82 -4.94 115.26 106.09 2ux1 n ASN 97 Ca 0.00 0.13 -0.41 0.00 -0.03 0.00 0.00 54.58 54.28 2ux1 n ASN 97 Cb 0.82 1.11 -0.02 0.00 -0.61 0.00 0.00 39.78 41.08 2ux1 n ASN 97 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2ux1 s SER 98 N -5.18 6.74 0.08 6.41 0.15 -0.17 -4.90 113.70 116.83 2ux1 s SER 98 Ca -0.06 2.68 0.26 0.00 0.70 0.00 0.00 55.95 59.53 2ux1 s SER 98 Cb 0.10 -2.64 0.74 0.00 -1.71 0.00 0.00 66.02 62.51 2ux1 s SER 98 CO 0.85 -0.58 1.62 0.00 1.20 0.00 0.00 173.24 176.33 2ux1 n GLN 99 N 1.23 0.13 -2.78 5.44 1.13 -1.26 -4.87 117.38 116.41 2ux1 n GLN 99 Ca 0.02 0.07 -0.40 0.00 -1.94 0.00 0.00 57.00 54.75 2ux1 n GLN 99 Cb 0.41 -1.62 -0.06 0.00 0.11 0.00 0.00 30.24 29.09 2ux1 n GLN 99 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2ux1 s LEU 100 N -3.67 4.61 -0.09 1.08 1.43 -1.26 -5.05 118.68 115.74 2ux1 s LEU 100 Ca 0.11 1.88 -0.02 0.00 -1.03 0.00 0.00 54.13 55.07 2ux1 s LEU 100 Cb 0.16 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 2ux1 s LEU 100 CO 0.63 0.12 -0.02 -1.59 0.23 0.00 0.00 176.35 175.73 2ux1 s LYS 101 N -0.95 3.04 -0.06 1.70 0.00 -1.26 -5.06 119.74 117.15 2ux1 s LYS 101 Ca 0.41 -0.45 -0.02 0.00 0.00 0.00 0.00 55.97 55.91 2ux1 s LYS 101 Cb -0.25 -2.77 -0.04 0.00 0.00 0.00 0.00 37.83 34.77 2ux1 s LYS 101 CO 0.31 0.63 0.05 -1.21 0.00 0.00 0.00 175.35 175.13 2ux1 s GLU 102 N -0.68 3.07 0.23 1.78 2.02 -1.26 -5.10 118.70 118.77 2ux1 s GLU 102 Ca 0.11 -0.40 0.11 0.00 0.02 0.00 0.00 54.97 54.80 2ux1 s GLU 102 Cb -0.12 -2.87 -0.05 0.00 0.10 0.00 0.00 34.13 31.19 2ux1 s GLU 102 CO 0.02 0.69 -0.19 0.14 0.02 0.00 0.00 175.26 175.94 2ux1 s VAL 103 N -1.03 2.21 0.58 2.63 -7.23 -1.26 -5.13 120.40 111.18 2ux1 s VAL 103 Ca 0.17 -2.23 -0.20 0.00 -1.81 0.00 0.00 61.98 57.91 2ux1 s VAL 103 Cb -0.12 -2.15 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 2ux1 s VAL 103 CO 0.07 -0.37 1.31 -0.76 -0.31 0.00 0.00 175.10 175.03 2ux1 s LEU 104 N -3.19 3.75 0.53 1.32 1.43 -1.26 -4.95 118.68 116.32 2ux1 s LEU 104 Ca 0.25 2.64 -0.21 0.00 -1.03 0.00 0.00 54.13 55.77 2ux1 s LEU 104 Cb -0.05 -4.43 -0.05 0.00 0.03 0.00 0.00 46.19 41.69 2ux1 s LEU 104 CO 0.11 -1.67 1.26 -0.83 0.23 0.00 0.00 176.35 175.45 2ux1 s GLY 105 N -1.21 2.82 -0.23 -3.19 0.00 -1.26 -5.02 107.32 99.23 2ux1 s GLY 105 Ca 0.75 1.13 -0.04 0.00 0.00 0.00 0.00 44.72 46.57 2ux1 s GLY 105 CO 0.42 1.60 0.38 -0.35 0.00 0.00 0.00 173.10 175.15 2ux1 s ASP 106 N -1.24 0.15 0.28 1.64 2.15 -1.26 -5.01 116.67 113.37 2ux1 s ASP 106 Ca 0.71 0.39 0.23 0.00 0.43 0.00 0.00 52.55 54.31 2ux1 s ASP 106 Cb -0.34 1.15 1.05 0.00 -0.30 0.00 0.00 42.92 44.48 2ux1 s ASP 106 CO 0.40 -0.28 1.70 -1.22 -0.17 0.00 0.00 175.17 175.60 