#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2az3 s ASP 5 N 0.00 4.41 0.23 0.41 1.01 -1.26 -5.03 116.67 116.43 2az3 s ASP 5 Ca 0.00 0.13 -0.31 0.00 0.71 0.00 0.00 52.55 53.08 2az3 s ASP 5 Cb 0.00 -0.61 -0.14 0.00 1.01 0.00 0.00 42.92 43.18 2az3 s ASP 5 CO 0.00 -1.84 1.28 1.21 0.21 0.00 0.00 175.17 176.02 2az3 n GLU 6 N -2.99 1.67 -4.73 8.23 2.13 -1.25 -4.69 120.64 119.00 2az3 n GLU 6 Ca 0.11 0.59 -0.29 0.00 0.66 0.00 0.00 57.16 58.24 2az3 n GLU 6 Cb 0.60 -2.16 -0.14 0.00 0.27 0.00 0.00 31.44 30.01 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 -0.61 1.62 0.00 5.31 0.52 -1.26 -2.13 118.95 122.41 2az3 s ARG 7 Ca 0.68 -1.14 0.02 0.00 -0.52 0.00 0.00 55.73 54.77 2az3 s ARG 7 Cb -0.72 -1.87 -0.01 0.00 0.52 0.00 0.00 34.95 32.88 2az3 s ARG 7 CO 0.52 0.47 -0.07 -0.08 0.02 0.00 0.00 175.30 176.17 2az3 s THR 8 N -0.87 0.53 -0.13 0.02 -1.32 -0.38 -4.55 115.64 108.93 2az3 s THR 8 Ca 0.11 -0.41 -0.29 0.00 -1.21 0.00 0.00 61.69 59.89 2az3 s THR 8 Cb -0.10 -0.47 -0.02 0.00 -1.51 0.00 0.00 72.50 70.40 2az3 s THR 8 CO 0.03 0.07 1.21 0.12 -2.21 0.00 0.00 174.62 173.84 2az3 s PHE 9 N -0.34 3.04 0.01 9.09 5.36 -1.26 -1.95 117.98 131.93 2az3 s PHE 9 Ca 0.01 1.15 0.07 0.00 -0.96 0.00 0.00 56.93 57.19 2az3 s PHE 9 Cb -0.04 -3.44 -0.02 0.00 -0.34 0.00 0.00 43.02 39.18 2az3 s PHE 9 CO -0.00 -1.38 -0.20 0.08 -1.46 0.00 0.00 175.22 172.25 2az3 s VAL 10 N 2.98 1.62 -0.04 3.12 1.01 0.30 -1.55 120.40 127.83 2az3 s VAL 10 Ca 0.54 -1.02 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 2az3 s VAL 10 Cb -0.22 -1.38 0.03 0.00 0.00 0.00 0.00 36.38 34.81 2az3 s VAL 10 CO 0.16 0.33 0.00 -0.32 0.00 0.00 0.00 175.10 175.27 2az3 s MET 11 N -0.81 0.42 -0.18 2.72 1.75 -0.26 0.23 119.30 123.17 2az3 s MET 11 Ca 0.08 0.09 -0.29 0.00 -1.25 0.00 0.00 55.69 54.32 2az3 s MET 11 Cb -0.08 -0.67 -0.00 0.00 2.84 0.00 0.00 34.83 36.92 2az3 s MET 11 CO 0.00 -0.19 1.00 0.08 -0.65 0.00 0.00 175.02 175.26 2az3 s VAL 12 N 1.39 4.74 0.98 10.11 1.01 -0.09 -0.82 120.40 137.72 2az3 s VAL 12 Ca -0.04 1.97 -0.16 0.00 0.00 0.00 0.00 61.98 63.75 2az3 s VAL 12 Cb -0.13 -4.28 0.20 0.00 0.00 0.00 0.00 36.38 32.16 2az3 s VAL 12 CO -0.02 -0.09 1.25 -0.54 0.00 0.00 0.00 175.10 175.70 2az3 s LYS 13 N 2.69 0.51 0.38 2.72 1.02 -0.22 -1.52 119.74 125.33 2az3 s LYS 13 Ca 0.44 -0.23 0.09 0.00 0.02 0.00 0.00 55.97 56.29 2az3 s LYS 13 Cb -0.16 -1.81 0.85 0.00 -0.52 0.00 0.00 37.83 36.18 2az3 s LYS 13 CO 0.11 -2.53 1.92 -1.35 -0.92 0.00 0.00 175.35 172.58 2az3 h PRO 14 N -1.72 0.62 0.00 -1.68 0.11 -1.84 -0.65 132.00 126.84 2az3 h PRO 14 Ca -0.45 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 2az3 h PRO 14 Cb 1.26 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2az3 h PRO 14 CO 0.43 0.41 -0.44 0.38 -0.21 0.00 0.00 178.00 178.56 2az3 h ASP 15 N 0.64 0.00 0.03 -2.05 2.03 -1.90 -2.24 116.42 112.93 2az3 h ASP 15 Ca 0.36 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.55 2az3 h ASP 15 Cb 0.55 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.06 2az3 h ASP 15 CO -0.14 0.44 -0.45 1.23 -1.03 0.00 0.00 179.24 179.29 2az3 h GLY 16 N 1.58 0.29 0.75 7.15 0.00 -1.33 -2.36 103.07 109.14 2az3 h GLY 16 Ca -0.00 -0.56 0.08 0.00 0.00 0.00 0.00 47.33 46.84 2az3 h GLY 16 CO 0.06 0.49 0.62 -2.08 0.00 0.00 0.00 176.54 175.63 2az3 h VAL 17 N -0.40 1.05 0.00 4.60 2.07 -1.49 -0.95 116.25 121.13 2az3 h VAL 17 Ca -0.07 -0.36 -0.12 0.00 0.82 0.00 0.00 66.70 66.97 2az3 h VAL 17 Cb 1.24 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2az3 h VAL 17 CO 0.09 0.19 -0.65 -0.61 0.02 0.00 0.00 177.57 176.62 2az3 h GLN 18 N 1.06 0.00 -0.02 1.57 5.75 -1.46 -3.26 115.11 118.75 2az3 h GLN 18 Ca 0.42 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.92 2az3 h GLN 18 Cb 0.25 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.80 2az3 h GLN 18 CO -0.17 0.50 -0.22 0.54 -2.65 0.00 0.00 178.83 176.83 2az3 n ARG 19 N -3.19 1.39 -0.68 1.69 1.74 -0.89 -4.96 116.66 111.76 2az3 n ARG 19 Ca 0.00 -1.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.09 2az3 n ARG 19 Cb 0.76 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.72 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 1.33 1.38 0.53 -0.13 0.00 -0.93 -5.00 105.19 102.38 2az3 n GLY 20 Ca 0.13 -0.28 0.05 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.03 2.39 0.17 0.99 4.77 -0.40 -4.51 117.00 120.39 2az3 n LEU 21 Ca 0.00 -1.49 0.02 0.00 -0.03 0.00 0.00 56.01 54.51 2az3 n LEU 21 Cb 0.16 -0.11 0.36 0.00 -2.33 0.00 0.00 43.42 41.50 2az3 n LEU 21 CO 0.00 0.54 0.74 -0.29 -1.33 0.00 0.00 177.39 177.05 2az3 h ILE 22 N 2.05 1.25 -0.18 -0.08 2.10 -1.89 -2.11 117.51 118.66 2az3 h ILE 22 Ca 0.00 -1.21 -0.21 0.00 1.08 0.00 0.00 64.86 64.53 2az3 h ILE 22 Cb 0.59 1.62 0.01 0.00 -1.09 0.00 0.00 36.82 37.94 2az3 h ILE 22 CO 0.00 0.35 -0.70 1.23 -1.08 0.00 0.00 178.15 177.95 2az3 h GLY 23 N 1.05 0.84 1.42 8.18 0.00 -1.95 -1.51 103.07 111.10 2az3 h GLY 23 Ca 0.00 -1.11 -0.19 0.00 0.00 0.00 0.00 47.33 46.03 2az3 h GLY 23 CO 0.05 0.99 -0.69 -0.55 0.00 0.00 0.00 176.54 176.34 2az3 h ASP 24 N 0.54 0.67 -0.34 0.19 3.32 -1.79 -0.61 116.42 118.41 2az3 h ASP 24 Ca -0.03 -0.42 -0.15 0.00 0.02 0.00 0.00 57.03 56.45 2az3 h ASP 24 Cb 1.32 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 2az3 h ASP 24 CO 0.14 1.17 -0.38 0.40 -1.72 0.00 0.00 179.24 178.86 2az3 h ILE 25 N 0.41 1.27 -0.20 0.35 2.04 -1.44 -1.19 117.51 118.75 2az3 h ILE 25 Ca -0.03 -1.55 -0.09 0.00 1.00 0.00 0.00 64.86 64.20 2az3 h ILE 25 Cb 1.28 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.73 2az3 h ILE 25 CO 0.13 0.52 -0.25 0.58 0.00 0.00 0.00 178.15 179.12 2az3 h VAL 26 N 0.73 1.26 -0.18 1.67 2.07 -1.07 -2.86 116.25 117.87 2az3 h VAL 26 Ca 0.06 -1.