#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2az3 n ASP 5 N 0.00 0.00 -4.64 0.26 9.92 -1.26 -3.97 116.55 116.85 2az3 n ASP 5 Ca 0.00 -1.33 -0.44 0.00 -0.53 0.00 0.00 54.79 52.49 2az3 n ASP 5 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 2az3 n ASP 5 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2az3 n GLU 6 N -0.74 2.49 -4.39 -1.24 2.13 -1.26 -4.87 120.64 112.76 2az3 n GLU 6 Ca 0.10 0.87 -0.27 0.00 0.66 0.00 0.00 57.16 58.52 2az3 n GLU 6 Cb 0.05 -2.97 -0.12 0.00 0.27 0.00 0.00 31.44 28.66 2az3 n GLU 6 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2az3 s ARG 7 N 4.87 1.42 0.07 5.31 0.52 -1.26 -1.66 118.95 128.21 2az3 s ARG 7 Ca 0.93 -1.42 0.01 0.00 -0.52 0.00 0.00 55.73 54.73 2az3 s ARG 7 Cb -0.48 -1.76 -0.04 0.00 0.52 0.00 0.00 34.95 33.19 2az3 s ARG 7 CO 0.43 0.39 -0.05 -0.08 0.02 0.00 0.00 175.30 176.01 2az3 s THR 8 N -1.46 0.47 -0.17 0.02 -1.32 0.80 -4.69 115.64 109.29 2az3 s THR 8 Ca 0.17 -1.75 -0.10 0.00 -1.21 0.00 0.00 61.69 58.80 2az3 s THR 8 Cb -0.09 -1.44 -0.05 0.00 -1.51 0.00 0.00 72.50 69.42 2az3 s THR 8 CO 0.08 -0.85 0.15 0.12 -2.21 0.00 0.00 174.62 171.91 2az3 s PHE 9 N -3.40 3.48 -0.00 9.09 5.36 -1.26 -1.71 117.98 129.54 2az3 s PHE 9 Ca 0.06 0.43 0.01 0.00 -0.96 0.00 0.00 56.93 56.47 2az3 s PHE 9 Cb 0.04 -2.11 -0.00 0.00 -0.34 0.00 0.00 43.02 40.61 2az3 s PHE 9 CO -0.06 0.43 -0.03 0.08 -1.46 0.00 0.00 175.22 174.18 2az3 s VAL 10 N -0.09 0.26 -0.09 3.12 1.01 -0.56 -1.94 120.40 122.10 2az3 s VAL 10 Ca 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 61.98 61.94 2az3 s VAL 10 Cb -0.12 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.07 2az3 s VAL 10 CO 0.01 0.08 0.03 -0.32 0.00 0.00 0.00 175.10 174.90 2az3 s MET 11 N -0.04 0.37 -0.05 2.72 1.75 -0.46 0.18 119.30 123.79 2az3 s MET 11 Ca 0.01 0.08 -0.30 0.00 -1.25 0.00 0.00 55.69 54.22 2az3 s MET 11 Cb -0.02 -1.13 -0.04 0.00 2.84 0.00 0.00 34.83 36.49 2az3 s MET 11 CO -0.00 -0.40 1.24 0.08 -0.65 0.00 0.00 175.02 175.29 2az3 s VAL 12 N 2.03 4.15 0.82 10.11 1.01 -0.21 -0.72 120.40 137.59 2az3 s VAL 12 Ca 0.04 1.48 -0.10 0.00 0.00 0.00 0.00 61.98 63.40 2az3 s VAL 12 Cb -0.13 -3.95 0.13 0.00 0.00 0.00 0.00 36.38 32.42 2az3 s VAL 12 CO -0.06 -0.01 1.16 -0.54 0.00 0.00 0.00 175.10 175.65 2az3 s LYS 13 N 2.31 1.48 0.47 2.72 1.02 -0.67 -1.37 119.74 125.71 2az3 s LYS 13 Ca 0.57 -0.40 0.14 0.00 0.02 0.00 0.00 55.97 56.31 2az3 s LYS 13 Cb -0.26 -2.04 1.08 0.00 -0.52 0.00 0.00 37.83 36.09 2az3 s LYS 13 CO 0.23 -1.78 2.05 -1.35 -0.92 0.00 0.00 175.35 173.57 2az3 h PRO 14 N -1.06 0.04 -0.57 -1.68 0.11 -1.81 -1.44 132.00 125.59 2az3 h PRO 14 Ca -0.43 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.57 2az3 h PRO 14 Cb 1.28 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2az3 h PRO 14 CO 0.49 0.14 -0.04 0.38 -0.21 0.00 0.00 178.00 178.76 2az3 h ASP 15 N 0.04 1.01 -0.48 -2.05 2.03 -1.88 -0.40 116.42 114.68 2az3 h ASP 15 Ca 0.01 -0.30 -0.11 0.00 -0.73 0.00 0.00 57.03 55.89 2az3 h ASP 15 Cb 0.19 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 38.40 2az3 h ASP 15 CO 0.01 1.09 -0.14 1.23 -1.03 0.00 0.00 179.24 180.39 2az3 h GLY 16 N 0.98 1.03 0.97 7.15 0.00 -1.44 0.04 103.07 111.79 2az3 h GLY 16 Ca 0.16 -0.87 -0.00 0.00 0.00 0.00 0.00 47.33 46.62 2az3 h GLY 16 CO 0.04 0.79 0.19 -2.08 0.00 0.00 0.00 176.54 175.48 2az3 h VAL 17 N 0.81 1.12 -0.07 4.60 2.07 -1.31 -0.56 116.25 122.90 2az3 h VAL 17 Ca 0.12 -0.29 -0.13 0.00 0.82 0.00 0.00 66.70 67.22 2az3 h VAL 17 Cb 0.71 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 2az3 h VAL 17 CO 0.05 0.12 -0.55 1.56 0.02 0.00 0.00 177.57 178.77 2az3 h GLN 18 N 0.41 0.20 -0.05 1.57 1.08 -0.86 -2.94 115.11 114.51 2az3 h GLN 18 Ca 0.11 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2az3 h GLN 18 Cb 0.03 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 2az3 h GLN 18 CO -0.02 0.70 0.00 0.54 -0.95 0.00 0.00 178.83 179.10 2az3 n ARG 19 N -3.91 1.31 -1.86 1.46 1.74 -0.02 -4.89 116.66 110.49 2az3 n ARG 19 Ca -0.02 -0.45 0.00 0.00 -0.77 0.00 0.00 57.85 56.61 2az3 n ARG 19 Cb 0.57 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 2az3 n ARG 19 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2az3 n GLY 20 N 0.98 0.47 0.83 -0.13 0.00 -1.03 -4.97 105.19 101.35 2az3 n GLY 20 Ca 0.17 -0.84 0.07 0.00 0.00 0.00 0.00 46.02 45.42 2az3 n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2az3 n LEU 21 N 0.00 3.39 -0.22 0.99 4.77 -0.25 -4.57 117.00 121.12 2az3 n LEU 21 Ca 0.00 -2.28 0.01 0.00 -0.03 0.00 0.00 56.01 53.71 2az3 n LEU 21 Cb 0.46 -0.35 0.13 0.00 -2.33 0.00 0.00 43.42 41.32 2az3 n LEU 21 CO 0.00 0.74 0.98 0.40 -1.33 0.00 0.00 177.39 178.19 2az3 h ILE 22 N 2.31 0.73 -0.39 -0.08 2.04 -1.88 -2.68 117.51 117.56 2az3 h ILE 22 Ca 0.00 -0.14 -0.10 0.00 1.00 0.00 0.00 64.86 65.63 2az3 h ILE 22 Cb 0.98 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 2az3 h ILE 22 CO 0.07 0.07 -0.14 1.23 0.00 0.00 0.00 178.15 179.39 2az3 h GLY 23 N 0.40 0.84 1.21 5.37 0.00 -1.96 -1.76 103.07 107.18 2az3 h GLY 23 Ca 0.33 -0.72 -0.04 0.00 0.00 0.00 0.00 47.33 46.90 2az3 h GLY 23 CO -0.34 0.66 0.26 -0.55 0.00 0.00 0.00 176.54 176.56 2az3 h ASP 24 N 0.58 0.92 -0.22 0.19 3.32 -1.84 -0.03 116.42 119.35 2az3 h ASP 