#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gza s LEU 24 N 0.00 4.07 0.41 -1.84 1.02 -1.26 -4.98 118.68 116.10 3gza s LEU 24 Ca 0.00 2.41 -0.26 0.00 0.02 0.00 0.00 54.13 56.30 3gza s LEU 24 Cb 0.00 -4.15 -0.09 0.00 0.02 0.00 0.00 46.19 41.98 3gza s LEU 24 CO 0.00 -0.92 1.33 -2.84 0.02 0.00 0.00 176.35 173.94 3gza s PRO 25 N -2.56 3.95 0.05 1.29 0.02 -1.26 -5.00 135.00 131.49 3gza s PRO 25 Ca 0.62 2.21 -0.02 0.00 0.02 0.00 0.00 61.00 63.84 3gza s PRO 25 Cb -0.32 -2.77 -0.04 0.00 0.02 0.00 0.00 34.50 31.40 3gza s PRO 25 CO 0.39 -0.53 -0.01 0.14 -0.33 0.00 0.00 177.00 176.66 3gza s VAL 26 N -1.24 0.21 0.62 3.83 -7.23 -1.26 -4.45 120.40 110.88 3gza s VAL 26 Ca 0.57 -1.77 -0.18 0.00 -1.81 0.00 0.00 61.98 58.79 3gza s VAL 26 Cb -0.39 -1.52 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 3gza s VAL 26 CO 0.51 -0.97 1.22 -2.84 -0.31 0.00 0.00 175.10 172.71 3gza s PRO 27 N -3.92 2.78 0.67 4.82 0.02 -1.26 -4.74 135.00 133.37 3gza s PRO 27 Ca 0.07 1.83 -0.13 0.00 0.02 0.00 0.00 61.00 62.79 3gza s PRO 27 Cb 0.08 -1.90 -0.00 0.00 0.02 0.00 0.00 34.50 32.69 3gza s PRO 27 CO -0.10 -1.36 1.07 0.15 -0.33 0.00 0.00 177.00 176.44 3gza s LYS 28 N -3.46 2.94 0.33 5.54 1.02 -1.26 -4.92 119.74 119.93 3gza s LYS 28 Ca 0.77 1.15 0.10 0.00 0.02 0.00 0.00 55.97 58.01 3gza s LYS 28 Cb -0.31 -1.98 0.88 0.00 -0.52 0.00 0.00 37.83 35.89 3gza s LYS 28 CO 0.36 -1.11 1.75 -1.35 -0.92 0.00 0.00 175.35 174.09 3gza h PRO 29 N -0.25 0.59 0.00 -1.68 0.11 -2.00 0.54 132.00 129.31 3gza h PRO 29 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3gza h PRO 29 Cb 1.22 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3gza h PRO 29 CO 0.56 0.39 0.00 -2.39 -0.21 0.00 0.00 178.00 176.35 3gza n HIS 30 N -4.80 0.00 0.79 0.65 1.44 -1.26 -2.51 115.22 109.53 3gza n HIS 30 Ca 0.25 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 56.09 3gza n HIS 30 Cb 0.71 -0.36 0.26 0.00 0.12 0.00 0.00 29.99 30.72 3gza n HIS 30 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 3gza n GLN 31 N -1.36 0.14 -0.21 -1.40 6.02 0.18 -4.08 117.38 116.66 3gza n GLN 31 Ca 0.10 0.05 -0.01 0.00 -0.01 0.00 0.00 57.00 57.13 3gza n GLN 31 Cb 0.24 -1.59 0.21 0.00 1.02 0.00 0.00 30.24 30.11 3gza n GLN 31 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3gza h LEU 32 N 0.00 0.87 -1.93 1.08 3.38 -1.49 -1.58 115.31 115.65 3gza h LEU 32 Ca 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3gza h LEU 32 Cb 0.62 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 3gza h LEU 32 CO 0.00 0.70 -0.04 0.07 0.09 0.00 0.00 178.44 179.26 3gza h LYS 33 N 0.99 0.00 0.40 1.13 2.10 -1.79 -0.79 116.57 118.60 3gza h LYS 33 Ca 0.25 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.88 3gza h LYS 33 Cb 0.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 3gza h LYS 33 CO -0.04 0.04 -0.19 2.35 -2.00 0.00 0.00 179.45 179.61 3gza h TRP 34 N 0.00 -0.49 -0.31 0.07 2.91 -1.51 -2.56 115.95 114.06 3gza h TRP 34 Ca -0.00 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.00 3gza h TRP 34 Cb 0.36 0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 29.16 3gza h TRP 34 CO 0.00 -0.17 0.15 0.45 -1.03 0.00 0.00 178.44 177.84 3gza h HIS 35 N -0.89 0.45 -0.03 2.65 3.86 -1.40 -3.18 115.15 116.61 3gza h HIS 35 Ca -0.05 -0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.08 3gza h HIS 35 Cb 0.55 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 3gza h HIS 35 CO 0.02 0.40 -0.25 0.93 0.86 0.00 0.00 177.93 179.89 3gza h GLU 36 N 0.37 0.06 -0.66 2.45 5.08 -1.24 -3.08 114.58 117.55 3gza h GLU 36 Ca 0.11 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 3gza h GLU 36 Cb 0.12 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 3gza h GLU 36 CO -0.01 0.30 0.34 0.00 -1.00 0.00 0.00 179.01 178.64 3gza h ALA 37 N 1.70 0.85 0.00 3.43 0.00 -1.43 -3.51 119.26 120.31 3gza h ALA 37 Ca 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3gza h ALA 37 Cb 0.47 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3gza h ALA 37 CO 0.03 0.39 0.00 0.39 0.00 0.00 0.00 179.25 180.07 3gza n GLU 38 N -4.50 0.00 0.00 0.00 1.02 -1.17 -4.52 120.64 111.48 3gza n GLU 38 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 3gza n GLU 38 Cb 0.11 -3.00 0.00 0.00 -0.02 0.00 0.00 31.44 28.52 3gza n GLU 38 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gza n GLY 40 N -2.00 -0.37 3.15 0.62 0.00 0.19 -1.07 105.19 105.69 3gza n GLY 40 Ca 0.00 -1.09 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 3gza n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gza s ALA 41 N -2.00 1.15 -0.08 4.61 0.00 -0.61 -0.96 121.76 123.88 3gza s ALA 41 Ca 0.00 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.15 3gza s ALA 41 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 3gza s ALA 41 CO 0.00 0.20 -0.23 0.54 0.00 0.00 0.00 175.76 176.27 3gza s VAL 42 N -0.95 2.20 -0.30 0.00 0.11 -0.03 -0.34 120.40 121.09 3gza s VAL 42 Ca 0.01 -1.00 -0.05 0.00 -2.93 0.00 0.00 61.98 58.01 3gza s VAL 42 Cb -0.08 -1.83 0.03 0.00 -1.53 0.00 0.00 36.38 32.97 3gza s VAL 42 CO 0.01 0.56 0.05 -0.36 -3.33 0.00 0.00 175.10 172.04 3gza s PHE 43 N 0.04 3.18 -0.13 1.54 0.40 0.57 -0.40 117.98 123.18 3gza s PHE 43 Ca -0.09 -1.33 -0.18 0.00 -0.60 0.00 0.00 56.93 54.74 3gza s PHE 43 Cb -0.15 -2.20 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 3gza s PHE 43 CO 0.06 -0.68 0.45 -1.01 0.70 0.00 0.00 175.22 174.74 3gza s HIS 44 N 1.41 3.50 -0.20 0.36 3.76 -1.17 -1.96 115.29 120.99 3gza s HIS 44 Ca -0.00 0.85 -0.10 0.00 -0.15 0.00 0.00 55.06 55.66 3gza s HIS 44 Cb -0.18 -2.53 0.07 0.00 1.11 0.00 0.00 32.58 31.05 3gza s HIS 44 CO 0.01 0.17 0.48 -0.47 -0.85 0.00 0.00 174.74 174.07 3gza s TYR 45 N 0.63 -0.75 0.36 1.40 5.04 -1.26 -4.38 117.35 118.39 3gza s TYR 45 Ca 0.25 1.53 -0.13 0.00 -2.44 0.00 0.00 57.07 56.27 3gza s TYR 45 Cb -0.15 0.37 0.04 0.00 0.35 0.00 0.00 41.96 42.57 3gza s TYR 45 CO 0.09 -0.41 0.70 0.34 -1.34 0.00 0.00 175.55 174.93 3gza s ASP 46 N 1.69 0.16 0.37 4.32 -1.08 -1.26 -4.85 116.67 116.02 3gza s ASP 46 Ca -0.08 -1.15 0.05 0.00 -0.52 0.00 0.00 52.55 50.85 3gza s ASP 46 Cb -0.08 0.79 0.72 0.00 -1.46 0.00 0.00 42.92 42.88 3gza s ASP 46 CO -0.14 -1.55 2.00 -0.07 0.52 0.00 0.00 175.17 175.93 3gza h LEU 47 N 2.03 0.66 -0.44 -1.34 3.38 -1.97 -2.27 115.31 115.36 3gza h LEU 47 Ca -0.30 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3gza h LEU 47 Cb 1.25 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3gza h LEU 47 CO 0.38 0.46 0.00 0.00 0.09 0.00 0.00 178.44 179.37 3gza n HIS 48 N -4.46 0.49 0.29 1.13 1.44 -1.26 -2.05 115.22 110.80 3gza n HIS 48 Ca 0.08 0.19 0.18 0.00 -2.01 0.00 0.00 57.72 56.16 3gza n HIS 48 Cb 0.12 -0.81 0.99 0.00 0.12 0.00 0.00 29.99 30.41 3gza n HIS 48 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 3gza h VAL 49 N 0.00 0.27 -0.61 0.61 2.07 -1.68 -2.71 116.25 114.20 3gza h VAL 49 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3gza h VAL 49 Cb 0.31 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3gza h VAL 49 CO 0.00 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.08 3gza n PHE 50 N -3.45 0.80 1.53 1.57 3.01 -0.87 -4.45 117.46 115.60 3gza n PHE 50 Ca -0.02 -0.43 0.14 0.00 1.01 0.00 0.00 57.45 58.15 3gza n PHE 50 Cb 0.18 -0.00 0.56 0.00 -0.01 0.00 0.00 39.48 40.20 3gza n PHE 50 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 3gza n ASP 51 N 1.49 1.36 0.00 4.37 5.68 -1.02 -4.93 116.55 123.49 3gza n ASP 51 Ca 0.22 -1.44 0.00 0.00 -0.50 0.00 0.00 54.79 53.07 3gza n ASP 51 Cb 0.59 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.58 3gza n ASP 51 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3gza n GLY 52 N 1.17 0.31 3.26 6.12 0.00 -1.26 -4.99 105.19 109.79 3gza n GLY 52 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 3gza n GLY 52 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gza s ILE 53 N -1.62 0.34 0.75 -0.61 -4.36 -1.26 -4.85 121.20 109.59 3gza s ILE 53 Ca 0.00 -1.99 -0.13 0.00 -0.26 0.00 0.00 60.65 58.26 3gza s ILE 53 Cb 0.00 -2.51 0.05 0.00 1.25 0.00 0.00 42.46 41.25 3gza s ILE 53 CO 0.00 -0.07 1.15 -0.13 0.24 0.00 0.00 174.94 176.13 3gza s ARG 54 N -4.07 2.17 0.01 0.37 0.52 -1.26 -4.59 118.95 112.10 3gza s ARG 54 Ca 0.36 1.51 -0.30 0.00 -0.52 0.00 0.00 55.73 56.78 3gza s ARG 54 Cb 0.07 -1.86 -0.04 0.00 0.52 0.00 0.00 34.95 33.65 3gza s ARG 54 CO 0.12 -1.76 1.04 -0.47 0.02 0.00 0.00 175.30 174.24 3gza s TYR 55 N -2.37 3.59 -0.28 -0.53 5.04 -1.26 -5.03 117.35 116.50 3gza s TYR 55 Ca 0.68 1.59 0.02 0.00 -2.44 0.00 0.00 57.07 56.92 3gza s TYR 55 Cb -0.23 -3.20 0.08 0.00 0.35 0.00 0.00 41.96 38.95 3gza s TYR 55 CO 0.48 -0.37 -0.00 0.20 -1.34 0.00 0.00 175.55 174.53 3gza s GLY 56 N 1.03 1.47 0.14 8.97 0.00 -1.26 -5.03 107.32 112.65 3gza s GLY 56 Ca 0.54 -1.80 -0.16 0.00 0.00 0.00 0.00 44.72 43.30 3gza s GLY 56 CO 0.28 1.03 1.76 -1.61 0.00 0.00 0.00 173.10 174.56 3gza h GLN 57 N 7.86 0.54 -0.42 2.90 4.15 -1.98 0.11 115.11 128.26 3gza h GLN 57 Ca -0.13 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 59.25 3gza h GLN 57 Cb 1.04 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.59 3gza h GLN 57 CO 0.46 0.42 0.24 0.78 -1.93 0.00 0.00 178.83 178.80 3gza h GLY 58 N 0.51 0.58 0.80 2.39 0.00 -2.00 -1.70 103.07 103.65 3gza h GLY 58 Ca 0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 3gza h GLY 58 CO -0.02 0.15 -0.01 -0.57 0.00 0.00 0.00 176.54 176.09 3gza h ASN 59 N 0.48 0.31 -0.88 0.19 -0.73 -1.93 -3.15 115.58 109.86 3gza h ASN 59 Ca 0.17 -0.32 0.03 0.00 1.87 0.00 0.00 56.30 58.05 3gza h ASN 59 Cb 0.03 -0.08 -0.05 0.00 0.27 0.00 0.00 38.32 38.49 3gza h ASN 59 CO -0.09 0.55 0.58 -1.13 -0.37 0.00 0.00 177.43 176.97 3gza h ASN 60 N 0.05 0.96 0.53 1.15 -1.24 -0.47 -1.69 115.58 114.87 3gza h ASN 60 Ca 0.05 -0.01 -0.03 0.00 0.71 0.00 0.00 56.30 57.02 3gza h ASN 60 Cb 0.40 -0.22 -0.00 0.00 0.73 0.00 0.00 38.32 39.22 3gza h ASN 60 CO 0.01 0.67 -0.12 0.03 -1.29 0.00 0.00 177.43 176.72 3gza h ARG 61 N 1.11 0.00 0.00 6.67 3.08 -1.28 -3.30 114.38 120.67 3gza h ARG 61 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 3gza h ARG 61 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.04 3gza h ARG 61 CO -0.10 0.12 -0.03 0.44 -1.07 0.00 0.00 179.97 179.34 3gza n ILE 62 N -3.49 0.97 -3.75 2.04 -5.35 -0.85 -3.90 119.36 105.03 3gza n ILE 62 Ca -0.01 -1.06 -0.30 0.00 -0.27 0.00 0.00 62.75 61.11 3gza n ILE 62 Cb 0.28 0.42 -0.14 0.00 -1.74 0.00 0.00 39.64 38.45 3gza n ILE 62 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 3gza s ASN 63 N -1.25 3.99 0.65 7.28 0.01 -0.70 -5.07 114.94 119.86 3gza s ASN 63 Ca 0.07 -1.99 -0.17 0.00 -0.71 0.00 0.00 52.86 50.06 3gza s ASN 63 Cb 0.06 -0.99 -0.03 0.00 0.41 0.00 0.00 41.25 40.70 3gza s ASN 63 CO 0.01 -0.37 0.94 -2.65 -1.51 0.00 0.00 177.10 173.52 3gza n PRO 64 N 4.39 0.72 -1.98 -0.60 -0.02 -1.26 -4.80 135.00 131.44 3gza n PRO 64 Ca 0.02 0.29 -0.42 0.00 -2.02 0.00 0.00 63.50 61.37 3gza n PRO 64 Cb 0.40 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 3gza n PRO 64 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3gza s ILE 65 N -1.64 2.76 0.13 4.25 -1.09 -1.26 -4.93 121.20 119.42 3gza s ILE 65 Ca 0.75 0.55 -0.13 0.00 -2.23 0.00 0.00 60.65 59.59 3gza s ILE 65 Cb -0.39 -3.35 -0.03 0.00 -1.58 0.00 0.00 42.46 37.12 3gza s ILE 65 CO 0.48 0.04 1.52 -0.33 -1.23 0.00 0.00 174.94 175.43 3gza h GLU 66 N 6.72 0.82 -2.50 2.79 4.39 -2.03 -3.42 114.58 121.35 3gza h GLU 66 Ca -0.43 -0.34 -0.33 0.00 0.34 