#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 -1.17 -4.70 0.26 -0.08 -1.26 -4.93 116.55 104.68 2az3 n ASP 5 Ca 0.00 -0.95 -0.42 0.00 -1.51 0.00 0.00 54.79 51.91 2az3 n ASP 5 Cb 0.00 -0.53 -0.03 0.00 2.34 0.00 0.00 41.12 42.90 2az3 n ASP 5 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2az3 s GLU 6 N -4.36 4.21 0.06 -0.67 2.12 -1.26 -4.78 118.70 114.02 2az3 s GLU 6 Ca 0.38 2.31 0.08 0.00 0.36 0.00 0.00 54.97 58.10 2az3 s GLU 6 Cb -0.03 -3.48 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 2az3 s GLU 6 CO 0.28 -0.69 -0.21 1.03 -0.54 0.00 0.00 175.26 175.14 2az3 s ARG 7 N 2.22 1.89 0.05 4.30 0.52 -1.26 -1.86 118.95 124.82 2az3 s ARG 7 Ca 0.72 -1.08 0.03 0.00 -0.52 0.00 0.00 55.73 54.88 2az3 s ARG 7 Cb -0.40 -2.10 -0.03 0.00 0.52 0.00 0.00 34.95 32.94 2az3 s ARG 7 CO 0.32 0.51 -0.10 -0.08 0.02 0.00 0.00 175.30 175.97 2az3 s THR 8 N -0.95 0.77 -0.05 0.02 -1.32 0.43 -4.65 115.64 109.89 2az3 s THR 8 Ca 0.14 -1.16 -0.14 0.00 -1.21 0.00 0.00 61.69 59.33 2az3 s THR 8 Cb -0.10 -0.79 -0.05 0.00 -1.51 0.00 0.00 72.50 70.04 2az3 s THR 8 CO 0.05 -0.31 0.35 0.12 -2.21 0.00 0.00 174.62 172.63 2az3 s PHE 9 N -1.31 3.65 -0.05 9.09 5.36 -1.26 -1.23 117.98 132.23 2az3 s PHE 9 Ca -0.07 0.85 -0.07 0.00 -0.96 0.00 0.00 56.93 56.69 2az3 s PHE 9 Cb -0.10 -2.26 0.01 0.00 -0.34 0.00 0.00 43.02 40.33 2az3 s PHE 9 CO 0.01 0.56 0.17 0.54 -1.46 0.00 0.00 175.22 175.05 2az3 s VAL 10 N -0.70 0.02 -0.06 3.12 0.11 -0.65 -1.71 120.40 120.53 2az3 s VAL 10 Ca 0.21 -0.15 -0.02 0.00 -2.93 0.00 0.00 61.98 59.10 2az3 s VAL 10 Cb -0.15 -0.30 0.03 0.00 -1.53 0.00 0.00 36.38 34.43 2az3 s VAL 10 CO 0.10 -0.08 0.03 -0.32 -3.33 0.00 0.00 175.10 171.50 2az3 s MET 11 N -0.23 0.31 -0.19 1.54 0.00 0.32 -0.02 119.30 121.04 2az3 s MET 11 Ca -0.03 0.22 -0.29 0.00 0.00 0.00 0.00 55.69 55.59 2az3 s MET 11 Cb -0.03 -0.78 -0.01 0.00 0.00 0.00 0.00 34.83 34.01 2az3 s MET 11 CO 0.01 -0.32 1.29 0.08 0.00 0.00 0.00 175.02 176.08 2az3 s VAL 12 N 2.06 4.22 0.88 10.11 1.01 0.05 0.62 120.40 139.35 2az3 s VAL 12 Ca 0.05 1.46 -0.12 0.00 0.00 0.00 0.00 61.98 63.37 2az3 s VAL 12 Cb -0.12 -4.01 0.12 0.00 0.00 0.00 0.00 36.38 32.37 2az3 s VAL 12 CO -0.04 -0.20 1.16 -0.54 0.00 0.00 0.00 175.10 175.48 2az3 s LYS 13 N 3.66 1.39 0.32 2.72 1.02 0.58 -2.47 119.74 126.97 2az3 s LYS 13 Ca 0.56 0.21 0.05 0.00 0.02 0.00 0.00 55.97 56.81 2az3 s LYS 13 Cb -0.21 -1.88 0.69 0.00 -0.52 0.00 0.00 37.83 35.92 2az3 s LYS 13 CO 0.17 -2.01 1.86 -1.35 -0.92 0.00 0.00 175.35 173.10 2az3 h PRO 14 N -1.36 0.81 -0.70 -1.68 0.11 -1.81 0.97 132.00 128.35 2az3 h PRO 14 Ca -0.49 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.62 2az3 h PRO 14 Cb 1.33 -0.18 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 2az3 h PRO 14 CO 0.62 0.54 0.42 0.38 -0.21 0.00 0.00 178.00 179.75 2az3 h ASP 15 N 0.84 0.67 -0.86 -2.05 2.03 -1.90 -0.51 116.42 114.64 2az3 h ASP 15 Ca 0.46 0.01 0.09 0.00 -0.73 0.00 0.00 57.03 56.86 2az3 h ASP 15 Cb 0.58 -0.13 -0.07 0.00 -0.83 0.00 0.00 39.33 38.88 2az3 h ASP 15 CO -0.22 0.45 0.51 1.23 -1.03 0.00 0.00 179.24 180.18 2az3 h GLY 16 N 0.81 1.33 0.52 7.15 0.00 -0.99 -0.54 103.07 111.35 2az3 h GLY 16 Ca 0.29 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 2az3 h GLY 16 CO -0.14 0.18 -0.02 -2.08 0.00 0.00 0.00 176.54 174.48 2az3 h VAL 17 N 0.88 1.40 -0.74 4.60 2.07 -1.00 -2.01 116.25 121.44 2az3 h VAL 17 Ca 0.40 -1.23 0.13 0.00 0.82 0.00 0.00 66.70 66.82 2az3 h VAL 17 Cb 0.31 2.19 -0.09 0.00 -1.52 0.00 0.00 31.29 32.18 2az3 h VAL 17 CO -0.22 0.33 0.32 1.56 0.02 0.00 0.00 177.57 179.57 2az3 h GLN 18 N -0.44 0.48 -0.10 1.57 1.08 -0.85 -2.87 115.11 113.99 2az3 h GLN 18 Ca 0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2az3 h GLN 18 Cb 0.54 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.86 2az3 h GLN 18 CO 0.01 0.32 0.00 0.54 -0.95 0.00 0.00 178.83 178.74 2az3 n ARG 19 N -4.96 1.38 -1.85 1.46 1.74 -0.23 -4.91 116.66 109.30 2az3 n ARG 19 Ca 0.13 -0.58 0.00 0.00 -0.77 0.00 0.00 57.85 56.63 2az3 n ARG 19 Cb 0.37 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.49 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 0.95 0.57 0.55 -0.13 0.00 -1.08 -4.96 105.19 101.09 2az3 n GLY 20 Ca 0.14 -0.79 0.05 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.04 2.62 0.30 0.99 4.77 -0.77 -4.65 117.00 120.23 2az3 n LEU 21 Ca 0.00 -1.75 -0.17 0.00 -0.03 0.00 0.00 56.01 54.06 2az3 n LEU 21 Cb 0.45 -0.16 -0.09 0.00 -2.33 0.00 0.00 43.42 41.29 2az3 n LEU 21 CO 0.00 0.63 0.69 0.40 -1.33 0.00 0.00 177.39 177.78 2az3 h ILE 22 N 1.94 0.47 -0.46 -0.08 2.04 -1.89 -2.70 117.51 116.84 2az3 h ILE 22 Ca 0.00 -0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 2az3 h ILE 22 Cb 0.65 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 2az3 h ILE 22 CO 0.00 0.00 0.30 1.23 0.00 0.00 0.00 178.15 179.68 2az3 h GLY 23 N -0.73 0.58 1.60 5.37 0.00 -1.97 -0.46 103.07 107.46 2az3 h GLY 23 Ca -0.07 -0.20 -0.11 0.00 0.00 0.00 0.00 47.33 46.94 2az3 h GLY 23 CO 0.12 0.18 -0.35 -0.55 0.00 0.00 0.00 176.54 175.95 2az3 h ASP 24 N 0.52 0.46 0.16 