24 Ca 0.09 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.93 2az3 h ASP 24 Cb 0.67 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 2az3 h ASP 24 CO 0.05 0.83 -0.16 0.40 -1.72 0.00 0.00 179.24 178.64 2az3 h ILE 25 N 0.98 1.32 -0.93 0.35 2.04 -1.22 -0.94 117.51 119.11 2az3 h ILE 25 Ca 0.23 -1.29 0.02 0.00 1.00 0.00 0.00 64.86 64.82 2az3 h ILE 25 Cb 0.21 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.91 2az3 h ILE 25 CO -0.02 0.40 0.62 0.58 0.00 0.00 0.00 178.15 179.72 2az3 h VAL 26 N 0.20 1.22 -0.41 1.67 2.07 -1.12 -2.03 116.25 117.85 2az3 h VAL 26 Ca 0.04 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 2az3 h VAL 26 Cb 0.69 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2az3 h VAL 26 CO 0.04 0.23 0.16 0.74 0.02 0.00 0.00 177.57 178.76 2az3 h THR 27 N 1.25 1.20 -0.66 2.57 2.02 -0.77 -0.54 112.91 117.98 2az3 h THR 27 Ca 0.35 -0.62 0.11 0.00 0.77 0.00 0.00 66.41 67.02 2az3 h THR 27 Cb -0.11 0.85 -0.08 0.00 -1.74 0.00 0.00 68.15 67.07 2az3 h THR 27 CO -0.09 0.23 0.24 0.03 0.37 0.00 0.00 175.52 176.30 2az3 h ARG 28 N 0.51 0.39 -0.00 6.66 3.08 -0.75 0.10 114.38 124.37 2az3 h ARG 28 Ca 0.13 -0.02 -0.25 0.00 0.07 0.00 0.00 59.98 59.91 2az3 h ARG 28 Cb 0.20 -0.09 0.01 0.00 0.08 0.00 0.00 29.97 30.17 2az3 h ARG 28 CO -0.01 0.26 -0.99 -0.07 -1.07 0.00 0.00 179.97 178.09 2az3 h LEU 29 N 0.40 0.73 -0.92 3.04 3.38 -0.91 -2.79 115.31 118.26 2az3 h LEU 29 Ca 0.34 -0.58 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 2az3 h LEU 29 Cb 0.47 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2az3 h LEU 29 CO -0.35 1.38 0.36 -0.33 0.09 0.00 0.00 178.44 179.58 2az3 h GLU 30 N 0.32 1.14 0.00 1.13 5.08 -0.62 -2.61 114.58 119.01 2az3 h GLU 30 Ca -0.10 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 57.96 2az3 h GLU 30 Cb 1.63 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.66 2az3 h GLU 30 CO 0.18 0.89 -0.58 1.15 -1.00 0.00 0.00 179.01 179.66 2az3 h THR 31 N 1.12 1.30 0.00 1.13 2.02 -0.79 -1.29 112.91 116.40 2az3 h THR 31 Ca 0.27 -2.05 0.00 0.00 0.77 0.00 0.00 66.41 65.40 2az3 h THR 31 Cb 0.14 2.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 2az3 h THR 31 CO -0.03 0.56 0.00 1.17 0.37 0.00 0.00 175.52 177.59 2az3 n LYS 32 N -3.69 0.03 -0.37 6.66 3.00 -1.06 -4.88 118.16 117.85 2az3 n LYS 32 Ca -0.01 0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.49 2az3 n LYS 32 Cb 0.61 -1.55 0.00 0.00 0.00 0.00 0.00 35.03 34.10 2az3 n LYS 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2az3 n GLY 33 N 0.53 0.78 3.89 3.14 0.00 -0.49 -5.07 105.19 107.97 2az3 n GLY 33 Ca 0.05 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 2az3 n GLY 33 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2az3 s LEU 34 N 0.00 4.06 -0.23 0.99 1.43 -1.00 -4.94 118.68 119.00 2az3 s LEU 34 Ca 0.00 0.83 -0.07 0.00 -1.03 0.00 0.00 54.13 53.86 2az3 s LEU 34 Cb 0.00 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 2az3 s LEU 34 CO 0.00 -0.18 0.06 -0.75 0.23 0.00 0.00 176.35 175.71 2az3 s LYS 35 N -3.35 3.70 -0.01 1.70 2.20 0.42 -4.45 119.74 119.95 2az3 s LYS 35 Ca 0.46 -0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 55.30 2az3 s LYS 35 Cb -0.11 -3.28 -0.06 0.00 -1.51 0.00 0.00 37.83 32.88 2az3 s LYS 35 CO 0.27 -0.09 1.51 1.41 -0.36 0.00 0.00 175.35 178.09 2az3 s MET 36 N 1.35 4.24 -0.00 4.03 -2.45 -1.26 -0.92 119.30 124.28 2az3 s MET 36 Ca 0.05 2.08 0.03 0.00 -1.25 0.00 0.00 55.69 56.60 2az3 s MET 36 Cb -0.15 -3.69 -0.04 0.00 1.25 0.00 0.00 34.83 32.20 2az3 s MET 36 CO 0.03 -0.69 0.15 1.33 1.05 0.00 0.00 175.02 176.89 2az3 n VAL 37 N 4.92 0.00 -3.87 10.11 0.24 -0.50 -4.95 118.33 124.29 2az3 n VAL 37 Ca 0.15 -0.42 -0.10 0.00 -2.04 0.00 0.00 64.34 61.93 2az3 n VAL 37 Cb 0.43 1.00 -0.09 0.00 -1.47 0.00 0.00 33.84 33.71 2az3 n VAL 37 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2az3 s GLY 38 N -1.33 0.07 -0.30 7.63 0.00 -1.02 0.04 107.32 112.41 2az3 s GLY 38 Ca 0.01 -0.29 -0.16 0.00 0.00 0.00 0.00 44.72 44.28 2az3 s GLY 38 CO 0.14 -0.45 1.13 -0.32 0.00 0.00 0.00 173.10 173.60 2az3 s GLY 39 N -1.90 0.31 -0.18 0.20 0.00 -1.26 -1.60 107.32 102.89 2az3 s GLY 39 Ca -0.08 3.51 -0.07 0.00 0.00 0.00 0.00 44.72 48.08 2az3 s GLY 39 CO -0.02 2.76 0.40 0.54 0.00 0.00 0.00 173.10 176.78 2az3 s LYS 40 N 1.30 0.33 -0.05 2.90 3.01 0.21 -4.98 119.74 122.46 2az3 s LYS 40 Ca -0.08 0.94 -0.26 0.00 -1.01 0.00 0.00 55.97 55.56 2az3 s LYS 40 Cb -0.03 0.20 -0.03 0.00 -1.01 0.00 0.00 37.83 36.96 2az3 s LYS 40 CO -0.13 -0.23 0.82 0.12 0.51 0.00 0.00 175.35 176.45 2az3 s PHE 41 N 2.25 3.60 -0.01 3.18 5.36 -1.26 -0.27 117.98 130.82 2az3 s PHE 41 Ca -0.04 1.43 -0.28 0.00 -0.96 0.00 0.00 56.93 57.08 2az3 s PHE 41 Cb -0.11 -2.95 0.10 0.00 -0.34 0.00 0.00 43.02 39.72 2az3 s PHE 41 CO -0.12 0.03 0.86 0.00 -1.46 0.00 0.00 175.22 174.52 2az3 s MET 42 N 0.97 0.85 -0.12 10.12 0.23 -0.84 -4.99 119.30 125.52 2az3 s MET 42 Ca 0.43 -0.23 -0.06 0.00 -1.03 0.00 0.00 55.69 54.80 2az3 s MET 42 Cb -0.19 0.39 -0.04 0.00 -1.53 0.00 0.00 34.83 33.47 2az3 s MET 42 CO 0.22 -0.36 0.09 0.50 -2.03 0.00 0.00 175.02 173.44 2az3 s ARG 43 N -2.83 3.41 -0.19 3.16 3.52 -1.26 -1.07 118.95 123.68 2az3 s ARG 43 Ca 0.03 -0.23 -0.09 0.00 -0.13 0.00 0.00 55.73 55.30 2az3 