#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 -1.83 -0.05 2.46 4.77 -1.26 -4.84 117.00 116.25 2ux1 n LEU 22 Ca 0.00 -1.07 -0.08 0.00 -0.03 0.00 0.00 56.01 54.83 2ux1 n LEU 22 Cb 0.00 -2.05 -0.02 0.00 -2.33 0.00 0.00 43.42 39.02 2ux1 n LEU 22 CO 0.00 0.40 0.91 0.00 -1.33 0.00 0.00 177.39 177.37 2ux1 h ALA 23 N 0.85 0.25 0.03 -1.18 0.00 -1.99 -1.26 119.26 115.96 2ux1 h ALA 23 Ca -0.63 0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.09 2ux1 h ALA 23 Cb 1.38 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2ux1 h ALA 23 CO 0.68 -0.35 -1.01 -0.44 0.00 0.00 0.00 179.25 178.14 2ux1 h ASP 24 N 0.18 0.14 -0.15 0.00 3.32 -1.94 -1.41 116.42 116.55 2ux1 h ASP 24 Ca 0.10 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 57.05 2ux1 h ASP 24 Cb 0.08 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 2ux1 h ASP 24 CO -0.11 1.06 -0.08 0.28 -1.72 0.00 0.00 179.24 178.67 2ux1 h SER 25 N 0.03 -0.26 -0.40 6.45 0.02 -1.77 0.82 113.55 118.45 2ux1 h SER 25 Ca -0.04 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2ux1 h SER 25 Cb 1.73 0.14 -0.02 0.00 0.14 0.00 0.00 62.40 64.39 2ux1 h SER 25 CO 0.14 -0.11 0.24 0.11 -1.14 0.00 0.00 176.83 176.08 2ux1 h LYS 26 N -0.07 0.48 -0.87 3.45 1.57 -1.16 -0.95 116.57 119.01 2ux1 h LYS 26 Ca 0.08 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.88 2ux1 h LYS 26 Cb 0.20 -0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.34 2ux1 h LYS 26 CO -0.19 0.32 0.56 0.00 -0.57 0.00 0.00 179.45 179.56 2ux1 h ALA 27 N 1.17 1.17 0.00 3.86 0.00 -1.02 -1.84 119.26 122.60 2ux1 h ALA 27 Ca 0.15 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 2ux1 h ALA 27 Cb -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2ux1 h ALA 27 CO -0.06 0.37 -0.85 -0.24 0.00 0.00 0.00 179.25 178.47 2ux1 h VAL 28 N 1.06 1.56 -0.82 0.00 3.04 -0.50 -1.28 116.25 119.31 2ux1 h VAL 28 Ca 0.36 -2.78 -0.04 0.00 -1.01 0.00 0.00 66.70 63.23 2ux1 h VAL 28 Cb 0.06 2.52 -0.04 0.00 -2.01 0.00 0.00 31.29 31.83 2ux1 h VAL 28 CO -0.14 0.80 0.37 -0.07 -1.01 0.00 0.00 177.57 177.52 2ux1 h LEU 29 N 0.03 1.09 -0.26 3.16 3.38 -0.93 -0.76 115.31 121.03 2ux1 h LEU 29 Ca -0.02 -0.14 -0.20 0.00 0.09 0.00 0.00 57.88 57.60 2ux1 h LEU 29 Cb 1.49 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2ux1 h LEU 29 CO 0.12 0.94 -0.68 -1.13 0.09 0.00 0.00 178.44 177.77 2ux1 h ASN 30 N 1.18 0.88 -0.29 -0.43 -1.24 -1.17 -1.25 115.58 113.25 2ux1 h ASN 30 Ca 0.28 -0.53 0.06 0.00 0.71 0.00 0.00 56.30 56.81 2ux1 h ASN 30 Cb 0.15 -0.26 -0.05 0.00 0.73 0.00 0.00 38.32 38.89 2ux1 h ASN 30 CO -0.03 1.32 -0.06 -0.61 -1.29 0.00 0.00 177.43 176.75 2ux1 h GLN 31 N 0.54 0.01 -0.73 6.67 5.75 -1.10 -2.13 115.11 124.12 2ux1 h GLN 31 Ca -0.02 -0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.56 2ux1 h GLN 31 Cb 1.29 -0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.77 2ux1 h GLN 31 CO 0.14 0.01 0.40 0.00 -2.65 0.00 0.00 178.83 176.72 2ux1 h ALA 32 N 1.28 1.01 -0.48 3.38 0.00 -0.90 -0.27 119.26 123.29 2ux1 h ALA 32 Ca 0.14 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.16 2ux1 h ALA 32 Cb 0.21 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 2ux1 h ALA 32 CO -0.29 0.03 0.09 0.28 0.00 0.00 0.00 179.25 179.36 2ux1 h VAL 33 N 0.69 0.72 0.18 0.00 2.07 -0.76 0.26 116.25 119.41 2ux1 h VAL 33 Ca 0.35 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.78 2ux1 h VAL 33 Cb 0.30 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2ux1 h VAL 33 CO -0.23 0.04 -0.09 0.00 0.02 0.00 0.00 177.57 177.31 2ux1 h ALA 34 N 1.38 -0.25 -0.32 1.67 0.00 -0.75 -2.24 119.26 118.75 2ux1 h ALA 34 Ca 0.24 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 2ux1 h ALA 34 Cb 0.32 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2ux1 h ALA 34 CO -0.32 -0.57 -0.22 -0.44 0.00 0.00 0.00 179.25 177.69 2ux1 h ASP 35 N -0.38 0.62 -0.37 0.00 3.32 -0.84 -2.14 116.42 116.63 2ux1 h ASP 35 Ca -0.03 -0.21 -0.12 0.00 0.02 0.00 0.00 57.03 56.69 2ux1 h ASP 35 Cb 0.29 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2ux1 h ASP 35 CO 0.04 0.84 -0.21 -0.07 -1.72 0.00 0.00 179.24 178.12 2ux1 h LEU 36 N 0.55 0.88 -1.06 1.55 3.38 -0.51 0.18 115.31 120.28 2ux1 h LEU 36 Ca 0.08 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.74 2ux1 h LEU 36 Cb 0.68 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 2ux1 h LEU 36 CO 0.05 1.07 0.63 0.28 0.09 0.00 0.00 178.44 180.56 2ux1 h SER 37 N 0.75 1.10 0.05 -0.43 0.02 -1.04 0.02 113.55 114.03 2ux1 h SER 37 Ca 0.10 -0.03 -0.28 0.00 -0.84 0.00 0.00 61.79 60.75 2ux1 h SER 37 Cb 0.75 -0.27 0.02 0.00 0.14 0.00 0.00 62.40 63.04 2ux1 h SER 37 CO 0.06 0.79 -1.12 0.58 -1.14 0.00 0.00 176.83 176.01 2ux1 h VAL 38 N 1.29 1.28 -0.90 2.27 2.07 -1.15 -2.82 116.25 118.30 2ux1 h VAL 38 Ca 0.35 -2.33 0.14 0.00 0.82 0.00 0.00 66.70 65.68 2ux1 h VAL 38 Cb -0.15 2.53 -0.09 0.00 -1.52 0.00 0.00 31.29 32.06 2ux1 h VAL 38 CO -0.08 0.71 0.52 0.00 0.02 0.00 0.00 177.57 178.74 2ux1 h ALA 39 N 0.35 1.37 -0.62 1.67 0.00 -0.42 -0.27 119.26 121.33 2ux1 h ALA 39 Ca -0.15 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2ux1 h ALA 39 Cb 1.78 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.45 2ux1 h ALA 39 CO 0.22 0.03 0.17 1.25 0.00 0.00 0.00 179.25 180.92 2ux1 h HIS 40 N 0.76 1.01 -0.51 0.00 6.17 -0.97 -0.65 115.15 