0.19 3.32 -1.82 0.21 116.42 119.46 2az3 h ASP 24 Ca 0.18 -0.18 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 2az3 h ASP 24 Cb 0.09 -0.13 0.02 0.00 0.22 0.00 0.00 39.33 39.53 2az3 h ASP 24 CO -0.04 0.78 -0.92 0.40 -1.72 0.00 0.00 179.24 177.73 2az3 h ILE 25 N 0.38 1.47 -0.70 0.35 2.04 -1.12 -2.57 117.51 117.36 2az3 h ILE 25 Ca 0.04 -2.56 -0.02 0.00 1.00 0.00 0.00 64.86 63.32 2az3 h ILE 25 Cb 0.79 3.16 -0.03 0.00 -0.74 0.00 0.00 36.82 40.00 2az3 h ILE 25 CO 0.06 0.73 0.35 0.58 0.00 0.00 0.00 178.15 179.87 2az3 h VAL 26 N -0.27 1.23 -0.73 1.67 2.07 -0.97 -2.35 116.25 116.90 2az3 h VAL 26 Ca -0.16 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 2az3 h VAL 26 Cb 1.73 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 2az3 h VAL 26 CO 0.17 0.27 0.38 0.74 0.02 0.00 0.00 177.57 179.15 2az3 h THR 27 N 0.98 1.22 0.00 2.57 2.02 -0.58 -1.03 112.91 118.09 2az3 h THR 27 Ca 0.24 -0.58 -0.07 0.00 0.77 0.00 0.00 66.41 66.77 2az3 h THR 27 Cb 0.10 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 66.76 2az3 h THR 27 CO -0.03 0.25 -0.33 0.03 0.37 0.00 0.00 175.52 175.81 2az3 h ARG 28 N 1.02 0.00 -0.04 6.66 3.08 -1.02 -1.75 114.38 122.34 2az3 h ARG 28 Ca 0.26 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.20 2az3 h ARG 28 Cb 0.05 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.11 2az3 h ARG 28 CO -0.04 0.33 -0.40 -0.07 -1.07 0.00 0.00 179.97 178.72 2az3 h LEU 29 N 0.00 0.42 -0.32 3.04 3.38 -0.73 -2.79 115.31 118.31 2az3 h LEU 29 Ca -0.00 -0.70 -0.19 0.00 0.09 0.00 0.00 57.88 57.07 2az3 h LEU 29 Cb 0.73 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2az3 h LEU 29 CO 0.04 1.06 -0.66 -0.33 0.09 0.00 0.00 178.44 178.64 2az3 h GLU 30 N -0.18 0.70 -0.05 1.13 5.08 -1.28 -2.55 114.58 117.42 2az3 h GLU 30 Ca -0.04 -0.50 -0.01 0.00 -1.00 0.00 0.00 59.36 57.81 2az3 h GLU 30 Cb 1.09 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 2az3 h GLU 30 CO 0.08 1.12 -0.00 1.15 -1.00 0.00 0.00 179.01 180.36 2az3 h THR 31 N 0.51 1.04 0.00 1.13 2.02 -1.43 -0.65 112.91 115.53 2az3 h THR 31 Ca -0.02 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.02 2az3 h THR 31 Cb 1.26 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 2az3 h THR 31 CO 0.13 0.05 0.00 0.50 0.37 0.00 0.00 175.52 176.57 2az3 h LYS 32 N 0.07 0.00 0.00 6.66 1.63 -1.34 -3.47 116.57 120.13 2az3 h LYS 32 Ca 0.02 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2az3 h LYS 32 Cb 0.05 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.68 2az3 h LYS 32 CO 0.00 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 176.41 2az3 n GLY 33 N 0.61 0.91 3.89 5.01 0.00 -0.25 -5.09 105.19 110.27 2az3 n GLY 33 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 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 3.72 -0.13 0.99 1.43 -0.98 -4.92 118.68 118.80 2az3 s LEU 34 Ca 0.00 1.06 -0.03 0.00 -1.03 0.00 0.00 54.13 54.13 2az3 s LEU 34 Cb 0.00 -3.97 -0.03 0.00 0.03 0.00 0.00 46.19 42.21 2az3 s LEU 34 CO 0.00 -0.49 -0.02 -0.75 0.23 0.00 0.00 176.35 175.32 2az3 s LYS 35 N -4.27 3.40 -0.00 1.70 2.20 0.74 -4.33 119.74 119.17 2az3 s LYS 35 Ca 0.50 -0.48 -0.27 0.00 -0.36 0.00 0.00 55.97 55.35 2az3 s LYS 35 Cb -0.10 -2.86 -0.04 0.00 -1.51 0.00 0.00 37.83 33.31 2az3 s LYS 35 CO 0.38 0.42 0.86 1.41 -0.36 0.00 0.00 175.35 178.06 2az3 s MET 36 N -0.11 4.53 0.00 4.03 -2.45 -1.26 -0.51 119.30 123.52 2az3 s MET 36 Ca 0.03 1.21 0.00 0.00 -1.25 0.00 0.00 55.69 55.68 2az3 s MET 36 Cb -0.13 -3.43 0.00 0.00 1.25 0.00 0.00 34.83 32.52 2az3 s MET 36 CO 0.02 0.06 0.00 1.33 1.05 0.00 0.00 175.02 177.48 2az3 n VAL 37 N 3.61 0.00 -3.86 10.11 0.24 -0.41 -4.94 118.33 123.07 2az3 n VAL 37 Ca 0.02 -0.28 -0.10 0.00 -2.04 0.00 0.00 64.34 61.94 2az3 n VAL 37 Cb 0.51 0.80 -0.09 0.00 -1.47 0.00 0.00 33.84 33.59 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 -1.14 0.06 -0.30 7.63 0.00 -1.12 0.52 107.32 112.97 2az3 s GLY 38 Ca 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 44.72 44.24 2az3 s GLY 38 CO 0.00 -0.48 1.11 -0.32 0.00 0.00 0.00 173.10 173.41 2az3 s GLY 39 N -2.03 0.12 -0.22 0.20 0.00 -1.25 -1.27 107.32 102.86 2az3 s GLY 39 Ca -0.06 3.37 -0.10 0.00 0.00 0.00 0.00 44.72 47.93 2az3 s GLY 39 CO -0.03 3.07 0.50 1.25 0.00 0.00 0.00 173.10 177.89 2az3 s LYS 40 N 1.89 0.46 -0.25 2.90 2.20 0.68 -4.99 119.74 122.63 2az3 s LYS 40 Ca -0.04 1.03 -0.16 0.00 -0.36 0.00 0.00 55.97 56.44 2az3 s LYS 40 Cb -0.03 0.22 -0.03 0.00 -1.51 0.00 0.00 37.83 36.47 2az3 s LYS 40 CO -0.15 -0.19 0.44 0.12 -0.36 0.00 0.00 175.35 175.21 2az3 s PHE 41 N 1.98 3.28 0.20 4.03 5.36 -1.26 -0.74 117.98 130.84 2az3 s PHE 41 Ca -0.07 0.56 -0.15 0.00 -0.96 0.00 0.00 56.93 56.31 2az3 s PHE 41 Cb -0.09 -2.63 0.01 0.00 -0.34 0.00 0.00 43.02 39.97 2az3 s PHE 41 CO -0.15 -0.21 0.47 0.00 -1.46 0.00 0.00 175.22 173.88 2az3 s MET 42 N 2.01 1.39 -0.17 10.12 0.23 -0.78 -4.98 119.30 127.11 2az3 s MET 42 Ca 0.19 -1.01 -0.07 0.00 -1.03 0.00 0.00 55.69 53.77 2az3 s MET 42 Cb -0.16 0.48 -0.04 0.00 -1.53 0.00 0.00 34.83 33.59 2az3 s MET 42 CO 0.09 -0.57 0.06 0.50 -2.03 0.00 