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.30 2az3 h VAL 26 Cb 0.96 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2az3 h VAL 26 CO 0.09 0.38 -0.17 0.74 0.02 0.00 0.00 177.57 178.63 2az3 h THR 27 N 0.33 1.33 -0.95 2.57 2.02 -0.90 -1.14 112.91 116.17 2az3 h THR 27 Ca 0.05 -1.33 0.06 0.00 0.77 0.00 0.00 66.41 65.97 2az3 h THR 27 Cb 0.63 1.80 -0.06 0.00 -1.74 0.00 0.00 68.15 68.78 2az3 h THR 27 CO 0.04 0.40 0.62 0.03 0.37 0.00 0.00 175.52 176.98 2az3 h ARG 28 N 0.09 1.07 -0.08 6.66 3.08 -1.08 -0.45 114.38 123.67 2az3 h ARG 28 Ca 0.03 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 2az3 h ARG 28 Cb 0.71 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 2az3 h ARG 28 CO 0.04 0.71 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.51 2az3 h LEU 29 N 1.10 0.20 -0.67 3.04 3.38 -1.33 -2.52 115.31 118.52 2az3 h LEU 29 Ca 0.41 -0.47 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 2az3 h LEU 29 Cb 0.18 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2az3 h LEU 29 CO -0.16 0.63 -0.37 1.05 0.09 0.00 0.00 178.44 179.68 2az3 h GLU 30 N -0.23 0.00 0.00 1.13 4.11 -0.72 -2.59 114.58 116.29 2az3 h GLU 30 Ca 0.01 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.28 2az3 h GLU 30 Cb 0.57 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 2az3 h GLU 30 CO 0.02 0.37 -0.77 1.15 0.07 0.00 0.00 179.01 179.85 2az3 h THR 31 N 0.00 1.53 0.00 -1.06 2.02 -1.14 -2.49 112.91 111.76 2az3 h THR 31 Ca -0.00 -2.68 0.00 0.00 0.77 0.00 0.00 66.41 64.50 2az3 h THR 31 Cb 1.02 2.45 0.00 0.00 -1.74 0.00 0.00 68.15 69.88 2az3 h THR 31 CO 0.05 0.76 0.03 0.50 0.37 0.00 0.00 175.52 177.22 2az3 h LYS 32 N 0.00 0.00 0.00 6.66 1.63 -1.05 -3.45 116.57 120.36 2az3 h LYS 32 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2az3 h LYS 32 Cb 1.39 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.02 2az3 h LYS 32 CO 0.10 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 176.51 2az3 n GLY 33 N -1.17 0.89 3.83 5.01 0.00 -0.94 -5.08 105.19 107.74 2az3 n GLY 33 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 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 3.73 -0.38 0.99 1.43 -1.13 -4.93 118.68 118.39 2az3 s LEU 34 Ca 0.00 1.62 -0.11 0.00 -1.03 0.00 0.00 54.13 54.61 2az3 s LEU 34 Cb 0.00 -4.52 0.03 0.00 0.03 0.00 0.00 46.19 41.73 2az3 s LEU 34 CO 0.00 -0.52 0.22 -0.75 0.23 0.00 0.00 176.35 175.53 2az3 s LYS 35 N -3.75 2.82 0.16 1.70 2.20 -0.38 -4.43 119.74 118.06 2az3 s LYS 35 Ca 0.60 -1.10 -0.31 0.00 -0.36 0.00 0.00 55.97 54.80 2az3 s LYS 35 Cb -0.10 -3.76 -0.11 0.00 -1.51 0.00 0.00 37.83 32.36 2az3 s LYS 35 CO 0.25 -0.72 1.70 1.41 -0.36 0.00 0.00 175.35 177.63 2az3 s MET 36 N 1.56 4.16 0.00 4.03 -2.45 -1.26 -0.18 119.30 125.16 2az3 s MET 36 Ca 0.02 2.50 0.00 0.00 -1.25 0.00 0.00 55.69 56.96 2az3 s MET 36 Cb -0.19 -3.30 0.00 0.00 1.25 0.00 0.00 34.83 32.58 2az3 s MET 36 CO 0.07 -0.74 0.08 1.33 1.05 0.00 0.00 175.02 176.82 2az3 n VAL 37 N 4.28 0.00 -3.76 10.11 0.24 -0.51 -4.92 118.33 123.77 2az3 n VAL 37 Ca 0.16 -0.31 -0.13 0.00 -2.04 0.00 0.00 64.34 62.02 2az3 n VAL 37 Cb 0.38 1.11 -0.11 0.00 -1.47 0.00 0.00 33.84 33.74 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 -0.44 -0.24 -0.29 7.63 0.00 -1.06 -0.28 107.32 112.64 2az3 s GLY 38 Ca 0.00 0.88 -0.14 0.00 0.00 0.00 0.00 44.72 45.46 2az3 s GLY 38 CO 0.00 0.75 0.69 -0.32 0.00 0.00 0.00 173.10 174.21 2az3 s GLY 39 N 0.08 -0.65 -0.25 0.20 0.00 -1.26 -1.74 107.32 103.70 2az3 s GLY 39 Ca -0.01 2.42 -0.16 0.00 0.00 0.00 0.00 44.72 46.97 2az3 s GLY 39 CO 0.01 2.68 0.62 1.25 0.00 0.00 0.00 173.10 177.66 2az3 s LYS 40 N 2.13 0.65 -0.24 2.90 2.20 -0.44 -5.02 119.74 121.92 2az3 s LYS 40 Ca -0.08 1.06 -0.14 0.00 -0.36 0.00 0.00 55.97 56.44 2az3 s LYS 40 Cb -0.08 0.16 -0.04 0.00 -1.51 0.00 0.00 37.83 36.36 2az3 s LYS 40 CO -0.19 -0.14 0.34 0.12 -0.36 0.00 0.00 175.35 175.12 2az3 s PHE 41 N 1.27 3.30 0.29 4.03 5.36 -1.26 -0.45 117.98 130.52 2az3 s PHE 41 Ca -0.07 0.44 -0.16 0.00 -0.96 0.00 0.00 56.93 56.18 2az3 s PHE 41 Cb -0.06 -2.49 0.01 0.00 -0.34 0.00 0.00 43.02 40.15 2az3 s PHE 41 CO -0.13 -0.10 0.62 0.00 -1.46 0.00 0.00 175.22 174.15 2az3 s MET 42 N 1.61 1.77 0.04 10.12 0.23 -0.98 -5.01 119.30 127.09 2az3 s MET 42 Ca 0.15 -1.22 0.02 0.00 -1.03 0.00 0.00 55.69 53.60 2az3 s MET 42 Cb -0.15 0.55 -0.04 0.00 -1.53 0.00 0.00 34.83 33.66 2az3 s MET 42 CO 0.08 -0.78 0.07 0.50 -2.03 0.00 0.00 175.02 172.86 2az3 s ARG 43 N -3.65 2.94 -0.30 3.16 3.52 -1.26 -0.80 