2ux1 n TYR 107 N 5.37 0.80 1.23 -5.34 4.01 -1.26 -3.00 117.16 118.98 2ux1 n TYR 107 Ca -0.05 0.35 0.14 0.00 -0.16 0.00 0.00 57.90 58.18 2ux1 n TYR 107 Cb 0.50 -1.06 0.53 0.00 -0.31 0.00 0.00 39.34 39.00 2ux1 n TYR 107 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2ux1 n ASN 108 N -2.26 0.42 -4.77 7.72 5.15 -1.26 -4.56 115.26 115.70 2ux1 n ASN 108 Ca 0.01 -0.32 -0.38 0.00 -0.60 0.00 0.00 54.58 53.29 2ux1 n ASN 108 Cb 0.17 -0.08 -0.03 0.00 -0.53 0.00 0.00 39.78 39.31 2ux1 n ASN 108 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2ux1 s VAL 109 N -2.69 3.28 0.52 3.44 1.01 -1.16 -5.01 120.40 119.79 2ux1 s VAL 109 Ca 0.22 1.11 -0.11 0.00 0.00 0.00 0.00 61.98 63.20 2ux1 s VAL 109 Cb 0.19 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 2ux1 s VAL 109 CO 0.53 0.13 0.91 0.42 0.00 0.00 0.00 175.10 177.09 2ux1 s THR 110 N -1.39 4.74 0.19 3.92 -4.23 -1.26 -4.61 115.64 113.00 2ux1 s THR 110 Ca 0.54 0.72 -0.14 0.00 -1.18 0.00 0.00 61.69 61.64 2ux1 s THR 110 Cb -0.30 -3.81 0.17 0.00 1.34 0.00 0.00 72.50 69.90 2ux1 s THR 110 CO 0.38 -0.85 1.65 0.40 -0.54 0.00 0.00 174.62 175.66 2ux1 h ILE 111 N 0.36 0.49 0.00 2.99 1.08 -1.92 0.70 117.51 121.21 2ux1 h ILE 111 Ca -0.46 -0.01 -0.07 0.00 -0.39 0.00 0.00 64.86 63.93 2ux1 h ILE 111 Cb 1.19 0.45 -0.01 0.00 -3.07 0.00 0.00 36.82 35.38 2ux1 h ILE 111 CO 0.62 0.01 -0.33 -0.33 -0.69 0.00 0.00 178.15 177.43 2ux1 h GLU 112 N 0.03 0.00 -0.25 2.37 5.08 -1.93 -0.90 114.58 118.99 2ux1 h GLU 112 Ca 0.27 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.53 2ux1 h GLU 112 Cb 0.41 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 2ux1 h GLU 112 CO -0.53 0.33 -0.23 0.93 -1.00 0.00 0.00 179.01 178.51 2ux1 h GLU 113 N 0.00 0.60 -0.36 2.33 5.08 -1.65 -2.24 114.58 118.34 2ux1 h GLU 113 Ca -0.00 -0.31 0.06 0.00 -1.00 0.00 0.00 59.36 58.11 2ux1 h GLU 113 Cb 0.62 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.83 2ux1 h GLU 113 CO 0.04 0.90 0.04 1.96 -1.00 0.00 0.00 179.01 180.96 2ux1 h GLN 114 N 0.31 0.15 -0.71 2.33 1.08 -0.19 -0.15 115.11 117.93 2ux1 h GLN 114 Ca 0.04 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 2ux1 h GLN 114 Cb 0.79 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 28.15 2ux1 h GLN 114 CO 0.06 0.10 0.35 -0.07 -0.95 0.00 0.00 178.83 178.32 2ux1 h LEU 115 N 0.15 0.92 -1.14 1.46 3.38 -1.24 -1.31 115.31 117.54 2ux1 h LEU 115 Ca 0.17 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2ux1 h LEU 115 Cb 0.22 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2ux1 h LEU 115 CO -0.26 0.79 0.59 0.00 0.09 0.00 0.00 178.44 179.65 2ux1 h ALA 116 N 1.17 1.42 -0.72 1.53 0.00 -1.01 0.05 119.26 121.70 2ux1 h ALA 116 Ca 