0.00 175.02 173.07 2az3 s ARG 43 N -3.92 3.86 -0.26 3.16 3.52 -1.26 -0.02 118.95 124.02 2az3 s ARG 43 Ca 0.13 -0.34 -0.29 0.00 -0.13 0.00 0.00 55.73 55.11 2az3 s ARG 43 Cb -0.00 -3.17 0.01 0.00 -1.56 0.00 0.00 34.95 30.22 2az3 s ARG 43 CO 0.01 0.34 1.15 0.42 -0.81 0.00 0.00 175.30 176.41 2az3 s ILE 44 N 0.17 4.44 0.89 4.11 1.01 -1.26 -4.99 121.20 125.56 2az3 s ILE 44 Ca 0.04 1.69 -0.13 0.00 0.00 0.00 0.00 60.65 62.26 2az3 s ILE 44 Cb -0.12 -4.25 0.13 0.00 0.01 0.00 0.00 42.46 38.22 2az3 s ILE 44 CO 0.01 -0.33 1.19 1.51 0.00 0.00 0.00 174.94 177.31 2az3 s ASP 45 N 1.81 3.79 0.24 3.58 1.47 -1.26 -4.48 116.67 121.82 2az3 s ASP 45 Ca 0.49 0.74 -0.00 0.00 1.18 0.00 0.00 52.55 54.96 2az3 s ASP 45 Cb -0.16 -1.17 0.27 0.00 -0.34 0.00 0.00 42.92 41.52 2az3 s ASP 45 CO 0.14 -2.35 1.64 -0.08 0.68 0.00 0.00 175.17 175.19 2az3 h GLU 46 N -1.37 0.56 -0.30 2.11 4.81 -1.98 -1.90 114.58 116.52 2az3 h GLU 46 Ca -0.47 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 58.48 2az3 h GLU 46 Cb 1.31 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 2az3 h GLU 46 CO 0.58 0.82 0.08 0.93 -0.73 0.00 0.00 179.01 180.69 2az3 h GLU 47 N 0.47 0.47 -0.70 1.92 5.08 -1.99 0.05 114.58 119.89 2az3 h GLU 47 Ca 0.05 -0.11 0.02 0.00 -1.00 0.00 0.00 59.36 58.32 2az3 h GLU 47 Cb 0.81 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.96 2az3 h GLU 47 CO 0.07 0.54 0.47 1.25 -1.00 0.00 0.00 179.01 180.34 2az3 h LEU 48 N 0.32 0.78 -0.26 1.33 5.85 -1.83 -1.14 115.31 120.35 2az3 h LEU 48 Ca 0.09 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.62 2az3 h LEU 48 Cb 0.28 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2az3 h LEU 48 CO -0.00 0.55 -0.83 0.00 -0.34 0.00 0.00 178.44 177.83 2az3 h ALA 49 N 1.57 0.58 0.05 1.25 0.00 -1.13 -0.76 119.26 120.83 2az3 h ALA 49 Ca 0.27 -0.75 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2az3 h ALA 49 Cb -0.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2az3 h ALA 49 CO -0.07 1.04 -0.03 0.45 0.00 0.00 0.00 179.25 180.64 2az3 h HIS 50 N 0.00 -0.07 -0.14 0.00 3.86 -0.22 -1.84 115.15 116.74 2az3 h HIS 50 Ca -0.01 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2az3 h HIS 50 Cb 1.51 0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.99 2az3 h HIS 50 CO 0.00 -0.01 0.09 0.93 0.86 0.00 0.00 177.93 179.80 2az3 h GLU 51 N -0.10 0.19 -0.58 2.45 5.08 -1.20 0.30 114.58 120.71 2az3 h GLU 51 Ca -0.01 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.41 2az3 h GLU 51 Cb 0.08 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2az3 h GLU 51 CO 0.01 0.15 0.39 1.25 -1.00 0.00 0.00 179.01 179.81 2az3 h HIS 52 N 0.17 0.52 -0.14 4.33 2.76 -1.12 -3.03 115.15 118.63 2az3 h HIS 52 Ca 0.05 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 2az3 h HIS 52 Cb 0.01 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.79 2az3 h HIS 52 CO -0.06 0.27 -0.03 0.66 -1.30 0.00 0.00 177.93 177.47 2az3 n TYR 53 N -4.48 0.49 -0.22 5.26 4.01 -0.70 -4.77 117.16 116.76 2az3 n TYR 53 Ca 0.08 -1.02 0.03 0.00 -0.16 0.00 0.00 57.90 56.83 2az3 n TYR 53 Cb 0.27 -0.25 0.14 0.00 -0.31 0.00 0.00 39.34 39.19 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 0.91 0.85 0.00 -0.72 0.00 -0.28 -0.39 119.26 119.61 2az3 h ALA 54 Ca 0.02 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2az3 h ALA 54 Cb 1.24 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2az3 h ALA 54 CO 0.13 -0.27 0.20 1.05 0.00 0.00 0.00 179.25 180.35 2az3 h GLU 55 N 0.33 0.00 -0.53 0.00 4.11 -1.86 -1.51 114.58 115.12 2az3 h GLU 55 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.79 2az3 h GLU 55 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2az3 h GLU 55 CO -0.41 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.39 2az3 n HIS 56 N -2.96 0.71 -0.04 2.06 8.25 -0.16 -4.70 115.22 118.37 2az3 n HIS 56 Ca -0.02 -0.47 0.09 0.00 -0.26 0.00 0.00 57.72 57.05 2az3 n HIS 56 Cb 0.25 -0.01 0.48 0.00 1.12 0.00 0.00 29.99 31.83 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 3.30 0.43 0.00 -0.41 4.81 -1.28 -0.57 114.58 120.87 2az3 h GLU 57 Ca 0.00 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.07 2az3 h GLU 57 Cb 0.87 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 2az3 h GLU 57 CO 0.00 0.29 -0.63 0.38 -0.73 0.00 0.00 179.01 178.32 2az3 h ASP 58 N 0.45 0.00 -4.10 1.04 2.03 -1.84 -3.47 116.42 110.52 2az3 h ASP 58 Ca 0.22 0.00 -0.48 0.00 -0.73 0.00 0.00 57.03 56.04 2az3 h ASP 58 Cb 0.30 0.00 0.03 0.00 -0.83 0.00 0.00 39.33 38.83 2az3 h ASP 58 CO -0.06 0.63 0.38 -0.54 -1.03 0.00 0.00 179.24 178.63 2az3 s LYS 59 N -3.57 3.69 0.46 4.15 1.02 -0.22 -4.96 119.74 120.31 2az3 s LYS 59 Ca -0.01 1.32 0.14 0.00 0.02 0.00 0.00 55.97 57.44 2az3 s LYS 59 Cb 0.13 -2.08 1.10 0.00 -0.52 0.00 0.00 37.83 36.46 2az3 s LYS 59 CO 0.76 -0.52 2.04 -1.35 -0.92 0.00 0.00 175.35 175.37 2az3 h PRO 60 N 1.29 0.28 -0.00 -1.68 0.11 -1.92 -2.79 132.00 127.28 2az3 h PRO 60 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2az3 h PRO 60 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2az3 h PRO 60 CO 0.59 0.18 -0.31 