#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dz3 s HIS 5 N 0.00 2.99 0.03 0.00 5.04 -1.26 -5.03 115.29 117.07 3dz3 s HIS 5 Ca 0.00 0.63 0.01 0.00 -1.54 0.00 0.00 55.06 54.16 3dz3 s HIS 5 Cb 0.00 -3.98 -0.04 0.00 0.04 0.00 0.00 32.58 28.60 3dz3 s HIS 5 CO 0.00 -3.55 0.06 0.12 -2.34 0.00 0.00 174.74 169.03 3dz3 s PHE 6 N 0.90 3.19 -0.03 3.88 5.36 -1.26 -5.13 117.98 124.89 3dz3 s PHE 6 Ca 0.69 0.12 0.01 0.00 -0.96 0.00 0.00 56.93 56.79 3dz3 s PHE 6 Cb -0.45 -1.67 0.02 0.00 -0.34 0.00 0.00 43.02 40.58 3dz3 s PHE 6 CO 0.34 0.52 -0.01 0.12 -1.46 0.00 0.00 175.22 174.73 3dz3 s PHE 7 N -1.24 0.37 -0.67 10.12 5.36 -1.26 -5.11 117.98 125.54 3dz3 s PHE 7 Ca 0.24 -0.03 -0.21 0.00 -0.96 0.00 0.00 56.93 55.97 3dz3 s PHE 7 Cb -0.12 -0.42 0.09 0.00 -0.34 0.00 0.00 43.02 42.23 3dz3 s PHE 7 CO 0.16 -0.12 0.90 -2.00 -1.46 0.00 0.00 175.22 172.69 3dz3 s GLU 8 N 0.88 3.15 0.22 10.12 2.56 -1.26 -4.90 118.70 129.47 3dz3 s GLU 8 Ca -0.09 -1.11 -0.05 0.00 0.00 0.00 0.00 54.97 53.72 3dz3 s GLU 8 Cb -0.13 -4.32 0.20 0.00 2.00 0.00 0.00 34.13 31.89 3dz3 s GLU 8 CO -0.01 -1.72 1.68 0.78 -0.56 0.00 0.00 175.26 175.43 3dz3 h GLY 9 N 10.77 0.95 -5.43 -1.50 0.00 -2.07 -3.44 103.07 102.35 3dz3 h GLY 9 Ca -0.24 -0.71 -0.66 0.00 0.00 0.00 0.00 47.33 45.72 3dz3 h GLY 9 CO 1.14 0.65 0.57 2.41 0.00 0.00 0.00 176.54 181.32 3dz3 n THR 10 N -4.17 0.04 -3.05 4.70 -1.04 -1.26 -4.95 114.28 104.55 3dz3 n THR 10 Ca 0.02 -0.01 -0.21 0.00 -2.04 0.00 0.00 64.05 61.81 3dz3 n THR 10 Cb 0.36 -1.02 0.01 0.00 -1.82 0.00 0.00 70.33 67.86 3dz3 n THR 10 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3dz3 s GLU 11 N 0.89 2.95 -0.32 -2.82 8.01 -1.26 -5.07 118.70 121.08 3dz3 s GLU 11 Ca 0.85 -0.77 -0.04 0.00 0.01 0.00 0.00 54.97 55.02 3dz3 s GLU 11 Cb -0.90 -2.64 0.05 0.00 -4.31 0.00 0.00 34.13 26.33 3dz3 s GLU 11 CO 0.47 -0.27 0.06 0.15 0.01 0.00 0.00 175.26 175.68 3dz3 s LYS 12 N -4.47 2.49 -0.15 1.61 1.02 -1.26 -5.09 119.74 113.90 3dz3 s LYS 12 Ca 0.50 -1.26 -0.06 0.00 0.02 0.00 0.00 55.97 55.17 3dz3 s LYS 12 Cb -0.10 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 33.84 3dz3 s LYS 12 CO 0.36 -0.67 0.08 -1.17 -0.92 0.00 0.00 175.35 173.03 3dz3 s LEU 13 N 1.31 3.99 -0.08 3.17 2.96 -1.26 -5.11 118.68 123.67 3dz3 s LEU 13 Ca -0.03 0.23 