0.00 0.00 59.36 58.60 3gza h GLU 66 Cb 1.21 -0.03 -0.36 0.00 -0.10 0.00 0.00 28.75 29.46 3gza h GLU 66 CO 0.90 0.97 -0.64 0.34 -1.16 0.00 0.00 179.01 179.42 3gza s ASP 67 N -6.50 1.53 0.11 1.42 -1.08 -1.26 -5.01 116.67 105.88 3gza s ASP 67 Ca -0.12 -0.34 0.21 0.00 -0.52 0.00 0.00 52.55 51.78 3gza s ASP 67 Cb 0.11 0.35 0.85 0.00 -1.46 0.00 0.00 42.92 42.76 3gza s ASP 67 CO 0.83 -0.34 1.65 0.00 0.52 0.00 0.00 175.17 177.83 3gza n TYR 68 N 5.31 0.36 1.53 -5.34 0.18 -1.26 -2.96 117.16 114.99 3gza n TYR 68 Ca -0.05 0.13 0.07 0.00 1.88 0.00 0.00 57.90 59.93 3gza n TYR 68 Cb 0.49 -0.71 0.43 0.00 -0.38 0.00 0.00 39.34 39.16 3gza n TYR 68 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 3gza n ASN 69 N -1.82 0.00 0.27 9.48 3.02 -1.26 -1.70 115.26 123.25 3gza n ASN 69 Ca 0.04 -1.08 0.18 0.00 -0.03 0.00 0.00 54.58 53.69 3gza n ASN 69 Cb 0.24 0.00 0.80 0.00 -0.61 0.00 0.00 39.78 40.22 3gza n ASN 69 CO 0.00 0.00 0.00 0.16 -2.62 0.00 0.00 177.26 174.80 3gza h ILE 70 N 0.00 0.00 -2.55 2.41 3.07 -1.90 -3.41 117.51 115.13 3gza h ILE 70 Ca 0.00 -0.33 -0.54 0.00 1.55 0.00 0.00 64.86 65.54 3gza h ILE 70 Cb 0.00 1.27 -0.05 0.00 -0.27 0.00 0.00 36.82 37.78 3gza h ILE 70 CO 0.00 0.00 1.21 0.12 -1.05 0.00 0.00 178.15 178.43 3gza s PHE 71 N -3.75 2.01 -0.45 0.16 2.19 -0.69 -4.81 117.98 112.64 3gza s PHE 71 Ca -0.00 0.59 0.07 0.00 0.33 0.00 0.00 56.93 57.92 3gza s PHE 71 Cb 0.10 -4.25 0.29 0.00 -1.31 0.00 0.00 43.02 37.85 3gza s PHE 71 CO 0.48 -2.27 0.92 -1.71 1.83 0.00 0.00 175.22 174.47 3gza n ASN 72 N 10.63 -1.84 -4.57 6.13 5.15 -1.26 -4.54 115.26 124.96 3gza n ASN 72 Ca 0.17 -3.36 -0.40 0.00 -0.60 0.00 0.00 54.58 50.39 3gza n ASN 72 Cb 0.49 1.27 -0.02 0.00 -0.53 0.00 0.00 39.78 41.00 3gza n ASN 72 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3gza s PRO 73 N -0.10 3.61 0.17 1.20 0.04 -1.25 -4.82 135.00 133.84 3gza s PRO 73 Ca 0.29 -1.49 0.20 0.00 0.04 0.00 0.00 61.00 60.05 3gza s PRO 73 Cb 0.26 -5.41 0.86 0.00 0.04 0.00 0.00 34.50 30.24 3gza s PRO 73 CO -0.13 -2.48 1.62 0.25 0.04 0.00 0.00 177.00 176.31 3gza n THR 74 N 6.81 0.89 -1.03 1.26 -2.24 -1.22 -1.91 114.28 116.84 3gza n THR 74 Ca 0.42 0.24 0.08 0.00 -2.27 0.00 0.00 64.05 62.52 3gza n THR 74 Cb 0.48 -1.11 0.24 0.00 -2.10 0.00 0.00 70.33 67.84 3gza n THR 74 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gza n GLU 75 N -1.99 2.69 -1.62 -0.78 -0.58 0.37 -5.05 120.64 113.69 3gza n GLU 75 Ca 0.03 -2.84 -0.49 0.00 -0.42 0.00 0.00 57.16 53.44 3gza n GLU 75 Cb 0.21 -1.81 -0.05 0.00 -0.57 0.00 0.00 31.44 29.22 3gza n GLU 75 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3gza n LEU 76 N -0.64 2.23 -3.32 -4.62 7.94 -0.80 -4.59 117.00 113.19 3gza n LEU 76 Ca 0.22 1.11 -0.11 0.00 -1.11 0.00 0.00 56.01 56.11 3gza n LEU 76 Cb 0.88 -1.29 -0.06 0.00 0.53 0.00 0.00 43.42 43.48 3gza n LEU 76 CO 0.14 -0.76 -0.08 0.21 -1.11 0.00 0.00 177.39 175.78 3gza s ASN 77 N 0.59 0.44 0.50 1.96 2.47 -0.95 -5.01 114.94 114.94 3gza s ASN 77 Ca 0.81 -1.07 0.33 0.00 0.42 0.00 0.00 52.86 53.36 3gza s ASN 77 Cb -0.83 0.98 1.55 0.00 -1.45 0.00 0.00 41.25 41.50 3gza s ASN 77 CO 0.44 -0.27 2.00 0.71 -3.72 0.00 0.00 177.10 176.26 3gza h THR 78 N 5.39 0.00 -0.69 -5.21 1.35 -1.90 -1.40 112.91 110.46 3gza h THR 78 Ca 0.01 -0.28 -0.00 0.00 -0.55 0.00 0.00 66.41 65.58 3gza h THR 78 Cb 1.10 1.18 -0.03 0.00 -1.73 0.00 0.00 68.15 68.67 3gza h THR 78 CO 0.20 0.00 0.42 0.44 -0.25 0.00 0.00 175.52 176.33 3gza h ASP 79 N 0.00 0.82 -0.69 5.36 3.32 -1.92 -1.68 116.42 121.64 3gza h ASP 79 Ca 0.00 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 3gza h ASP 79 Cb 0.31 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 3gza h ASP 79 CO 0.00 0.64 0.31 -0.61 -1.72 0.00 0.00 179.24 177.86 3gza h GLN 80 N 0.94 1.03 -0.05 3.56 -0.00 -1.66 -0.79 115.11 118.13 3gza h GLN 80 Ca 0.25 -0.16 -0.00 0.00 -0.00 0.00 0.00 58.65 58.74 3gza h GLN 80 Cb -0.03 -0.18 -0.00 0.00 0.00 0.00 0.00 27.48 27.26 3gza h GLN 80 CO -0.05 0.82 0.03 -1.49 0.00 0.00 0.00 178.83 178.14 3gza h TRP 81 N 1.01 0.07 -0.48 3.99 4.06 -1.34 -1.35 115.95 121.91 3gza h TRP 81 Ca 0.24 -0.00 -0.09 0.00 2.06 0.00 0.00 58.89 61.10 3gza h TRP 81 Cb 0.16 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 28.28 3gza h TRP 81 CO 0.01 0.09 -0.06 0.28 -3.56 0.00 0.00 178.44 175.20 3gza h VAL 82 N 0.03 1.27 -0.38 1.49 2.07 -1.13 -2.15 116.25 117.45 3gza h VAL 82 Ca 0.02 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.32 3gza h VAL 82 Cb 0.04 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3gza h VAL 82 CO -0.00 0.40 -0.04 1.56 0.02 0.00 0.00 177.57 179.51 3gza h GLN 83 N 0.73 0.62 -0.50 1.57 4.20 -1.09 -0.27 115.11 120.37 3gza h GLN 83 Ca 0.13 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 3gza h GLN 83 Cb 0.59 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 3gza h GLN 83 CO 0.04 0.67 0.17 0.00 -0.67 0.00 0.00 178.83 179.04 3gza h ALA 84 N 1.38 0.65 -0.40 3.87 0.00 -0.88 -2.09 119.26 121.79 3gza h ALA 84 Ca 0.12 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 3gza h ALA 84 Cb 0.42 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3gza h ALA 84 CO 0.02 0.29 -0.15 0.00 0.00 0.00 0.00 179.25 179.41 3gza h ALA 85 N 1.03 0.56 -0.71 0.00 0.00 -1.10 -2.91 119.26 116.12 3gza h ALA 85 Ca 0.16 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.76 3gza h ALA 85 Cb 0.24 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3gza h ALA 85 CO -0.01 0.48 0.47 -0.22 0.00 0.00 0.00 179.25 179.97 3gza h LYS 86 N 0.62 0.82 0.00 0.00 3.64 -0.91 -1.62 116.57 119.12 3gza h LYS 86 Ca 0.09 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3gza h LYS 86 Cb 0.70 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3gza h LYS 86 CO 0.05 