0.25 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2ux1 h ALA 116 Cb 0.10 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2ux1 h ALA 116 CO -0.03 0.50 0.30 -0.09 0.00 0.00 0.00 179.25 179.92 2ux1 h ARG 117 N 1.14 1.07 -0.40 0.00 2.43 -0.36 -1.95 114.38 116.31 2ux1 h ARG 117 Ca 0.35 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2ux1 h ARG 117 Cb -0.01 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 2ux1 h ARG 117 CO -0.10 0.87 0.17 0.28 -1.51 0.00 0.00 179.97 179.69 2ux1 h VAL 118 N 1.03 1.19 -0.67 0.20 2.07 -0.58 -2.02 116.25 117.46 2ux1 h VAL 118 Ca 0.24 -0.58 0.07 0.00 0.82 0.00 0.00 66.70 67.25 2ux1 h VAL 118 Cb 0.20 0.82 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 2ux1 h VAL 118 CO -0.02 0.21 0.36 0.58 0.02 0.00 0.00 177.57 178.72 2ux1 h VAL 119 N 0.51 0.94 -0.59 2.57 2.07 -0.83 -1.22 116.25 119.69 2ux1 h VAL 119 Ca 0.14 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 2ux1 h VAL 119 Cb 0.17 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 2ux1 h VAL 119 CO -0.01 0.12 0.17 -0.08 0.02 0.00 0.00 177.57 177.78 2ux1 h GLU 120 N 0.66 0.92 -0.48 1.57 4.57 -1.06 0.48 114.58 121.24 2ux1 h GLU 120 Ca 0.31 -0.21 0.04 0.00 -1.18 0.00 0.00 59.36 58.32 2ux1 h GLU 120 Cb 0.23 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 2ux1 h GLU 120 CO -0.20 0.84 0.25 0.28 -1.18 0.00 0.00 179.01 179.00 2ux1 h VAL 121 N 0.84 0.99 -0.14 0.32 2.07 -0.97 -1.94 116.25 117.41 2ux1 h VAL 121 Ca 0.19 -0.17 -0.11 0.00 0.82 0.00 0.00 66.70 67.43 2ux1 h VAL 121 Cb 0.31 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2ux1 h VAL 121 CO -0.00 0.09 -0.38 -0.26 0.02 0.00 0.00 177.57 177.04 2ux1 h PHE 122 N 0.50 0.36 -0.62 1.57 0.04 -0.86 -0.90 116.94 117.04 2ux1 h PHE 122 Ca 0.20 -0.09 -0.05 0.00 2.80 0.00 0.00 57.97 60.83 2ux1 h PHE 122 Cb 0.09 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.13 2ux1 h PHE 122 CO -0.09 0.65 0.18 0.00 -0.60 0.00 0.00 178.31 178.45 2ux1 h ARG 123 N 0.26 0.97 -0.13 1.51 3.08 -0.64 0.35 114.38 119.78 2ux1 h ARG 123 Ca 0.03 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 2ux1 h ARG 123 Cb 0.80 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 2ux1 h ARG 123 CO 0.06 0.86 0.06 -0.92 -1.07 0.00 0.00 179.97 178.96 2ux1 h TYR 124 N 0.89 0.19 -0.88 3.04 3.20 -1.06 -1.67 116.97 120.69 2ux1 h TYR 124 Ca 0.20 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.08 2ux1 h TYR 124 Cb 0.31 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.47 2ux1 h TYR 124 CO 0.02 0.27 0.58 -0.07 -1.64 0.00 0.00 178.16 177.31 2ux1 h LEU 125 N 0.06 0.98 -0.72 2.82 3.38 -1.01 0.59 115.31 121.41 2ux1 h LEU 125 Ca 0.04 