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 3dz3 s LEU 13 Cb -0.20 -1.98 0.02 0.00 0.50 0.00 0.00 46.19 44.53 3dz3 s LEU 13 CO 0.01 0.29 -0.06 -0.22 -1.32 0.00 0.00 176.35 175.05 3dz3 s LEU 14 N -0.32 1.14 -0.13 -0.68 2.96 -1.26 -5.12 118.68 115.28 3dz3 s LEU 14 Ca 0.09 -0.21 -0.02 0.00 -0.22 0.00 0.00 54.13 53.77 3dz3 s LEU 14 Cb -0.12 -0.66 0.04 0.00 0.50 0.00 0.00 46.19 45.95 3dz3 s LEU 14 CO 0.01 -0.10 0.00 -0.70 -1.32 0.00 0.00 176.35 174.25 3dz3 s GLU 15 N 1.44 0.77 -0.06 1.98 2.12 -1.26 -5.13 118.70 118.56 3dz3 s GLU 15 Ca -0.01 -0.16 0.04 0.00 0.36 0.00 0.00 54.97 55.19 3dz3 s GLU 15 Cb -0.13 -1.51 0.00 0.00 0.26 0.00 0.00 34.13 32.75 3dz3 s GLU 15 CO -0.04 -0.43 -0.17 0.08 -0.54 0.00 0.00 175.26 174.16 3dz3 s VAL 16 N 1.88 1.48 -0.07 3.70 1.01 -1.26 -5.13 120.40 122.01 3dz3 s VAL 16 Ca 0.03 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.29 3dz3 s VAL 16 Cb -0.14 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 3dz3 s VAL 16 CO -0.07 0.43 -0.06 0.26 0.00 0.00 0.00 175.10 175.66 3dz3 s TRP 17 N 0.21 2.96 0.41 5.22 0.52 -1.26 -5.13 118.94 121.88 3dz3 s TRP 17 Ca -0.08 0.04 0.08 0.00 0.02 0.00 0.00 56.10 56.15 3dz3 s TRP 17 Cb -0.14 -1.72 -0.04 0.00 -1.15 0.00 0.00 33.47 30.43 3dz3 s TRP 17 CO 0.04 0.34 0.27 -0.06 0.02 0.00 0.00 176.95 177.56 3dz3 s PHE 18 N -0.81 2.66 0.17 -1.98 0.40 -1.26 -5.14 117.98 112.02 3dz3 s PHE 18 Ca 0.12 -0.53 -0.11 0.00 -0.60 0.00 0.00 56.93 55.81 3dz3 s PHE 18 Cb -0.11 -2.05 0.04 0.00 0.51 0.00 0.00 43.02 41.41 3dz3 s PHE 18 CO 0.01 0.05 0.54 0.43 0.70 0.00 0.00 175.22 176.96 3dz3 n SER 19 N -1.38 -1.20 -4.01 1.36 7.64 -1.26 -5.20 113.62 109.56 3dz3 n SER 19 Ca 0.01 -1.75 -0.10 0.00 1.01 0.00 0.00 58.87 58.05 3dz3 n SER 19 Cb 0.63 1.99 -0.07 0.00 -1.01 0.00 0.00 64.21 65.75 3dz3 n SER 19 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dz3 s ARG 20 N -2.04 1.35 -0.01 1.43 3.03 -1.26 -5.07 118.95 116.38 3dz3 s ARG 20 Ca 0.12 -1.27 0.08 0.00 2.03 0.00 0.00 55.73 56.68 3dz3 s ARG 20 Cb -0.02 0.41 0.13 0.00 -1.03 0.00 0.00 34.95 34.44 3dz3 s ARG 20 CO 0.05 -0.52 1.06 0.00 -1.13 0.00 0.00 175.30 174.75 3dz3 n GLN 21 N -0.31 0.12 -1.76 3.89 10.64 -1.26 -5.09 117.38 123.62 3dz3 n GLN 21 Ca -0.03 -1.40 -0.42 0.00 -1.83 0.00 0.00 57.00 53.32 3dz3 n GLN 21 Cb 0.63 -0.47 -0.03 