0.54 -0.00 0.00 -2.27 0.00 0.00 179.45 177.77 3gza h ALA 87 N 1.59 1.01 0.00 5.00 0.00 -1.16 -1.32 119.26 124.38 3gza h ALA 87 Ca 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3gza h ALA 87 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3gza h ALA 87 CO -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 179.25 178.79 3gza n ALA 88 N -2.09 2.84 0.00 0.00 0.00 -0.64 -3.36 120.51 117.26 3gza n ALA 88 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.22 3gza n ALA 88 Cb 0.16 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.34 3gza n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gza n GLY 89 N 1.39 0.82 3.74 0.00 0.00 -0.50 -3.53 105.19 107.12 3gza n GLY 89 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3gza n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gza n LYS 91 N 2.54 1.41 -4.10 0.00 4.76 -1.26 -4.44 118.16 117.07 3gza n LYS 91 Ca 0.08 -0.07 -0.09 0.00 -2.87 0.00 0.00 58.31 55.36 3gza n LYS 91 Cb 0.40 -1.24 -0.10 0.00 -1.84 0.00 0.00 35.03 32.25 3gza n LYS 91 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 3gza s PHE 92 N -2.64 0.61 -0.09 2.13 -0.71 -1.26 -1.49 117.98 114.53 3gza s PHE 92 Ca -0.00 -0.89 -0.07 0.00 -1.04 0.00 0.00 56.93 54.93 3gza s PHE 92 Cb 0.09 -0.40 0.03 0.00 -1.21 0.00 0.00 43.02 41.53 3gza s PHE 92 CO 0.56 -0.25 0.23 0.00 -1.34 0.00 0.00 175.22 174.42 3gza s ALA 93 N -3.22 -0.55 -0.02 1.99 0.00 -0.54 -1.57 121.76 117.85 3gza s ALA 93 Ca 0.03 0.75 0.06 0.00 0.00 0.00 0.00 51.96 52.81 3gza s ALA 93 Cb 0.03 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 3gza s ALA 93 CO -0.06 -0.14 -0.20 0.08 0.00 0.00 0.00 175.76 175.44 3gza s VAL 94 N 0.50 1.60 -0.05 0.00 1.01 0.53 -0.72 120.40 123.27 3gza s VAL 94 Ca -0.03 -0.86 0.07 0.00 0.00 0.00 0.00 61.98 61.15 3gza s VAL 94 Cb -0.05 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.99 3gza s VAL 94 CO -0.03 0.45 -0.25 -0.22 0.00 0.00 0.00 175.10 175.06 3gza s LEU 95 N -0.46 2.09 -0.63 3.92 2.96 -1.11 -0.31 118.68 125.13 3gza s LEU 95 Ca 0.07 -0.49 -0.26 0.00 -0.22 0.00 0.00 54.13 53.23 3gza s LEU 95 Cb -0.08 -1.37 -0.02 0.00 0.50 0.00 0.00 46.19 45.22 3gza s LEU 95 CO -0.01 0.27 1.82 0.42 -1.32 0.00 0.00 176.35 177.53 3gza s THR 96 N -0.31 3.38 0.18 3.68 -4.23 -0.83 -0.86 115.64 116.66 3gza s THR 96 Ca 0.01 0.19 -0.09 0.00 -1.18 0.00 0.00 61.69 60.62 3gza s THR 96 Cb -0.13 -4.02 0.08 0.00 1.34 0.00 0.00 72.50 69.78 3gza s THR 96 CO 0.02 -0.98 1.67 0.00 -0.54 0.00 0.00 174.62 174.78 3gza h ALA 97 N 14.47 0.85 -2.34 3.99 0.00 -1.00 -3.43 119.26 131.79 3gza h ALA 97 Ca -0.25 -0.28 -0.23 0.00 0.00 0.00 0.00 54.91 54.15 3gza h ALA 97 Cb 1.15 -0.24 -0.15 0.00 0.00 0.00 0.00 17.79 18.55 3gza h ALA 97 CO 1.22 0.64 -0.66 0.95 0.00 0.00 0.00 179.25 181.40 3gza s THR 98 N -5.15 0.39 0.00 0.00 -4.23 -1.24 -0.98 115.64 104.44 3gza s THR 98 Ca -0.12 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 3gza s THR 98 Cb 0.14 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.92 3gza s THR 98 CO 0.85 -0.50 0.00 1.57 -0.54 0.00 0.00 174.62 176.00 3gza n HIS 99 N -0.16 0.00 -0.00 3.99 -0.00 -1.26 -2.27 115.22 115.52 3gza n HIS 99 Ca -0.06 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.66 3gza n HIS 99 Cb 0.63 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.60 3gza n HIS 99 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 3gza n GLU 100 N 0.00 0.63 0.23 1.57 1.02 -1.26 -4.32 120.64 118.50 3gza n GLU 100 Ca 0.00 -0.02 0.12 0.00 -0.02 0.00 0.00 57.16 57.24 3gza n GLU 100 Cb 0.00 -1.06 0.26 0.00 -0.02 0.00 0.00 31.44 30.62 3gza n GLU 100 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3gza h THR 101 N 0.00 0.05 0.00 2.62 1.35 -1.85 -1.43 112.91 113.65 3gza h THR 101 Ca -0.01 -0.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 3gza h THR 101 Cb 0.28 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.63 3gza h THR 101 CO 0.00 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 3gza n GLY 102 N 0.90 0.68 3.75 5.82 0.00 -1.26 -2.86 105.19 112.22 3gza n GLY 102 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 3gza n GLY 102 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3gza s PHE 103 N -2.22 3.62 -0.11 1.61 5.36 -1.26 -4.84 117.98 120.15 3gza s PHE 103 Ca 0.00 1.71 0.00 0.00 -0.96 0.00 0.00 56.93 57.68 3gza s PHE 103 Cb 0.00 -3.25 -0.02 0.00 -0.34 0.00 0.00 43.02 39.41 3gza s PHE 103 CO 0.00 -0.46 -0.11 0.20 -1.46 0.00 0.00 175.22 173.39 3gza s GLY 104 N -0.79 1.59 -0.21 13.12 0.00 0.08 -4.40 107.32 116.72 3gza s GLY 104 Ca 0.45 -0.90 -0.00 0.00 0.00 0.00 0.00 44.72 44.27 3gza s GLY 104 CO 0.39 -0.37 1.86 1.04 0.00 0.00 0.00 173.10 176.02 3gza n LEU 105 N 3.06 5.74 -4.08 0.66 4.77 -0.15 -2.43 117.00 124.57 3gza n LEU 105 Ca -0.18 -2.86 -0.13 0.00 -0.03 0.00 0.00 56.01 52.81 3gza n LEU 105 Cb 0.53 -0.98 -0.05 0.00 -2.33 0.00 0.00 43.42 40.58 3gza n LEU 105 CO 0.29 1.06 0.09 -1.66 -1.33 0.00 0.00 177.39 175.85 3gza s TRP 106 N -1.25 0.89 -1.01 -1.77 -2.14 -1.26 -1.75 118.94 110.65 3gza s TRP 106 Ca 0.21 -1.15 -0.20 0.00 2.66 0.00 0.00 56.10 57.62 3gza s TRP 106 Cb 0.17 -0.09 0.10 0.00 -3.10 0.00 0.00 33.47 30.55 3gza s TRP 106 CO 0.01 -1.02 1.31 -0.65 -2.66 0.00 0.00 176.95 173.93 3gza s GLN 107 N -3.49 3.66 0.05 3.25 -1.52 -1.26 -3.13 119.66 117.22 3gza s GLN 107 Ca 0.30 -1.62 -0.06 0.00 -1.95 0.00 0.00 55.36 52.03 3gza s GLN 107 Cb 0.01 -5.13 -0.05 0.00 -0.22 0.00 0.00 33.01 27.62 3gza s GLN 107 CO 0.16 -1.96 0.30 0.45 -0.25 0.00 0.00 175.29 173.99 3gza s SER 108 N 4.08 6.49 0.00 5.90 0.15 -1.26 -4.98 113.70 124.08 3gza s SER 108 Ca 0.40 0.55 0.20 0.00 0.70 0.00 0.00 55.95 57.80 3gza s SER 108 Cb -0.02 -2.08 0.46 0.00 -1.71 0.00 0.00 66.02 62.67 3gza s SER 