s ARG 43 Cb -0.01 -3.09 -0.05 0.00 -1.56 0.00 0.00 34.95 30.24 2az3 s ARG 43 CO -0.07 0.68 0.12 0.42 -0.81 0.00 0.00 175.30 175.64 2az3 s ILE 44 N -0.78 5.32 0.21 4.11 1.01 -1.26 -5.02 121.20 124.80 2az3 s ILE 44 Ca 0.13 0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.96 2az3 s ILE 44 Cb -0.12 -3.41 0.02 0.00 0.01 0.00 0.00 42.46 38.96 2az3 s ILE 44 CO 0.03 0.46 0.19 -0.90 0.00 0.00 0.00 174.94 174.72 2az3 n ASP 45 N 3.37 1.43 0.11 3.58 5.68 -1.26 -4.50 116.55 124.96 2az3 n ASP 45 Ca -0.16 -1.67 -0.13 0.00 -0.50 0.00 0.00 54.79 52.33 2az3 n ASP 45 Cb 0.52 -0.05 -0.06 0.00 -1.14 0.00 0.00 41.12 40.39 2az3 n ASP 45 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2az3 h GLU 46 N 0.00 -0.48 0.11 0.11 4.39 -1.98 -2.07 114.58 114.66 2az3 h GLU 46 Ca -0.12 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.61 2az3 h GLU 46 Cb 0.47 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 2az3 h GLU 46 CO 0.19 -0.32 -0.09 1.49 -1.16 0.00 0.00 179.01 179.12 2az3 h GLU 47 N -0.50 -0.20 -0.76 2.33 4.81 -1.99 -1.52 114.58 116.76 2az3 h GLU 47 Ca 0.03 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2az3 h GLU 47 Cb 0.53 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.92 2az3 h GLU 47 CO -0.18 -0.14 0.46 1.25 -0.73 0.00 0.00 179.01 179.67 2az3 h LEU 48 N -0.21 0.91 -0.80 1.64 5.85 -1.94 -1.46 115.31 119.29 2az3 h LEU 48 Ca 0.00 -0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.56 2az3 h LEU 48 Cb 0.20 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2az3 h LEU 48 CO -0.02 0.70 -0.11 0.00 -0.34 0.00 0.00 178.44 178.68 2az3 h ALA 49 N 1.24 0.99 -0.32 1.25 0.00 -1.27 -0.28 119.26 120.87 2az3 h ALA 49 Ca 0.27 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2az3 h ALA 49 Cb -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2az3 h ALA 49 CO -0.05 0.60 -0.26 0.45 0.00 0.00 0.00 179.25 179.99 2az3 h HIS 50 N 0.72 0.72 -0.00 0.00 3.86 -0.81 -0.57 115.15 119.06 2az3 h HIS 50 Ca 0.12 -0.17 -0.16 0.00 -1.16 0.00 0.00 60.37 59.01 2az3 h HIS 50 Cb 0.59 -0.17 0.01 0.00 1.06 0.00 0.00 27.41 28.90 2az3 h HIS 50 CO 0.03 0.83 -0.62 1.49 0.86 0.00 0.00 177.93 180.53 2az3 h GLU 51 N 0.55 0.42 -0.81 2.45 4.81 -1.17 -1.52 114.58 119.31 2az3 h GLU 51 Ca 0.07 -0.45 0.10 0.00 -0.13 0.00 0.00 59.36 58.96 2az3 h GLU 51 Cb 0.73 0.13 -0.08 0.00 0.63 0.00 0.00 28.75 30.17 2az3 h GLU 51 CO 0.06 1.11 0.44 1.25 -0.73 0.00 0.00 179.01 181.14 2az3 h HIS 52 N -0.08 0.80 -0.02 0.92 2.76 -0.74 -3.03 115.15 115.76 2az3 h HIS 52 Ca -0.08 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.12 2az3 h HIS 52 Cb 1.33 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 30.05 2az3 h HIS 52 CO 0.14 0.30 -0.32 0.66 -1.30 0.00 0.00 177.93 177.41 2az3 n TYR 53 N -4.79 0.00 -0.32 5.26 4.01 -0.25 -4.73 117.16 116.35 2az3 n TYR 53 Ca 0.14 0.00 0.34 0.00 -0.16 0.00 0.00 57.90 58.22 2az3 n TYR 53 Cb 0.30 0.00 0.73 0.00 -0.31 0.00 0.00 39.34 40.06 2az3 n TYR 53 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2az3 h ALA 54 N 3.54 3.03 0.00 -0.72 0.00 -1.14 0.97 119.26 124.94 2az3 h ALA 54 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2az3 h ALA 54 Cb 0.71 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2az3 h ALA 54 CO 0.00 -1.37 0.57 0.93 0.00 0.00 0.00 179.25 179.38 2az3 h GLU 55 N 0.04 0.00 -0.25 0.00 3.07 -1.84 0.17 114.58 115.76 2az3 h GLU 55 Ca 0.57 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.43 2az3 h GLU 55 Cb 2.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.09 2az3 h GLU 55 CO -0.04 0.00 0.00 0.72 -1.40 0.00 0.00 179.01 178.29 2az3 n HIS 56 N -2.61 0.32 0.25 4.33 8.25 0.34 -4.69 115.22 121.41 2az3 n HIS 56 Ca -0.01 -0.26 0.18 0.00 -0.26 0.00 0.00 57.72 57.37 2az3 n HIS 56 Cb 0.60 -0.01 0.90 0.00 1.12 0.00 0.00 29.99 32.59 2az3 n HIS 56 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2az3 h GLU 57 N 2.84 0.00 -0.68 -0.41 4.81 -0.78 -0.59 114.58 119.77 2az3 h GLU 57 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2az3 h GLU 57 Cb 0.72 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.10 2az3 h GLU 57 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 177.88 2az3 n ASP 58 N -3.50 4.49 -4.73 1.04 5.75 -1.26 -4.98 116.55 113.36 2az3 n ASP 58 Ca 0.00 -2.29 -0.26 0.00 -0.01 0.00 0.00 54.79 52.23 2az3 n ASP 58 Cb 0.30 -0.55 -0.07 0.00 -1.03 0.00 0.00 41.12 39.77 2az3 n ASP 58 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2az3 s LYS 59 N -1.54 2.63 0.41 0.11 1.02 -0.23 -5.01 119.74 117.13 2az3 s LYS 59 Ca 0.51 -1.00 0.28 0.00 0.02 0.00 0.00 55.97 55.77 2az3 s LYS 59 Cb 0.30 -2.49 0.96 0.00 -0.52 0.00 0.00 37.83 36.09 2az3 s LYS 59 CO 0.28 0.47 1.81 -1.00 -0.92 0.00 0.00 175.35 175.98 2az3 h PRO 60 N 2.55 0.00 -0.01 -1.68 0.14 -1.93 -3.00 132.00 128.07 2az3 h PRO 60 Ca -0.47 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.67 2az3 h PRO 60 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.34 2az3 h PRO 60 CO 0.60 0.00 -0.53 1.97 0.14 0.00 0.00 178.00 180.18 2az3 n PHE 61 N -2.79 0.00 -0.20 1.56 1.16 -1.26 -4.54 117.46 111.39 2az3 n PHE 61 Ca 0.02 0.00 0.01 0.00 -1.87 0.00 0.00 57.45 55.61 2az3 n PHE 61 Cb 0.36 -0.09 0.11 0.00 -1.61 0.00 0.00 39.48 38.24 2az3 n PHE 61 