120.96 2ux1 h HIS 40 Ca 0.48 -0.11 -0.03 0.00 0.71 0.00 0.00 60.37 61.42 2ux1 h HIS 40 Cb 0.59 -0.29 -0.02 0.00 2.52 0.00 0.00 27.41 30.21 2ux1 h HIS 40 CO -0.05 0.84 0.22 1.03 0.71 0.00 0.00 177.93 180.69 2ux1 h SER 41 N 0.89 0.70 -0.49 3.26 0.87 -1.04 0.68 113.55 118.42 2ux1 h SER 41 Ca 0.20 -0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 2ux1 h SER 41 Cb 0.32 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 2ux1 h SER 41 CO -0.00 0.66 0.13 0.40 -0.53 0.00 0.00 176.83 177.49 2ux1 h ILE 42 N 0.69 1.23 -0.74 2.23 2.04 -0.86 -0.42 117.51 121.68 2ux1 h ILE 42 Ca 0.17 -0.81 -0.04 0.00 1.00 0.00 0.00 64.86 65.19 2ux1 h ILE 42 Cb 0.17 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2ux1 h ILE 42 CO -0.02 0.29 0.31 -0.07 0.00 0.00 0.00 178.15 178.67 2ux1 h LEU 43 N 0.66 1.00 -0.88 1.44 3.38 -0.79 -1.03 115.31 119.09 2ux1 h LEU 43 Ca 0.15 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2ux1 h LEU 43 Cb 0.31 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2ux1 h LEU 43 CO -0.00 0.88 -0.50 -0.74 0.09 0.00 0.00 178.44 178.17 2ux1 h HIS 44 N 1.07 0.18 -0.32 1.13 2.76 -0.60 -0.57 115.15 118.80 2ux1 h HIS 44 Ca 0.25 -0.06 -0.04 0.00 -2.20 0.00 0.00 60.37 58.32 2ux1 h HIS 44 Cb 0.18 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.09 2ux1 h HIS 44 CO 0.02 0.62 0.03 0.37 -1.30 0.00 0.00 177.93 177.67 2ux1 h GLN 45 N 0.12 0.55 -0.61 5.26 4.15 -0.69 -2.35 115.11 121.54 2ux1 h GLN 45 Ca 0.00 -0.16 0.04 0.00 0.77 0.00 0.00 58.65 59.30 2ux1 h GLN 45 Cb 0.92 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.51 2ux1 h GLN 45 CO 0.07 0.65 0.36 0.28 -1.93 0.00 0.00 178.83 178.27 2ux1 h VAL 46 N 0.37 1.03 -0.77 2.39 2.07 -0.99 -0.85 116.25 119.50 2ux1 h VAL 46 Ca 0.10 -0.24 0.14 0.00 0.82 0.00 0.00 66.70 67.52 2ux1 h VAL 46 Cb 0.38 0.27 -0.09 0.00 -1.52 0.00 0.00 31.29 30.34 2ux1 h VAL 46 CO 0.01 0.13 0.34 -0.74 0.02 0.00 0.00 177.57 177.33 2ux1 h HIS 47 N 0.70 0.58 0.21 1.57 -0.00 -1.00 -1.53 115.15 115.68 2ux1 h HIS 47 Ca 0.26 0.03 -0.34 0.00 -0.00 0.00 0.00 60.37 60.32 2ux1 h HIS 47 Cb 0.08 -0.14 0.02 0.00 -0.00 0.00 0.00 27.41 27.37 2ux1 h HIS 47 CO -0.07 0.11 -1.61 -1.49 -0.00 0.00 0.00 177.93 174.87 2ux1 h TRP 48 N 0.50 0.82 -0.00 5.26 6.55 -0.95 -3.38 115.95 124.75 2ux1 h TRP 48 Ca 0.42 -0.60 0.00 0.00 0.95 0.00 0.00 58.89 59.66 2ux1 h TRP 48 Cb 0.61 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 28.87 2ux1 h TRP 48 CO -0.14 1.60 -0.73 0.66 -1.05 0.00 0.00 178.44 178.79 2ux1 n TYR 49 N -3.64 0.00 -1.63 0.49 4.01 -0.37 -4.95 117.16 111.08 2ux1 n TYR 49 Ca -0.20 0.00 -0.48 0.00 -0.16 0.00 0.00 57.90 57.05 2ux1 n TYR 49 Cb 1.09 -0.10 -0.04 0.00 -0.31 0.00 0.00 39.34 39.97 2ux1 n TYR 49 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 2ux1 n MET 50 N -1.32 1.62 -3.75 -0.72 1.56 -0.58 -4.47 117.12 109.45 2ux1 n MET 50 Ca 0.06 0.58 -0.13 0.00 -0.27 0.00 0.00 57.70 57.94 2ux1 n MET 50 Cb 0.34 -2.24 -0.11 0.00 2.15 0.00 0.00 33.22 33.36 2ux1 n MET 50 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 2ux1 s ARG 51 N 0.31 0.35 0.00 2.12 0.52 -1.26 -5.04 118.95 115.95 2ux1 s ARG 51 Ca 0.78 0.48 0.00 0.00 -0.52 0.00 0.00 55.73 56.47 2ux1 s ARG 51 Cb -0.80 0.12 0.00 0.00 0.52 0.00 0.00 34.95 34.79 2ux1 s ARG 51 CO 0.45 -0.07 0.00 0.41 0.02 0.00 0.00 175.30 176.11 2ux1 n GLY 52 N 3.20 2.51 3.69 -3.53 0.00 -1.26 -3.84 105.19 105.96 2ux1 n GLY 52 Ca -0.15 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 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 -1.81 4.23 0.00 1.61 1.81 -1.26 -1.76 118.95 121.77 2ux1 s ARG 53 Ca 0.00 2.22 0.00 0.00 -1.72 0.00 0.00 55.73 56.23 2ux1 s ARG 53 Cb 0.00 -3.52 0.00 0.00 -0.45 0.00 0.00 34.95 30.98 2ux1 s ARG 53 CO 0.00 -0.66 0.00 0.41 -0.68 0.00 0.00 175.30 174.37 2ux1 n GLY 54 N 3.84 1.12 0.32 -3.53 0.00 -1.26 -4.93 105.19 100.74 2ux1 n GLY 54 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.31 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 0.22 0.00 1.61 3.57 -1.72 -1.20 116.94 119.41 2ux1 h PHE 55 Ca 0.00 0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.49 2ux1 h PHE 55 Cb 0.00 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 2ux1 h PHE 55 CO 0.00 -0.30 -0.33 1.98 -2.23 0.00 0.00 178.31 177.42 2ux1 h MET 56 N 0.12 0.00 0.09 1.11 4.05 -1.95 0.13 114.93 118.48 2ux1 h MET 56 Ca 0.57 0.00 -0.20 0.00 -0.28 0.00 0.00 59.70 59.79 2ux1 h MET 56 Cb 1.19 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.99 2ux1 h MET 56 CO -0.75 0.33 -1.02 0.82 0.23 0.00 0.00 176.91 176.52 2ux1 h ILE 57 N 0.00 1.26 0.00 1.77 2.04 -1.87 -3.41 117.51 117.30 2ux1 h ILE 57 Ca -0.00 -2.40 -0.11 0.00 1.00 0.00 0.00 64.86 63.34 2ux1 h ILE 57 Cb 0.61 2.88 -0.02 0.00 -0.74 0.00 0.00 36.82 39.55 2ux1 h ILE 57 CO 0.04 0.64 -0.56 -0.50 0.00 0.00 0.00 178.15 177.78 2ux1 h TRP 58 N -0.52 0.00 0.87 1.37 4.06 -1.01 -2.75 115.95 117.96 2ux1 h TRP 58 Ca -0.22 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.69 2ux1 h TRP 58 Cb 1.55 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.72 2ux1 h TRP 58 CO 0.16 0.54 -0.42 1.25 -3.56 0.00 0.00 178.44 176.42 2ux1 h HIS 59 N 0.00 -1.08 0.00 0.49 2.76 -0.98 -1.68 115.15 114.66 2ux1 h HIS 59 Ca -0.01 -0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.09 2ux1 h HIS 59 Cb 1.42 0.36 -0.01 0.00 