118.95 122.56 2az3 s ARG 43 Ca 0.18 -0.61 -0.12 0.00 -0.13 0.00 0.00 55.73 55.04 2az3 s ARG 43 Cb -0.03 -2.77 -0.04 0.00 -1.56 0.00 0.00 34.95 30.55 2az3 s ARG 43 CO 0.10 0.60 0.22 0.42 -0.81 0.00 0.00 175.30 175.83 2az3 s ILE 44 N -1.30 5.29 0.54 4.11 1.01 -1.26 -4.94 121.20 124.65 2az3 s ILE 44 Ca 0.26 0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.88 2az3 s ILE 44 Cb -0.12 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 2az3 s ILE 44 CO 0.18 0.14 0.89 1.51 0.00 0.00 0.00 174.94 177.66 2az3 s ASP 45 N 1.74 6.22 0.23 3.58 1.47 -1.26 -4.46 116.67 124.19 2az3 s ASP 45 Ca 0.07 1.13 -0.17 0.00 1.18 0.00 0.00 52.55 54.76 2az3 s ASP 45 Cb -0.17 -2.32 0.24 0.00 -0.34 0.00 0.00 42.92 40.33 2az3 s ASP 45 CO 0.11 -0.72 1.56 -0.33 0.68 0.00 0.00 175.17 176.47 2az3 h GLU 46 N -0.02 -0.03 -0.24 2.11 5.08 -1.97 -1.71 114.58 117.79 2az3 h GLU 46 Ca -0.46 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.84 2az3 h GLU 46 Cb 1.20 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2az3 h GLU 46 CO 0.62 -0.02 -0.12 0.93 -1.00 0.00 0.00 179.01 179.41 2az3 h GLU 47 N -0.04 0.40 -0.26 2.33 4.39 -2.00 -1.47 114.58 117.94 2az3 h GLU 47 Ca 0.34 -0.11 -0.14 0.00 0.34 0.00 0.00 59.36 59.79 2az3 h GLU 47 Cb 0.60 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 2az3 h GLU 47 CO -0.92 0.53 -0.41 1.25 -1.16 0.00 0.00 179.01 178.30 2az3 h LEU 48 N 0.38 0.66 0.43 1.33 5.85 -1.72 -2.57 115.31 119.67 2az3 h LEU 48 Ca 0.07 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.47 2az3 h LEU 48 Cb 0.44 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.29 2az3 h LEU 48 CO 0.03 0.99 -0.21 0.00 -0.34 0.00 0.00 178.44 178.91 2az3 h ALA 49 N 1.04 -0.58 -0.90 1.25 0.00 -0.66 -0.92 119.26 118.50 2az3 h ALA 49 Ca 0.04 -0.18 0.24 0.00 0.00 0.00 0.00 54.91 55.01 2az3 h ALA 49 Cb 0.92 0.22 -0.16 0.00 0.00 0.00 0.00 17.79 18.78 2az3 h ALA 49 CO 0.08 -0.70 0.10 0.45 0.00 0.00 0.00 179.25 179.18 2az3 h HIS 50 N -0.83 0.10 -0.43 0.00 3.86 -1.34 0.30 115.15 116.82 2az3 h HIS 50 Ca -0.06 0.06 -0.14 0.00 -1.16 0.00 0.00 60.37 59.07 2az3 h HIS 50 Cb 0.55 0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.11 2az3 h HIS 50 CO 0.00 -0.32 -0.28 0.93 0.86 0.00 0.00 177.93 179.13 2az3 h GLU 51 N 0.09 0.93 -0.39 2.45 5.08 -1.14 -0.29 114.58 121.30 2az3 h GLU 51 Ca 0.55 -0.42 -0.07 0.00 -1.00 0.00 0.00 59.36 58.41 2az3 h GLU 51 Cb 1.10 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 2az3 h GLU 51 CO -0.77 1.08 -0.04 1.25 -1.00 0.00 0.00 179.01 179.53 2az3 h HIS 52 N 0.79 0.69 -0.80 4.33 2.76 0.66 -3.22 115.15 120.35 2az3 h HIS 52 Ca 0.09 -0.09 -0.57 0.00 -2.20 0.00 0.00 60.37 57.59 2az3 h HIS 52 Cb 0.85 -0.19 -0.38 0.00 1.55 0.00 0.00 27.41 29.24 2az3 h HIS 52 CO 0.05 0.68 -0.35 0.66 -1.30 0.00 0.00 177.93 177.67 2az3 n TYR 53 N -4.22 2.83 0.05 5.26 4.01 0.79 -4.81 117.16 121.06 2az3 n TYR 53 Ca 0.02 -2.42 -0.07 0.00 -0.16 0.00 0.00 57.90 55.26 2az3 n TYR 53 Cb 0.30 -0.64 0.09 0.00 -0.31 0.00 0.00 39.34 38.78 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 2.10 0.78 -0.49 -0.72 0.00 -1.06 -2.94 119.26 116.94 2az3 h ALA 54 Ca 0.43 -0.52 0.10 0.00 0.00 0.00 0.00 54.91 54.91 2az3 h ALA 54 Cb 1.34 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.96 2az3 h ALA 54 CO 0.97 0.70 -0.15 1.05 0.00 0.00 0.00 179.25 181.83 2az3 h GLU 55 N 0.30 -0.03 -0.57 0.00 4.11 -1.87 -1.83 114.58 114.68 2az3 h GLU 55 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2az3 h GLU 55 Cb 1.09 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2az3 h GLU 55 CO 0.10 -0.02 0.00 0.72 0.07 0.00 0.00 179.01 179.88 2az3 n HIS 56 N -5.37 0.27 -0.17 2.06 8.25 -1.11 -4.38 115.22 114.77 2az3 n HIS 56 Ca 0.04 -0.11 -0.07 0.00 -0.26 0.00 0.00 57.72 57.33 2az3 n HIS 56 Cb 0.28 -0.09 0.02 0.00 1.12 0.00 0.00 29.99 31.31 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 0.70 0.67 -1.12 -0.41 4.22 -1.36 -2.24 114.58 115.05 2az3 h GLU 57 Ca 0.00 -0.05 -0.51 0.00 0.08 0.00 0.00 59.36 58.88 2az3 h GLU 57 Cb 0.49 -0.15 -0.24 0.00 0.50 0.00 0.00 28.75 29.35 2az3 h GLU 57 CO 0.05 0.46 0.66 -0.25 -2.18 0.00 0.00 179.01 177.75 2az3 n ASP 58 N -4.72 6.08 -4.50 1.04 9.92 -1.26 -4.90 116.55 118.20 2az3 n ASP 58 Ca 0.02 -3.47 -0.24 0.00 -0.53 0.00 0.00 54.79 50.57 2az3 n ASP 58 Cb 0.03 -0.93 -0.10 0.00 -0.64 0.00 0.00 41.12 39.48 2az3 n ASP 58 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2az3 s LYS 59 N -3.00 1.72 0.45 -1.24 1.02 -0.84 -5.08 119.74 112.77 2az3 s LYS 59 Ca 0.51 -1.89 0.25 0.00 0.02 0.00 0.00 55.97 54.86 2az3 s LYS 59 Cb 0.41 -1.47 0.55 0.00 -0.52 0.00 0.00 37.83 36.80 2az3 s LYS 59 CO 0.02 0.08 1.68 -1.00 -0.92 0.00 0.00 175.35 175.22 2az3 h PRO 60 N 2.11 0.00 -0.65 -1.68 0.14 -1.92 -3.08 132.00 126.92 2az3 h PRO 60 Ca -0.41 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.73 2az3 h PRO 60 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.38 2az3 h PRO 60 CO 0.70 0.05 0.00 1.97 0.14 0.00 0.00 178.00 180.86 2az3 n PHE 61 N -3.12 1.33 0.11 1.56 1.16 -1.26 -4.64 117.46 112.60 2az3 n PHE 61 Ca 0.03 -0.59 -0.13 0.00 -1.87 0.00 0.00 