1.97 -0.21 0.00 0.00 178.00 180.22 2az3 n PHE 61 N -4.47 0.00 -0.09 0.65 1.16 -1.26 -4.29 117.46 109.16 2az3 n PHE 61 Ca 0.05 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.54 2az3 n PHE 61 Cb 0.26 -0.21 -0.03 0.00 -1.61 0.00 0.00 39.48 37.89 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 0.53 -1.01 -0.77 2.97 3.57 -1.70 -0.72 116.94 119.82 2az3 h PHE 62 Ca 0.00 0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.62 2az3 h PHE 62 Cb 0.48 0.49 -0.06 0.00 2.79 0.00 0.00 35.95 39.65 2az3 h PHE 62 CO 0.00 -0.41 0.46 -0.44 -2.23 0.00 0.00 178.31 175.69 2az3 h ASP 63 N -0.31 0.70 0.69 0.41 3.32 -1.83 0.39 116.42 119.79 2az3 h ASP 63 Ca 0.14 0.02 -0.14 0.00 0.02 0.00 0.00 57.03 57.08 2az3 h ASP 63 Cb 0.56 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 2az3 h ASP 63 CO -0.51 0.45 -0.67 1.23 -1.72 0.00 0.00 179.24 178.02 2az3 h GLY 64 N 0.83 0.00 0.98 2.75 0.00 -1.81 -2.33 103.07 103.49 2az3 h GLY 64 Ca 0.34 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.61 2az3 h GLY 64 CO -0.18 0.00 0.07 -2.00 0.00 0.00 0.00 176.54 174.43 2az3 h LEU 65 N 0.00 0.76 -0.80 3.11 5.85 -0.48 -0.45 115.31 123.29 2az3 h LEU 65 Ca -0.01 -0.26 -0.12 0.00 0.84 0.00 0.00 57.88 58.33 2az3 h LEU 65 Cb 1.19 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 2az3 h LEU 65 CO 0.09 0.83 -0.56 -0.37 -0.34 0.00 0.00 178.44 178.09 2az3 h VAL 66 N 0.66 1.32 -0.05 1.05 -1.51 -0.80 -2.09 116.25 114.84 2az3 h VAL 66 Ca 0.14 -1.98 -0.07 0.00 -1.23 0.00 0.00 66.70 63.56 2az3 h VAL 66 Cb 0.40 2.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.65 2az3 h VAL 66 CO 0.01 0.55 -0.25 -1.28 -1.23 0.00 0.00 177.57 175.37 2az3 h SER 67 N 0.00 0.30 -0.08 4.19 0.87 -1.42 -2.79 113.55 114.62 2az3 h SER 67 Ca -0.01 -0.66 0.04 0.00 -1.23 0.00 0.00 61.79 59.93 2az3 h SER 67 Cb 1.05 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.86 2az3 h SER 67 CO 0.07 0.92 -0.26 0.15 -0.53 0.00 0.00 176.83 177.18 2az3 h PHE 68 N -0.29 -0.71 0.00 2.24 3.57 -1.07 -1.47 116.94 119.22 2az3 h PHE 68 Ca -0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2az3 h PHE 68 Cb 0.91 0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.98 2az3 h PHE 68 CO 0.14 -0.35 0.00 0.97 -2.23 0.00 0.00 178.31 176.84 2az3 h ILE 69 N -0.36 0.00 -0.12 1.41 6.09 -1.43 -0.44 117.51 122.66 2az3 h ILE 69 Ca 0.09 -0.48 0.00 0.00 -1.37 0.00 0.00 64.86 63.10 2az3 h ILE 69 Cb 0.48 1.39 0.00 0.00 0.47 0.00 0.00 36.82 39.17 2az3 h ILE 69 CO -0.29 0.00 0.00 0.35 -3.07 0.00 0.00 178.15 175.14 2az3 n THR 70 N -2.73 0.14 1.62 2.19 -2.24 -1.05 -4.55 114.28 107.66 2az3 n THR 70 Ca 0.02 -0.50 0.12 0.00 -2.27 0.00 0.00 64.05 61.42 2az3 n THR 70 Cb 0.32 1.11 0.55 0.00 -2.10 0.00 0.00 70.33 70.21 2az3 n THR 70 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2az3 n SER 71 N 1.09 0.91 -3.62 3.42 3.41 -0.17 -4.86 113.62 113.80 2az3 n SER 71 Ca 0.16 -1.46 -0.01 0.00 -0.26 0.00 0.00 58.87 57.30 2az3 n SER 71 Cb 0.54 -0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.43 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 -1.74 -0.28 0.86 5.00 0.00 -1.26 -5.08 107.32 104.82 2az3 s GLY 72 Ca 0.35 1.67 -0.11 0.00 0.00 0.00 0.00 44.72 46.63 2az3 s GLY 72 CO 0.28 0.52 1.15 2.56 0.00 0.00 0.00 173.10 177.62 2az3 s PRO 73 N -2.05 1.39 0.30 2.90 0.04 -1.26 -4.56 135.00 131.75 2az3 s PRO 73 Ca 0.13 1.54 0.07 0.00 0.04 0.00 0.00 61.00 62.78 2az3 s PRO 73 Cb 0.01 -1.77 -0.06 0.00 0.04 0.00 0.00 34.50 32.72 2az3 s PRO 73 CO -0.03 -2.36 -0.06 0.14 0.04 0.00 0.00 177.00 174.73 2az3 s VAL 74 N -2.56 1.78 -0.27 -0.36 -7.23 0.98 -4.02 120.40 108.72 2az3 s VAL 74 Ca 0.67 -2.14 0.01 0.00 -1.81 0.00 0.00 61.98 58.72 2az3 s VAL 74 Cb -0.23 -2.53 0.05 0.00 0.56 0.00 0.00 36.38 34.23 2az3 s VAL 74 CO 0.55 -0.25 -0.07 0.12 -0.31 0.00 0.00 175.10 175.14 2az3 s PHE 75 N -2.92 3.21 -0.15 2.82 5.36 -1.03 -1.87 117.98 123.41 2az3 s PHE 75 Ca 0.31 -2.05 -0.06 0.00 -0.96 0.00 0.00 56.93 54.16 2az3 s PHE 75 Cb 0.04 -2.00 -0.04 0.00 -0.34 0.00 0.00 43.02 40.68 2az3 s PHE 75 CO 0.13 -0.83 0.08 0.00 -1.46 0.00 0.00 175.22 173.14 2az3 s ALA 76 N 1.19 3.55 0.05 11.12 0.00 0.08 -0.77 121.76 136.98 2az3 s ALA 76 Ca -0.06 -0.72 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 2az3 s ALA 76 Cb -0.19 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 2az3 s ALA 76 CO -0.04 0.38 0.00 -1.64 0.00 0.00 0.00 175.76 174.46 2az3 s MET 77 N -0.27 0.59 -0.02 0.00 1.00 0.98 -0.23 119.30 121.35 2az3 s MET 77 Ca 0.09 -1.08 0.03 0.00 0.00 0.00 0.00 55.69 54.73 2az3 s MET 77 Cb -0.12 0.21 0.00 0.00 0.00 0.00 0.00 34.83 34.92 2az3 s MET 77 CO 0.01 -0.12 -0.09 0.08 0.00 0.00 0.00 175.02 174.90 2az3 s VAL 78 N -3.50 0.74 -0.02 -6.03 1.01 -0.40 -1.64 120.40 110.57 2az3 s VAL 78 Ca 0.03 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.68 2az3 s VAL 78 Cb 0.05 -0.65 -0.00 0.00 0.00 0.00 0.00 36.38 35.77 2az3 s VAL 78 CO -0.09 0.23 -0.11 0.26 0.00 0.00 0.00 175.10 175.39 2az3 s TRP 79 N 0.07 1.08 0.04 5.22 0.52 -0.36 -1.29 118.94 124.21 2az3 s TRP 79 Ca -0.01 -0.24 0.07 0.00 0.02 0.00 0.00 