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2ux1 h LEU 125 Cb 0.15 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2ux1 h LEU 125 CO -0.00 0.69 0.46 0.00 0.09 0.00 0.00 178.44 179.67 2ux1 h ALA 126 N 1.35 0.93 -0.39 1.53 0.00 -0.79 0.15 119.26 122.03 2ux1 h ALA 126 Ca 0.34 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 2ux1 h ALA 126 Cb -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2ux1 h ALA 126 CO -0.10 0.27 -0.06 0.00 0.00 0.00 0.00 179.25 179.37 2ux1 h ALA 127 N 1.29 0.53 -0.86 0.00 0.00 -0.62 -2.02 119.26 117.59 2ux1 h ALA 127 Ca 0.28 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2ux1 h ALA 127 Cb -0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2ux1 h ALA 127 CO -0.09 0.36 0.44 1.25 0.00 0.00 0.00 179.25 181.21 2ux1 h LEU 128 N 0.54 1.09 -0.84 0.00 5.85 -0.59 -1.32 115.31 120.04 2ux1 h LEU 128 Ca 0.10 -0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 2ux1 h LEU 128 Cb 0.56 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2ux1 h LEU 128 CO 0.03 0.90 -0.42 -0.26 -0.34 0.00 0.00 178.44 178.36 2ux1 h PHE 129 N 1.21 0.41 -0.34 1.25 0.04 -0.88 0.60 116.94 119.23 2ux1 h PHE 129 Ca 0.30 -0.11 -0.04 0.00 2.80 0.00 0.00 57.97 60.91 2ux1 h PHE 129 Cb 0.07 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 2ux1 h PHE 129 CO 0.01 0.71 0.06 0.37 -0.60 0.00 0.00 178.31 178.86 2ux1 h GLN 130 N 0.29 0.55 -0.66 1.51 5.75 -0.94 0.22 115.11 121.82 2ux1 h GLN 130 Ca 0.02 -0.15 0.06 0.00 -0.15 0.00 0.00 58.65 58.44 2ux1 h GLN 130 Cb 0.86 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 29.29 2ux1 h GLN 130 CO 0.07 0.63 0.37 0.87 -2.65 0.00 0.00 178.83 178.12 2ux1 h LYS 131 N 0.39 0.67 -0.38 1.69 1.57 -1.00 0.86 116.57 120.36 2ux1 h LYS 131 Ca 0.10 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.91 2ux1 h LYS 131 Cb 0.34 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 32.45 2ux1 h LYS 131 CO 0.01 0.44 0.05 0.78 -0.57 0.00 0.00 179.45 180.16 2ux1 h GLY 132 N 0.69 0.43 0.84 3.86 0.00 -0.67 -0.67 103.07 107.55 2ux1 h GLY 132 Ca 0.30 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.65 2ux1 h GLY 132 CO -0.18 -0.06 0.06 -2.75 0.00 0.00 0.00 176.54 173.62 2ux1 h PHE 133 N 0.17 0.11 -0.27 5.60 3.57 0.40 -1.64 116.94 124.88 2ux1 h PHE 133 Ca 0.19 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 2ux1 h PHE 133 Cb 0.24 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 2ux1 h PHE 133 CO -0.22 0.05 0.11 -0.44 -2.23 0.00 0.00 178.31 175.58 2ux1 h ASP 134 N 0.15 0.38 -0.01 0.41 3.32 -0.63 -0.50 116.42 119.54 2ux1 h ASP 134 Ca 0.08 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 2ux1 h ASP 134 Cb 0.06 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2ux1 