1.55 0.00 0.00 27.41 30.73 2ux1 h HIS 59 CO 0.00 -0.67 -0.23 -1.00 -1.30 0.00 0.00 177.93 174.74 2ux1 h PRO 60 N -1.23 0.00 -0.98 5.26 0.13 -1.78 -2.78 132.00 130.62 2ux1 h PRO 60 Ca -0.12 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.03 2ux1 h PRO 60 Cb 0.90 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.98 2ux1 h PRO 60 CO 0.20 0.23 0.65 -0.22 -0.23 0.00 0.00 178.00 178.62 2ux1 h LYS 61 N 0.00 1.27 -0.68 0.86 1.63 -1.31 -0.76 116.57 117.59 2ux1 h LYS 61 Ca -0.00 -0.08 0.08 0.00 -0.85 0.00 0.00 60.65 59.81 2ux1 h LYS 61 Cb 0.52 -0.29 -0.04 0.00 -0.60 0.00 0.00 32.23 31.82 2ux1 h LYS 61 CO 0.03 0.84 0.45 0.52 -3.45 0.00 0.00 179.45 177.84 2ux1 h MET 62 N 1.31 0.58 -0.60 1.90 2.86 -1.01 0.06 114.93 120.02 2ux1 h MET 62 Ca 0.37 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.95 2ux1 h MET 62 Cb -0.12 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.38 2ux1 h MET 62 CO -0.09 0.38 0.31 -0.44 1.06 0.00 0.00 176.91 178.13 2ux1 h ASP 63 N 0.59 0.77 0.02 1.22 3.32 -1.18 0.17 116.42 121.33 2ux1 h ASP 63 Ca 0.30 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 2ux1 h ASP 63 Cb 0.41 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2ux1 h ASP 63 CO -0.10 0.66 -0.01 -0.33 -1.72 0.00 0.00 179.24 177.74 2ux1 h GLU 64 N 0.81 -0.02 -0.70 3.56 5.08 -0.56 -1.66 114.58 121.08 2ux1 h GLU 64 Ca 0.21 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.64 2ux1 h GLU 64 Cb 0.08 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.28 2ux1 h GLU 64 CO -0.03 0.04 0.38 1.88 -1.00 0.00 0.00 179.01 180.28 2ux1 h TYR 65 N -0.08 0.70 -0.71 4.33 0.05 -0.89 -2.39 116.97 117.98 2ux1 h TYR 65 Ca -0.00 0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.73 2ux1 h TYR 65 Cb 0.07 -0.21 -0.03 0.00 1.01 0.00 0.00 36.73 37.57 2ux1 h TYR 65 CO -0.06 0.31 0.16 0.52 -1.05 0.00 0.00 178.16 178.04 2ux1 h MET 66 N 0.69 1.14 -0.79 4.88 2.86 -0.45 -0.59 114.93 122.66 2ux1 h MET 66 Ca 0.33 -0.28 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2ux1 h MET 66 Cb 0.25 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 2ux1 h MET 66 CO -0.21 1.01 0.52 0.93 1.06 0.00 0.00 176.91 180.21 2ux1 h GLU 67 N 1.07 1.05 -0.07 1.72 3.07 -0.92 0.36 114.58 120.86 2ux1 h GLU 67 Ca 0.22 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.99 2ux1 h GLU 67 Cb 0.39 -0.23 -0.00 0.00 -0.84 0.00 0.00 28.75 28.06 2ux1 h GLU 67 CO 0.00 0.71 -0.03 1.49 -1.40 0.00 0.00 179.01 179.78 2ux1 h GLU 68 N 1.08 0.15 -0.55 2.33 4.81 -1.14 -0.77 114.58 120.50 2ux1 h GLU 68 Ca 0.29 -0.06 0.10 0.00 -0.13 0.00 0.00 59.36 59.55 2ux1 h GLU 68 Cb -0.11 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.19 2ux1 h GLU 68 CO -0.06 0.50 0.13 0.82 -0.73 0.00 0.00 179.01 179.67 2ux1 h ILE 69 N -0.21 0.70 -0.71 2.32 5.03 -0.98 -0.75 117.51 122.92 2ux1 h ILE 69 Ca 0.02 -0.09 -0.03 0.00 -0.12 0.00 0.00 64.86 64.63 2ux1 h ILE 69 Cb 0.45 0.41 -0.03 0.00 -3.03 0.00 0.00 36.82 34.62 2ux1 h ILE 69 CO 0.01 0.05 0.31 0.44 -0.68 0.00 0.00 178.15 178.28 2ux1 h ASP 70 N 0.27 0.94 -0.35 1.72 3.32 -0.78 -0.59 116.42 120.94 2ux1 h ASP 70 Ca 0.28 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.20 2ux1 h ASP 70 Cb 0.39 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2ux1 h ASP 70 CO -0.35 0.81 0.16 1.23 -1.72 0.00 0.00 179.24 179.37 2ux1 h GLY 71 N 1.08 0.55 1.01 2.75 0.00 0.25 -2.10 103.07 106.61 2ux1 h GLY 71 Ca 0.24 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 2ux1 h GLY 71 CO -0.03 0.27 0.30 -0.97 0.00 0.00 0.00 176.54 176.11 2ux1 h TYR 72 N 0.42 1.02 -0.40 5.60 0.05 -0.87 -1.75 116.97 121.04 2ux1 h TYR 72 Ca 0.12 -0.07 0.01 0.00 0.05 0.00 0.00 58.73 58.85 2ux1 h TYR 72 Cb 0.14 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 37.55 2ux1 h TYR 72 CO -0.01 0.78 0.25 1.25 -1.05 0.00 0.00 178.16 179.38 2ux1 h LEU 73 N 0.97 0.42 -0.37 3.88 5.85 -0.95 0.16 115.31 125.27 2ux1 h LEU 73 Ca 0.23 -0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.77 2ux1 h LEU 73 Cb 0.17 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 2ux1 h LEU 73 CO -0.02 0.30 -0.60 -0.78 -0.34 0.00 0.00 178.44 177.00 2ux1 h ASP 74 N 0.51 0.79 -0.32 1.25 3.58 -1.21 -1.26 116.42 119.76 2ux1 h ASP 74 Ca 0.16 -0.45 -0.08 0.00 0.42 0.00 0.00 57.03 57.08 2ux1 h ASP 74 Cb -0.02 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 40.79 2ux1 h ASP 74 CO -0.06 1.21 -0.12 -0.08 -2.88 0.00 0.00 179.24 177.32 2ux1 h GLU 75 N 0.52 0.65 -0.33 0.28 4.81 -1.13 -1.34 114.58 118.04 2ux1 h GLU 75 Ca -0.00 -0.27 -0.06 0.00 -0.13 0.00 0.00 59.36 58.90 2ux1 h GLU 75 Cb 1.19 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 2ux1 h GLU 75 CO 0.12 0.85 -0.03 0.52 -0.73 0.00 0.00 179.01 179.74 2ux1 h MET 76 N 0.42 0.60 -0.55 1.92 2.86 -0.67 0.17 114.93 119.69 2ux1 h MET 76 Ca 0.08 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2ux1 h MET 76 Cb 0.63 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.22 2ux1 h MET 76 CO 0.04 0.75 0.36 1.03 1.06 0.00 0.00 176.91 180.15 2ux1 h SER 77 N 0.40 0.63 0.94 1.22 0.87 -1.26 -0.68 113.55 115.67 2ux1 h SER 77 Ca 0.09 -0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.54 2ux1 h SER 77 Cb 0.49 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.28 2ux1 h SER 77 CO 0.02 0.47 -0.43 -0.33 -0.53 0.00 0.00 176.83 176.03 2ux1 h GLU 78 