56.10 55.94 2az3 s TRP 79 Cb -0.07 -0.73 -0.02 0.00 -1.15 0.00 0.00 33.47 31.50 2az3 s TRP 79 CO 0.00 -0.06 -0.20 -2.00 0.02 0.00 0.00 176.95 174.71 2az3 s GLU 80 N -0.07 1.34 0.00 4.98 2.12 0.34 -0.43 118.70 126.98 2az3 s GLU 80 Ca 0.01 -0.90 0.00 0.00 0.36 0.00 0.00 54.97 54.43 2az3 s GLU 80 Cb -0.07 -1.43 0.00 0.00 0.26 0.00 0.00 34.13 32.89 2az3 s GLU 80 CO 0.00 0.37 0.00 0.41 -0.54 0.00 0.00 175.26 175.50 2az3 n GLY 81 N 1.89 3.71 3.65 -1.50 0.00 -0.78 -0.19 105.19 111.98 2az3 n GLY 81 Ca -0.17 -1.10 -0.47 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.40 0.65 -4.10 4.61 0.00 -1.26 -2.36 120.51 116.65 2az3 n ALA 82 Ca 0.00 0.45 -0.32 0.00 0.00 0.00 0.00 53.44 53.57 2az3 n ALA 82 Cb 0.00 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 17.18 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 2.82 -2.68 0.03 0.00 2.03 -1.26 -4.87 116.55 112.63 2az3 n ASP 83 Ca 0.16 -0.97 -0.13 0.00 0.52 0.00 0.00 54.79 54.36 2az3 n ASP 83 Cb 0.27 -3.02 -0.02 0.00 -0.72 0.00 0.00 41.12 37.63 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 0.90 0.44 -0.22 -1.67 0.00 -1.71 0.17 119.26 117.17 2az3 h ALA 84 Ca -0.60 -0.63 0.01 0.00 0.00 0.00 0.00 54.91 53.69 2az3 h ALA 84 Cb 1.38 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 2az3 h ALA 84 CO 0.72 0.74 0.12 1.15 0.00 0.00 0.00 179.25 181.98 2az3 h THR 85 N 0.35 1.01 -0.01 0.00 2.02 -1.86 -1.02 112.91 113.40 2az3 h THR 85 Ca -0.05 -0.08 -0.25 0.00 0.77 0.00 0.00 66.41 66.80 2az3 h THR 85 Cb 1.41 0.74 0.01 0.00 -1.74 0.00 0.00 68.15 68.58 2az3 h THR 85 CO 0.15 0.05 -0.98 -0.09 0.37 0.00 0.00 175.52 175.01 2az3 h ARG 86 N 0.25 0.58 -0.82 6.66 2.43 -1.81 -1.65 114.38 120.02 2az3 h ARG 86 Ca 0.09 -0.61 0.02 0.00 -0.81 0.00 0.00 59.98 58.66 2az3 h ARG 86 Cb 0.01 0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 2az3 h ARG 86 CO -0.05 1.22 0.54 1.96 -1.51 0.00 0.00 179.97 182.14 2az3 h GLN 87 N 0.33 1.05 -0.35 0.20 1.08 -0.51 -1.45 115.11 115.46 2az3 h GLN 87 Ca -0.10 -0.06 -0.15 0.00 -1.45 0.00 0.00 58.65 56.88 2az3 h GLN 87 Cb 1.62 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 28.81 2az3 h GLN 87 CO 0.18 0.69 -0.39 0.28 -0.95 0.00 0.00 178.83 178.65 2az3 h VAL 88 N 1.08 1.28 -0.01 -0.54 2.07 -0.89 -1.28 116.25 117.96 2az3 h VAL 88 Ca 0.31 -1.57 -0.03 0.00 0.82 0.00 0.00 66.70 66.24 2az3 h VAL 88 Cb -0.07 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2az3 h VAL 88 CO -0.08 0.52 -0.13 0.03 0.02 0.00 0.00 177.57 177.93 2az3 h ARG 89 N 0.69 0.02 0.15 1.57 2.47 -0.53 -1.83 114.38 116.92 2az3 h ARG 89 Ca 0.06 -0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.48 2az3 h ARG 89 Cb 0.96 -0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.30 2az3 h ARG 89 CO 0.09 0.15 -1.28 1.96 0.56 0.00 0.00 179.97 181.45 2az3 h GLN 90 N 0.02 0.40 0.00 0.04 4.20 -0.90 -2.60 115.11 116.27 2az3 h GLN 90 Ca 0.00 -0.63 -0.03 0.00 0.06 0.00 0.00 58.65 58.05 2az3 h GLN 90 Cb 0.24 0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.24 2az3 h GLN 90 CO 0.02 1.29 -0.14 -0.07 -0.67 0.00 0.00 178.83 179.26 2az3 h LEU 91 N 0.13 0.00 0.02 1.46 3.38 -0.80 -3.02 115.31 116.48 2az3 h LEU 91 Ca -0.17 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.52 2az3 h LEU 91 Cb 1.98 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.69 2az3 h LEU 91 CO 0.22 0.14 -1.57 0.24 0.09 0.00 0.00 178.44 177.56 2az3 h MET 92 N 0.00 0.04 0.00 1.13 2.86 -1.29 -0.67 114.93 117.00 2az3 h MET 92 Ca -0.00 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2az3 h MET 92 Cb 0.37 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.05 2az3 h MET 92 CO 0.02 0.69 0.00 0.41 1.06 0.00 0.00 176.91 179.09 2az3 n GLY 93 N 1.55 -1.33 3.77 8.32 0.00 -0.99 -1.93 105.19 114.58 2az3 n GLY 93 Ca -0.14 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.32 3.43 0.23 4.61 0.00 -1.26 -4.84 121.76 122.61 2az3 s ALA 94 Ca 0.00 1.33 -0.09 0.00 0.00 0.00 0.00 51.96 53.20 2az3 s ALA 94 Cb 0.00 -3.52 0.36 0.00 0.00 0.00 0.00 23.12 19.97 2az3 s ALA 94 CO 0.00 -0.81 1.63 1.15 0.00 0.00 0.00 175.76 177.72 2az3 h THR 95 N 2.82 0.34 -3.58 0.00 2.02 -1.96 -3.32 112.91 109.23 2az3 h THR 95 Ca -0.50 -0.02 -0.57 0.00 0.77 0.00 0.00 66.41 66.09 2az3 h THR 95 Cb 1.24 0.27 -0.07 0.00 -1.74 0.00 0.00 68.15 67.85 2az3 h THR 95 CO 0.64 0.01 0.86 -0.62 0.37 0.00 0.00 175.52 176.79 2az3 s ASP 96 N -5.21 6.72 0.48 4.18 -1.08 -1.26 -4.77 116.67 115.72 2az3 s ASP 96 Ca -0.14 0.63 0.25 0.00 -0.52 0.00 0.00 52.55 52.77 2az3 s ASP 96 Cb 0.21 -2.54 1.20 0.00 -1.46 0.00 0.00 42.92 40.33 2az3 s ASP 96 CO 0.75 -1.11 1.96 0.00 0.52 0.00 0.00 175.17 177.29 2az3 h ALA 97 N 8.83 1.18 0.00 3.66 0.00 -1.62 0.32 119.26 131.63 2az3 h ALA 97 Ca -0.22 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2az3 h ALA 97 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2az3 h ALA 97 CO 1.09 0.23 0.00 1.04 0.00 0.00 0.00 179.25 181.60 2az3 n GLN 98 N -3.57 0.08 0.00 0.00 6.02 -1.26 -2.45 117.38 116.20 2az3 n GLN 98 Ca -0.01 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.23 2az3 n GLN 98 Cb 