h ASP 134 CO -0.09 0.44 0.00 0.58 -1.72 0.00 0.00 179.24 178.45 2ux1 h VAL 135 N 0.29 1.19 -0.71 -1.35 2.07 -1.05 -1.84 116.25 114.85 2ux1 h VAL 135 Ca 0.09 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 2ux1 h VAL 135 Cb 0.18 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 2ux1 h VAL 135 CO -0.01 0.15 0.30 0.77 0.02 0.00 0.00 177.57 178.81 2ux1 h SER 136 N -0.21 0.95 -0.16 0.57 4.64 -1.23 -1.89 113.55 116.21 2ux1 h SER 136 Ca 0.00 -0.13 0.03 0.00 -0.47 0.00 0.00 61.79 61.23 2ux1 h SER 136 Cb 0.24 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2ux1 h SER 136 CO 0.00 0.83 -0.01 -0.78 -0.87 0.00 0.00 176.83 176.00 2ux1 h ASP 137 N 1.03 -0.09 -0.73 4.97 3.58 -1.00 -0.21 116.42 123.97 2ux1 h ASP 137 Ca 0.24 0.04 0.06 0.00 0.42 0.00 0.00 57.03 57.79 2ux1 h ASP 137 Cb 0.17 0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.25 2ux1 h ASP 137 CO -0.02 -0.02 0.48 -0.33 -2.88 0.00 0.00 179.24 176.46 2ux1 h GLU 138 N 0.03 0.77 -0.01 0.28 3.07 -0.87 -2.78 114.58 115.07 2ux1 h GLU 138 Ca 0.08 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 2ux1 h GLU 138 Cb 0.10 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 27.84 2ux1 h GLU 138 CO -0.14 0.51 -0.13 0.39 -1.40 0.00 0.00 179.01 178.24 2ux1 n GLU 139 N -4.47 1.10 -2.39 2.33 1.02 -0.75 -4.93 120.64 112.55 2ux1 n GLU 139 Ca 0.10 -0.59 -0.10 0.00 -0.02 0.00 0.00 57.16 56.56 2ux1 n GLU 139 Cb 0.20 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.14 2ux1 n GLU 139 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ux1 n GLY 140 N 1.26 0.04 3.23 0.62 0.00 -0.75 -4.93 105.19 104.65 2ux1 n GLY 140 Ca 0.15 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 2ux1 n GLY 140 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ux1 n ASP 141 N -0.03 5.33 0.22 1.61 -0.08 -0.16 -4.90 116.55 118.54 2ux1 n ASP 141 Ca -0.09 -3.12 0.06 0.00 -1.51 0.00 0.00 54.79 50.14 2ux1 n ASP 141 Cb 0.57 -1.28 0.52 0.00 2.34 0.00 0.00 41.12 43.27 2ux1 n ASP 141 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2ux1 h SER 142 N 6.28 0.00 -0.02 1.67 4.64 -1.94 -0.05 113.55 124.13 2ux1 h SER 142 Ca 0.18 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 2ux1 h SER 142 Cb 0.82 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2ux1 h SER 142 CO 1.02 0.20 -0.03 0.58 -0.87 0.00 0.00 176.83 177.73 2ux1 h VAL 143 N 0.00 1.41 -0.70 0.95 2.07 -1.96 -1.52 116.25 116.49 2ux1 h VAL 143 Ca -0.00 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.27 2ux1 h VAL 143 Cb 0.37 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.31 2ux1 h VAL 143 CO 0.03 0.33 0.45 0.74 0.02 0.00 0.00 177.57 179.14 2ux1 h THR 144 N -0.43 1.19 -0.68 2.57 2.02 -1.92 -2.08 112.91 113.58 2ux1 h THR 144 Ca 0.00 -0.35 0.13 0.00 0.77 0.00 0.00 66.41 66.96 2ux1 h THR 144 Cb 0.56 0.17 -0.09 0.00 -1.74 0.00 0.00 68.15 67.05 2ux1 h THR 144 CO 0.01 0.18 0.21 -1.13 0.37 0.00 0.00 175.52 175.16 2ux1 h ASN 145 N 0.95 0.13 0.12 4.18 -0.73 -0.95 -1.89 115.58 117.39 2ux1 h ASN 145 Ca 0.25 0.11 -0.12 0.00 1.87 0.00 0.00 56.30 58.42 2ux1 h ASN 145 Cb -0.09 0.12 -0.01 0.00 0.27 0.00 0.00 38.32 38.61 2ux1 h ASN 145 CO -0.05 0.05 -0.41 -0.78 -0.37 0.00 0.00 177.43 175.87 2ux1 h ASP 146 N 0.34 0.39 -0.01 1.15 3.58 -0.74 -2.39 116.42 118.75 2ux1 h ASP 146 Ca 0.36 -0.17 -0.00 0.00 0.42 0.00 0.00 57.03 57.65 2ux1 h ASP 146 Cb 0.55 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.49 2ux1 h ASP 146 CO -0.41 0.76 0.00 0.40 -2.88 0.00 0.00 179.24 177.11 2ux1 h ILE 147 N 0.31 1.09 -0.54 2.25 2.04 -0.69 -1.75 117.51 120.22 2ux1 h ILE 147 Ca 0.03 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 2ux1 h ILE 147 Cb 0.85 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 2ux1 h ILE 147 CO 0.07 0.07 0.26 -0.26 0.00 0.00 0.00 178.15 178.29 2ux1 h PHE 148 N -0.10 0.78 -0.17 1.37 0.04 -1.43 -2.28 116.94 115.15 2ux1 h PHE 148 Ca 0.00 -0.04 0.02 0.00 2.80 0.00 0.00 57.97 60.75 2ux1 h PHE 148 Cb 0.11 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.00 2ux1 h PHE 148 CO -0.04 0.61 0.04 -0.97 -0.60 0.00 0.00 178.31 177.35 2ux1 h ASN 149 N 0.73 0.02 -0.67 2.17 -1.24 -1.35 0.90 115.58 116.14 2ux1 h ASN 149 Ca 0.19 0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.22 2ux1 h ASN 149 Cb 0.12 0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.16 2ux1 h ASN 149 CO -0.02 0.04 0.40 0.58 -1.29 0.00 0.00 177.43 177.13 2ux1 h VAL 150 N 0.11 1.20 -0.24 2.57 2.07 -1.31 -1.66 116.25 118.98 2ux1 h VAL 150 Ca 0.07 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 2ux1 h VAL 150 Cb 0.06 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 2ux1 h VAL 150 CO -0.09 0.21 0.10 0.00 0.02 0.00 0.00 177.57 177.80 2ux1 h ALA 151 N 1.20 0.31 -0.94 1.67 0.00 -1.07 -2.86 119.26 117.57 2ux1 h ALA 151 Ca 0.24 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2ux1 h ALA 151 Cb -0.02 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 2ux1 h ALA 151 CO -0.04 -0.10 0.62 -0.22 0.00 0.00 0.00 179.25 179.51 2ux1 h LYS 152 N 0.24 1.19 -0.39 0.00 3.64 -0.66 -1.66 116.57 118.94 2ux1 h LYS 152 Ca 0.08 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.43 2ux1 h LYS 152 Cb 0.17 -0.27 -0.04 0.00 -0.41 0.00 0.00 32.23 31.68 2ux1 h LYS 152 CO -0.01 0.79 0.16 0.00 -2.27 0.00 0.00 179.45 178.12 2ux1 h ALA 153 N 1.37 0.46 -0.01 5.00 0.00 -1.19 -0.79 119.26 124.11 2ux1 