0.00 -0.86 0.00 0.00 30.24 29.51 3dz3 n GLN 21 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 3dz3 s GLN 22 N -0.27 3.75 0.00 2.61 0.74 -1.26 -5.37 119.66 119.86 3dz3 s GLN 22 Ca 0.11 2.20 0.01 0.00 0.05 0.00 0.00 55.36 57.73 3dz3 s GLN 22 Cb 0.12 -4.19 0.06 0.00 1.10 0.00 0.00 33.01 30.10 3dz3 s GLN 22 CO -0.04 -1.39 0.62 -2.30 -0.55 0.00 0.00 175.29 171.63 3dz3 n PRO 23 N 7.93 0.03 -0.88 1.67 -0.02 -1.26 -5.29 135.00 137.19 3dz3 n PRO 23 Ca 0.23 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 3dz3 n PRO 23 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 3dz3 n PRO 23 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dz3 n GLN 27 N -1.07 -0.05 -3.52 -0.52 0.00 -1.26 -5.30 117.38 105.66 3dz3 n GLN 27 Ca 0.01 0.01 -0.06 0.00 0.00 0.00 0.00 57.00 56.96 3dz3 n GLN 27 Cb 0.00 -3.09 -0.07 0.00 0.00 0.00 0.00 30.24 27.08 3dz3 n GLN 27 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 3dz3 s GLY 28 N -2.00 -0.50 0.07 2.61 0.00 -1.26 -5.04 107.32 101.20 3dz3 s GLY 28 Ca 0.00 1.51 -0.01 0.00 0.00 0.00 0.00 44.72 46.22 3dz3 s GLY 28 CO 0.00 2.68 1.10 1.76 0.00 0.00 0.00 173.10 178.63 3dz3 h SER 29 N 8.13 0.31 -1.28 1.64 0.02 -2.04 -3.48 113.55 116.85 3dz3 h SER 29 Ca -0.18 -0.36 -0.20 0.00 -0.84 0.00 0.00 61.79 60.21 3dz3 h SER 29 Cb 1.12 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 3dz3 h SER 29 CO 0.17 1.29 -0.25 0.61 -1.14 0.00 0.00 176.83 177.51 3dz3 n GLY 30 N 1.52 0.14 3.37 -3.77 0.00 -1.26 -5.00 105.19 100.19 3dz3 n GLY 30 Ca -0.08 -0.48 -0.05 0.00 0.00 0.00 0.00 46.02 45.40 3dz3 n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dz3 s ASP 31 N -2.60 -0.57 0.51 1.61 -1.08 -1.26 -5.04 116.67 108.23 3dz3 s ASP 31 Ca 0.00 1.14 0.25 0.00 -0.52 0.00 0.00 52.55 53.42 3dz3 s ASP 31 Cb 0.00 1.69 1.35 0.00 -1.46 0.00 0.00 42.92 44.50 3dz3 s ASP 31 CO 0.00 -0.23 2.04 -0.07 0.52 0.00 0.00 175.17 177.43 3dz3 h LEU 32 N 8.11 0.00 0.00 -1.34 3.38 -1.99 -2.49 115.31 120.98 3dz3 h LEU 32 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3dz3 h LEU 32 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 3dz3 h LEU 32 CO 0.13 0.14 0.00 0.54 0.09 0.00 0.00 178.44 179.34 3dz3 n ARG 33 N -3.72 0.07 0.08 1.13 1.74 -1.26 -1.12 116.66 113.58 3dz3 n ARG 33 Ca -0.02 0.26 -0.10 0.00 -0.77 0.00 0.00 