0.33 -1.50 -0.00 0.00 1.02 0.00 0.00 30.24 30.09 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 -1.39 0.53 -4.77 1.08 2.03 0.06 -5.04 116.55 109.05 2az3 n ASP 99 Ca 0.04 -0.76 -0.36 0.00 0.52 0.00 0.00 54.79 54.22 2az3 n ASP 99 Cb 0.11 0.48 -0.01 0.00 -0.72 0.00 0.00 41.12 40.98 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 -0.50 2.92 0.26 -1.67 0.00 -0.97 -4.64 121.76 117.17 2az3 s ALA 100 Ca 0.00 0.86 -0.19 0.00 0.00 0.00 0.00 51.96 52.63 2az3 s ALA 100 Cb 0.00 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.68 2az3 s ALA 100 CO 0.00 -0.59 0.75 0.00 0.00 0.00 0.00 175.76 175.92 2az3 s ALA 101 N -1.64 3.36 0.52 0.00 0.00 -1.26 -4.28 121.76 118.46 2az3 s ALA 101 Ca 0.65 0.17 -0.23 0.00 0.00 0.00 0.00 51.96 52.55 2az3 s ALA 101 Cb -0.26 -2.85 -0.06 0.00 0.00 0.00 0.00 23.12 19.96 2az3 s ALA 101 CO 0.31 0.31 1.36 -2.14 0.00 0.00 0.00 175.76 175.60 2az3 s PRO 102 N -2.25 3.31 0.00 0.00 0.02 -1.26 -1.99 135.00 132.83 2az3 s PRO 102 Ca 0.47 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.73 2az3 s PRO 102 Cb -0.15 -2.36 0.00 0.00 0.02 0.00 0.00 34.50 32.01 2az3 s PRO 102 CO 0.20 -1.06 0.00 0.41 -0.33 0.00 0.00 177.00 176.22 2az3 n GLY 103 N 0.68 2.94 3.90 0.52 0.00 -1.26 -4.97 105.19 106.99 2az3 n GLY 103 Ca 0.09 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.74 4.10 0.31 2.61 -4.23 -0.84 -4.91 115.64 109.94 2az3 s THR 104 Ca 0.00 0.30 -0.01 0.00 -1.18 0.00 0.00 61.69 60.80 2az3 s THR 104 Cb 0.00 -3.63 0.26 0.00 1.34 0.00 0.00 72.50 70.47 2az3 s THR 104 CO 0.00 -0.71 1.97 0.40 -0.54 0.00 0.00 174.62 175.74 2az3 h ILE 105 N -0.21 1.20 0.12 2.99 2.04 -1.18 -0.94 117.51 121.53 2az3 h ILE 105 Ca -0.45 -0.39 -0.28 0.00 1.00 0.00 0.00 64.86 64.74 2az3 h ILE 105 Cb 1.23 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2az3 h ILE 105 CO 0.62 0.20 -1.33 0.03 0.00 0.00 0.00 178.15 177.67 2az3 h ARG 106 N 1.06 0.25 -0.28 2.37 3.08 -1.65 -2.70 114.38 116.51 2az3 h ARG 106 Ca 0.28 -0.42 -0.07 0.00 0.07 0.00 0.00 59.98 59.84 2az3 h ARG 106 Cb -0.10 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2az3 h ARG 106 CO -0.06 1.16 -0.13 0.78 -1.07 0.00 0.00 179.97 180.66 2az3 h GLY 107 N 1.72 0.50 1.83 0.04 0.00 -1.66 -1.92 103.07 103.59 2az3 h GLY 107 Ca -0.16 -0.34 -0.24 0.00 0.00 0.00 0.00 47.33 46.58 2az3 h GLY 107 CO 0.19 0.32 -1.12 -0.55 0.00 0.00 0.00 176.54 175.38 2az3 h ASP 108 N 0.43 0.20 0.00 0.19 3.32 -1.22 -3.42 116.42 115.93 2az3 h ASP 108 Ca 0.08 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 56.92 2az3 h ASP 108 Cb 0.48 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2az3 h ASP 108 CO 0.03 1.17 -0.77 -1.22 -1.72 0.00 0.00 179.24 176.73 2az3 n TYR 109 N -3.44 0.00 -4.31 4.55 4.01 -1.02 -5.08 117.16 111.87 2az3 n TYR 109 Ca -0.04 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.52 2az3 n TYR 109 Cb 0.98 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.91 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 -1.70 1.31 -0.27 2.72 0.00 -0.72 -5.04 107.32 103.62 2az3 s GLY 110 Ca 0.00 -1.56 0.19 0.00 0.00 0.00 0.00 44.72 43.35 2az3 s GLY 110 CO 0.00 -1.65 1.25 -2.01 0.00 0.00 0.00 173.10 170.69 2az3 n ASN 111 N -0.14 0.51 -3.65 1.64 5.15 -1.26 -4.51 115.26 112.99 2az3 n ASN 111 Ca -0.10 -2.08 -0.10 0.00 -0.60 0.00 0.00 54.58 51.70 2az3 n ASN 111 Cb 0.60 -0.08 -0.03 0.00 -0.53 0.00 0.00 39.78 39.74 2az3 n ASN 111 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2az3 s ASP 112 N -2.79 -0.35 -0.24 1.20 2.15 -1.26 -4.78 116.67 110.60 2az3 s ASP 112 Ca 0.21 -0.34 0.04 0.00 0.43 0.00 0.00 52.55 52.89 2az3 s ASP 112 Cb 0.36 0.60 -0.17 0.00 -0.30 0.00 0.00 42.92 43.40 2az3 s ASP 112 CO -0.07 -1.05 -0.18 -0.11 -0.17 0.00 0.00 175.17 173.59 2az3 n LEU 113 N -0.36 2.58 -0.04 -1.34 7.94 -1.26 -2.84 117.00 121.68 2az3 n LEU 113 Ca -0.12 -0.11 -0.15 0.00 -1.11 0.00 0.00 56.01 54.52 2az3 n LEU 113 Cb 0.63 -0.68 -0.12 0.00 0.53 0.00 0.00 43.42 43.78 2az3 n LEU 113 CO 0.15 0.85 0.41 1.23 -1.11 0.00 0.00 177.39 178.93 2az3 h GLY 114 N 2.12 0.09 -7.71 -3.96 0.00 -1.97 -3.36 103.07 88.28 2az3 h GLY 114 Ca -0.54 -0.17 -0.73 0.00 0.00 0.00 0.00 47.33 45.89 2az3 h GLY 114 CO -0.07 0.15 1.45 1.42 0.00 0.00 0.00 176.54 179.49 2az3 n HIS 115 N -4.59 4.92 -1.67 5.60 8.25 -1.26 -4.79 115.22 121.68 2az3 n HIS 115 Ca -0.10 -3.31 0.06 0.00 -0.26 0.00 0.00 57.72 54.11 2az3 n HIS 115 Cb 0.47 -2.23 0.18 0.00 1.12 0.00 0.00 29.99 29.53 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 5.86 1.65 0.00 0.41 6.94 -1.26 -4.14 115.26 124.73 2az3 n ASN 116 Ca 0.38 -3.62 0.00 0.00 -0.02 0.00 0.00 54.58 51.32 2az3 n ASN 116 Cb 0.43 -0.49 0.00 0.00 -2.36 0.00 0.00 39.78 37.35 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 -0.94 0.00 -3.44 -4.53 4.77 -1.26 -4.82 117.00 106.77 2az3 n LEU 117 Ca 0.17 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.03 2az3 n LEU 117 Cb 0.74 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.80 2az3 n LEU 117 CO -0.04 0.00 0.43 -0.51 -1.33 0.00 0.00 177.39 175.95 2az3 s ILE 118 N -0.12 0.00 0.03 -0.08 2.07 -1.26 -0.30 121.20 121.54 2az3 s ILE 118 Ca 0.00 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 59.30 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 -0.18 -2.28 -1.91 0.00 0.00 174.94 170.57 2az3 s HIS 119 N -3.30 1.56 0.03 3.50 5.65 0.20 -4.85 115.29 118.07 2az3 s HIS 119 Ca -0.00 -0.35 -0.04 0.00 0.25 0.00 0.00 55.06 54.92 2az3 s HIS 119 Cb -0.01 -0.94 -0.01 0.00 -1.18 0.00 0.00 32.58 30.44 2az3 s HIS 119 CO -0.09 0.06 0.06 0.20 -0.65 0.00 0.00 174.74 174.31 2az3 s GLY 120 N -1.05 0.20 0.52 1.59 0.00 -1.26 -0.52 107.32 106.80 2az3 s GLY 120 Ca 0.05 -0.56 -0.21 0.00 0.00 0.00 0.00 44.72 44.00 2az3 s GLY 120 CO 0.01 -0.68 1.20 -0.56 0.00 0.00 0.00 173.10 173.08 2az3 s SER 121 N -1.91 5.71 -0.44 1.64 0.01 -0.69 -4.93 113.70 113.09 2az3 s SER 121 Ca -0.08 2.38 -0.27 0.00 1.31 0.00 0.00 55.95 59.29 2az3 s SER 121 Cb -0.04 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.61 2az3 s SER 121 CO -0.03 -1.24 0.99 -0.62 0.41 0.00 0.00 173.24 172.75 2az3 s ASP 122 N -1.42 6.60 0.59 2.44 2.15 -1.26 -4.75 116.67 121.02 2az3 s ASP 122 Ca 0.70 0.36 0.32 0.00 0.43 0.00 0.00 52.55 54.37 2az3 s ASP 122 Cb -0.30 -2.49 1.87 0.00 -0.30 0.00 0.00 42.92 41.70 2az3 s ASP 122 CO 0.35 -1.06 2.24 1.12 -0.17 0.00 0.00 175.17 177.65 2az3 h HIS 123 N 8.94 0.00 0.00 -5.34 2.07 -1.92 -2.54 115.15 116.36 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 1.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.05 2az3 h HIS 123 CO 0.89 0.02 -0.23 0.39 -3.07 0.00 0.00 177.93 175.94 2az3 n GLU 124 N -3.63 0.13 -3.22 5.12 1.02 -1.26 -4.47 120.64 114.33 2az3 n GLU 124 Ca -0.03 0.08 -0.44 0.00 -0.02 0.00 0.00 57.16 56.75 2az3 n GLU 124 Cb 0.11 -1.62 -0.07 0.00 -0.02 0.00 0.00 31.44 29.84 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 -3.69 6.21 0.00 1.62 2.15 -0.96 -5.04 116.67 116.96 2az3 s ASP 125 Ca 0.11 -0.91 -0.30 0.00 0.43 0.00 0.00 52.55 51.88 2az3 s ASP 125 Cb 0.16 -2.26 -0.08 0.00 -0.30 0.00 0.00 42.92 40.43 2az3 s ASP 125 CO 0.62 -0.79 1.98 -0.70 -0.17 0.00 0.00 175.17 176.11 2az3 s GLU 126 N 2.38 4.02 0.00 4.34 2.56 -1.26 -1.60 118.70 129.14 2az3 s GLU 126 Ca 0.13 2.52 0.00 0.00 0.00 0.00 0.00 54.97 57.62 2az3 s GLU 126 Cb -0.19 -4.18 0.00 0.00 2.00 0.00 0.00 34.13 31.76 2az3 s GLU 126 CO 0.12 -1.09 0.00 0.41 -0.56 0.00 0.00 175.26 174.14 2az3 n GLY 127 N 4.67 0.47 0.09 -1.50 0.00 -1.26 -4.96 105.19 102.71 2az3 n GLY 127 Ca 0.21 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 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 0.12 -0.20 4.61 0.00 -1.57 -2.54 119.26 119.68 2az3 h ALA 128 Ca 0.00 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.70 2az3 h ALA 128 Cb 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 2az3 h ALA 128 CO 0.00 -0.12 -0.34 -2.95 0.00 0.00 0.00 179.25 175.84 2az3 h ASN 129 N -0.17 -1.12 -0.56 0.00 7.08 -1.84 0.82 115.58 119.78 2az3 h ASN 129 Ca 0.02 0.14 0.09 0.00 -3.08 0.00 0.00 56.30 53.47 2az3 h ASN 129 Cb 0.47 0.45 -0.07 0.00 -2.08 0.00 0.00 38.32 37.10 2az3 h ASN 129 CO 0.01 -0.26 0.17 -0.33 -2.08 0.00 0.00 177.43 174.94 2az3 h GLU 130 N -0.28 0.32 -0.53 4.14 5.08 -1.83 -0.07 114.58 121.42 2az3 h GLU 130 Ca 0.04 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2az3 h GLU 130 Cb 0.38 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2az3 h GLU 130 CO -0.34 0.21 0.20 -0.09 -1.00 0.00 0.00 179.01 177.99 2az3 h ARG 131 N 0.33 0.80 -0.04 2.33 2.43 -1.31 -1.55 114.38 117.37 2az3 h ARG 131 Ca 0.28 -0.15 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 2az3 h ARG 131 Cb 0.36 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2az3 h ARG 131 CO -0.31 0.71 -0.15 0.93 -1.51 0.00 0.00 179.97 179.64 2az3 h GLU 132 N 0.72 0.18 -0.67 0.20 5.08 0.01 -0.64 114.58 119.45 2az3 h GLU 132 Ca 0.17 -0.13 0.10 0.00 -1.00 0.00 0.00 59.36 58.50 2az3 h GLU 132 Cb 0.22 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.38 2az3 h GLU 132 CO -0.01 0.77 -0.42 0.82 -1.00 0.00 0.00 179.01 179.16 2az3 h ILE 133 N -0.38 0.08 -0.39 3.13 2.04 -1.11 -0.75 117.51 120.14 2az3 h ILE 133 Ca -0.01 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.89 2az3 h ILE 133 Cb 0.78 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2az3 h ILE 133 CO 0.03 0.00 0.26 0.00 0.00 0.00 0.00 178.15 178.44 2az3 h ALA 134 N 0.78 1.88 -0.08 1.87 0.00 -1.25 0.33 119.26 122.79 2az3 h ALA 134 Ca 0.21 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2az3 h ALA 134 Cb 0.56 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2az3 h ALA 134 CO -0.75 0.07 -0.03 1.25 0.00 0.00 0.00 179.25 179.79 2az3 h LEU 135 N 0.39 0.16 0.00 0.00 5.85 0.29 -3.37 115.31 118.63 2az3 h LEU 135 Ca 0.16 -0.39 -0.21 0.00 0.84 0.00 0.00 57.88 58.29 2az3 h LEU 135 Cb 0.16 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2az3 h LEU 135 CO -0.04 0.51 -1.40 -0.26 -0.34 0.00 0.00 178.44 176.91 2az3 h PHE 136 N -0.19 0.00 -3.87 1.25 0.04 -1.22 -3.47 116.94 109.48 2az3 h PHE 136 Ca 0.02 0.00 -0.68 0.00 2.80 0.00 0.00 57.97 60.11 2az3 h PHE 136 Cb 0.44 0.00 -0.32 0.00 2.20 0.00 0.00 35.95 38.27 2az3 