h ALA 153 Ca 0.36 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 2ux1 h ALA 153 Cb -0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2ux1 h ALA 153 CO -0.10 -0.22 -0.01 1.03 0.00 0.00 0.00 179.25 179.94 2ux1 h SER 154 N 0.33 0.03 -0.85 0.00 0.87 -1.22 -2.40 113.55 110.32 2ux1 h SER 154 Ca 0.17 -0.51 0.13 0.00 -1.23 0.00 0.00 61.79 60.35 2ux1 h SER 154 Cb 0.12 -0.01 -0.09 0.00 -0.44 0.00 0.00 62.40 61.99 2ux1 h SER 154 CO -0.15 0.54 0.46 0.40 -0.53 0.00 0.00 176.83 177.55 2ux1 h ILE 155 N -0.47 0.80 -0.44 2.23 1.08 -1.30 -1.81 117.51 117.59 2ux1 h ILE 155 Ca 0.00 -0.24 -0.10 0.00 -0.39 0.00 0.00 64.86 64.13 2ux1 h ILE 155 Cb 0.53 0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 2ux1 h ILE 155 CO 0.00 0.13 -0.13 -0.33 -0.69 0.00 0.00 178.15 177.13 2ux1 h GLU 156 N 0.70 0.82 -0.61 2.37 5.08 -1.05 -0.81 114.58 121.08 2ux1 h GLU 156 Ca 0.44 -0.29 0.05 0.00 -1.00 0.00 0.00 59.36 58.57 2ux1 h GLU 156 Cb 0.55 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 2ux1 h GLU 156 CO -0.32 0.91 0.33 -0.22 -1.00 0.00 0.00 179.01 178.71 2ux1 h LYS 157 N 0.73 0.60 -0.84 2.33 3.64 -0.88 -2.14 116.57 120.01 2ux1 h LYS 157 Ca 0.12 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.43 2ux1 h LYS 157 Cb 0.64 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2ux1 h LYS 157 CO 0.04 0.40 0.39 0.45 -2.27 0.00 0.00 179.45 178.46 2ux1 h HIS 158 N 0.62 1.23 -0.71 1.91 3.86 -0.78 -1.96 115.15 119.32 2ux1 h HIS 158 Ca 0.27 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 2ux1 h HIS 158 Cb 0.17 -0.38 -0.03 0.00 1.06 0.00 0.00 27.41 28.23 2ux1 h HIS 158 CO -0.09 0.90 0.45 0.82 0.86 0.00 0.00 177.93 180.87 2ux1 h ILE 159 N 1.21 1.19 -0.27 2.45 2.04 -0.76 0.13 117.51 123.50 2ux1 h ILE 159 Ca 0.29 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.79 2ux1 h ILE 159 Cb 0.14 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.37 2ux1 h ILE 159 CO -0.03 0.19 0.09 -0.25 0.00 0.00 0.00 178.15 178.15 2ux1 h TRP 160 N 0.97 0.16 -0.38 1.37 7.01 -1.09 -0.56 115.95 123.42 2ux1 h TRP 160 Ca 0.26 0.01 -0.12 0.00 2.11 0.00 0.00 58.89 61.15 2ux1 h TRP 160 Cb -0.07 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 26.95 2ux1 h TRP 160 CO -0.02 0.07 -0.22 0.52 -2.79 0.00 0.00 178.44 176.00 2ux1 h MET 161 N 0.21 0.82 -0.53 2.65 2.86 -0.78 0.61 114.93 120.77 2ux1 h MET 161 Ca 0.12 -0.37 -0.07 0.00 -2.06 0.00 0.00 59.70 57.32 2ux1 h MET 161 Cb 0.09 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 2ux1 h MET 161 CO -0.13 1.01 0.07 -0.07 1.06 0.00 0.00 176.91 178.85 2ux1 h LEU 162 N 0.62 0.81 -0.34 1.22 3.38 -0.73 -1.37 115.31 118.90 2ux1 h LEU 162 Ca 0.08 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.72 