N 0.74 0.00 -0.51 2.24 5.08 -1.08 0.11 114.58 121.15 2ux1 h GLU 78 Ca 0.20 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.46 2ux1 h GLU 78 Cb -0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 2ux1 h GLU 78 CO -0.04 0.43 -0.05 -0.09 -1.00 0.00 0.00 179.01 178.26 2ux1 h ARG 79 N 0.00 0.94 -0.45 2.33 9.65 -0.67 -0.12 114.38 126.06 2ux1 h ARG 79 Ca -0.00 -0.33 -0.01 0.00 -1.10 0.00 0.00 59.98 58.54 2ux1 h ARG 79 Cb 1.02 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.50 2ux1 h ARG 79 CO 0.06 0.99 0.26 1.25 2.80 0.00 0.00 179.97 185.33 2ux1 h LEU 80 N 0.81 0.56 -0.42 3.80 5.85 -0.36 -0.74 115.31 124.81 2ux1 h LEU 80 Ca 0.14 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.83 2ux1 h LEU 80 Cb 0.59 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 2ux1 h LEU 80 CO 0.04 0.47 0.20 0.40 -0.34 0.00 0.00 178.44 179.20 2ux1 h ILE 81 N 0.60 0.95 -0.87 4.05 2.04 -0.69 -0.66 117.51 122.93 2ux1 h ILE 81 Ca 0.16 -0.14 0.08 0.00 1.00 0.00 0.00 64.86 65.96 2ux1 h ILE 81 Cb 0.02 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.55 2ux1 h ILE 81 CO -0.03 0.07 0.57 0.74 0.00 0.00 0.00 178.15 179.50 2ux1 h THR 82 N 0.40 1.02 -0.03 -0.27 2.02 -0.58 -1.80 112.91 113.67 2ux1 h THR 82 Ca 0.19 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 67.05 2ux1 h THR 82 Cb 0.11 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.53 2ux1 h THR 82 CO -0.14 0.17 0.00 0.18 0.37 0.00 0.00 175.52 176.10 2ux1 n LEU 83 N -4.50 0.27 0.00 2.58 4.77 -0.32 -4.88 117.00 114.92 2ux1 n LEU 83 Ca 0.14 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2ux1 n LEU 83 Cb 0.25 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2ux1 n LEU 83 CO 0.32 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2ux1 n GLY 84 N 0.84 0.86 2.74 -0.72 0.00 -0.68 -5.04 105.19 103.20 2ux1 n GLY 84 Ca 0.14 -0.01 -0.18 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 -2.27 0.11 2.62 -0.02 0.00 -0.29 -5.01 105.19 100.33 2ux1 n GLY 85 Ca 0.00 -1.92 -0.29 0.00 0.00 0.00 0.00 46.02 43.80 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 -3.31 1.22 0.47 4.61 0.00 -1.26 -4.46 121.76 119.02 2ux1 s ALA 86 Ca 0.49 -1.64 -0.24 0.00 0.00 0.00 0.00 51.96 50.57 2ux1 s ALA 86 Cb -0.02 -1.58 -0.07 0.00 0.00 0.00 0.00 23.12 21.44 2ux1 s ALA 86 CO 0.33 -1.79 1.34 -1.25 0.00 0.00 0.00 175.76 174.39 2ux1 s PRO 87 N 1.52 3.62 0.34 0.00 0.04 -1.26 -4.96 135.00 134.30 2ux1 s PRO 87 Ca 0.12 2.21 -0.27 0.00 0.04 0.00 0.00 61.00 63.10 2ux1 s PRO 87 Cb -0.19 -2.54 -0.13 0.00 0.04 0.00 0.00 34.50 31.69 2ux1 s PRO 87 CO -0.21 -0.80 1.06 1.19 0.04 0.00 0.00 177.00 178.29 2ux1 n PHE 88 N -0.38 1.44 -2.04 0.56 3.72 -1.26 -4.90 117.46 114.60 2ux1 n PHE 88 Ca 0.06 0.62 -0.01 0.00 -0.05 0.00 0.00 57.45 58.07 2ux1 n PHE 88 Cb 0.44 -2.28 -0.02 0.00 -0.94 0.00 0.00 39.48 36.69 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 0.90 -0.17 -4.16 4.37 3.41 -1.26 -4.94 113.62 111.77 2ux1 n SER 89 Ca 0.08 -1.49 -0.15 0.00 -0.26 0.00 0.00 58.87 57.05 2ux1 n SER 89 Cb 0.35 0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.21 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 0.92 0.34 6.66 -4.23 -1.26 -5.05 115.64 113.01 2ux1 s THR 90 Ca 0.03 -1.50 0.03 0.00 -1.18 0.00 0.00 61.69 59.06 2ux1 s THR 90 Cb 0.03 -1.21 0.22 0.00 1.34 0.00 0.00 72.50 72.88 2ux1 s THR 90 CO -0.01 -0.48 1.95 -0.07 -0.54 0.00 0.00 174.62 175.47 2ux1 h LEU 91 N 3.82 0.64 -0.26 4.79 3.38 -1.99 -1.90 115.31 123.79 2ux1 h LEU 91 Ca -0.38 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.56 2ux1 h LEU 91 Cb 1.19 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 2ux1 h LEU 91 CO 0.49 0.55 0.10 0.50 0.09 0.00 0.00 178.44 180.17 2ux1 h LYS 92 N 0.72 0.21 -0.90 1.13 3.64 -1.99 0.67 116.57 120.05 2ux1 h LYS 92 Ca 0.18 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2ux1 h LYS 92 Cb 0.09 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.81 2ux1 h LYS 92 CO -0.02 0.14 0.57 0.93 -2.27 0.00 0.00 179.45 178.80 2ux1 h GLU 93 N 0.22 1.20 0.12 1.90 5.08 -1.87 -1.02 114.58 120.22 2ux1 h GLU 93 Ca 0.11 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2ux1 h GLU 93 Cb 0.07 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.06 2ux1 h GLU 93 CO -0.11 0.82 -0.06 0.74 -1.00 0.00 0.00 179.01 179.40 2ux1 h PHE 94 N 1.23 -0.15 -0.49 4.33 0.04 -0.92 -2.08 116.94 118.88 2ux1 h PHE 94 Ca 0.33 -0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.10 2ux1 h PHE 94 Cb -0.10 0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.08 2ux1 h PHE 94 CO 0.00 0.13 0.33 0.77 -0.60 0.00 0.00 178.31 178.93 2ux1 h SER 95 N -0.43 0.56 1.16 2.17 0.02 -0.79 -1.10 113.55 115.14 2ux1 h SER 95 Ca -0.02 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.82 2ux1 h SER 95 Cb 0.35 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2ux1 h SER 95 CO 0.03 0.41 -0.48 -0.33 -1.14 0.00 0.00 176.83 175.32 2ux1 h GLU 96 N 0.66 0.00 0.00 3.45 5.08 -1.22 -3.28 114.58 119.27 2ux1 h GLU 96 Ca 0.18 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 2ux1 h GLU 96 Cb -0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2ux1 h GLU 96 CO -0.04 0.48 -1.73 0.09 -1.00 0.00 0.00 179.01 176.80 2ux1 n ASN 97 N -3.37 0.26 -4.78 1.42 3.02 -0.78 -4.97 115.26 106.06 2ux1 n ASN 97 Ca 0.01 0.10 -0.37 0.00 -0.03 0.00 0.00 