57.45 54.89 2az3 n PHE 61 Cb 0.50 -0.18 -0.08 0.00 -1.61 0.00 0.00 39.48 38.10 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 4.01 -0.28 -0.39 2.97 3.57 -1.74 -2.97 116.94 122.11 2az3 h PHE 62 Ca 0.00 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.41 2az3 h PHE 62 Cb 1.33 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 40.14 2az3 h PHE 62 CO 0.68 0.08 -0.10 -0.44 -2.23 0.00 0.00 178.31 176.30 2az3 h ASP 63 N -0.73 0.66 -0.11 0.41 3.32 -1.83 -1.03 116.42 117.11 2az3 h ASP 63 Ca -0.03 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.84 2az3 h ASP 63 Cb 0.49 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 2az3 h ASP 63 CO 0.05 0.80 0.07 1.23 -1.72 0.00 0.00 179.24 179.67 2az3 h GLY 64 N 0.96 0.15 0.38 2.75 0.00 -1.89 0.16 103.07 105.59 2az3 h GLY 64 Ca 0.11 -0.06 0.10 0.00 0.00 0.00 0.00 47.33 47.48 2az3 h GLY 64 CO 0.03 0.06 0.25 1.41 0.00 0.00 0.00 176.54 178.29 2az3 h LEU 65 N 0.13 0.26 0.56 3.11 3.38 -1.29 0.11 115.31 121.57 2az3 h LEU 65 Ca 0.04 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2az3 h LEU 65 Cb 0.00 0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.81 2az3 h LEU 65 CO -0.01 0.15 -0.27 0.58 0.09 0.00 0.00 178.44 178.98 2az3 h VAL 66 N 0.43 0.45 -0.11 1.22 2.07 -0.66 -1.24 116.25 118.41 2az3 h VAL 66 Ca 0.32 -0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.86 2az3 h VAL 66 Cb 0.40 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 2az3 h VAL 66 CO -0.31 0.00 -0.05 -1.28 0.02 0.00 0.00 177.57 175.95 2az3 h SER 67 N -0.76 -0.17 -0.29 0.57 0.87 -0.40 -2.15 113.55 111.23 2az3 h SER 67 Ca -0.08 0.04 0.06 0.00 -1.23 0.00 0.00 61.79 60.59 2az3 h SER 67 Cb 0.58 0.10 -0.06 0.00 -0.44 0.00 0.00 62.40 62.58 2az3 h SER 67 CO 0.13 -0.07 -0.10 0.15 -0.53 0.00 0.00 176.83 176.41 2az3 h PHE 68 N -0.04 -0.24 0.00 2.24 3.57 -0.99 0.18 116.94 121.66 2az3 h PHE 68 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2az3 h PHE 68 Cb 0.13 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.02 2az3 h PHE 68 CO -0.18 -0.17 0.00 0.97 -2.23 0.00 0.00 178.31 176.71 2az3 h ILE 69 N -0.05 0.00 -0.02 1.41 6.09 -0.59 -1.59 117.51 122.77 2az3 h ILE 69 Ca 0.15 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 63.44 2az3 h ILE 69 Cb 0.27 0.98 0.00 0.00 0.47 0.00 0.00 36.82 38.54 2az3 h ILE 69 CO -0.33 0.00 -0.03 0.35 -3.07 0.00 0.00 178.15 175.08 2az3 n THR 70 N -2.59 0.00 0.30 2.19 -2.24 -0.96 -4.48 114.28 106.50 2az3 n THR 70 Ca -0.00 -0.49 0.19 0.00 -2.27 0.00 0.00 64.05 61.48 2az3 n THR 70 Cb 0.17 1.29 0.95 0.00 -2.10 0.00 0.00 70.33 70.65 2az3 n THR 70 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2az3 h SER 71 N 2.76 0.00 -2.76 3.42 4.64 0.40 -3.46 113.55 118.55 2az3 h SER 71 Ca 0.00 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.40 2az3 h SER 71 Cb 0.60 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 2az3 h SER 71 CO 0.00 0.00 0.46 0.61 -0.87 0.00 0.00 176.83 177.03 2az3 n GLY 72 N -0.86 0.75 3.74 -0.77 0.00 -1.26 -5.10 105.19 101.68 2az3 n GLY 72 Ca -0.02 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 2az3 n GLY 72 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2az3 s PRO 73 N -2.07 2.43 0.38 1.61 0.04 -1.26 -4.58 135.00 131.55 2az3 s PRO 73 Ca 0.20 1.74 0.08 0.00 0.04 0.00 0.00 61.00 63.06 2az3 s PRO 73 Cb -0.04 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.58 2az3 s PRO 73 CO 0.08 -1.60 0.11 0.14 0.04 0.00 0.00 177.00 175.77 2az3 s VAL 74 N -1.92 2.50 -0.37 -0.36 -7.23 0.02 -3.96 120.40 109.09 2az3 s VAL 74 Ca 0.74 -1.80 -0.01 0.00 -1.81 0.00 0.00 61.98 59.10 2az3 s VAL 74 Cb -0.29 -2.93 0.09 0.00 0.56 0.00 0.00 36.38 33.81 2az3 s VAL 74 CO 0.42 -0.09 0.12 0.12 -0.31 0.00 0.00 175.10 175.36 2az3 s PHE 75 N -2.55 3.53 0.14 2.82 5.36 -0.57 -2.31 117.98 124.40 2az3 s PHE 75 Ca 0.38 -2.36 -0.16 0.00 -0.96 0.00 0.00 56.93 53.83 2az3 s PHE 75 Cb 0.02 -2.86 -0.07 0.00 -0.34 0.00 0.00 43.02 39.77 2az3 s PHE 75 CO 0.21 -0.92 0.58 0.00 -1.46 0.00 0.00 175.22 173.64 2az3 s ALA 76 N 1.13 3.55 0.08 11.12 0.00 0.41 -0.91 121.76 137.14 2az3 s ALA 76 Ca 0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 51.96 51.90 2az3 s ALA 76 Cb -0.21 -2.60 -0.01 0.00 0.00 0.00 0.00 23.12 20.30 2az3 s ALA 76 CO -0.04 0.42 0.15 -1.64 0.00 0.00 0.00 175.76 174.65 2az3 s MET 77 N -1.77 0.81 -0.05 0.00 1.00 0.62 -1.33 119.30 118.58 2az3 s MET 77 Ca 0.37 -1.03 0.04 0.00 0.00 0.00 0.00 55.69 55.07 2az3 s MET 77 Cb -0.16 0.32 0.00 0.00 0.00 0.00 0.00 34.83 34.98 2az3 s MET 77 CO 0.19 -0.24 -0.17 0.08 0.00 0.00 0.00 175.02 174.89 2az3 s VAL 78 N -3.88 1.42 -0.06 -6.03 1.01 -0.71 -0.54 120.40 111.61 2az3 s VAL 78 Ca 0.06 -0.69 0.06 0.00 0.00 0.00 0.00 61.98 61.41 2az3 s VAL 78 Cb 0.05 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 2az3 s VAL 78 CO -0.10 0.41 -0.24 0.26 0.00 0.00 0.00 175.10 175.43 2az3 s TRP 79 N 0.18 2.36 0.18 5.22 0.52 -0.82 -1.43 118.94 125.15 2az3 s TRP 79 Ca -0.07 -0.71 0.08 0.00 0.02 0.00 0.00 56.10 55.42 2az3 s TRP 79 Cb -0.13 -1.55 -0.04 0.00 -1.15 0.00 0.00 33.47 30.60 2az3 s TRP 79 CO 0.03 -0.22 -0.03 -2.00 