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 2az3 h PHE 62 N 0.98 0.10 -0.15 2.97 3.57 -1.76 -1.67 116.94 120.97 2az3 h PHE 62 Ca 0.00 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.40 2az3 h PHE 62 Cb 0.57 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2az3 h PHE 62 CO 0.00 -0.09 -0.49 -0.44 -2.23 0.00 0.00 178.31 175.06 2az3 h ASP 63 N 0.19 0.42 -0.07 0.41 3.32 -1.81 -1.82 116.42 117.07 2az3 h ASP 63 Ca 0.32 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 2az3 h ASP 63 Cb 0.50 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2az3 h ASP 63 CO -0.46 0.85 -0.09 1.23 -1.72 0.00 0.00 179.24 179.05 2az3 h GLY 64 N 1.21 0.37 1.35 2.75 0.00 -1.73 -2.62 103.07 104.40 2az3 h GLY 64 Ca 0.02 -0.22 -0.29 0.00 0.00 0.00 0.00 47.33 46.83 2az3 h GLY 64 CO 0.08 0.21 -1.26 -2.00 0.00 0.00 0.00 176.54 173.58 2az3 h LEU 65 N 0.33 0.76 -0.69 3.11 6.46 -0.99 -2.12 115.31 122.17 2az3 h LEU 65 Ca 0.07 -0.73 -0.14 0.00 -0.12 0.00 0.00 57.88 56.96 2az3 h LEU 65 Cb 0.37 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 2az3 h LEU 65 CO 0.02 1.54 -0.63 -0.37 -0.62 0.00 0.00 178.44 178.38 2az3 h VAL 66 N 0.21 1.43 -0.47 1.05 -1.51 -1.32 -0.69 116.25 114.95 2az3 h VAL 66 Ca -0.18 -2.10 -0.10 0.00 -1.23 0.00 0.00 66.70 63.09 2az3 h VAL 66 Cb 1.94 2.11 -0.02 0.00 -2.13 0.00 0.00 31.29 33.19 2az3 h VAL 66 CO 0.23 0.61 -0.10 -1.28 -1.23 0.00 0.00 177.57 175.80 2az3 h SER 67 N 0.08 0.84 -0.02 4.19 0.87 -1.45 -2.58 113.55 115.48 2az3 h SER 67 Ca -0.01 -0.25 -0.05 0.00 -1.23 0.00 0.00 61.79 60.24 2az3 h SER 67 Cb 1.13 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.86 2az3 h SER 67 CO 0.09 0.96 -0.20 0.15 -0.53 0.00 0.00 176.83 177.30 2az3 h PHE 68 N 0.77 0.24 0.00 2.24 3.57 -1.18 -1.93 116.94 120.65 2az3 h PHE 68 Ca 0.13 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2az3 h PHE 68 Cb 0.60 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.31 2az3 h PHE 68 CO 0.03 0.87 0.00 1.51 -2.23 0.00 0.00 178.31 178.49 2az3 n ILE 69 N -4.55 0.68 0.53 1.41 0.13 -0.28 -1.20 119.36 116.07 2az3 n ILE 69 Ca -0.09 0.17 0.06 0.00 -1.10 0.00 0.00 62.75 61.79 2az3 n ILE 69 Cb 0.46 -0.85 -0.00 0.00 -0.84 0.00 0.00 39.64 38.40 2az3 n ILE 69 CO 0.00 0.00 0.00 1.07 2.80 0.00 0.00 176.55 180.42 2az3 n THR 70 N -1.47 0.00 1.53 9.51 5.66 -0.97 -4.58 114.28 123.96 2az3 n THR 70 Ca 0.05 -0.37 0.15 0.00 -3.05 0.00 0.00 64.05 60.83 2az3 n THR 70 Cb 0.21 1.14 0.77 0.00 -1.55 0.00 0.00 70.33 70.89 2az3 n THR 70 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2az3 n SER 71 N -0.24 0.10 -3.63 1.09 3.41 -0.35 -4.89 113.62 109.11 2az3 n SER 71 Ca 0.05 -0.39 -0.03 0.00 -0.26 0.00 0.00 58.87 58.24 2az3 n SER 71 Cb 0.25 -0.19 -0.01 0.00 -0.26 0.00 0.00 64.21 64.00 2az3 n SER 71 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2az3 s GLY 72 N -2.45 -0.35 0.81 5.00 0.00 -1.26 -5.09 107.32 103.99 2az3 s GLY 72 Ca 0.32 0.83 -0.12 0.00 0.00 0.00 0.00 44.72 45.76 2az3 s GLY 72 CO 0.45 0.23 1.15 2.56 0.00 0.00 0.00 173.10 177.48 2az3 s PRO 73 N -2.76 1.73 0.15 2.90 0.04 -1.26 -4.58 135.00 131.21 2az3 s PRO 73 Ca 0.11 1.50 0.07 0.00 0.04 0.00 0.00 61.00 62.72 2az3 s PRO 73 Cb 0.01 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 2az3 s PRO 73 CO -0.03 -2.10 -0.15 0.14 0.04 0.00 0.00 177.00 174.90 2az3 s VAL 74 N -2.52 1.52 -0.41 -0.36 -7.23 -0.24 -3.83 120.40 107.34 2az3 s VAL 74 Ca 0.67 -1.89 -0.12 0.00 -1.81 0.00 0.00 61.98 58.84 2az3 s VAL 74 Cb -0.23 -1.73 0.05 0.00 0.56 0.00 0.00 36.38 35.03 2az3 s VAL 74 CO 0.53 -0.45 0.27 0.12 -0.31 0.00 0.00 175.10 175.26 2az3 s PHE 75 N -2.36 3.27 0.17 2.82 5.36 -0.47 -1.98 117.98 124.78 2az3 s PHE 75 Ca 0.14 -1.09 -0.15 0.00 -0.96 0.00 0.00 56.93 54.87 2az3 s PHE 75 Cb -0.04 -2.75 -0.07 0.00 -0.34 0.00 0.00 43.02 39.82 2az3 s PHE 75 CO 0.04 -0.73 0.58 0.00 -1.46 0.00 0.00 175.22 173.65 2az3 s ALA 76 N 1.54 3.54 0.17 11.12 0.00 0.62 -1.04 121.76 137.72 2az3 s ALA 76 Ca 0.03 -0.10 -0.12 0.00 0.00 0.00 0.00 51.96 51.77 2az3 s ALA 76 Cb -0.21 -2.56 0.01 0.00 0.00 0.00 0.00 23.12 20.35 2az3 s ALA 76 CO 0.06 0.44 0.37 -1.64 0.00 0.00 0.00 175.76 174.98 2az3 s MET 77 N -2.08 1.21 -0.04 0.00 1.00 0.13 -0.62 119.30 118.89 2az3 s MET 77 Ca 0.40 -1.02 0.01 0.00 0.00 0.00 0.00 55.69 55.09 2az3 s MET 77 Cb -0.15 0.43 0.02 0.00 0.00 0.00 0.00 34.83 35.13 2az3 s MET 77 CO 0.19 -0.47 -0.06 0.08 0.00 0.00 0.00 175.02 174.76 2az3 s VAL 78 N -3.92 0.67 0.18 -6.03 1.01 -0.63 -1.50 120.40 110.18 2az3 s VAL 78 Ca 0.12 -0.22 0.10 0.00 0.00 0.00 0.00 61.98 61.98 2az3 s VAL 78 Cb 0.02 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 2az3 s VAL 78 CO -0.03 0.25 -0.20 0.26 0.00 0.00 0.00 175.10 175.38 2az3 s TRP 79 N 0.74 2.01 0.04 5.22 0.52 -0.69 -1.41 118.94 125.37 2az3 s TRP 79 Ca -0.11 -0.42 0.02 0.00 0.02 0.00 0.00 56.10 55.60 2az3 s TRP 79 Cb -0.14 -0.99 -0.02 0.00 -1.15 0.00 0.00 33.47 31.17 2az3 s TRP 79 CO 0.01 0.41 -0.07 -2.00 0.02 0.00 0.00 176.95 175.32 2az3 s GLU 80 N -2.81 0.50 0.00 4.98 2.12 -0.10 -0.14 118.70 123.25 2az3 s GLU 80 Ca 0.18 -0.69 0.00 0.00 0.36 0.00 0.00 54.97 54.82 2az3 s GLU 80 Cb -0.06 -0.26 0.00 0.00 0.26 0.00 0.00 34.13 34.06 2az3 s GLU 80 CO 0.08 0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.26 2az3 n