108 CO -0.08 0.20 1.39 0.47 1.20 0.00 0.00 173.24 176.42 3gza n ASP 109 N 0.80 3.46 0.00 5.45 8.00 -1.26 -4.60 116.55 128.40 3gza n ASP 109 Ca -0.08 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.45 3gza n ASP 109 Cb 0.52 -0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 3gza n ASP 109 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3gza n VAL 110 N 1.33 0.00 -3.44 2.53 0.24 -1.26 -4.95 118.33 112.78 3gza n VAL 110 Ca 0.19 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.06 3gza n VAL 110 Cb 0.56 -0.48 -0.08 0.00 -1.47 0.00 0.00 33.84 32.37 3gza n VAL 110 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3gza s ASN 111 N -2.77 6.00 0.37 -1.34 2.47 -1.26 -4.95 114.94 113.46 3gza s ASN 111 Ca 0.00 -1.47 0.27 0.00 0.42 0.00 0.00 52.86 52.09 3gza s ASN 111 Cb 0.00 -2.13 1.09 0.00 -1.45 0.00 0.00 41.25 38.76 3gza s ASN 111 CO 0.00 -0.65 1.81 1.55 -3.72 0.00 0.00 177.10 176.09 3gza h PRO 112 N 8.67 0.00 -3.98 0.43 0.13 -1.92 -3.35 132.00 131.98 3gza h PRO 112 Ca -0.27 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 64.12 3gza h PRO 112 Cb 1.10 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.10 3gza h PRO 112 CO 0.87 0.00 2.18 0.98 -0.23 0.00 0.00 178.00 181.80 3gza n TYR 113 N -2.58 3.52 -3.61 1.56 9.36 -1.26 -4.43 117.16 119.73 3gza n TYR 113 Ca 0.02 -2.93 0.00 0.00 3.32 0.00 0.00 57.90 58.31 3gza n TYR 113 Cb 0.28 -2.17 0.00 0.00 -0.63 0.00 0.00 39.34 36.82 3gza n TYR 113 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3gza h LEU 115 N 0.00 0.00 -2.16 0.00 3.38 -1.42 -0.02 115.31 115.09 3gza h LEU 115 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3gza h LEU 115 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3gza h LEU 115 CO 0.00 0.00 -0.07 0.11 0.09 0.00 0.00 178.44 178.57 3gza h LYS 116 N 0.00 0.00 0.00 1.13 1.57 -1.79 -3.15 116.57 114.33 3gza h LYS 116 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3gza h LYS 116 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3gza h LYS 116 CO 0.00 0.07 -0.26 0.00 -0.57 0.00 0.00 179.45 178.68 3gza h ALA 117 N 1.93 0.86 -2.38 3.86 0.00 -1.20 -3.42 119.26 118.91 3gza h ALA 117 Ca -0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.41 3gza h ALA 117 Cb 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3gza h ALA 117 CO 0.01 0.00 -0.44 0.14 0.00 0.00 0.00 179.25 178.95 3gza s VAL 118 N -3.23 5.29 0.27 0.00 -7.23 -1.19 -5.00 120.40 109.31 3gza s VAL 118 Ca 0.06 -0.82 0.07 0.00 -1.81 0.00 0.00 61.98 59.47 3gza s VAL 118 Cb 0.07 -3.80 -0.00 0.00 0.56 0.00 0.00 36.38 33.21 3gza s VAL 118 CO 0.69 -0.21 1.63 0.11 -0.31 0.00 0.00 175.10 177.02 3gza h LYS 119 N 1.67 0.18 -6.49 4.82 1.57 -1.89 -2.55 116.57 113.88 3gza h LYS 119 Ca -0.50 -0.11 -0.60 0.00 -1.87 0.00 0.00 60.65 57.57 3gza h LYS 119 Cb 1.21 0.01 0.06 0.00 0.08 0.00 0.00 32.23 33.59 3gza h LYS 119 CO 0.65 0.67 0.69 1.87 -0.57 0.00 0.00 179.45 182.76 3gza n TRP 120 N -3.93 2.12 -2.13 -1.35 -0.00 -1.26 -0.76 117.44 110.13 3gza n TRP 120 Ca -0.02 0.37 -0.15 0.00 -0.00 0.00 0.00 57.50 57.70 3gza n TRP 120 Cb 0.56 -2.49 -0.02 0.00 -0.00 0.00 0.00 31.31 29.35 3gza n TRP 120 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 3gza n ARG 121 N 2.91 -1.85 -3.08 5.87 1.74 -1.26 -2.59 116.66 118.41 3gza n ARG 121 Ca 0.16 0.76 -0.22 0.00 -0.77 0.00 0.00 57.85 57.78 3gza n ARG 121 Cb 0.28 -5.27 0.01 0.00 -1.02 0.00 0.00 32.46 26.46 3gza n ARG 121 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3gza n ASP 122 N -1.50 -4.85 -0.49 0.55 10.43 0.06 -1.31 116.55 119.44 3gza n ASP 122 Ca -0.17 -0.27 -0.06 0.00 2.57 0.00 0.00 54.79 56.86 3gza n ASP 122 Cb 0.59 -3.97 -0.03 0.00 1.84 0.00 0.00 41.12 39.55 3gza n ASP 122 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3gza n GLY 123 N -1.28 0.79 0.35 0.44 0.00 -0.96 -4.88 105.19 99.66 3gza n GLY 123 Ca -0.08 -0.25 0.03 0.00 0.00 0.00 0.00 46.02 45.72 3gza n GLY 123 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gza n LYS 124 N -1.75 1.84 -2.09 1.61 4.76 -0.43 -3.85 118.16 118.27 3gza n LYS 124 Ca -0.06 -1.50 -0.35 0.00 -2.87 0.00 0.00 58.31 53.53 3gza n LYS 124 Cb 0.34 -1.15 0.02 0.00 -1.84 0.00 0.00 35.03 32.40 3gza n LYS 124 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3gza s GLY 125 N -0.84 2.51 -0.32 0.72 0.00 -1.25 -5.01 107.32 103.13 3gza s GLY 125 Ca 0.12 0.77 0.02 0.00 0.00 0.00 0.00 44.72 45.63 3gza s GLY 125 CO 0.09 1.13 0.37 -0.35 0.00 0.00 0.00 173.10 174.34 3gza s ASP 126 N -1.98 0.97 0.25 1.64 -1.08 -1.26 -4.20 116.67 111.01 3gza s ASP 126 Ca 0.72 -0.94 0.11 0.00 -0.52 0.00 0.00 52.55 51.91 3gza s ASP 126 Cb -0.24 0.77 0.26 0.00 -1.46 0.00 0.00 42.92 42.26 3gza s ASP 126 CO 0.32 -0.32 1.55 0.40 0.52 0.00 0.00 175.17 177.63 3gza h ILE 127 N 5.75 1.43 -0.75 4.11 2.04 -1.74 -1.73 117.51 126.61 3gza h ILE 127 Ca -0.05 -2.34 -0.00 0.00 1.00 0.00 0.00 64.86 63.47 3gza h ILE 127 Cb 1.09 2.28 -0.04 0.00 -0.74 0.00 0.00 36.82 39.41 3gza h ILE 127 CO 0.26 0.66 0.47 0.58 0.00 0.00 0.00 178.15 180.11 3gza h VAL 128 N 0.00 1.21 -0.06 1.67 2.07 -1.73 0.39 116.25 119.80 3gza h VAL 128 Ca -0.01 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 3gza h VAL 128 Cb 1.23 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 3gza h VAL 128 CO 0.09 0.21 0.01 -0.09 0.02 0.00 0.00 177.57 177.81 3gza h ARG 129 N 1.03 0.09 -0.57 1.57 2.43 -1.78 -0.11 114.38 117.04 3gza h ARG 129 Ca 0.27 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.52 3gza h ARG 129 Cb -0.06 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.40 3gza h ARG 129 CO -0.05 0.31 0.12 -0.44 -1.51 0.00 0.00 179.97 178.40 3gza h ASP 130 N -0.14 0.00 -0.17 -3.80 5.19 -1.13 -1.58 116.42 114.79 3gza h ASP 130 Ca 0.02 