57.85 57.22 3dz3 n ARG 33 Cb 0.25 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.15 3dz3 n ARG 33 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3dz3 h THR 34 N 0.00 1.51 -2.12 0.55 2.02 -1.88 -3.44 112.91 109.55 3dz3 h THR 34 Ca 0.00 -2.75 -0.58 0.00 0.77 0.00 0.00 66.41 63.85 3dz3 h THR 34 Cb 0.06 2.57 0.01 0.00 -1.74 0.00 0.00 68.15 69.06 3dz3 h THR 34 CO 0.00 0.80 1.25 -0.38 0.37 0.00 0.00 175.52 177.56 3dz3 n ILE 35 N -3.62 0.61 -1.46 3.11 5.41 -0.27 -4.93 119.36 118.21 3dz3 n ILE 35 Ca -0.04 -0.19 -0.32 0.00 1.00 0.00 0.00 62.75 63.20 3dz3 n ILE 35 Cb 0.86 -2.19 0.07 0.00 -0.71 0.00 0.00 39.64 37.67 3dz3 n ILE 35 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3dz3 s PRO 36 N 4.77 2.46 0.27 0.38 0.04 -1.26 -4.94 135.00 136.71 3dz3 s PRO 36 Ca 0.93 1.28 -0.00 0.00 0.04 0.00 0.00 61.00 63.25 3dz3 s PRO 36 Cb -0.52 -1.91 0.60 0.00 0.04 0.00 0.00 34.50 32.70 3dz3 s PRO 36 CO 0.44 -1.50 1.69 -0.09 0.04 0.00 0.00 177.00 177.59 3dz3 h ARG 37 N -0.65 0.34 -0.32 4.56 9.65 -1.96 -2.44 114.38 123.56 3dz3 h ARG 37 Ca -0.45 -0.02 0.06 0.00 -1.10 0.00 0.00 59.98 58.47 3dz3 h ARG 37 Cb 1.24 -0.08 -0.06 0.00 -1.39 0.00 0.00 29.97 29.68 3dz3 h ARG 37 CO 0.52 0.23 -0.07 0.77 2.80 0.00 0.00 179.97 184.22 3dz3 h SER 38 N 0.35 -0.28 -0.50 -3.80 0.02 -2.00 -1.36 113.55 105.99 3dz3 h SER 38 Ca 0.49 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 3dz3 h SER 38 Cb 0.88 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.59 3dz3 h SER 38 CO -0.52 -0.10 0.33 -0.33 -1.14 0.00 0.00 176.83 175.08 3dz3 h GLU 39 N 0.01 0.66 -0.22 3.45 4.39 -1.83 -1.84 114.58 119.22 3dz3 h GLU 39 Ca 0.16 -0.04 -0.20 0.00 0.34 0.00 0.00 59.36 59.62 3dz3 h GLU 39 Cb 0.23 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 3dz3 h GLU 39 CO -0.32 0.44 -0.66 -1.49 -1.16 0.00 0.00 179.01 175.82 3dz3 h TRP 40 N 0.68 1.04 -0.36 4.33 -0.00 -1.23 -1.03 115.95 119.38 3dz3 h TRP 40 Ca 0.18 -0.41 -0.06 0.00 -0.00 0.00 0.00 58.89 58.60 3dz3 h TRP 40 Cb -0.08 -0.18 -0.02 0.00 -0.00 0.00 0.00 29.16 28.88 3dz3 h TRP 40 CO 0.00 1.24 -0.05 -0.44 -0.00 0.00 0.00 178.44 179.19 3dz3 h ASP 41 N 0.59 0.56 -0.04 -3.49 3.32 -0.79 0.26 116.42 116.83 3dz3 h ASP 41 Ca -0.02 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 56.82 3dz3 h ASP 41 Cb 1.27 