GLY 81 N 1.60 0.27 3.67 -1.50 0.00 -0.67 -0.43 105.19 108.13 2az3 n GLY 81 Ca -0.22 -1.61 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 2az3 n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2az3 n ALA 82 N -1.05 1.80 -2.45 4.61 0.00 -1.26 -2.52 120.51 119.64 2az3 n ALA 82 Ca 0.00 0.25 -0.20 0.00 0.00 0.00 0.00 53.44 53.49 2az3 n ALA 82 Cb 0.00 -2.65 -0.01 0.00 0.00 0.00 0.00 19.45 16.79 2az3 n ALA 82 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2az3 n ASP 83 N 6.88 -5.61 -0.23 0.00 2.03 -1.26 -4.81 116.55 113.54 2az3 n ASP 83 Ca 0.19 -0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.53 2az3 n ASP 83 Cb 0.39 -4.67 0.14 0.00 -0.72 0.00 0.00 41.12 36.27 2az3 n ASP 83 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2az3 h ALA 84 N 1.00 0.88 -0.14 -1.67 0.00 -1.74 0.79 119.26 118.38 2az3 h ALA 84 Ca -0.47 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2az3 h ALA 84 Cb 1.34 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2az3 h ALA 84 CO 0.55 -0.24 0.09 1.79 0.00 0.00 0.00 179.25 181.44 2az3 h THR 85 N 0.37 1.05 -0.20 0.00 1.35 -1.88 0.38 112.91 113.99 2az3 h THR 85 Ca 0.36 -0.13 -0.03 0.00 -0.55 0.00 0.00 66.41 66.06 2az3 h THR 85 Cb 0.52 0.89 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 2az3 h THR 85 CO -0.38 0.05 0.00 -0.09 -0.25 0.00 0.00 175.52 174.85 2az3 h ARG 86 N 0.17 0.35 -0.85 4.72 2.43 -1.68 -2.26 114.38 117.27 2az3 h ARG 86 Ca 0.05 -0.11 0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2az3 h ARG 86 Cb 0.01 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.48 2az3 h ARG 86 CO -0.01 0.54 0.56 1.96 -1.51 0.00 0.00 179.97 181.51 2az3 h GLN 87 N 0.11 1.07 -0.26 0.20 1.08 -0.31 -1.36 115.11 115.65 2az3 h GLN 87 Ca 0.06 -0.06 -0.14 0.00 -1.45 0.00 0.00 58.65 57.05 2az3 h GLN 87 Cb 0.38 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 2az3 h GLN 87 CO 0.01 0.71 -0.43 0.28 -0.95 0.00 0.00 178.83 178.45 2az3 h VAL 88 N 1.10 1.30 -0.57 -0.54 2.07 -0.20 -1.05 116.25 118.36 2az3 h VAL 88 Ca 0.33 -1.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.15 2az3 h VAL 88 Cb -0.05 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2az3 h VAL 88 CO -0.08 0.51 0.03 0.03 0.02 0.00 0.00 177.57 178.08 2az3 h ARG 89 N 0.51 0.96 -0.29 1.57 2.47 -0.82 -1.57 114.38 117.22 2az3 h ARG 89 Ca 0.04 -0.27 -0.16 0.00 -1.26 0.00 0.00 59.98 58.33 2az3 h ARG 89 Cb 0.96 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 29.17 2az3 h ARG 89 CO 0.09 0.93 -0.44 1.96 0.56 0.00 0.00 179.97 183.07 2az3 h GLN 90 N 0.90 0.80 -0.78 0.04 4.20 -0.92 -3.05 115.11 116.30 2az3 h GLN 90 Ca 0.17 -0.48 0.12 0.00 0.06 0.00 0.00 58.65 58.52 2az3 h GLN 90 Cb 0.48 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.25 2az3 h GLN 90 CO 0.02 1.11 0.51 -0.07 -0.67 0.00 0.00 178.83 179.73 2az3 h LEU 91 N 0.56 0.54 -0.36 1.46 4.07 -0.91 -2.78 115.31 117.89 2az3 h LEU 91 Ca 0.03 0.02 -0.19 0.00 0.08 0.00 0.00 57.88 57.82 2az3 h LEU 91 Cb 1.04 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.69 2az3 h LEU 91 CO 0.10 0.30 -0.68 0.24 -1.08 0.00 0.00 178.44 177.31 2az3 h MET 92 N 0.58 0.58 0.00 1.13 2.86 -1.26 -1.27 114.93 117.56 2az3 h MET 92 Ca 0.37 -0.44 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2az3 h MET 92 Cb 0.65 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.39 2az3 h MET 92 CO -0.14 1.06 0.00 0.41 1.06 0.00 0.00 176.91 179.30 2az3 n GLY 93 N 0.50 -1.37 3.58 8.32 0.00 -1.05 -1.42 105.19 113.76 2az3 n GLY 93 Ca -0.05 -1.54 -0.40 0.00 0.00 0.00 0.00 46.02 44.03 2az3 n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2az3 n ALA 94 N -1.26 -0.13 -0.17 4.61 0.00 -1.26 -4.84 120.51 117.46 2az3 n ALA 94 Ca 0.00 0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.69 2az3 n ALA 94 Cb 0.00 -2.03 0.45 0.00 0.00 0.00 0.00 19.45 17.88 2az3 n ALA 94 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2az3 h THR 95 N 1.02 0.86 -3.11 0.00 2.02 -1.97 -3.29 112.91 108.44 2az3 h THR 95 Ca -0.45 -0.18 -0.66 0.00 0.77 0.00 0.00 66.41 65.89 2az3 h THR 95 Cb 1.36 0.30 -0.16 0.00 -1.74 0.00 0.00 68.15 67.90 2az3 h THR 95 CO 0.53 0.10 0.26 -0.62 0.37 0.00 0.00 175.52 176.16 2az3 s ASP 96 N -6.03 6.24 0.42 4.18 -1.08 -1.26 -4.73 116.67 114.40 2az3 s ASP 96 Ca -0.09 -0.85 0.23 0.00 -0.52 0.00 0.00 52.55 51.33 2az3 s ASP 96 Cb 0.21 -2.35 1.23 0.00 -1.46 0.00 0.00 42.92 40.54 2az3 s ASP 96 CO 0.77 -1.08 1.73 0.00 0.52 0.00 0.00 175.17 177.11 2az3 h ALA 97 N 9.18 2.44 0.00 3.66 0.00 -1.59 0.61 119.26 133.56 2az3 h ALA 97 Ca -0.28 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2az3 h ALA 97 Cb 1.08 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2az3 h ALA 97 CO 1.04 -0.90 0.00 1.04 0.00 0.00 0.00 179.25 180.43 2az3 n GLN 98 N -4.61 0.04 -0.01 0.00 6.02 -1.26 -1.59 117.38 115.97 2az3 n GLN 98 Ca 0.29 0.25 0.08 0.00 -0.01 0.00 0.00 57.00 57.61 2az3 n GLN 98 Cb 1.06 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 30.70 2az3 n GLN 98 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2az3 n ASP 99 N -1.46 1.26 -4.76 1.08 2.03 0.21 -5.02 116.55 109.89 2az3 n ASP 99 Ca 0.04 -0.14 -0.38 0.00 0.52 0.00 0.00 54.79 54.83 2az3 n ASP 99 Cb 0.15 1.61 0.02 0.00 -0.72 0.00 0.00 41.12 42.18 2az3 n ASP 99 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2az3 s ALA 100 N -3.00 2.96 0.26 -1.67 0.00 -0.62 -4.78 121.76 114.91 2az3 s ALA 100 Ca -0.04 1.