h PHE 136 CO 0.06 0.75 -0.88 -0.06 -0.60 0.00 0.00 178.31 177.58 2az3 s PHE 137 N -2.80 2.42 0.58 -0.55 0.08 0.10 -5.11 117.98 112.70 2az3 s PHE 137 Ca -0.03 -0.78 -0.14 0.00 0.12 0.00 0.00 56.93 56.11 2az3 s PHE 137 Cb 0.08 -1.60 -0.05 0.00 -0.57 0.00 0.00 43.02 40.89 2az3 s PHE 137 CO 0.81 -0.26 1.02 -0.51 -0.10 0.00 0.00 175.22 176.18 2az3 s ASP 138 N -0.05 6.29 0.01 1.36 1.01 -1.26 -4.35 116.67 119.69 2az3 s ASP 138 Ca -0.07 1.54 0.15 0.00 0.71 0.00 0.00 52.55 54.88 2az3 s ASP 138 Cb -0.15 -2.49 0.66 0.00 1.01 0.00 0.00 42.92 41.95 2az3 s ASP 138 CO 0.05 -0.82 1.49 0.47 0.21 0.00 0.00 175.17 176.57 2az3 n ASP 139 N -2.20 0.04 0.09 0.27 9.92 -1.26 -2.05 116.55 121.35 2az3 n ASP 139 Ca 0.07 0.51 0.13 0.00 -0.53 0.00 0.00 54.79 54.96 2az3 n ASP 139 Cb 0.54 -0.52 0.45 0.00 -0.64 0.00 0.00 41.12 40.95 2az3 n ASP 139 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2az3 n ASP 140 N -1.54 0.63 -0.43 -2.24 5.75 -1.26 -3.68 116.55 113.78 2az3 n ASP 140 Ca 0.04 0.57 0.09 0.00 -0.01 0.00 0.00 54.79 55.48 2az3 n ASP 140 Cb 0.18 -0.74 0.01 0.00 -1.03 0.00 0.00 41.12 39.54 2az3 n ASP 140 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2az3 n GLU 141 N -2.10 1.58 -2.89 0.11 1.02 -0.87 -4.89 120.64 112.60 2az3 n GLU 141 Ca 0.05 -0.92 -0.38 0.00 -0.02 0.00 0.00 57.16 55.89 2az3 n GLU 141 Cb 0.37 -1.32 -0.06 0.00 -0.02 0.00 0.00 31.44 30.41 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 -2.07 4.46 -0.14 -4.62 1.43 -1.24 -4.52 118.68 111.98 2az3 s LEU 142 Ca 0.15 1.73 0.01 0.00 -1.03 0.00 0.00 54.13 54.99 2az3 s LEU 142 Cb 0.14 -3.68 -0.00 0.00 0.03 0.00 0.00 46.19 42.67 2az3 s LEU 142 CO 0.42 0.06 -0.16 -0.69 0.23 0.00 0.00 176.35 176.21 2az3 s VAL 143 N -1.41 2.67 -0.52 -1.59 1.01 0.18 -4.99 120.40 115.75 2az3 s VAL 143 Ca 0.44 -0.78 -0.18 0.00 0.00 0.00 0.00 61.98 61.45 2az3 s VAL 143 Cb -0.21 -2.11 0.07 0.00 0.00 0.00 0.00 36.38 34.13 2az3 s VAL 143 CO 0.25 0.52 0.60 -1.81 0.00 0.00 0.00 175.10 174.67 2az3 s ASP 144 N 0.67 6.20 0.11 3.32 1.11 -1.26 -4.68 116.67 122.14 2az3 s ASP 144 Ca -0.08 -1.08 -0.05 0.00 0.18 0.00 0.00 52.55 51.52 2az3 s ASP 144 Cb -0.16 -2.27 -0.02 0.00 1.07 0.00 0.00 42.92 41.54 2az3 s ASP 144 CO 0.02 -0.89 0.14 -1.66 1.18 0.00 0.00 175.17 173.96 2az3 s TRP 145 N 2.47 0.48 -0.31 4.23 1.48 -1.26 -5.14 118.94 120.88 2az3 s TRP 145 Ca 0.13 -0.90 -0.10 0.00 -1.06 0.00 0.00 56.10 54.16 2az3 s TRP 145 Cb -0.21 -0.23 -0.01 0.00 -1.16 0.00 0.00 33.47 31.85 2az3 s TRP 145 CO 0.10 -0.55 0.17 -0.51 -4.06 0.00 0.00 176.95 172.10 2az3 s ASP 146 N -2.95 5.68 -0.55 -2.66 1.01 -1.26 -5.07 116.67 110.87 2az3 s ASP 146 Ca 0.14 -0.44 -0.22 0.00 0.71 0.00 0.00 52.55 52.75 2az3 s ASP 146 Cb 0.06 -2.04 0.05 0.00 1.01 0.00 0.00 42.92 42.00 2az3 s ASP 146 CO -0.04 -0.18 0.80 -0.60 0.21 0.00 0.00 175.17 175.36 2az3 s ARG 147 N 1.65 3.21 0.44 8.23 3.52 -1.26 -4.94 118.95 129.80 2az3 s ARG 147 Ca 0.05 -0.64 0.19 0.00 -0.13 0.00 0.00 55.73 55.20 2az3 s ARG 147 Cb -0.17 -4.10 1.14 0.00 -1.56 0.00 0.00 34.95 30.25 2az3 s ARG 147 CO 0.07 -1.42 1.88 -0.44 -0.81 0.00 0.00 175.30 174.58 2az3 h ASP 148 N 9.21 0.34 0.81 -2.12 3.32 -2.04 0.70 116.42 126.64 2az3 h ASP 148 Ca -0.27 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.81 2az3 h ASP 148 Cb 1.08 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2az3 h ASP 148 CO 1.05 0.15 0.00 0.00 -1.72 0.00 0.00 179.24 178.72 2az3 h ALA 149 N 1.62 1.00 -1.49 3.45 0.00 -2.01 -1.08 119.26 120.75 2az3 h ALA 149 Ca 0.43 0.00 0.46 0.00 0.00 0.00 0.00 54.91 55.80 2az3 h ALA 149 Cb 1.14 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.84 2az3 h ALA 149 CO -0.13 0.00 1.03 0.43 0.00 0.00 0.00 179.25 180.58 2az3 n SER 150 N -2.61 0.08 0.21 0.00 7.64 0.24 -0.73 113.62 118.45 2az3 n SER 150 Ca 0.01 1.00 0.09 0.00 1.01 0.00 0.00 58.87 60.98 2az3 n SER 150 Cb 0.25 -0.49 0.40 0.00 -1.01 0.00 0.00 64.21 63.36 2az3 n SER 150 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2az3 h ALA 151 N 1.07 0.99 0.00 -0.43 0.00 -1.39 -2.89 119.26 116.61 2az3 h ALA 151 Ca 0.79 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.46 2az3 h ALA 151 Cb 2.92 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 20.67 2az3 h ALA 151 CO -0.17 0.33 -1.68 0.91 0.00 0.00 0.00 179.25 178.63 2az3 n TRP 152 N -3.39 0.04 0.06 0.00 7.02 0.09 -4.51 117.44 116.76 2az3 n TRP 152 Ca 0.00 0.01 -0.11 0.00 -1.02 0.00 0.00 57.50 56.38 2az3 n TRP 152 Cb 0.46 -0.39 -0.01 0.00 -2.42 0.00 0.00 31.31 28.95 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 1.40 -3.14 -0.99 2.07 -1.01 -3.47 116.25 111.11 2az3 h VAL 153 Ca 0.00 -2.34 -0.46 0.00 0.82 0.00 0.00 66.70 64.73 2az3 h VAL 153 Cb 0.87 2.29 -0.16 0.00 -1.52 0.00 0.00 31.29 32.77 2az3 h VAL 153 CO 0.00 0.70 -0.75 -0.31 0.02 0.00 0.00 177.57 177.23 2az3 s TYR 154 N -3.41 1.66 -2.00 1.57 2.02 -1.11 -5.09 117.35 110.99 2az3 s TYR 154 Ca -0.05 -0.55 0.31 0.00 -0.37 0.00 0.00 57.07 56.40 2az3 s TYR 154 Cb 0.10 -0.81 1.83 0.00 -0.40 0.00 0.00 41.96 42.68 2az3 s TYR 154 CO 0.85 0.30 2.16 -1.91 -1.57 0.00 0.00 175.55 175.38