54.58 54.29 2ux1 n ASN 97 Cb 0.64 1.47 -0.02 0.00 -0.61 0.00 0.00 39.78 41.26 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 -4.84 6.38 0.07 6.41 0.15 -0.42 -4.90 113.70 116.55 2ux1 s SER 98 Ca -0.06 2.19 0.26 0.00 0.70 0.00 0.00 55.95 59.03 2ux1 s SER 98 Cb 0.12 -2.59 0.62 0.00 -1.71 0.00 0.00 66.02 62.46 2ux1 s SER 98 CO 0.87 -0.76 1.52 0.00 1.20 0.00 0.00 173.24 176.07 2ux1 n GLN 99 N -0.38 0.14 -2.88 5.44 1.13 -1.26 -4.88 117.38 114.69 2ux1 n GLN 99 Ca 0.07 0.06 -0.40 0.00 -1.94 0.00 0.00 57.00 54.78 2ux1 n GLN 99 Cb 0.49 -1.61 -0.04 0.00 0.11 0.00 0.00 30.24 29.18 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 -3.66 4.44 -0.17 1.08 1.43 -1.26 -5.06 118.68 115.48 2ux1 s LEU 100 Ca 0.10 1.54 -0.09 0.00 -1.03 0.00 0.00 54.13 54.66 2ux1 s LEU 100 Cb 0.16 -3.36 -0.05 0.00 0.03 0.00 0.00 46.19 42.97 2ux1 s LEU 100 CO 0.66 -0.06 0.12 -0.54 0.23 0.00 0.00 176.35 176.76 2ux1 s LYS 101 N 0.22 3.90 0.00 1.70 1.02 -1.26 -5.06 119.74 120.25 2ux1 s LYS 101 Ca 0.43 -0.21 -0.03 0.00 0.02 0.00 0.00 55.97 56.17 2ux1 s LYS 101 Cb -0.21 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.75 2ux1 s LYS 101 CO 0.25 0.46 0.21 -1.21 -0.92 0.00 0.00 175.35 174.14 2ux1 s GLU 102 N -0.12 3.47 0.25 1.68 2.02 -1.26 -5.11 118.70 119.64 2ux1 s GLU 102 Ca 0.10 -0.27 0.11 0.00 0.02 0.00 0.00 54.97 54.93 2ux1 s GLU 102 Cb -0.11 -3.08 -0.05 0.00 0.10 0.00 0.00 34.13 30.98 2ux1 s GLU 102 CO 0.00 0.66 -0.18 0.14 0.02 0.00 0.00 175.26 175.90 2ux1 s VAL 103 N -1.34 2.22 0.64 2.63 -7.23 -1.26 -5.13 120.40 110.94 2ux1 s VAL 103 Ca 0.28 -2.34 -0.17 0.00 -1.81 0.00 0.00 61.98 57.94 2ux1 s VAL 103 Cb -0.13 -2.21 -0.01 0.00 0.56 0.00 0.00 36.38 34.59 2ux1 s VAL 103 CO 0.19 -0.47 1.17 -0.76 -0.31 0.00 0.00 175.10 174.92 2ux1 s LEU 104 N -3.44 3.51 0.27 1.32 1.43 -1.26 -4.95 118.68 115.56 2ux1 s LEU 104 Ca 0.27 2.26 -0.30 0.00 -1.03 0.00 0.00 54.13 55.33 2ux1 s LEU 104 Cb -0.04 -4.58 -0.10 0.00 0.03 0.00 0.00 46.19 41.50 2ux1 s LEU 104 CO 0.12 -1.75 1.43 -0.83 0.23 0.00 0.00 176.35 175.55 2ux1 s GLY 105 N -1.98 2.44 -0.16 -3.19 0.00 -1.26 -5.02 107.32 98.15 2ux1 s GLY 105 Ca 0.73 1.33 -0.04 0.00 0.00 0.00 0.00 44.72 46.75 2ux1 s GLY 105 CO 0.38 2.23 0.14 -0.35 0.00 0.00 0.00 173.10 175.50 2ux1 s ASP 106 N 0.22 1.75 0.29 1.64 2.15 -1.26 -5.02 116.67 116.44 2ux1 s ASP 106 Ca 0.58 -0.33 0.24 0.00 0.43 0.00 0.00 52.55 53.47 2ux1 s ASP 106 Cb -0.42 0.03 1.06 0.00 -0.30 0.00 0.00 42.92 43.29 2ux1 s ASP 106 CO 0.46 -0.32 1.72 1.88 -0.17 0.00 0.00 175.17 178.74 2ux1 h TYR 107 N 8.38 0.00 -0.01 -5.34 0.05 -1.96 -3.03 116.97 115.06 2ux1 h TYR 107 Ca -0.15 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.63 2ux1 h TYR 107 Cb 1.14 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.88 2ux1 h TYR 107 CO 0.20 0.00 -0.00 0.09 -1.05 0.00 0.00 178.16 177.40 2ux1 n ASN 108 N -2.30 0.97 -4.73 3.88 3.02 -1.26 -4.61 115.26 110.22 2ux1 n ASN 108 Ca 0.01 -1.31 -0.41 0.00 -0.03 0.00 0.00 54.58 52.84 2ux1 n ASN 108 Cb 0.19 -0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.33 2ux1 n ASN 108 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2ux1 s VAL 109 N -2.01 3.15 0.68 2.41 1.01 -1.15 -5.03 120.40 119.46 2ux1 s VAL 109 Ca 0.41 0.92 -0.11 0.00 0.00 0.00 0.00 61.98 63.20 2ux1 s VAL 109 Cb 0.21 -3.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 2ux1 s VAL 109 CO 0.35 0.12 1.05 0.42 0.00 0.00 0.00 175.10 177.05 2ux1 s THR 110 N 0.32 4.12 0.14 3.92 -4.23 -1.26 -4.54 115.64 114.12 2ux1 s THR 110 Ca 0.59 0.70 -0.22 0.00 -1.18 0.00 0.00 61.69 61.58 2ux1 s THR 110 Cb -0.37 -3.47 0.01 0.00 1.34 0.00 0.00 72.50 70.01 2ux1 s THR 110 CO 0.37 -0.89 1.64 0.40 -0.54 0.00 0.00 174.62 175.61 2ux1 h ILE 111 N -0.60 0.45 -0.70 2.99 1.08 -1.92 0.20 117.51 119.01 2ux1 h ILE 111 Ca -0.44 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.06 2ux1 h ILE 111 Cb 1.21 0.45 -0.04 0.00 -3.07 0.00 0.00 36.82 35.37 2ux1 h ILE 111 CO 0.58 0.00 0.46 -0.33 -0.69 0.00 0.00 178.15 178.17 2ux1 h GLU 112 N -0.23 0.85 -0.28 2.37 5.08 -1.93 0.20 114.58 120.64 2ux1 h GLU 112 Ca 0.12 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 2ux1 h GLU 112 Cb 0.42 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2ux1 h GLU 112 CO -0.34 0.56 -0.19 0.93 -1.00 0.00 0.00 179.01 178.98 2ux1 h GLU 113 N 0.88 0.62 -0.25 2.33 5.08 -1.79 -1.29 114.58 120.16 2ux1 h GLU 113 Ca 0.27 -0.29 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2ux1 h GLU 113 Cb 0.01 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2ux1 h GLU 113 CO -0.07 0.88 0.13 1.96 -1.00 0.00 0.00 179.01 180.91 2ux1 h GLN 114 N 0.36 0.26 -0.66 2.33 1.08 0.54 -0.74 115.11 118.27 2ux1 h GLN 114 Ca 0.06 -0.02 0.02 0.00 -1.45 0.00 0.00 58.65 57.26 2ux1 h GLN 114 Cb 0.73 -0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 28.06 2ux1 h GLN 114 CO 0.05 0.17 0.42 -0.07 -0.95 0.00 0.00 178.83 178.45 2ux1 h LEU 115 N 0.27 0.71 -0.87 1.46 3.38 -0.68 -2.26 115.31 117.31 2ux1 h LEU 115 Ca 0.10 -0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.19 2ux1 h LEU 115 Cb 0.02 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 40.52 2ux1 h LEU 115 CO -0.06 0.50 0.48 0.00 0.09 0.00 0.00 178.44 179.45 2ux1 h ALA 116 N 1.26 1.31 -0.77 1.53 0.00 -0.72 -0.66 119.26 121.22 2ux1 h ALA 116 Ca 0.25 