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.67 3dz3 h ASP 41 CO 0.14 0.67 -0.30 0.40 -1.72 0.00 0.00 179.24 178.43 3dz3 h ILE 42 N 0.55 1.46 -0.91 0.35 2.04 -1.31 -1.20 117.51 118.49 3dz3 h ILE 42 Ca 0.11 -1.79 0.02 0.00 1.00 0.00 0.00 64.86 64.19 3dz3 h ILE 42 Cb 0.43 2.48 -0.05 0.00 -0.74 0.00 0.00 36.82 38.94 3dz3 h ILE 42 CO 0.02 0.51 0.60 0.25 0.00 0.00 0.00 178.15 179.53 3dz3 h LEU 43 N -0.28 1.03 -0.80 1.44 6.46 -0.96 -1.54 115.31 120.66 3dz3 h LEU 43 Ca -0.03 -0.02 -0.06 0.00 -0.12 0.00 0.00 57.88 57.65 3dz3 h LEU 43 Cb 0.98 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.65 3dz3 h LEU 43 CO 0.06 0.74 -0.30 -0.07 -0.62 0.00 0.00 178.44 178.25 3dz3 h LEU 44 N 1.22 0.00 -0.71 2.25 3.38 -0.51 -3.05 115.31 117.88 3dz3 h LEU 44 Ca 0.34 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.21 3dz3 h LEU 44 Cb -0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3dz3 h LEU 44 CO -0.09 0.30 -0.11 0.50 0.09 0.00 0.00 178.44 179.13 3dz3 h LYS 45 N 0.00 0.87 -0.61 1.13 1.63 -0.20 0.60 116.57 120.00 3dz3 h LYS 45 Ca -0.00 -0.30 -0.09 0.00 -0.85 0.00 0.00 60.65 59.40 3dz3 h LYS 45 Cb 0.92 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.46 3dz3 h LYS 45 CO 0.04 0.94 0.02 -0.44 -3.45 0.00 0.00 179.45 176.56 3dz3 h ASP 46 N 0.78 1.04 0.51 4.20 3.32 -1.36 -2.05 116.42 122.86 3dz3 h ASP 46 Ca 0.13 -0.30 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 3dz3 h ASP 46 Cb 0.63 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3dz3 h ASP 46 CO 0.04 1.08 -0.24 0.58 -1.72 0.00 0.00 179.24 178.98 3dz3 h VAL 47 N 0.97 0.82 -1.98 -1.35 2.07 -1.40 -3.47 116.25 111.91 3dz3 h VAL 47 Ca 0.18 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.73 3dz3 h VAL 47 Cb 0.54 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 3dz3 h VAL 47 CO 0.03 0.24 0.00 0.00 0.02 0.00 0.00 177.57 177.86 3dz3 n GLN 48 N -3.74 0.00 -4.00 1.57 6.02 0.11 -5.10 117.38 112.25 3dz3 n GLN 48 Ca -0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.86 3dz3 n GLN 48 Cb 0.35 -2.38 -0.03 0.00 1.02 0.00 0.00 30.24 29.21 3dz3 n GLN 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dz3 s SER 50 N -3.15 0.20 -0.22 0.00 0.01 -0.55 -4.01 113.70 105.97 3dz3 s SER 50 Ca 0.25 -0.70 -0.22 0.00 1.31 0.00 0.00 55.95 56.58 3dz3 s SER 50 Cb -0.02 0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.50 3dz3 s SER 50 CO 0.16 -0.68 0.71 -0.63 0.41 0.00 0.00 173.24 173.22 3dz3 s ILE 51 N -3.72 4.94 -1.37 1.44 1.01 -1.26 -1.30 121.20 120.94 3dz3 s ILE 51 Ca 0.04 1.34 0.15 0.00 0.00 0.00 0.00 60.65 62.18 3dz3 s ILE 51 Cb 0.05 -4.02 -0.00 0.00 0.01 0.00 0.00 42.46 38.50 3dz3 s ILE 51 CO -0.10 0.02 0.81 2.30 0.00 0.00 0.00 174.94 177.98 3dz3 n ILE 52 N 5.00 0.00 -3.58 2.92 -5.35 0.54 -4.99 119.36 113.91 3dz3 n ILE 52 Ca 0.02 -0.35 -0.13 0.00 -0.27 0.00 0.00 62.75 62.02 3dz3 n ILE 52 Cb 0.49 1.18 -0.06 0.00 -1.74 0.00 0.00 39.64 39.51 3dz3 n ILE 52 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 3dz3 s SER 53 N -1.79 -0.51 -0.03 7.28 0.01 -1.21 -4.95 113.70 112.49 3dz3 s SER 53 Ca 0.12 0.69 -0.01 0.00 1.31 0.00 0.00 55.95 58.07 3dz3 s SER 53 Cb 0.12 0.60 0.03 0.00 0.21 0.00 0.00 66.02 66.98 3dz3 s SER 53 CO 0.37 -0.38 0.04 -0.69 0.41 0.00 0.00 173.24 172.99 3dz3 s VAL 54 N -0.75 -0.07 -0.10 3.43 1.01 -1.26 -1.90 120.40 120.76 3dz3 s VAL 54 Ca -0.04 0.25 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 3dz3 s VAL 54 Cb -0.02 -0.10 0.02 0.00 0.00 0.00 0.00 36.38 36.29 3dz3 s VAL 54 CO 0.03 0.10 -0.06 -0.89 0.00 0.00 0.00 175.10 174.29 3dz3 s THR 55 N 1.27 0.84 -0.02 3.92 2.01 -0.89 -5.03 115.64 117.73 3dz3 s THR 55 Ca -0.07 -0.18 0.01 0.00 0.31 0.00 0.00 61.69 61.76 3dz3 s THR 55 Cb -0.13 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.46 3dz3 s THR 55 CO -0.03 0.33 -0.01 -0.54 -0.69 0.00 0.00 174.62 173.68 3dz3 s LYS 56 N 1.67 2.79 0.48 4.92 1.02 -1.26 -1.45 119.74 127.90 3dz3 s LYS 56 Ca 0.03 -0.58 0.02 0.00 0.02 0.00 0.00 55.97 55.45 3dz3 s LYS 56 Cb -0.13 -2.66 -0.01 0.00 -0.52 0.00 0.00 37.83 34.51 3dz3 s LYS 56 CO -0.06 0.64 0.06 0.95 -0.92 0.00 0.00 175.35 176.02 3dz3 s THR 57 N -1.02 0.83 0.25 2.17 -4.23 -0.42 -5.01 115.64 108.21 3dz3 s THR 57 Ca 0.18 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.64 3dz3 s THR 57 Cb -0.11 -2.16 0.16 0.00 1.34 0.00 0.00 72.50 71.72 3dz3 s THR 57 CO 0.08 0.00 1.80 -0.78 -0.54 0.00 0.00 174.62 175.18 3dz3 h ASP 58 N 1.49 0.96 0.04 3.99 1.82 -2.05 -3.30 116.42 119.36 3dz3 h ASP 58 Ca -0.40 -0.16 -0.26 0.00 -0.39 0.00 0.00 57.03 55.82 3dz3 h ASP 58 Cb 1.30 -0.25 -0.05 0.00 0.68 0.00 0.00 39.33 41.02 