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.86 2az3 s ALA 100 Cb 0.10 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.62 2az3 s ALA 100 CO 0.66 -1.10 1.09 0.00 0.00 0.00 0.00 175.76 176.40 2az3 s ALA 101 N -1.35 3.40 0.46 0.00 0.00 -1.26 -4.41 121.76 118.60 2az3 s ALA 101 Ca 0.67 0.87 -0.24 0.00 0.00 0.00 0.00 51.96 53.25 2az3 s ALA 101 Cb -0.37 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.34 2az3 s ALA 101 CO 0.45 -0.13 1.32 -2.30 0.00 0.00 0.00 175.76 175.11 2az3 n PRO 102 N 1.35 1.94 0.00 0.00 -0.02 -1.26 -2.16 135.00 134.85 2az3 n PRO 102 Ca -0.01 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2az3 n PRO 102 Cb 0.45 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2az3 n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2az3 n GLY 103 N 0.75 2.86 3.95 -1.23 0.00 -1.26 -4.97 105.19 105.29 2az3 n GLY 103 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 2az3 n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2az3 s THR 104 N -2.78 3.52 0.15 2.61 -4.23 -0.92 -4.95 115.64 109.03 2az3 s THR 104 Ca 0.00 -0.48 -0.17 0.00 -1.18 0.00 0.00 61.69 59.86 2az3 s THR 104 Cb 0.00 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.52 2az3 s THR 104 CO 0.00 -0.24 1.79 0.40 -0.54 0.00 0.00 174.62 176.03 2az3 h ILE 105 N 0.21 1.11 -0.14 2.99 2.04 -1.24 -1.32 117.51 121.16 2az3 h ILE 105 Ca -0.45 -0.23 -0.20 0.00 1.00 0.00 0.00 64.86 64.99 2az3 h ILE 105 Cb 1.27 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2az3 h ILE 105 CO 0.56 0.11 -0.72 0.03 0.00 0.00 0.00 178.15 178.13 2az3 h ARG 106 N 0.50 0.62 0.00 2.37 3.08 -1.50 -1.80 114.38 117.65 2az3 h ARG 106 Ca 0.14 -0.48 -0.02 0.00 0.07 0.00 0.00 59.98 59.69 2az3 h ARG 106 Cb -0.03 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 2az3 h ARG 106 CO -0.03 1.10 -0.08 0.78 -1.07 0.00 0.00 179.97 180.67 2az3 h GLY 107 N 0.92 0.00 0.98 0.04 0.00 -1.63 -0.78 103.07 102.60 2az3 h GLY 107 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.00 2az3 h GLY 107 CO 0.14 0.00 -1.71 -0.55 0.00 0.00 0.00 176.54 174.42 2az3 h ASP 108 N 0.00 0.04 0.00 0.19 3.32 -1.10 -3.41 116.42 115.46 2az3 h ASP 108 Ca -0.00 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 2az3 h ASP 108 Cb 0.67 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 2az3 h ASP 108 CO 0.01 1.08 -1.16 -1.22 -1.72 0.00 0.00 179.24 176.23 2az3 n TYR 109 N -3.09 0.00 -4.29 4.55 4.01 -0.69 -5.06 117.16 112.58 2az3 n TYR 109 Ca -0.18 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.33 2az3 n TYR 109 Cb 1.05 -0.10 -0.08 0.00 -0.31 0.00 0.00 39.34 39.90 2az3 n TYR 109 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2az3 s GLY 110 N -2.79 1.68 -0.41 2.72 0.00 -0.31 -5.04 107.32 103.17 2az3 s GLY 110 Ca -0.01 -1.61 0.09 0.00 0.00 0.00 0.00 44.72 43.18 2az3 s GLY 110 CO 0.12 -1.67 0.84 1.16 0.00 0.00 0.00 173.10 173.54 2az3 n ASN 111 N -0.69 -0.60 -3.79 1.64 6.94 -1.26 -4.47 115.26 113.02 2az3 n ASN 111 Ca -0.07 -3.21 -0.10 0.00 -0.02 0.00 0.00 54.58 51.18 2az3 n ASN 111 Cb 0.58 0.40 -0.07 0.00 -2.36 0.00 0.00 39.78 38.34 2az3 n ASN 111 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2az3 s ASP 112 N -1.83 -0.02 -0.20 0.53 2.15 -1.26 -4.69 116.67 111.35 2az3 s ASP 112 Ca 0.33 -0.42 -0.21 0.00 0.43 0.00 0.00 52.55 52.69 2az3 s ASP 112 Cb 0.29 0.36 -0.20 0.00 -0.30 0.00 0.00 42.92 43.07 2az3 s ASP 112 CO -0.09 -0.69 0.25 0.25 -0.17 0.00 0.00 175.17 174.72 2az3 h LEU 113 N 2.94 0.04 0.50 -1.34 5.85 -1.94 -2.98 115.31 118.38 2az3 h LEU 113 Ca -0.33 -0.57 -0.02 0.00 0.84 0.00 0.00 57.88 57.80 2az3 h LEU 113 Cb 1.21 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2az3 h LEU 113 CO 0.50 1.50 -0.26 1.23 -0.34 0.00 0.00 178.44 181.08 2az3 h GLY 114 N -0.82 -0.74 -7.49 3.75 0.00 -1.98 -3.33 103.07 92.46 2az3 h GLY 114 Ca -0.34 0.28 -0.80 0.00 0.00 0.00 0.00 47.33 46.48 2az3 h GLY 114 CO -0.18 -0.27 0.57 1.42 0.00 0.00 0.00 176.54 178.09 2az3 n HIS 115 N -5.40 4.94 -1.57 5.60 8.25 -1.26 -4.79 115.22 120.99 2az3 n HIS 115 Ca -0.12 -3.73 -0.13 0.00 -0.26 0.00 0.00 57.72 53.48 2az3 n HIS 115 Cb 0.30 -1.70 0.14 0.00 1.12 0.00 0.00 29.99 29.85 2az3 n HIS 115 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2az3 n ASN 116 N 2.75 3.69 0.00 0.41 6.94 -1.25 -4.25 115.26 123.55 2az3 n ASN 116 Ca 0.25 -3.79 0.00 0.00 -0.02 0.00 0.00 54.58 51.03 2az3 n ASN 116 Cb 0.39 -0.62 0.00 0.00 -2.36 0.00 0.00 39.78 37.18 2az3 n ASN 116 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2az3 n LEU 117 N -1.01 0.00 -3.57 -4.53 4.32 -1.26 -4.75 117.00 106.20 2az3 n LEU 117 Ca 0.40 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 56.30 2az3 n LEU 117 Cb 0.99 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.75 2az3 n LEU 117 CO 0.32 0.00 0.81 -0.51 -1.22 0.00 0.00 177.39 176.79 2az3 s ILE 118 N 0.00 0.00 0.02 -0.08 2.07 -1.26 -1.66 121.20 120.29 2az3 s ILE 118 Ca 0.00 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 2az3 s ILE 118 Cb 0.00 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 2az3 s ILE 118 CO 0.00 0.00 -0.03 -2.28 -1.91 0.00 0.00 