0.02 0.00 0.00 176.95 174.75 2az3 s GLU 80 N -0.12 2.29 0.00 4.98 2.12 0.75 -1.25 118.70 127.47 2az3 s GLU 80 Ca -0.04 -1.17 0.00 0.00 0.36 0.00 0.00 54.97 54.12 2az3 s GLU 80 Cb -0.14 -2.29 0.00 0.00 0.26 0.00 0.00 34.13 31.97 2az3 s GLU 80 CO 0.04 0.44 0.00 0.41 -0.54 0.00 0.00 175.26 175.61 2az3 n GLY 81 N -0.11 3.77 3.70 -1.50 0.00 -0.91 -1.24 105.19 108.90 2az3 n GLY 81 Ca -0.10 -1.31 -0.60 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.64 -0.81 -2.24 4.61 0.00 -1.26 -1.40 120.51 117.77 2az3 n ALA 82 Ca 0.00 0.44 -0.20 0.00 0.00 0.00 0.00 53.44 53.69 2az3 n ALA 82 Cb 0.00 -2.09 -0.02 0.00 0.00 0.00 0.00 19.45 17.33 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 4.49 -5.55 -0.22 0.00 2.03 -1.26 -4.82 116.55 111.22 2az3 n ASP 83 Ca 0.27 0.11 0.02 0.00 0.52 0.00 0.00 54.79 55.71 2az3 n ASP 83 Cb 0.08 -4.69 0.12 0.00 -0.72 0.00 0.00 41.12 35.91 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 0.83 0.67 -0.61 -1.67 0.00 -1.48 -1.42 119.26 115.58 2az3 h ALA 84 Ca -0.46 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2az3 h ALA 84 Cb 1.33 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 19.42 2az3 h ALA 84 CO 0.56 -0.39 0.27 1.15 0.00 0.00 0.00 179.25 180.84 2az3 h THR 85 N 0.14 1.21 0.05 0.00 2.02 -1.87 -1.24 112.91 113.21 2az3 h THR 85 Ca 0.35 -0.62 -0.08 0.00 0.77 0.00 0.00 66.41 66.83 2az3 h THR 85 Cb 0.57 0.45 0.01 0.00 -1.74 0.00 0.00 68.15 67.44 2az3 h THR 85 CO -0.54 0.25 -0.34 -0.09 0.37 0.00 0.00 175.52 175.17 2az3 h ARG 86 N 0.87 0.15 -0.76 6.66 2.43 -1.63 -2.64 114.38 119.47 2az3 h ARG 86 Ca 0.21 -0.22 0.17 0.00 -0.81 0.00 0.00 59.98 59.33 2az3 h ARG 86 Cb 0.13 0.08 -0.11 0.00 -0.42 0.00 0.00 29.97 29.64 2az3 h ARG 86 CO -0.02 1.07 0.18 1.96 -1.51 0.00 0.00 179.97 181.65 2az3 h GLN 87 N -0.66 0.26 -0.03 0.20 1.08 -0.87 -0.43 115.11 114.66 2az3 h GLN 87 Ca -0.06 -0.02 -0.13 0.00 -1.45 0.00 0.00 58.65 57.00 2az3 h GLN 87 Cb 1.22 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.58 2az3 h GLN 87 CO 0.06 0.17 -0.57 0.28 -0.95 0.00 0.00 178.83 177.82 2az3 h VAL 88 N 0.26 1.40 -0.21 -0.54 2.07 -1.25 -1.25 116.25 116.73 2az3 h VAL 88 Ca 0.43 -1.95 -0.12 0.00 0.82 0.00 0.00 66.70 65.88 2az3 h VAL 88 Cb 0.76 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 2az3 h VAL 88 CO -0.53 0.56 -0.38 -0.09 0.02 0.00 0.00 177.57 177.15 2az3 h ARG 89 N 0.06 0.48 -0.09 1.57 9.65 -0.76 -2.04 114.38 123.26 2az3 h ARG 89 Ca -0.00 -0.23 -0.11 0.00 -1.10 0.00 0.00 59.98 58.54 2az3 h ARG 89 Cb 1.03 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.60 2az3 h ARG 89 CO 0.08 0.79 -0.42 1.96 2.80 0.00 0.00 179.97 185.18 2az3 h GLN 90 N 0.40 0.20 -0.08 0.20 4.20 -0.63 -2.95 115.11 116.45 2az3 h GLN 90 Ca 0.04 -0.10 -0.13 0.00 0.06 0.00 0.00 58.65 58.52 2az3 h GLN 90 Cb 0.85 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 2az3 h GLN 90 CO 0.07 0.59 -0.54 -0.07 -0.67 0.00 0.00 178.83 178.22 2az3 h LEU 91 N 0.17 0.26 -0.53 1.46 3.38 -0.90 -3.20 115.31 115.95 2az3 h LEU 91 Ca 0.01 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 2az3 h LEU 91 Cb 0.82 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2az3 h LEU 91 CO 0.06 0.75 -0.08 0.24 0.09 0.00 0.00 178.44 179.50 2az3 h MET 92 N 0.18 0.98 0.00 1.13 2.86 -1.37 0.38 114.93 119.10 2az3 h MET 92 Ca 0.00 -0.36 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 2az3 h MET 92 Cb 1.00 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.60 2az3 h MET 92 CO 0.08 1.03 0.00 0.41 1.06 0.00 0.00 176.91 179.49 2az3 n GLY 93 N -0.28 -2.12 3.77 8.32 0.00 -1.12 -1.42 105.19 112.33 2az3 n GLY 93 Ca 0.01 -1.49 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 2az3 n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2az3 s ALA 94 N -1.06 3.22 0.12 4.61 0.00 -1.26 -4.92 121.76 122.47 2az3 s ALA 94 Ca 0.00 1.22 -0.30 0.00 0.00 0.00 0.00 51.96 52.89 2az3 s ALA 94 Cb 0.00 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 2az3 s ALA 94 CO 0.00 -0.85 1.59 1.15 0.00 0.00 0.00 175.76 177.65 2az3 h THR 95 N 2.38 0.18 -2.88 0.00 2.02 -1.97 -3.26 112.91 109.38 2az3 h THR 95 Ca -0.50 0.00 -0.57 0.00 0.77 0.00 0.00 66.41 66.12 2az3 h THR 95 Cb 1.25 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 2az3 h THR 95 CO 0.62 0.00 1.19 -0.62 0.37 0.00 0.00 175.52 177.08 2az3 s ASP 96 N -4.79 6.04 0.28 4.18 -1.08 -1.26 -4.80 116.67 115.24 2az3 s ASP 96 Ca -0.16 1.03 0.24 0.00 -0.52 0.00 0.00 52.55 53.13 2az3 s ASP 96 Cb 0.08 -2.53 1.02 0.00 -1.46 0.00 0.00 42.92 40.03 2az3 s ASP 96 CO 0.64 -1.64 1.71 0.00 0.52 0.00 0.00 175.17 176.40 2az3 n ALA 97 N 9.81 1.56 0.32 3.66 0.00 -1.20 -0.40 120.51 134.26 2az3 n ALA 97 Ca 0.20 0.11 0.21 0.00 0.00 0.00 0.00 53.44 53.95 2az3 n ALA 97 Cb 0.48 -1.38 1.04 0.00 0.00 0.00 0.00 19.45 19.58 2az3 n ALA 97 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2az3 h GLN 98 N 0.00 0.00 0.00 0.00 4.20 -1.80 -3.27 115.11 114.24 2az3 h GLN 98 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2az3 h GLN 98 Cb 0.31 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 2az3 h GLN 98 CO 0.00 0.00 -1.41 -0.25 -0.67 