3dz3 h ASP 58 CO 0.65 0.88 -2.23 0.29 -1.61 0.00 0.00 179.24 177.22 3dz3 n LYS 59 N -4.28 0.68 -3.69 0.28 5.02 -1.26 -5.05 118.16 109.86 3dz3 n LYS 59 Ca 0.06 -0.04 -0.13 0.00 -2.02 0.00 0.00 58.31 56.18 3dz3 n LYS 59 Cb 0.20 -1.54 -0.07 0.00 -0.02 0.00 0.00 35.03 33.61 3dz3 n LYS 59 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 3dz3 s GLN 60 N -2.78 0.87 -0.13 1.97 -2.07 -1.24 -5.13 119.66 111.15 3dz3 s GLN 60 Ca -0.09 -0.38 -0.03 0.00 -1.82 0.00 0.00 55.36 53.04 3dz3 s GLN 60 Cb 0.08 0.39 -0.03 0.00 -1.09 0.00 0.00 33.01 32.36 3dz3 s GLN 60 CO 0.85 -0.29 -0.02 -1.21 -1.32 0.00 0.00 175.29 173.30 3dz3 s GLU 61 N -2.39 3.42 0.11 9.60 2.02 -1.26 -1.30 118.70 128.90 3dz3 s GLU 61 Ca -0.06 -0.48 0.10 0.00 0.02 0.00 0.00 54.97 54.55 3dz3 s GLU 61 Cb -0.01 -2.87 -0.04 0.00 0.10 0.00 0.00 34.13 31.31 3dz3 s GLU 61 CO -0.02 0.41 -0.22 0.00 0.02 0.00 0.00 175.26 175.46 3dz3 s ALA 62 N -0.09 2.54 -0.00 5.21 0.00 -0.53 -5.02 121.76 123.86 3dz3 s ALA 62 Ca 0.03 -1.38 0.01 0.00 0.00 0.00 0.00 51.96 50.62 3dz3 s ALA 62 Cb -0.13 -0.55 0.00 0.00 0.00 0.00 0.00 23.12 22.44 3dz3 s ALA 62 CO 0.02 0.57 -0.02 0.71 0.00 0.00 0.00 175.76 177.05 3dz3 s TYR 63 N -1.08 0.17 -0.16 0.00 1.51 -1.26 -2.10 117.35 114.43 3dz3 s TYR 63 Ca 0.16 -0.02 -0.08 0.00 -1.01 0.00 0.00 57.07 56.12 3dz3 s TYR 63 Cb -0.10 -0.13 -0.04 0.00 -0.11 0.00 0.00 41.96 41.57 3dz3 s TYR 63 CO 0.08 -0.01 0.11 0.08 -1.11 0.00 0.00 175.55 174.70 3dz3 s VAL 64 N 0.07 5.27 0.35 0.71 1.01 -0.80 -4.99 120.40 122.02 3dz3 s VAL 64 Ca -0.00 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.19 3dz3 s VAL 64 Cb -0.02 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 3dz3 s VAL 64 CO -0.00 0.52 0.09 -0.76 0.00 0.00 0.00 175.10 174.94 3dz3 s LEU 65 N -0.21 3.11 -0.28 3.92 1.43 -1.26 -0.34 118.68 125.06 3dz3 s LEU 65 Ca 0.10 -0.92 -0.22 0.00 -1.03 0.00 0.00 54.13 52.06 3dz3 s LEU 65 Cb -0.12 -1.51 0.09 0.00 0.03 0.00 0.00 46.19 44.68 3dz3 s LEU 65 CO 0.01 -0.31 0.80 -0.44 0.23 0.00 0.00 176.35 176.64 3dz3 s SER 66 N -3.79 -0.71 0.00 2.29 0.01 -0.42 -4.86 113.70 106.22 3dz3 s SER 66 Ca 0.37 1.29 0.16 0.00 1.31 0.00 0.00 55.95 59.08 3dz3 s SER 66 Cb -0.00 1.30 0.96 0.00 0.21 0.00 0.00 66.02 68.49 3dz3 s SER 66 CO 0.21 -0.22 1.37 -0.62 0.41 0.00 0.00 173.24 174.39