0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 56.52 3gza h ASP 130 Cb 0.27 0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.91 3gza h ASP 130 CO 0.00 0.02 0.05 0.15 -3.12 0.00 0.00 179.24 176.34 3gza h PHE 131 N 0.25 0.28 -0.20 4.55 3.57 -0.63 -0.27 116.94 124.49 3gza h PHE 131 Ca 0.29 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.66 3gza h PHE 131 Cb 0.42 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 3gza h PHE 131 CO -0.24 0.37 -0.33 -0.39 -2.23 0.00 0.00 178.31 175.49 3gza h VAL 132 N 0.10 1.29 -0.44 1.41 -1.51 -0.88 -0.01 116.25 116.21 3gza h VAL 132 Ca 0.06 -1.40 -0.02 0.00 -1.23 0.00 0.00 66.70 64.10 3gza h VAL 132 Cb 0.23 1.50 -0.02 0.00 -2.13 0.00 0.00 31.29 30.87 3gza h VAL 132 CO -0.00 0.43 0.21 0.78 -1.23 0.00 0.00 177.57 177.76 3gza h ASN 133 N 0.35 0.58 -0.46 4.19 2.35 -1.06 -2.00 115.58 119.52 3gza h ASN 133 Ca 0.04 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.64 3gza h ASN 133 Cb 0.76 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.96 3gza h ASN 133 CO 0.06 0.55 0.22 0.28 -1.65 0.00 0.00 177.43 176.89 3gza h SER 134 N 0.57 0.60 -0.08 5.81 0.02 -0.51 -0.91 113.55 119.04 3gza h SER 134 Ca 0.15 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 3gza h SER 134 Cb 0.13 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.46 3gza h SER 134 CO -0.02 0.55 -0.26 0.00 -1.14 0.00 0.00 176.83 175.97 3gza h ARG 136 N -0.35 0.54 -0.93 0.00 3.08 -1.17 0.45 114.38 115.99 3gza h ARG 136 Ca 0.09 -0.14 0.06 0.00 0.07 0.00 0.00 59.98 60.06 3gza h ARG 136 Cb 0.48 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.40 3gza h ARG 136 CO -0.28 0.61 0.61 -0.22 -1.07 0.00 0.00 179.97 179.62 3gza h LYS 137 N 0.50 1.06 -0.37 0.04 3.64 -0.78 -2.84 116.57 117.83 3gza h LYS 137 Ca 0.10 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3gza h LYS 137 Cb 0.43 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3gza h LYS 137 CO 0.02 0.70 0.00 0.66 -2.27 0.00 0.00 179.45 178.56 3gza n TYR 138 N -4.48 0.47 -1.20 1.91 4.01 -0.95 -4.98 117.16 111.94 3gza n TYR 138 Ca 0.14 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 3gza n TYR 138 Cb 0.17 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 3gza n TYR 138 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3gza n GLY 139 N 1.32 0.45 3.81 2.72 0.00 -0.44 -5.05 105.19 108.00 3gza n GLY 139 Ca 0.17 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.90 3gza n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gza s LEU 140 N 0.00 4.04 -0.13 0.99 1.02 0.02 -4.95 118.68 119.68 3gza s LEU 140 Ca 0.00 0.24 -0.26 0.00 0.02 0.00 0.00 54.13 54.13 3gza s LEU 140 Cb 0.00 -2.26 -0.02 0.00 0.02 0.00 0.00 46.19 43.93 3gza s LEU 140 CO 0.00 0.31 0.84 -1.10 0.02 0.00 0.00 176.35 176.42 3gza s GLN 141 N -1.56 4.36 0.09 1.70 -0.21 -0.55 -3.53 119.66 119.95 3gza s GLN 141 Ca 0.21 1.07 -0.24 0.00 0.02 0.00 0.00 55.36 56.42 3gza s GLN 141 Cb -0.12 -3.54 -0.07 0.00 1.00 0.00 0.00 33.01 30.29 3gza s GLN 141 CO 0.12 -0.23 0.73 -1.25 -2.12 0.00 0.00 175.29 172.54 3gza s PRO 142 N 1.77 4.47 0.34 2.91 0.04 -1.26 -1.47 135.00 141.80 3gza s PRO 142 Ca 0.41 1.02 0.06 0.00 0.04 0.00 0.00 61.00 62.52 3gza s PRO 142 Cb -0.17 -3.31 -0.07 0.00 0.04 0.00 0.00 34.50 30.99 3gza s PRO 142 CO 0.16 0.44 0.02 0.20 0.04 0.00 0.00 177.00 177.85 3gza s GLY 143 N -0.61 2.17 -0.05 0.56 0.00 0.10 -0.45 107.32 109.05 3gza s GLY 143 Ca 0.35 -2.11 0.02 0.00 0.00 0.00 0.00 44.72 42.98 3gza s GLY 143 CO 0.23 -1.92 -0.11 -0.42 0.00 0.00 0.00 173.10 170.89 3gza s ILE 144 N -3.03 0.97 -0.13 0.90 1.01 -1.26 -2.76 121.20 116.90 3gza s ILE 144 Ca 0.35 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.53 3gza s ILE 144 Cb 0.08 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 3gza s ILE 144 CO 0.16 0.31 0.09 -0.47 0.00 0.00 0.00 174.94 175.02 3gza s TYR 145 N 0.51 3.41 -0.08 3.97 6.14 -0.04 -1.46 117.35 129.80 3gza s TYR 145 Ca -0.10 0.35 -0.00 0.00 0.64 0.00 0.00 57.07 57.96 3gza s TYR 145 Cb -0.13 -1.94 0.02 0.00 0.42 0.00 0.00 41.96 40.33 3gza s TYR 145 CO 0.02 0.53 -0.04 0.42 0.64 0.00 0.00 175.55 177.12 3gza s ILE 146 N -0.64 0.69 -0.39 3.14 1.01 0.53 -0.29 121.20 125.25 3gza s ILE 146 Ca 0.12 -0.11 -0.15 0.00 0.00 0.00 0.00 60.65 60.51 3gza s ILE 146 Cb -0.12 -0.75 0.01 0.00 0.01 0.00 0.00 42.46 41.61 3gza s ILE 146 CO 0.02 0.30 0.31 -0.83 0.00 0.00 0.00 174.94 174.74 3gza s GLY 147 N 1.56 1.97 0.00 6.18 0.00 -0.96 -2.01 107.32 114.06 3gza s GLY 147 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 43.16 3gza s GLY 147 CO -0.04 0.93 0.64 0.29 0.00 0.00 0.00 173.10 174.91 3gza n ILE 148 N 5.20 0.27 0.08 0.90 -6.64 -1.26 -4.40 119.36 113.51 3gza n ILE 148 Ca -0.11 -0.64 -0.15 0.00 -1.77 0.00 0.00 62.75 60.09 3gza n ILE 148 Cb 0.48 0.86 -0.08 0.00 -1.44 0.00 0.00 39.64 39.46 3gza n ILE 148 CO 0.00 0.00 0.00 -0.09 -1.77 0.00 0.00 176.55 174.69 3gza h ARG 149 N 0.00 0.40 -4.97 6.28 2.43 -1.86 -3.42 114.38 113.25 3gza h ARG 149 Ca 0.00 -0.50 -0.57 0.00 -0.81 0.00 0.00 59.98 58.11 3gza h ARG 149 Cb 0.14 0.16 -0.33 0.00 -0.42 0.00 0.00 29.97 29.52 3gza h ARG 149 CO 0.00 1.17 -0.84 -1.58 -1.51 0.00 0.00 179.97 177.21 3gza s TRP 150 N -3.08 1.78 -0.29 2.20 0.52 -1.26 -0.58 118.94 118.23 3gza s TRP 150 Ca -0.06 -0.63 -0.01 0.00 0.02 0.00 0.00 56.10 55.42 3gza s TRP 150 Cb 0.08 -1.23 0.13 0.00 -1.15 0.00 0.00 33.47 31.30 3gza s TRP 150 CO 0.88 -0.27 0.27 1.21 0.02 0.00 0.00 176.95 179.06 3gza s ASN 151 N 0.39 2.01 0.24 2.95 3.84 -0.70 -4.27 114.94 119.40 3gza s ASN 151 Ca -0.12 -0.86 -0.04 0.00 0.21 0.00 0.00 52.86 52.05 3gza s ASN 151 Cb -0.15 0.36 0.26 0.00 -0.55 0.00 0.00 41.25 41.17 3gza s ASN 151 CO 0.04 -0.40 1.76 0.77 -2.79 0.00 0.00 177.10 176.48 3gza h SER 152 N 8.28 