174.94 170.72 2az3 s HIS 119 N -1.64 0.27 -0.17 3.50 5.65 0.10 -4.91 115.29 118.08 2az3 s HIS 119 Ca 0.02 -0.46 -0.18 0.00 0.25 0.00 0.00 55.06 54.69 2az3 s HIS 119 Cb -0.01 -0.19 0.05 0.00 -1.18 0.00 0.00 32.58 31.25 2az3 s HIS 119 CO -0.02 -0.16 0.49 0.20 -0.65 0.00 0.00 174.74 174.61 2az3 s GLY 120 N -1.28 -0.37 0.40 1.59 0.00 -1.26 -1.35 107.32 105.05 2az3 s GLY 120 Ca -0.13 1.33 -0.27 0.00 0.00 0.00 0.00 44.72 45.64 2az3 s GLY 120 CO -0.01 1.12 1.38 -0.56 0.00 0.00 0.00 173.10 175.04 2az3 s SER 121 N 0.10 6.29 -0.47 1.64 0.01 -0.82 -4.88 113.70 115.58 2az3 s SER 121 Ca -0.01 2.83 -0.28 0.00 1.31 0.00 0.00 55.95 59.79 2az3 s SER 121 Cb -0.03 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.57 2az3 s SER 121 CO 0.01 -0.88 1.10 -0.62 0.41 0.00 0.00 173.24 173.26 2az3 s ASP 122 N -0.49 6.61 0.47 2.44 -1.08 -1.26 -4.82 116.67 118.55 2az3 s ASP 122 Ca 0.55 0.41 0.12 0.00 -0.52 0.00 0.00 52.55 53.12 2az3 s ASP 122 Cb -0.42 -2.53 1.09 0.00 -1.46 0.00 0.00 42.92 39.60 2az3 s ASP 122 CO 0.55 -1.21 2.10 1.12 0.52 0.00 0.00 175.17 178.25 2az3 h HIS 123 N 9.17 0.19 0.00 -5.34 2.07 -1.90 -1.11 115.15 118.24 2az3 h HIS 123 Ca -0.23 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.29 2az3 h HIS 123 Cb 1.06 -0.06 0.00 0.00 2.57 0.00 0.00 27.41 30.98 2az3 h HIS 123 CO 0.95 0.14 0.00 0.39 -3.07 0.00 0.00 177.93 176.34 2az3 n GLU 124 N -4.50 0.14 -3.45 5.12 1.02 -1.26 -4.35 120.64 113.36 2az3 n GLU 124 Ca -0.01 0.10 -0.43 0.00 -0.02 0.00 0.00 57.16 56.80 2az3 n GLU 124 Cb 0.09 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.94 2az3 n GLU 124 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2az3 s ASP 125 N -2.82 5.96 0.03 1.62 2.15 -0.42 -5.06 116.67 118.13 2az3 s ASP 125 Ca 0.15 -1.60 -0.30 0.00 0.43 0.00 0.00 52.55 51.23 2az3 s ASP 125 Cb 0.15 -2.11 -0.09 0.00 -0.30 0.00 0.00 42.92 40.57 2az3 s ASP 125 CO 0.38 -0.69 1.95 -1.61 -0.17 0.00 0.00 175.17 175.03 2az3 s GLU 126 N 1.53 4.14 0.00 4.34 8.01 -1.26 -1.77 118.70 133.69 2az3 s GLU 126 Ca 0.04 2.59 0.00 0.00 0.01 0.00 0.00 54.97 57.61 2az3 s GLU 126 Cb -0.26 -4.14 0.00 0.00 -4.31 0.00 0.00 34.13 25.42 2az3 s GLU 126 CO 0.03 -0.95 0.00 0.41 0.01 0.00 0.00 175.26 174.76 2az3 n GLY 127 N 4.52 2.17 0.23 -1.39 0.00 -1.26 -4.96 105.19 104.51 2az3 n GLY 127 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2az3 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2az3 h ALA 128 N 0.00 0.76 0.82 4.61 0.00 -1.61 0.55 119.26 124.39 2az3 h ALA 128 Ca 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2az3 h ALA 128 Cb 0.00 0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.89 2az3 h ALA 128 CO 0.00 -0.23 -0.40 -2.95 0.00 0.00 0.00 179.25 175.67 2az3 h ASN 129 N 0.36 -0.94 0.27 0.00 7.08 -1.84 0.20 115.58 120.71 2az3 h ASN 129 Ca 0.31 0.03 -0.04 0.00 -3.08 0.00 0.00 56.30 53.52 2az3 h ASN 129 Cb 0.41 0.24 -0.01 0.00 -2.08 0.00 0.00 38.32 36.89 2az3 h ASN 129 CO -0.34 -0.67 -0.21 -0.33 -2.08 0.00 0.00 177.43 173.81 2az3 h GLU 130 N -1.10 0.00 -0.01 4.14 4.39 -1.80 -1.26 114.58 118.94 2az3 h GLU 130 Ca -0.11 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.36 2az3 h GLU 130 Cb 0.85 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2az3 h GLU 130 CO 0.18 0.21 -0.95 -0.09 -1.16 0.00 0.00 179.01 177.20 2az3 h ARG 131 N 0.00 0.49 -0.15 2.33 2.43 0.54 -2.86 114.38 117.15 2az3 h ARG 131 Ca -0.00 -0.52 -0.21 0.00 -0.81 0.00 0.00 59.98 58.45 2az3 h ARG 131 Cb 0.40 0.14 0.01 0.00 -0.42 0.00 0.00 29.97 30.10 2az3 h ARG 131 CO 0.03 1.16 -0.71 0.93 -1.51 0.00 0.00 179.97 179.87 2az3 h GLU 132 N 0.29 0.75 -0.09 0.20 5.08 -0.11 -1.93 114.58 118.77 2az3 h GLU 132 Ca -0.09 -0.60 0.02 0.00 -1.00 0.00 0.00 59.36 57.70 2az3 h GLU 132 Cb 1.58 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.93 2az3 h GLU 132 CO 0.17 1.21 -0.06 0.82 -1.00 0.00 0.00 179.01 180.15 2az3 h ILE 133 N 0.47 0.81 0.00 3.13 2.04 -1.34 -1.17 117.51 121.45 2az3 h ILE 133 Ca -0.04 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 2az3 h ILE 133 Cb 1.34 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 2az3 h ILE 133 CO 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 178.28 2az3 h ALA 134 N 1.01 1.04 -0.08 1.87 0.00 -1.48 0.14 119.26 121.76 2az3 h ALA 134 Ca 0.06 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2az3 h ALA 134 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2az3 h ALA 134 CO -0.13 0.02 -0.23 1.25 0.00 0.00 0.00 179.25 180.16 2az3 h LEU 135 N 0.00 0.34 0.00 0.00 5.85 -0.49 -3.37 115.31 117.65 2az3 h LEU 135 Ca -0.00 -0.60 -0.11 0.00 0.84 0.00 0.00 57.88 58.01 2az3 h LEU 135 Cb 0.27 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2az3 h LEU 135 CO 0.00 0.88 -1.37 0.49 -0.34 0.00 0.00 178.44 178.10 2az3 n PHE 136 N -4.51 0.88 -4.52 1.25 3.72 -0.53 -4.90 117.46 108.84 2az3 n PHE 136 Ca -0.08 0.28 -0.22 0.00 -0.05 0.00 0.00 57.45 57.39 2az3 n PHE 136 Cb 0.44 -1.01 -0.15 0.00 -0.94 0.00 0.00 39.48 37.82 2az3 n PHE 136 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2az3 s PHE 137 N -3.08 1.14 0.46 1.38 0.08 0.41 -5.10 117.98 113.28 2az3 s PHE 137 Ca -0.03 -0.28 -0.14 0.00 0.12 0.00 0.00 56.93 56.60 2az3 s PHE 137 Cb 0.09 -0.78 -0.07 0.00 -0.57 0.00 0.00 43.02 41.69 2az3 