2ux1 h LEU 162 Cb 0.78 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 2ux1 h LEU 162 CO 0.06 0.83 -0.39 1.56 0.09 0.00 0.00 178.44 180.60 2ux1 h GLN 163 N 0.81 0.87 -0.98 1.13 1.08 -0.88 -2.31 115.11 114.84 2ux1 h GLN 163 Ca 0.17 -0.48 0.02 0.00 -1.45 0.00 0.00 58.65 56.91 2ux1 h GLN 163 Cb 0.39 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.79 2ux1 h GLN 163 CO 0.01 1.12 0.64 0.00 -0.95 0.00 0.00 178.83 179.66 2ux1 h ALA 164 N 0.74 1.27 -0.09 3.87 0.00 -0.64 0.12 119.26 124.52 2ux1 h ALA 164 Ca 0.05 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2ux1 h ALA 164 Cb 0.98 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2ux1 h ALA 164 CO 0.09 0.58 -0.21 1.49 0.00 0.00 0.00 179.25 181.20 2ux1 h GLU 165 N 1.28 0.16 -0.35 0.00 4.57 -1.11 -1.49 114.58 117.63 2ux1 h GLU 165 Ca 0.37 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 2ux1 h GLU 165 Cb -0.07 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 2ux1 h GLU 165 CO -0.10 0.37 0.00 1.28 -1.18 0.00 0.00 179.01 179.37 2ux1 n LEU 166 N -4.23 1.84 -0.85 1.64 4.77 -0.36 -4.92 117.00 114.89 2ux1 n LEU 166 Ca -0.01 -0.92 -0.10 0.00 -0.03 0.00 0.00 56.01 54.95 2ux1 n LEU 166 Cb 0.31 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 2ux1 n LEU 166 CO 0.38 0.46 -0.10 0.61 -1.33 0.00 0.00 177.39 177.41 2ux1 n GLY 167 N 1.04 0.77 3.46 -0.72 0.00 -0.48 -5.02 105.19 104.25 2ux1 n GLY 167 Ca 0.11 -0.56 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 2ux1 n GLY 167 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ux1 s GLN 168 N -3.33 1.63 0.76 1.61 -0.21 0.27 -4.99 119.66 115.40 2ux1 s GLN 168 Ca 0.00 -1.78 -0.11 0.00 0.02 0.00 0.00 55.36 53.49 2ux1 s GLN 168 Cb 0.00 -1.52 0.05 0.00 1.00 0.00 0.00 33.01 32.54 2ux1 s GLN 168 CO 0.00 0.20 1.09 0.00 -2.12 0.00 0.00 175.29 174.46 2ux1 s ALA 169 N -2.71 2.30 0.25 6.09 0.00 -1.26 -3.37 121.76 123.06 2ux1 s ALA 169 Ca 0.29 0.25 -0.05 0.00 0.00 0.00 0.00 51.96 52.46 2ux1 s ALA 169 Cb -0.01 -3.26 0.29 0.00 0.00 0.00 0.00 23.12 20.13 2ux1 s ALA 169 CO 0.13 -1.71 1.83 -1.35 0.00 0.00 0.00 175.76 174.67 2ux1 h PRO 170 N -1.07 1.07 -5.99 0.00 0.11 -1.87 -3.46 132.00 120.80 2ux1 h PRO 170 Ca -0.44 -0.17 -0.39 0.00 0.11 0.00 0.00 66.00 65.12 2ux1 h PRO 170 Cb 1.23 -0.19 0.09 0.00 0.11 0.00 0.00 31.00 32.25 2ux1 h PRO 170 CO 0.52 0.86 -0.86 1.63 -0.21 0.00 0.00 178.00 179.93 2ux1 n LYS 171 N -4.30 -3.49 0.00 1.05 5.02 -1.26 -4.84 118.16 110.33 2ux1 n LYS 171 Ca 0.07 0.63 0.04 0.00 -2.02 0.00 0.00 58.31 57.03 2ux1 n LYS 171 Cb 0.16 -5.05 0.23 0.00 -0.02 0.00 0.00 35.03 30.36 2ux1 n LYS 171 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16