0.90 -0.12 -4.21 4.64 -1.33 -1.23 113.55 120.49 3gza h SER 152 Ca -0.14 -0.19 -0.01 0.00 -0.47 0.00 0.00 61.79 60.98 3gza h SER 152 Cb 1.06 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 3gza h SER 152 CO 0.35 0.90 0.05 0.25 -0.87 0.00 0.00 176.83 177.52 3gza h LEU 153 N 0.90 0.16 -0.66 5.97 5.85 -1.80 -3.19 115.31 122.53 3gza h LEU 153 Ca 0.19 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3gza h LEU 153 Cb 0.38 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.37 3gza h LEU 153 CO 0.01 0.25 -0.07 0.18 -0.34 0.00 0.00 178.44 178.47 3gza n LEU 154 N -4.92 1.10 -0.49 2.25 4.77 -1.19 -4.96 117.00 113.56 3gza n LEU 154 Ca -0.05 -0.33 -0.01 0.00 -0.03 0.00 0.00 56.01 55.58 3gza n LEU 154 Cb 0.10 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3gza n LEU 154 CO 0.34 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3gza n GLY 155 N 1.20 0.65 3.56 -0.72 0.00 -0.70 -4.88 105.19 104.31 3gza n GLY 155 Ca 0.18 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 3gza n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gza s ILE 156 N -2.65 4.34 -0.06 -0.61 -1.09 -0.55 -1.80 121.20 118.78 3gza s ILE 156 Ca 0.02 -0.19 -0.01 0.00 -2.23 0.00 0.00 60.65 58.25 3gza s ILE 156 Cb -0.01 -2.94 0.03 0.00 -1.58 0.00 0.00 42.46 37.96 3gza s ILE 156 CO 0.03 0.47 -0.02 -2.28 -1.23 0.00 0.00 174.94 171.91 3gza s HIS 157 N 0.43 0.73 -1.38 3.97 2.46 -0.16 -1.72 115.29 119.63 3gza s HIS 157 Ca -0.00 -0.21 -0.01 0.00 0.47 0.00 0.00 55.06 55.30 3gza s HIS 157 Cb -0.13 -0.78 0.01 0.00 -0.13 0.00 0.00 32.58 31.55 3gza s HIS 157 CO 0.02 -0.30 0.58 -1.71 -2.47 0.00 0.00 174.74 170.86 3gza n ASN 158 N 4.79 -1.00 0.00 9.88 5.15 -0.53 -1.47 115.26 132.07 3gza n ASN 158 Ca -0.13 -0.92 0.00 0.00 -0.60 0.00 0.00 54.58 52.93 3gza n ASN 158 Cb 0.50 -3.51 0.00 0.00 -0.53 0.00 0.00 39.78 36.24 3gza n ASN 158 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3gza n PHE 159 N -4.36 0.00 -4.09 1.20 3.72 0.26 -5.00 117.46 109.19 3gza n PHE 159 Ca -0.27 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 56.78 3gza n PHE 159 Cb 0.67 -0.19 -0.10 0.00 -0.94 0.00 0.00 39.48 38.92 3gza n PHE 159 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3gza s LYS 160 N 0.00 3.75 0.07 -1.08 1.02 -0.54 -4.84 119.74 118.12 3gza s LYS 160 Ca 0.00 -0.35 -0.31 0.00 0.02 0.00 0.00 55.97 55.33 3gza s LYS 160 Cb 0.00 -3.12 -0.07 0.00 -0.52 0.00 0.00 37.83 34.12 3gza s LYS 160 CO 0.00 0.39 1.40 0.00 -0.92 0.00 0.00 175.35 176.22 3gza s ALA 161 N 0.04 3.58 0.33 5.17 0.00 -1.26 -0.98 121.76 128.63 3gza s ALA 161 Ca 0.05 1.04 -0.27 0.00 0.00 0.00 0.00 51.96 52.77 3gza s ALA 161 Cb -0.12 -3.56 -0.09 0.00 0.00 0.00 0.00 23.12 19.35 3gza s ALA 161 CO 0.01 -0.72 1.12 -1.21 0.00 0.00 0.00 175.76 174.96 3gza s GLU 162 N 1.59 4.40 0.00 0.00 2.02 -0.74 -4.88 118.70 121.08 3gza s GLU 162 Ca 0.65 1.80 0.00 0.00 0.02 0.00 0.00 54.97 57.43 3gza s GLU 162 Cb -0.35 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 30.93 3gza s GLU 162 CO 0.29 -0.01 0.00 0.41 0.02 0.00 0.00 175.26 175.97 3gza n GLY 163 N 0.88 0.86 3.26 -1.39 0.00 -1.26 -4.86 105.19 102.68 3gza n GLY 163 Ca 0.01 -2.01 -0.14 0.00 0.00 0.00 0.00 46.02 43.88 3gza n GLY 163 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3gza s GLU 164 N -1.38 1.39 3.49 1.61 1.03 -1.26 -4.80 118.70 118.77 3gza s GLU 164 Ca 0.00 -1.70 0.00 0.00 0.03 0.00 0.00 54.97 53.30 3gza s GLU 164 Cb 0.00 0.31 0.00 0.00 -0.80 0.00 0.00 34.13 33.64 3gza s GLU 164 CO 0.00 -0.49 0.00 0.41 -1.33 0.00 0.00 175.26 173.85 3gza n GLY 165 N -0.37 0.66 0.37 -3.83 0.00 -1.26 -2.44 105.19 98.32 3gza n GLY 165 Ca 0.03 -0.77 -0.00 0.00 0.00 0.00 0.00 46.02 45.27 3gza n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gza h ALA 166 N -0.80 1.31 -0.32 4.61 0.00 -2.00 -1.37 119.26 120.69 3gza h ALA 166 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.93 3gza h ALA 166 Cb 0.00 -0.37 -0.07 0.00 0.00 0.00 0.00 17.79 17.35 3gza h ALA 166 CO 0.00 0.58 -0.14 0.35 0.00 0.00 0.00 179.25 180.04 3gza h PHE 167 N 1.29 -0.34 -0.32 0.00 3.57 -1.99 0.74 116.94 119.88 3gza h PHE 167 Ca 0.39 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.76 3gza h PHE 167 Cb -0.04 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 3gza h PHE 167 CO -0.00 -0.21 -0.44 0.00 -2.23 0.00 0.00 178.31 175.43 3gza h ALA 168 N 1.17 0.62 -0.21 2.41 0.00 -1.09 -0.11 119.26 122.06 3gza h ALA 168 Ca 0.16 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 3gza h ALA 168 Cb 0.33 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3gza h ALA 168 CO -0.38 0.67 0.11 0.00 0.00 0.00 0.00 179.25 179.66 3gza h ARG 169 N 0.66 0.29 -0.63 0.00 3.08 -0.90 0.90 114.38 117.79 3gza h ARG 169 Ca 0.04 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 3gza h ARG 169 Cb 1.01 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 3gza h ARG 169 CO 0.10 0.28 0.03 -0.91 -1.07 0.00 0.00 179.97 178.40 3gza h ASN 170 N 0.23 1.06 -0.22 7.04 2.35 -0.84 -1.91 115.58 123.28 3gza h ASN 170 Ca 0.07 -0.29 -0.13 0.00 -0.55 0.00 0.00 56.30 55.41 3gza h ASN 170 Cb 0.08 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 3gza h ASN 170 CO -0.01 1.09 -0.31 -0.09 -1.65 0.00 0.00 177.43 176.46 3gza h ARG 171 N 1.00 0.72 -0.74 0.81 2.43 -0.85 -1.23 114.38 116.52 3gza h ARG 171 Ca 0.18 -0.33 -0.06 0.00 -0.81 0.00 0.00 59.98 58.96 3gza h ARG 171 Cb 0.53 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 3gza h ARG 171 CO 0.03 0.94 0.22 0.37 -1.51 0.00 0.00 179.97 180.01 3gza h GLN 172 N 0.61 1.15 -0.51 0.20 5.75 -0.65 0.95 115.11 122.62 3gza h GLN 172 Ca 0.07 -0.25 -0.02 0.00 -0.15 0.00 0.00 58.65 58.29 3gza h GLN 172 Cb 0.83 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.19 3gza h