0.00 0.00 178.83 176.50 2az3 n ASP 99 N -3.03 3.07 -4.56 1.46 8.00 0.46 -5.01 116.55 116.95 2az3 n ASP 99 Ca -0.02 0.00 -0.44 0.00 0.71 0.00 0.00 54.79 55.04 2az3 n ASP 99 Cb 0.14 1.29 -0.01 0.00 -0.02 0.00 0.00 41.12 42.52 2az3 n ASP 99 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2az3 n ALA 100 N -1.86 -0.52 -1.71 2.24 0.00 -0.82 -4.76 120.51 113.08 2az3 n ALA 100 Ca -0.03 0.33 -0.33 0.00 0.00 0.00 0.00 53.44 53.41 2az3 n ALA 100 Cb 0.29 -1.97 -0.00 0.00 0.00 0.00 0.00 19.45 17.78 2az3 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2az3 s ALA 101 N -1.16 2.78 0.45 0.00 0.00 -1.26 -4.40 121.76 118.18 2az3 s ALA 101 Ca 0.60 0.44 -0.25 0.00 0.00 0.00 0.00 51.96 52.76 2az3 s ALA 101 Cb -0.67 -3.24 -0.08 0.00 0.00 0.00 0.00 23.12 19.13 2az3 s ALA 101 CO 0.59 -0.67 1.33 -2.14 0.00 0.00 0.00 175.76 174.86 2az3 s PRO 102 N -3.87 3.70 0.00 0.00 0.02 -1.26 -2.38 135.00 131.22 2az3 s PRO 102 Ca 0.64 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.86 2az3 s PRO 102 Cb -0.16 -2.59 0.00 0.00 0.02 0.00 0.00 34.50 31.77 2az3 s PRO 102 CO 0.33 -0.72 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 2az3 n GLY 103 N 0.63 2.49 3.90 0.52 0.00 -1.26 -4.98 105.19 106.49 2az3 n GLY 103 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.44 4.21 0.14 2.61 -4.23 -1.00 -4.95 115.64 109.98 2az3 s THR 104 Ca 0.00 0.22 -0.21 0.00 -1.18 0.00 0.00 61.69 60.52 2az3 s THR 104 Cb 0.00 -3.65 0.00 0.00 1.34 0.00 0.00 72.50 70.19 2az3 s THR 104 CO 0.00 -0.70 1.67 0.40 -0.54 0.00 0.00 174.62 175.45 2az3 h ILE 105 N -0.09 0.59 -0.04 2.99 2.04 -0.93 -1.57 117.51 120.49 2az3 h ILE 105 Ca -0.46 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.25 2az3 h ILE 105 Cb 1.23 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 2az3 h ILE 105 CO 0.61 0.00 -0.67 0.03 0.00 0.00 0.00 178.15 178.12 2az3 h ARG 106 N -0.16 0.18 -0.04 2.37 3.08 -1.49 -1.37 114.38 116.95 2az3 h ARG 106 Ca 0.11 -0.14 -0.16 0.00 0.07 0.00 0.00 59.98 59.86 2az3 h ARG 106 Cb 0.32 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2az3 h ARG 106 CO -0.28 0.78 -0.70 0.78 -1.07 0.00 0.00 179.97 179.49 2az3 h GLY 107 N 1.64 0.24 1.08 0.04 0.00 -1.65 -0.12 103.07 104.30 2az3 h GLY 107 Ca -0.01 -0.34 -0.29 0.00 0.00 0.00 0.00 47.33 46.69 2az3 h GLY 107 CO 0.10 0.30 -1.26 -0.55 0.00 0.00 0.00 176.54 175.14 2az3 h ASP 108 N 0.15 0.74 0.00 0.19 3.32 -1.20 -3.42 116.42 116.20 2az3 h ASP 108 Ca -0.02 -0.92 -0.04 0.00 0.02 0.00 0.00 57.03 56.07 2az3 h ASP 108 Cb 1.25 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 2az3 h ASP 108 CO 0.11 1.61 -1.94 -1.22 -1.72 0.00 0.00 179.24 176.07 2az3 n TYR 109 N -3.85 0.00 -4.44 4.55 4.01 -0.52 -5.02 117.16 111.88 2az3 n TYR 109 Ca -0.16 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.29 2az3 n TYR 109 Cb 1.01 -0.51 -0.12 0.00 -0.31 0.00 0.00 39.34 39.41 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 -4.39 1.63 -0.39 2.72 0.00 -0.06 -5.02 107.32 101.81 2az3 s GLY 110 Ca -0.07 -1.32 0.09 0.00 0.00 0.00 0.00 44.72 43.41 2az3 s GLY 110 CO 0.81 -1.27 0.56 1.16 0.00 0.00 0.00 173.10 174.36 2az3 n ASN 111 N 1.06 0.20 -3.73 1.64 6.94 -1.26 -4.55 115.26 115.56 2az3 n ASN 111 Ca -0.16 -2.75 -0.11 0.00 -0.02 0.00 0.00 54.58 51.54 2az3 n ASN 111 Cb 0.53 -0.58 -0.06 0.00 -2.36 0.00 0.00 39.78 37.30 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 -1.38 -0.12 -0.16 0.53 2.15 -1.26 -4.80 116.67 111.63 2az3 s ASP 112 Ca 0.36 -0.29 -0.15 0.00 0.43 0.00 0.00 52.55 52.89 2az3 s ASP 112 Cb 0.20 0.39 -0.11 0.00 -0.30 0.00 0.00 42.92 43.10 2az3 s ASP 112 CO -0.11 -0.71 0.11 0.25 -0.17 0.00 0.00 175.17 174.55 2az3 h LEU 113 N 2.87 0.00 0.00 -1.34 5.85 -1.95 -3.18 115.31 117.57 2az3 h LEU 113 Ca -0.33 -0.31 -0.00 0.00 0.84 0.00 0.00 57.88 58.08 2az3 h LEU 113 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2az3 h LEU 113 CO 0.48 1.02 -0.00 1.23 -0.34 0.00 0.00 178.44 180.83 2az3 h GLY 114 N -1.00 -0.00 -7.71 3.75 0.00 -1.97 -3.34 103.07 92.80 2az3 h GLY 114 Ca -0.13 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.48 2az3 h GLY 114 CO -0.08 -0.00 1.52 1.42 0.00 0.00 0.00 176.54 179.40 2az3 n HIS 115 N -5.05 4.89 -1.59 5.60 8.25 -1.26 -4.81 115.22 121.25 2az3 n HIS 115 Ca -0.07 -3.27 0.06 0.00 -0.26 0.00 0.00 57.72 54.19 2az3 n HIS 115 Cb 0.07 -2.26 0.16 0.00 1.12 0.00 0.00 29.99 29.08 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 6.06 1.71 0.00 0.41 6.94 -1.25 -4.09 115.26 125.03 2az3 n ASN 116 Ca 0.39 -3.41 0.00 0.00 -0.02 0.00 0.00 54.58 51.54 2az3 n ASN 116 Cb 0.43 -0.46 0.00 0.00 -2.36 0.00 0.00 39.78 37.39 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 -0.97 0.00 -3.53 -4.53 7.99 -1.26 -4.76 117.00 109.93 2az3 n LEU 117 Ca 0.16 0.00 -0.17 0.00 -0.01 0.00 0.00 56.01 55.99 2az3 n LEU 117 Cb 0.73 0.00 -0.06 0.00 -0.11 0.00 0.00 43.42 43.98 2az3 n LEU 117 CO -0.03 0.00 0.45 -0.51 -1.51 0.00 0.00 177.39 175.80 2az3 s ILE 118 N 0.00 0.00 0.10 -0.08 2.07 -1.26 -1.06 121.20 120.97 2az3 s ILE 118 Ca 0.00 0.00 0.08 0.00 -1.41 0.00 0.00 60.65 59.32 2az3 s ILE 118 Cb 0.00 