s PHE 137 CO 0.81 -0.09 0.89 -0.51 -0.10 0.00 0.00 175.22 176.22 2az3 s ASP 138 N 0.03 6.59 0.56 1.36 1.01 -1.26 -4.25 116.67 120.71 2az3 s ASP 138 Ca -0.01 1.38 0.36 0.00 0.71 0.00 0.00 52.55 54.99 2az3 s ASP 138 Cb -0.08 -2.43 1.68 0.00 1.01 0.00 0.00 42.92 43.10 2az3 s ASP 138 CO 0.01 -0.49 2.08 0.44 0.21 0.00 0.00 175.17 177.41 2az3 h ASP 139 N 1.12 0.00 0.87 0.27 3.32 -1.95 -0.37 116.42 119.68 2az3 h ASP 139 Ca -0.47 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 2az3 h ASP 139 Cb 1.19 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2az3 h ASP 139 CO 0.63 0.00 -0.18 -0.78 -1.72 0.00 0.00 179.24 177.18 2az3 h ASP 140 N 0.00 0.00 -0.01 6.45 -0.00 -2.04 -3.16 116.42 117.66 2az3 h ASP 140 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 2az3 h ASP 140 Cb 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.65 2az3 h ASP 140 CO 0.00 0.18 -0.01 -0.62 -0.00 0.00 0.00 179.24 178.80 2az3 n GLU 141 N -3.38 1.75 -3.82 0.28 1.02 -0.15 -4.88 120.64 111.46 2az3 n GLU 141 Ca -0.00 -1.10 -0.35 0.00 -0.02 0.00 0.00 57.16 55.69 2az3 n GLU 141 Cb 0.39 -1.48 -0.05 0.00 -0.02 0.00 0.00 31.44 30.28 2az3 n GLU 141 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2az3 s LEU 142 N -2.01 4.38 -0.09 -4.62 1.43 -1.19 -4.59 118.68 111.99 2az3 s LEU 142 Ca 0.36 0.49 -0.03 0.00 -1.03 0.00 0.00 54.13 53.93 2az3 s LEU 142 Cb 0.21 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.92 2az3 s LEU 142 CO 0.33 0.31 0.03 -0.69 0.23 0.00 0.00 176.35 176.56 2az3 s VAL 143 N -1.22 4.57 -0.38 -1.59 1.01 0.11 -5.01 120.40 117.88 2az3 s VAL 143 Ca 0.24 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 61.96 2az3 s VAL 143 Cb -0.13 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 33.35 2az3 s VAL 143 CO 0.13 0.61 0.21 -1.81 0.00 0.00 0.00 175.10 174.24 2az3 s ASP 144 N -0.90 5.70 0.31 3.32 1.01 -1.26 -4.73 116.67 120.12 2az3 s ASP 144 Ca 0.13 -1.12 -0.09 0.00 0.71 0.00 0.00 52.55 52.19 2az3 s ASP 144 Cb -0.11 -2.01 0.01 0.00 1.01 0.00 0.00 42.92 41.81 2az3 s ASP 144 CO 0.03 -0.42 0.52 -1.66 0.21 0.00 0.00 175.17 173.85 2az3 s TRP 145 N 1.52 0.64 -0.30 4.23 1.48 -1.26 -5.13 118.94 120.12 2az3 s TRP 145 Ca 0.02 -0.99 0.03 0.00 -1.06 0.00 0.00 56.10 54.09 2az3 s TRP 145 Cb -0.20 0.16 0.07 0.00 -1.16 0.00 0.00 33.47 32.35 2az3 s TRP 145 CO 0.06 -1.14 -0.03 -0.51 -4.06 0.00 0.00 176.95 171.26 2az3 s ASP 146 N -3.12 4.64 -0.52 -2.66 1.01 -1.26 -5.06 116.67 109.69 2az3 s ASP 146 Ca 0.25 -1.67 -0.27 0.00 0.71 0.00 0.00 52.55 51.57 2az3 s ASP 146 Cb -0.01 -1.61 -0.02 0.00 1.01 0.00 0.00 42.92 42.29 2az3 s ASP 146 CO 0.14 -0.28 1.82 -0.60 0.21 0.00 0.00 175.17 176.46 2az3 s ARG 147 N 1.05 2.88 0.54 8.23 3.00 -1.26 -4.88 118.95 128.51 2az3 s ARG 147 Ca -0.01 0.87 0.20 0.00 -1.00 0.00 0.00 55.73 55.79 2az3 s ARG 147 Cb -0.20 -4.31 1.41 0.00 0.00 0.00 0.00 34.95 31.85 2az3 s ARG 147 CO -0.06 -2.42 2.16 -0.44 0.00 0.00 0.00 175.30 174.54 2az3 h ASP 148 N 14.14 0.00 0.05 -2.12 3.32 -2.04 -0.95 116.42 128.82 2az3 h ASP 148 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 2az3 h ASP 148 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 2az3 h ASP 148 CO 1.16 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 178.68 2az3 h ALA 149 N 1.97 1.00 -0.64 3.45 0.00 -2.01 -2.64 119.26 120.39 2az3 h ALA 149 Ca 0.02 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.12 2az3 h ALA 149 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2az3 h ALA 149 CO -0.00 0.00 0.51 0.77 0.00 0.00 0.00 179.25 180.53 2az3 h SER 150 N 0.00 0.00 1.26 0.00 0.02 -1.53 0.14 113.55 113.44 2az3 h SER 150 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2az3 h SER 150 Cb 0.02 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 2az3 h SER 150 CO 0.00 0.00 -0.01 0.00 -1.14 0.00 0.00 176.83 175.68 2az3 h ALA 151 N 1.59 1.00 0.00 3.77 0.00 -1.69 -1.87 119.26 122.06 2az3 h ALA 151 Ca 0.31 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2az3 h ALA 151 Cb 1.32 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2az3 h ALA 151 CO -0.00 0.01 -1.50 0.91 0.00 0.00 0.00 179.25 178.67 2az3 n TRP 152 N -3.11 0.49 0.13 0.00 7.02 0.43 -4.18 117.44 118.22 2az3 n TRP 152 Ca 0.01 0.14 -0.01 0.00 -1.02 0.00 0.00 57.50 56.63 2az3 n TRP 152 Cb 0.37 -0.74 0.15 0.00 -2.42 0.00 0.00 31.31 28.67 2az3 n TRP 152 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 2az3 h VAL 153 N 0.00 1.39 -3.97 -0.99 2.07 -0.85 -3.46 116.25 110.44 2az3 h VAL 153 Ca -0.00 -2.22 -0.34 0.00 0.82 0.00 0.00 66.70 64.96 2az3 h VAL 153 Cb 1.01 2.22 -0.23 0.00 -1.52 0.00 0.00 31.29 32.77 2az3 h VAL 153 CO 0.00 0.62 -0.76 -0.31 0.02 0.00 0.00 177.57 177.15 2az3 s TYR 154 N -3.47 0.83 -1.52 1.57 2.02 -0.75 -5.04 117.35 110.99 2az3 s TYR 154 Ca -0.01 -0.40 0.26 0.00 -0.37 0.00 0.00 57.07 56.55 2az3 s TYR 154 Cb 0.12 -0.49 0.71 0.00 -0.40 0.00 0.00 41.96 41.90 2az3 s TYR 154 CO 0.76 -0.03 1.54 -0.85 -1.57 0.00 0.00 175.55 175.40 2az3 n GLU 155 N 1.74 0.57 0.00 -0.62 0.28 -1.26 -4.58 120.64 116.78 2az3 n GLU 155 Ca -0.20 -0.33 0.00 0.00 -0.16 0.00 0.00 57.16 56.47 2az3 n GLU 155 Cb 0.55 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.93 2az3 n GLU 155 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57