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2ux1 h ALA 116 Cb -0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2ux1 h ALA 116 CO -0.08 0.00 0.48 0.00 0.00 0.00 0.00 179.25 179.65 2ux1 h ARG 117 N 0.73 1.03 -0.38 0.00 3.08 -0.61 -0.77 114.38 117.45 2ux1 h ARG 117 Ca 0.46 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 60.36 2ux1 h ARG 117 Cb 0.57 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2ux1 h ARG 117 CO -0.32 0.71 -0.01 0.28 -1.07 0.00 0.00 179.97 179.55 2ux1 h VAL 118 N 1.04 1.26 -0.69 2.04 2.07 -0.80 -1.22 116.25 119.95 2ux1 h VAL 118 Ca 0.28 -1.03 0.06 0.00 0.82 0.00 0.00 66.70 66.83 2ux1 h VAL 118 Cb -0.07 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 2ux1 h VAL 118 CO -0.06 0.34 0.39 0.58 0.02 0.00 0.00 177.57 178.85 2ux1 h VAL 119 N 0.50 0.99 -0.79 2.57 2.07 -0.91 0.34 116.25 121.02 2ux1 h VAL 119 Ca 0.11 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 2ux1 h VAL 119 Cb 0.49 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 2ux1 h VAL 119 CO 0.02 0.13 0.33 -0.33 0.02 0.00 0.00 177.57 177.75 2ux1 h GLU 120 N 0.73 1.17 -0.46 1.57 5.08 -0.73 0.85 114.58 122.78 2ux1 h GLU 120 Ca 0.30 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2ux1 h GLU 120 Cb 0.17 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2ux1 h GLU 120 CO -0.17 0.94 0.15 0.28 -1.00 0.00 0.00 179.01 179.20 2ux1 h VAL 121 N 1.14 1.22 -0.40 3.13 2.07 -0.62 -2.40 116.25 120.39 2ux1 h VAL 121 Ca 0.26 -0.72 -0.14 0.00 0.82 0.00 0.00 66.70 66.93 2ux1 h VAL 121 Cb 0.19 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2ux1 h VAL 121 CO -0.02 0.26 -0.30 -0.26 0.02 0.00 0.00 177.57 177.26 2ux1 h PHE 122 N 0.60 1.03 -0.86 1.57 0.04 -0.62 -1.58 116.94 117.12 2ux1 h PHE 122 Ca 0.15 -0.28 0.04 0.00 2.80 0.00 0.00 57.97 60.68 2ux1 h PHE 122 Cb 0.25 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 38.12 2ux1 h PHE 122 CO 0.01 1.07 0.57 0.00 -0.60 0.00 0.00 178.31 179.36 2ux1 h ARG 123 N 0.75 1.02 0.22 1.51 3.08 -0.72 0.20 114.38 120.43 2ux1 h ARG 123 Ca 0.08 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2ux1 h ARG 123 Cb 0.87 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2ux1 h ARG 123 CO 0.08 0.67 -0.11 -0.92 -1.07 0.00 0.00 179.97 178.62 2ux1 h TYR 124 N 1.05 -0.28 -0.72 3.04 3.20 -1.11 -2.09 116.97 120.06 2ux1 h TYR 124 Ca 0.35 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.25 2ux1 h TYR 124 Cb 0.07 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.39 2ux1 h TYR 124 CO -0.00 -0.01 0.44 -0.07 -1.64 0.00 0.00 178.16 176.88 2ux1 h LEU 125 N -0.53 0.70 -1.26 2.82 3.38 -0.96 0.13 115.31 119.60 2ux1 h LEU 125 Ca -0.03 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.02 2ux1 h LEU 125 Cb 0.39 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 2ux1 h LEU 125 CO 0.05 0.48 0.54 0.00 0.09 0.00 0.00 178.44 179.59 2ux1 h ALA 126 N 1.32 1.62 -0.16 1.53 0.00 -0.59 0.17 119.26 123.16 2ux1 h ALA 126 Ca 0.30 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 55.02 2ux1 h ALA 126 Cb 0.07 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.65 2ux1 h ALA 126 CO -0.13 0.24 -0.55 0.00 0.00 0.00 0.00 179.25 178.81 2ux1 h ALA 127 N 1.56 0.28 -0.41 0.00 0.00 -0.47 -1.79 119.26 118.43 2ux1 h ALA 127 Ca 0.36 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.79 2ux1 h ALA 127 Cb 0.27 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2ux1 h ALA 127 CO -0.13 0.49 0.18 1.25 0.00 0.00 0.00 179.25 181.04 2ux1 h LEU 128 N 0.32 0.25 -1.02 0.00 6.46 -0.34 -1.34 115.31 119.64 2ux1 h LEU 128 Ca -0.02 0.03 -0.08 0.00 -0.12 0.00 0.00 57.88 57.68 2ux1 h LEU 128 Cb 1.18 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 41.08 2ux1 h LEU 128 CO 0.12 0.18 -0.18 -0.26 -0.62 0.00 0.00 178.44 177.68 2ux1 h PHE 129 N 0.38 0.54 -0.45 1.25 0.04 -0.67 -0.47 116.94 117.56 2ux1 h PHE 129 Ca 0.18 -0.10 0.03 0.00 2.80 0.00 0.00 57.97 60.88 2ux1 h PHE 129 Cb 0.11 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 2ux1 h PHE 129 CO -0.12 0.65 0.25 0.37 -0.60 0.00 0.00 178.31 178.87 2ux1 h GLN 130 N 0.45 0.49 -0.68 1.51 5.75 -0.91 0.66 115.11 122.39 2ux1 h GLN 130 Ca 0.08 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 2ux1 h GLN 130 Cb 0.57 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.98 2ux1 h GLN 130 CO 0.04 0.32 0.29 0.87 -2.65 0.00 0.00 178.83 177.71 2ux1 h LYS 131 N 0.51 1.00 -0.36 1.69 6.56 -0.80 -0.48 116.57 124.70 2ux1 h LYS 131 Ca 0.19 -0.17 -0.07 0.00 -1.06 0.00 0.00 60.65 59.53 2ux1 h LYS 131 Cb 0.05 -0.17 -0.02 0.00 -0.57 0.00 0.00 32.23 31.52 2ux1 h LYS 131 CO -0.11 0.82 -0.09 0.78 -2.06 0.00 0.00 179.45 178.80 2ux1 h GLY 132 N 0.96 0.65 0.85 3.86 0.00 -0.88 -1.13 103.07 107.39 2ux1 h GLY 132 Ca 0.23 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 2ux1 h GLY 132 CO -0.02 0.41 -0.10 -2.75 0.00 0.00 0.00 176.54 174.08 2ux1 h PHE 133 N 0.56 -0.26 -0.51 5.60 3.57 -0.42 -2.23 116.94 123.24 2ux1 h PHE 133 Ca 0.10 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.61 2ux1 h PHE 133 Cb 0.49 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 2ux1 h PHE 133 CO 0.02 -0.05 0.32 -0.44 -2.23 0.00 0.00 178.31 175.93 2ux1 h ASP 134 N -0.44 0.54 -0.51 0.41 3.32 -0.97 -1.15 116.42 117.62 2ux1 h ASP 134 Ca -0.03 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 2ux1 h