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.56 2az3 s ILE 118 CO 0.00 0.00 -0.20 -2.28 -1.91 0.00 0.00 174.94 170.55 2az3 s HIS 119 N -1.02 1.68 -0.09 3.50 5.65 -0.00 -4.89 115.29 120.12 2az3 s HIS 119 Ca -0.09 -0.43 -0.11 0.00 0.25 0.00 0.00 55.06 54.68 2az3 s HIS 119 Cb -0.01 -0.92 0.03 0.00 -1.18 0.00 0.00 32.58 30.50 2az3 s HIS 119 CO 0.09 0.18 0.29 0.20 -0.65 0.00 0.00 174.74 174.85 2az3 s GLY 120 N -1.89 -0.20 0.59 1.59 0.00 -1.26 -1.10 107.32 105.06 2az3 s GLY 120 Ca 0.05 0.70 -0.20 0.00 0.00 0.00 0.00 44.72 45.27 2az3 s GLY 120 CO 0.04 0.57 1.29 -0.56 0.00 0.00 0.00 173.10 174.44 2az3 s SER 121 N -0.18 5.05 -0.08 1.64 0.01 -0.60 -4.95 113.70 114.59 2az3 s SER 121 Ca -0.03 2.62 -0.30 0.00 1.31 0.00 0.00 55.95 59.55 2az3 s SER 121 Cb -0.03 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 2az3 s SER 121 CO 0.01 -1.71 1.07 -0.62 0.41 0.00 0.00 173.24 172.41 2az3 s ASP 122 N -1.27 7.19 0.03 2.44 -1.08 -1.26 -4.80 116.67 117.91 2az3 s ASP 122 Ca 0.77 1.64 0.28 0.00 -0.52 0.00 0.00 52.55 54.72 2az3 s ASP 122 Cb -0.37 -2.56 1.05 0.00 -1.46 0.00 0.00 42.92 39.58 2az3 s ASP 122 CO 0.41 -0.48 1.81 0.00 0.52 0.00 0.00 175.17 177.43 2az3 n HIS 123 N 4.97 0.12 1.07 -5.34 1.44 -1.26 -3.45 115.22 112.76 2az3 n HIS 123 Ca 0.09 0.03 0.12 0.00 -2.01 0.00 0.00 57.72 55.95 2az3 n HIS 123 Cb 0.48 -0.51 0.16 0.00 0.12 0.00 0.00 29.99 30.24 2az3 n HIS 123 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2az3 n GLU 124 N -1.60 0.43 -3.71 -1.40 1.02 -1.26 -4.70 120.64 109.41 2az3 n GLU 124 Ca 0.06 -0.30 -0.37 0.00 -0.02 0.00 0.00 57.16 56.54 2az3 n GLU 124 Cb 0.35 -1.49 -0.10 0.00 -0.02 0.00 0.00 31.44 30.18 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 -2.78 5.31 0.03 1.62 3.68 -1.22 -5.06 116.67 118.25 2az3 s ASP 125 Ca 0.15 -2.55 -0.38 0.00 2.13 0.00 0.00 52.55 51.90 2az3 s ASP 125 Cb 0.18 -1.87 -0.19 0.00 -1.45 0.00 0.00 42.92 39.59 2az3 s ASP 125 CO 0.67 -0.45 0.99 -0.62 0.13 0.00 0.00 175.17 175.89 2az3 n GLU 126 N 3.91 0.03 -1.05 4.34 -0.58 -1.26 -0.85 120.64 125.18 2az3 n GLU 126 Ca 0.04 0.01 -0.07 0.00 -0.42 0.00 0.00 57.16 56.72 2az3 n GLU 126 Cb 0.39 -1.44 -0.03 0.00 -0.57 0.00 0.00 31.44 29.80 2az3 n GLU 126 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2az3 n GLY 127 N 1.60 0.68 0.22 0.62 0.00 -1.26 -4.82 105.19 102.24 2az3 n GLY 127 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 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 0.29 1.70 0.45 4.61 0.00 -1.22 -2.55 119.26 122.54 2az3 h ALA 128 Ca -0.15 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 2az3 h ALA 128 Cb 0.83 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2az3 h ALA 128 CO 0.21 0.23 -0.22 -2.95 0.00 0.00 0.00 179.25 176.53 2az3 h ASN 129 N 0.00 -0.52 0.37 0.00 -1.07 -1.80 -2.45 115.58 110.13 2az3 h ASN 129 Ca -0.00 -0.08 -0.08 0.00 0.07 0.00 0.00 56.30 56.20 2az3 h ASN 129 Cb 0.32 0.13 -0.01 0.00 -2.07 0.00 0.00 38.32 36.69 2az3 h ASN 129 CO 0.02 -0.20 -0.39 -0.33 0.07 0.00 0.00 177.43 176.61 2az3 h GLU 130 N -0.85 0.02 -0.01 4.14 4.39 -1.79 -2.76 114.58 117.73 2az3 h GLU 130 Ca -0.06 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.50 2az3 h GLU 130 Cb 0.57 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.22 2az3 h GLU 130 CO 0.10 0.41 -0.51 -0.09 -1.16 0.00 0.00 179.01 177.76 2az3 h ARG 131 N 0.02 0.37 -0.60 2.33 2.43 -1.55 -2.56 114.38 114.82 2az3 h ARG 131 Ca -0.00 -0.38 -0.07 0.00 -0.81 0.00 0.00 59.98 58.72 2az3 h ARG 131 Cb 0.70 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.32 2az3 h ARG 131 CO 0.05 1.05 0.11 0.93 -1.51 0.00 0.00 179.97 180.61 2az3 h GLU 132 N -0.16 0.97 -1.00 0.20 5.08 -1.45 -1.61 114.58 116.59 2az3 h GLU 132 Ca -0.06 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.10 2az3 h GLU 132 Cb 1.22 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 30.28 2az3 h GLU 132 CO 0.10 0.88 0.66 0.82 -1.00 0.00 0.00 179.01 180.47 2az3 h ILE 133 N 0.92 1.18 -0.74 3.13 2.04 -1.55 -0.42 117.51 122.07 2az3 h ILE 133 Ca 0.19 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 2az3 h ILE 133 Cb 0.38 -0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.22 2az3 h ILE 133 CO 0.01 0.23 0.44 0.00 0.00 0.00 0.00 178.15 178.83 2az3 h ALA 134 N 1.40 0.95 0.16 1.87 0.00 -0.95 -1.25 119.26 121.45 2az3 h ALA 134 Ca 0.40 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2az3 h ALA 134 Cb -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.47 2az3 h ALA 134 CO -0.12 0.43 -0.08 1.25 0.00 0.00 0.00 179.25 180.73 2az3 h LEU 135 N 1.02 -0.19 -0.07 0.00 5.85 -0.98 -3.33 115.31 117.61 2az3 h LEU 135 Ca 0.27 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2az3 h LEU 135 Cb -0.02 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2az3 h LEU 135 CO -0.05 0.22 -0.18 0.49 -0.34 0.00 0.00 178.44 178.58 2az3 n PHE 136 N -5.01 0.00 -3.90 1.25 3.01 -0.20 -4.89 117.46 107.72 2az3 n PHE 136 Ca -0.09 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.27 2az3 n PHE 136 Cb 0.24 -0.33 -0.10 0.00 -0.01 0.00 0.00 39.48 39.29 2az3 n PHE 136 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2az3 s PHE 137 N -2.83 0.10 0.48 1.38 0.40 -0.48 -5.06 117.98 111.98 2az3 s PHE 137 Ca 0.18 -0.26 0.07 0.00 -0.60 0.00 0.00 56.93 56.32 2az3 s PHE 137 Cb 0.19 -0.09 0.03 0.00 0.51 0.00 0.00 43.02 43.67 2az3 s PHE 137 CO 0.56 -0.29 0.66 -0.51 0.70 0.00 0.00 175.22 176.35 2az3 s ASP 138 N -1.53 5.43 0.00 1.36 1.01 -1.26 -4.43 116.67 117.25 2az3 s ASP 138 Ca -0.13 -0.44 0.29 0.00 0.71 0.00 0.00 52.55 52.98 2az3 s ASP 138 Cb -0.07 -0.47 1.35 0.00 1.01 0.00 0.00 42.92 44.74 2az3 s ASP 138 CO 0.00 -0.98 1.92 0.47 0.21 0.00 0.00 175.17 176.79 2az3 n ASP 139 N -2.05 0.57 -0.05 0.27 8.00 -1.26 -2.59 116.55 119.45 2az3 n ASP 139 Ca 0.10 -0.87 -0.06 0.00 0.71 0.00 0.00 54.79 54.67 2az3 n ASP 139 Cb 0.60 -0.04 0.13 0.00 -0.02 0.00 0.00 41.12 41.78 2az3 n ASP 139 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2az3 h ASP 140 N 0.80 0.67 0.16 -2.24 3.32 -2.02 -3.11 116.42 114.01 2az3 h ASP 140 Ca 0.00 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.81 2az3 h ASP 140 Cb 0.30 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2az3 h ASP 140 CO 0.00 0.90 -0.14 -0.62 -1.72 0.00 0.00 179.24 177.66 2az3 n GLU 141 N -4.11 1.10 -3.59 3.56 1.02 -1.07 -4.77 120.64 112.79 2az3 n GLU 141 Ca -0.00 -0.60 -0.24 0.00 -0.02 0.00 0.00 57.16 56.30 2az3 n GLU 141 Cb 0.43 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.35 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 -2.31 4.14 -0.02 -4.62 1.43 -1.18 -4.32 118.68 111.80 2az3 s LEU 142 Ca 0.30 0.36 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 2az3 s LEU 142 Cb 0.20 -3.18 0.01 0.00 0.03 0.00 0.00 46.19 43.25 2az3 s LEU 142 CO 0.45 -0.18 -0.04 -0.69 0.23 0.00 0.00 176.35 176.11 2az3 s VAL 143 N -2.13 0.42 -0.28 -1.59 1.01 0.61 -4.95 120.40 113.49 2az3 s VAL 143 Ca 0.38 -0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.08 2az3 s VAL 143 Cb -0.10 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2az3 s VAL 143 CO 0.33 0.15 0.27 -1.81 0.00 0.00 0.00 175.10 174.04 2az3 s ASP 144 N 0.33 6.12 0.21 3.32 1.01 -1.26 -4.76 116.67 121.64 2az3 s ASP 144 Ca -0.04 0.08 -0.07 0.00 0.71 0.00 0.00 52.55 53.24 2az3 s ASP 144 Cb -0.07 -2.16 -0.02 0.00 1.01 0.00 0.00 42.92 41.68 2az3 s ASP 144 CO -0.00 -0.12 0.29 -1.66 0.21 0.00 0.00 175.17 173.88 2az3 s TRP 145 N 1.89 0.70 -0.22 4.23 1.48 -1.26 -5.14 118.94 120.62 2az3 s TRP 145 Ca 0.10 -1.01 -0.05 0.00 -1.06 0.00 0.00 56.10 54.08 2az3 s TRP 145 Cb -0.16 -0.17 -0.02 0.00 -1.16 0.00 0.00 33.47 31.95 2az3 s TRP 145 CO 0.11 -0.79 0.01 0.16 -4.06 0.00 0.00 176.95 172.38 2az3 s ASP 146 N -3.06 4.81 -0.68 -2.66 3.84 -1.26 -5.05 116.67 112.61 2az3 s ASP 146 Ca 0.28 -0.24 -0.27 0.00 -0.00 0.00 0.00 52.55 52.32 2az3 s ASP 146 Cb 0.03 -1.84 0.01 0.00 -1.38 0.00 0.00 42.92 39.75 2az3 s ASP 146 CO 0.08 0.02 1.49 -0.13 -0.00 0.00 0.00 175.17 176.63 2az3 s ARG 147 N 1.28 3.01 0.34 2.11 1.81 -1.26 -4.89 118.95 121.35 2az3 s ARG 147 Ca 0.04 0.12 0.14 0.00 -1.72 0.00 0.00 55.73 54.31 2az3 s ARG 147 Cb -0.15 -4.24 1.08 0.00 -0.45 0.00 0.00 34.95 31.19 2az3 s ARG 147 CO 0.01 -2.32 1.64 -0.44 -0.68 0.00 0.00 175.30 173.51 2az3 h ASP 148 N 11.79 0.39 0.47 0.23 5.19 -2.05 -1.35 116.42 131.09 2az3 h ASP 148 Ca -0.27 0.21 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 2az3 h ASP 148 Cb 1.09 0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.79 2az3 h ASP 148 CO 1.25 -0.20 0.00 0.00 -3.12 0.00 0.00 179.24 177.17 2az3 h ALA 149 N 1.87 1.00 -0.02 3.45 0.00 -2.01 -2.53 119.26 121.03 2az3 h ALA 149 Ca 0.73 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.65 2az3 h ALA 149 Cb 1.70 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 2az3 h ALA 149 CO -0.65 0.00 0.33 0.77 0.00 0.00 0.00 179.25 179.69 2az3 h SER 150 N 0.00 0.00 0.18 0.00 0.02 -1.60 -0.52 113.55 111.63 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 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 2az3 h SER 150 CO 0.00 0.00 -0.01 0.00 -1.14 0.00 0.00 176.83 175.68 2az3 n ALA 151 N -1.91 2.63 -0.02 3.77 0.00 -0.95 -2.06 120.51 121.97 2az3 n ALA 151 Ca -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 53.44 53.22 2az3 n ALA 151 Cb 0.38 -1.48 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 2az3 n ALA 151 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2az3 n TRP 152 N -1.03 0.00 -0.00 0.00 7.02 -0.26 -4.72 117.44 118.46 2az3 n TRP 152 Ca 0.20 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.63 2az3 n TRP 152 Cb 0.17 -0.23 0.14 0.00 -2.42 0.00 0.00 31.31 28.96 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 1.29 -3.32 -0.99 2.07 -1.30 -3.45 116.25 110.56 2az3 h VAL 153 Ca -0.10 -1.48 -0.36 0.00 0.82 0.00 0.00 66.70 65.58 2az3 h VAL 153 Cb 0.99 1.49 -0.15 0.00 -1.52 0.00 0.00 31.29 32.10 2az3 h VAL 153 CO 0.01 0.47 -0.72 -0.31 0.02 0.00 0.00 177.57 177.03 2az3 s TYR 154 N -4.33 1.37 -2.67 1.57 2.02 -0.87 -5.08 117.35 109.35 2az3 s TYR 154 Ca -0.07 -0.69 0.27 0.00 -0.37 0.00 0.00 57.07 56.21 2az3 s TYR 154 Cb 0.13 -0.68 0.75 0.00 -0.40 0.00 0.00 41.96 41.75 2az3 s TYR 154 CO 0.81 0.15 1.58 -0.85 -1.57 0.00 0.00 175.55 175.66