ASP 134 Cb 0.33 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2ux1 h ASP 134 CO 0.05 0.38 0.08 0.58 -1.72 0.00 0.00 179.24 178.61 2ux1 h VAL 135 N 0.65 1.25 -0.01 -1.35 2.07 -1.24 -2.12 116.25 115.50 2ux1 h VAL 135 Ca 0.20 -0.94 -0.16 0.00 0.82 0.00 0.00 66.70 66.62 2ux1 h VAL 135 Cb -0.02 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2ux1 h VAL 135 CO -0.07 0.34 -0.72 0.77 0.02 0.00 0.00 177.57 177.91 2ux1 h SER 136 N 0.73 0.10 -0.52 0.57 4.64 -1.25 -2.10 113.55 115.72 2ux1 h SER 136 Ca 0.16 -0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2ux1 h SER 136 Cb 0.40 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 2ux1 h SER 136 CO 0.01 0.78 0.17 -0.78 -0.87 0.00 0.00 176.83 176.14 2ux1 h ASP 137 N 0.06 0.76 0.45 4.97 3.58 -1.10 0.31 116.42 125.44 2ux1 h ASP 137 Ca -0.01 -0.20 -0.15 0.00 0.42 0.00 0.00 57.03 57.09 2ux1 h ASP 137 Cb 1.27 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.10 2ux1 h ASP 137 CO 0.10 0.76 -0.63 -0.08 -2.88 0.00 0.00 179.24 176.51 2ux1 h GLU 138 N 0.71 0.18 -0.00 0.28 4.81 -1.22 -2.89 114.58 116.45 2ux1 h GLU 138 Ca 0.17 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2ux1 h GLU 138 Cb 0.27 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2ux1 h GLU 138 CO -0.01 0.75 -0.21 0.39 -0.73 0.00 0.00 179.01 179.20 2ux1 n GLU 139 N -3.83 0.41 -1.95 1.92 1.02 -0.80 -4.93 120.64 112.47 2ux1 n GLU 139 Ca -0.02 -0.17 -0.04 0.00 -0.02 0.00 0.00 57.16 56.90 2ux1 n GLU 139 Cb 0.64 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.55 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 1.38 0.26 3.31 0.62 0.00 -0.39 -4.96 105.19 105.41 2ux1 n GLY 140 Ca 0.10 -0.72 -0.44 0.00 0.00 0.00 0.00 46.02 44.96 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 1.16 5.52 0.19 1.61 -0.08 0.96 -4.88 116.55 121.04 2ux1 n ASP 141 Ca -0.05 -3.07 0.03 0.00 -1.51 0.00 0.00 54.79 50.19 2ux1 n ASP 141 Cb 0.48 -1.43 0.39 0.00 2.34 0.00 0.00 41.12 42.90 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 6.59 0.00 -0.24 1.67 4.64 -1.94 -1.20 113.55 123.06 2ux1 h SER 142 Ca 0.24 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.52 2ux1 h SER 142 Cb 0.83 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 2ux1 h SER 142 CO 1.16 0.35 0.02 0.58 -0.87 0.00 0.00 176.83 178.07 2ux1 h VAL 143 N 0.00 1.24 -0.69 0.95 2.07 -1.95 -1.42 116.25 116.45 2ux1 h VAL 143 Ca -0.00 -0.82 -0.07 0.00 0.82 0.00 0.00 66.70 66.63 2ux1 h VAL 143 Cb 0.64 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 2ux1 h VAL 143 CO 0.05 0.26 0.17 0.74 0.02 0.00 0.00 177.57 178.81 2ux1 h THR 144 N 0.20 1.26 -0.72 2.57 2.02 -1.89 -2.45 112.91 113.89 2ux1 h THR 144 Ca 0.07 -0.95 0.08 0.00 0.77 0.00 0.00 66.41 66.38 2ux1 h THR 144 Cb 0.36 0.57 -0.07 0.00 -1.74 0.00 0.00 68.15 67.27 2ux1 h THR 144 CO 0.01 0.36 0.38 -1.13 0.37 0.00 0.00 175.52 175.51 2ux1 h ASN 145 N 1.03 0.53 -0.43 4.18 -0.73 -1.03 -1.92 115.58 117.21 2ux1 h ASN 145 Ca 0.22 0.05 -0.12 0.00 1.87 0.00 0.00 56.30 58.31 2ux1 h ASN 145 Cb 0.36 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 38.89 2ux1 h ASN 145 CO 0.00 0.31 -0.19 -0.78 -0.37 0.00 0.00 177.43 176.41 2ux1 h ASP 146 N 0.66 0.94 -0.05 1.15 3.58 -0.93 -1.23 116.42 120.54 2ux1 h ASP 146 Ca 0.35 -0.34 0.02 0.00 0.42 0.00 0.00 57.03 57.48 2ux1 h ASP 146 Cb 0.32 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 41.08 2ux1 h ASP 146 CO -0.24 1.10 -0.10 0.40 -2.88 0.00 0.00 179.24 177.53 2ux1 h ILE 147 N 0.81 0.74 -0.90 2.25 2.04 -0.97 -0.96 117.51 120.52 2ux1 h ILE 147 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 2ux1 h ILE 147 Cb 0.74 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 2ux1 h ILE 147 CO 0.06 0.00 0.56 -0.26 0.00 0.00 0.00 178.15 178.51 2ux1 h PHE 148 N -0.14 1.17 -0.59 1.37 0.04 -1.24 -2.33 116.94 115.22 2ux1 h PHE 148 Ca 0.05 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 2ux1 h PHE 148 Cb 0.22 -0.39 -0.03 0.00 2.20 0.00 0.00 35.95 37.95 2ux1 h PHE 148 CO -0.18 0.76 0.29 -0.97 -0.60 0.00 0.00 178.31 177.61 2ux1 h ASN 149 N 1.23 0.77 -0.40 2.17 -1.24 -0.79 0.01 115.58 117.33 2ux1 h ASN 149 Ca 0.33 -0.13 -0.13 0.00 0.71 0.00 0.00 56.30 57.08 2ux1 h ASN 149 Cb -0.08 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 38.76 2ux1 h ASN 149 CO -0.06 0.68 -0.26 0.58 -1.29 0.00 0.00 177.43 177.08 2ux1 h VAL 150 N 0.81 1.28 -0.37 2.57 2.07 -1.12 -2.07 116.25 119.42 2ux1 h VAL 150 Ca 0.20 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.28 2ux1 h VAL 150 Cb 0.11 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2ux1 h VAL 150 CO -0.03 0.47 0.11 0.00 0.02 0.00 0.00 177.57 178.15 2ux1 h ALA 151 N 0.80 0.49 -0.73 1.67 0.00 -1.20 -2.85 119.26 117.44 2ux1 h ALA 151 Ca 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2ux1 h ALA 151 Cb 0.83 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2ux1 h ALA 151 CO 0.07 0.13 0.41 -0.22 0.00 0.00 0.00 179.25 179.64 2ux1 h LYS 152 N 0.45 1.01 -0.41 0.00 3.64 -0.93 -1.60 116.57 118.73 2ux1 h LYS 152 Ca 0.12 -0.11 0.06 0.00 -1.27 0.00 0.00 60.65 59.45 2ux1 h LYS 152 Cb 0.26 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.82 2ux1 h LYS 152 CO -0.00 0.74 0.11 0.00 -2.27 0.00 0.00 179.45 178.02 2ux1 h ALA 153 N 1.21 0.46 -0.21 5.00 0.00 -1.27 0.10 119.26 124.55 2ux1 h ALA 153 Ca 0.26 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 2ux1 h ALA 153 Cb 0.02 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2ux1 h ALA 153 CO -0.04 -0.29 -0.17 1.03 0.00 0.00 0.00 179.25 179.78 2ux1 h SER 154 N 0.25 0.52 -0.65 0.00 0.87 -1.28 -2.16 113.55 111.09 2ux1 h SER 154 Ca 0.19 -0.45 -0.01 0.00 -1.23 0.00 0.00 61.79 60.30 2ux1 h SER 154 Cb 0.22 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.00 2ux1 h SER 154 CO -0.23 0.86 0.39 0.40 -0.53 0.00 0.00 176.83 177.71 2ux1 h ILE 155 N 0.18 1.19 -0.25 2.23 1.08 -1.12 -0.48 117.51 120.34 2ux1 h ILE 155 Ca 0.04 -0.44 -0.10 0.00 -0.39 0.00 0.00 64.86 63.97 2ux1 h ILE 155 Cb 0.69 0.30 -0.01 0.00 -3.07 0.00 0.00 36.82 34.73 2ux1 h ILE 155 CO 0.04 0.20 -0.27 -0.33 -0.69 0.00 0.00 178.15 177.11 2ux1 h GLU 156 N 0.89 0.49 -0.58 2.37 5.08 -0.91 -0.97 114.58 120.94 2ux1 h GLU 156 Ca 0.23 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2ux1 h GLU 156 Cb -0.01 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 2ux1 h GLU 156 CO -0.04 0.72 0.27 -0.22 -1.00 0.00 0.00 179.01 178.74 2ux1 h LYS 157 N 0.43 0.85 -0.92 2.33 3.64 -0.86 -1.97 116.57 120.07 2ux1 h LYS 157 Ca 0.06 -0.13 0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2ux1 h LYS 157 Cb 0.70 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 2ux1 h LYS 157 CO 0.05 0.70 0.60 0.45 -2.27 0.00 0.00 179.45 178.98 2ux1 h HIS 158 N 0.80 1.13 -0.44 1.91 3.86 -0.30 -2.28 115.15 119.83 2ux1 h HIS 158 Ca 0.20 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.47 2ux1 h HIS 158 Cb 0.13 -0.38 -0.04 0.00 1.06 0.00 0.00 27.41 28.19 2ux1 h HIS 158 CO 0.00 0.68 0.22 0.82 0.86 0.00 0.00 177.93 180.52 2ux1 h ILE 159 N 1.20 0.98 -0.28 2.45 2.04 -0.91 0.17 117.51 123.15 2ux1 h ILE 159 Ca 0.35 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 66.12 2ux1 h ILE 159 Cb -0.07 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.44 2ux1 h ILE 159 CO -0.10 0.08 -0.09 -0.25 0.00 0.00 0.00 178.15 177.80 2ux1 h TRP 160 N 0.45 -0.19 -0.32 1.37 7.01 -0.96 -0.43 115.95 122.87 2ux1 h TRP 160 Ca 0.19 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.20 2ux1 h TRP 160 Cb 0.09 0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.26 2ux1 h TRP 160 CO -0.10 -0.14 0.13 0.52 -2.79 0.00 0.00 178.44 176.06 2ux1 h MET 161 N -0.02 0.48 -0.46 2.65 2.86 -0.88 0.34 114.93 119.90 2ux1 h MET 161 Ca 0.14 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2ux1 h MET 161 Cb 0.24 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 2ux1 h MET 161 CO -0.31 0.48 0.25 -0.07 1.06 0.00 0.00 176.91 178.32 2ux1 h LEU 162 N 0.38 0.57 -0.89 1.22 3.38 -0.54 -1.52 115.31 117.91 2ux1 h LEU 162 Ca 0.11 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 2ux1 h LEU 162 Cb 0.17 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2ux1 h LEU 162 CO -0.01 0.50 0.04 1.56 0.09 0.00 0.00 178.44 180.62 2ux1 h GLN 163 N 0.61 0.86 -0.44 1.13 1.08 -0.92 -1.99 115.11 115.44 2ux1 h GLN 163 Ca 0.16 -0.22 -0.00 0.00 -1.45 0.00 0.00 58.65 57.14 2ux1 h GLN 163 Cb 0.05 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 2ux1 h GLN 163 CO -0.03 0.83 0.26 0.00 -0.95 0.00 0.00 178.83 178.95 2ux1 h ALA 164 N 1.23 0.56 -0.99 3.87 0.00 -0.73 0.26 119.26 123.45 2ux1 h ALA 164 Ca 0.16 -0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.16 2ux1 h ALA 164 Cb 0.43 -0.18 -0.09 0.00 0.00 0.00 0.00 17.79 17.95 2ux1 h ALA 164 CO 0.02 0.05 0.62 1.49 0.00 0.00 0.00 179.25 181.42 2ux1 h GLU 165 N 0.58 0.83 -0.09 0.00 4.57 -0.82 -0.95 114.58 118.69 2ux1 h GLU 165 Ca 0.16 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2ux1 h GLU 165 Cb 0.00 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.40 2ux1 h GLU 165 CO -0.03 0.55 0.00 1.28 -1.18 0.00 0.00 179.01 179.63 2ux1 n LEU 166 N -4.67 0.55 -0.23 1.64 4.77 -0.59 -4.87 117.00 113.60 2ux1 n LEU 166 Ca 0.21 -0.26 -0.03 0.00 -0.03 0.00 0.00 56.01 55.89 2ux1 n LEU 166 Cb 0.47 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2ux1 n LEU 166 CO 0.25 0.13 -0.03 0.61 -1.33 0.00 0.00 177.39 177.02 2ux1 n GLY 167 N 0.73 0.61 3.40 -0.72 0.00 -0.36 -5.02 105.19 103.84 2ux1 n GLY 167 Ca 0.07 -0.87 -0.21 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.13 1.48 0.82 1.61 -0.21 0.83 -4.99 119.66 117.07 2ux1 s GLN 168 Ca 0.00 -1.68 -0.11 0.00 0.02 0.00 0.00 55.36 53.59 2ux1 s GLN 168 Cb 0.00 -1.36 0.08 0.00 1.00 0.00 0.00 33.01 32.73 2ux1 s GLN 168 CO 0.00 0.22 1.09 0.00 -2.12 0.00 0.00 175.29 174.48 2ux1 s ALA 169 N -2.81 2.03 0.26 6.09 0.00 -1.26 -3.06 121.76 123.02 2ux1 s ALA 169 Ca 0.26 -0.04 -0.00 0.00 0.00 0.00 0.00 51.96 52.17 2ux1 s ALA 169 Cb -0.02 -3.17 0.35 0.00 0.00 0.00 0.00 23.12 20.28 2ux1 s ALA 169 CO 0.10 -1.91 1.73 -1.35 0.00 0.00 0.00 175.76 174.33 2ux1 h PRO 170 N -1.23 0.66 -6.12 0.00 0.11 -1.89 -3.45 132.00 120.08 2ux1 h PRO 170 Ca -0.47 -0.21 -0.43 0.00 0.11 0.00 0.00 66.00 65.00 2ux1 h PRO 170 Cb 1.26 -0.06 0.04 0.00 0.11 0.00 0.00 31.00 32.35 2ux1 h PRO 170 CO 0.56 0.77 -0.80 1.63 -0.21 0.00 0.00 178.00 179.94 2ux1 n LYS 171 N -4.17 -5.28 0.00 1.05 5.02 -1.26 -4.86 118.16 108.66 2ux1 n LYS 171 Ca 0.01 0.63 0.11 0.00 -2.02 0.00 0.00 58.31 57.04 2ux1 n LYS 171 Cb 0.36 -5.32 0.66 0.00 -0.02 0.00 0.00 35.03 30.71 2ux1 n LYS 171 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16