GLN 172 CO 0.07 0.99 0.23 0.00 -2.65 0.00 0.00 178.83 177.47 3gza h ALA 173 N 1.11 0.66 -0.33 3.38 0.00 -1.05 -0.24 119.26 122.79 3gza h ALA 173 Ca 0.24 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3gza h ALA 173 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3gza h ALA 173 CO -0.01 0.23 0.15 2.35 0.00 0.00 0.00 179.25 181.98 3gza h TRP 174 N 0.68 0.49 -0.62 0.00 7.01 -0.92 -2.34 115.95 120.24 3gza h TRP 174 Ca 0.17 -0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.13 3gza h TRP 174 Cb 0.14 -0.15 -0.03 0.00 -2.10 0.00 0.00 29.16 27.03 3gza h TRP 174 CO -0.00 0.44 0.31 -0.92 -2.79 0.00 0.00 178.44 175.48 3gza h TYR 175 N 0.39 0.88 -0.59 2.65 3.20 -0.53 0.98 116.97 123.95 3gza h TYR 175 Ca 0.11 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.00 3gza h TYR 175 Cb 0.14 -0.27 -0.05 0.00 1.54 0.00 0.00 36.73 38.09 3gza h TYR 175 CO -0.01 0.65 0.31 0.87 -1.64 0.00 0.00 178.16 178.33 3gza h LYS 176 N 0.85 0.56 -0.62 1.82 1.57 -0.95 -0.09 116.57 119.71 3gza h LYS 176 Ca 0.21 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.89 3gza h LYS 176 Cb 0.09 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 3gza h LYS 176 CO -0.03 0.37 0.11 0.00 -0.57 0.00 0.00 179.45 179.32 3gza h ARG 177 N 0.57 1.00 -0.47 3.15 3.08 -0.84 -0.57 114.38 120.31 3gza h ARG 177 Ca 0.27 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 60.07 3gza h ARG 177 Cb 0.18 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 3gza h ARG 177 CO -0.18 0.92 0.31 1.25 -1.07 0.00 0.00 179.97 181.20 3gza h LEU 178 N 0.95 0.53 -0.49 3.04 5.85 -0.11 0.52 115.31 125.60 3gza h LEU 178 Ca 0.19 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 3gza h LEU 178 Cb 0.40 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 3gza h LEU 178 CO 0.01 0.38 0.12 0.00 -0.34 0.00 0.00 178.44 178.62 3gza h GLU 180 N 0.66 0.52 -1.40 0.00 5.08 -0.80 -0.04 114.58 118.61 3gza h GLU 180 Ca 0.15 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3gza h GLU 180 Cb 0.32 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3gza h GLU 180 CO 0.00 0.35 0.00 1.63 -1.00 0.00 0.00 179.01 179.99 3gza n LYS 181 N -4.88 0.33 0.00 2.33 5.02 0.15 -0.77 118.16 120.33 3gza n LYS 181 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 3gza n LYS 181 Cb 0.20 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 3gza n LYS 181 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3gza n VAL 183 N 0.74 0.00 -0.14 -0.18 0.31 -0.03 -1.38 118.33 117.65 3gza n VAL 183 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 3gza n VAL 183 Cb 0.15 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.07 3gza n VAL 183 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3gza h THR 184 N 0.00 1.20 -0.11 2.52 2.02 -1.19 -0.47 112.91 116.89 3gza h THR 184 Ca 0.00 -0.64 0.02 0.00 0.77 0.00 0.00 66.41 66.56 3gza h THR 184 Cb 0.00 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 3gza h THR 184 CO 0.00 0.23 -0.04 -0.33 0.37 0.00 0.00 175.52 175.75 3gza h GLU 185 N 0.53 -0.02 0.00 6.66 5.08 -1.49 -1.49 114.58 123.85 3gza h GLU 185 Ca 0.14 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 3gza h GLU 185 Cb 0.21 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3gza h GLU 185 CO -0.01 -0.02 -0.19 -0.07 -1.00 0.00 0.00 179.01 177.73 3gza h LEU 186 N -0.02 0.00 -0.27 1.33 3.38 -1.77 -1.86 115.31 116.10 3gza h LEU 186 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3gza h LEU 186 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3gza h LEU 186 CO -0.12 0.19 -0.37 0.00 0.09 0.00 0.00 178.44 178.22 3gza n THR 188 N -1.04 0.00 0.16 0.00 -2.24 -0.59 -4.64 114.28 105.92 3gza n THR 188 Ca 0.09 -0.10 0.04 0.00 -2.27 0.00 0.00 64.05 61.81 3gza n THR 188 Cb 0.34 0.55 0.07 0.00 -2.10 0.00 0.00 70.33 69.19 3gza n THR 188 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3gza n ARG 189 N -1.47 1.25 -0.56 -0.78 1.74 -0.73 -4.66 116.66 111.46 3gza n ARG 189 Ca -0.00 -1.36 0.05 0.00 -0.77 0.00 0.00 57.85 55.77 3gza n ARG 189 Cb 0.04 -1.18 0.09 0.00 -1.02 0.00 0.00 32.46 30.39 3gza n ARG 189 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3gza n TYR 190 N 0.39 0.00 -3.39 -1.55 4.01 -1.26 -5.07 117.16 110.29 3gza n TYR 190 Ca 0.06 -0.70 0.01 0.00 -0.16 0.00 0.00 57.90 57.12 3gza n TYR 190 Cb 0.28 -0.14 -0.00 0.00 -0.31 0.00 0.00 39.34 39.17 3gza n TYR 190 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3gza n GLY 191 N -0.59 -1.87 3.72 2.72 0.00 -1.26 -4.84 105.19 103.06 3gza n GLY 191 Ca 0.10 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 3gza n GLY 191 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gza s ASP 192 N -3.87 7.28 0.12 1.61 1.01 -1.26 -4.86 116.67 116.70 3gza s ASP 192 Ca 0.00 1.89 0.06 0.00 0.71 0.00 0.00 52.55 55.21 3gza s ASP 192 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 3gza s ASP 192 CO 0.00 -0.28 -0.01 -0.76 0.21 0.00 0.00 175.17 174.34 3gza s LEU 193 N 0.51 3.38 0.36 1.23 1.43 -1.26 -4.74 118.68 119.58 3gza s LEU 193 Ca 0.52 -0.27 0.19 0.00 -1.03 0.00 0.00 54.13 53.54 3gza s LEU 193 Cb -0.26 -2.09 0.42 0.00 0.03 0.00 0.00 46.19 44.30 3gza s LEU 193 CO 0.30 0.14 1.61 0.22 0.23 0.00 0.00 176.35 178.86 3gza h TYR 194 N 3.17 0.00 -3.26 0.29 3.20 -1.06 -3.36 116.97 115.95 3gza h TYR 194 Ca -0.48 0.00 -0.47 0.00 3.14 0.00 0.00 58.73 60.92 3gza h TYR 194 Cb 1.18 0.00 -0.37 0.00 1.54 0.00 0.00 36.73 39.08 3gza h TYR 194 CO 0.61 0.36 -0.78 -1.50 -1.64 0.00 0.00 178.16 175.20 3gza s ILE 196 N -3.27 0.70 -0.23 1.81 2.07 -0.29 -1.39 121.20 120.60 3gza s ILE 196 Ca 0.03 -0.10 -0.01 0.00 -1.41 0.00 0.00 60.65 59.16 3gza s ILE 196 Cb 0.08 -0.77 0.02 0.00 0.13 0.00 0.00 42.46 41.93 3gza s ILE 196 CO 0.70 0.30 -0.09 0.86 -1.91 0.00 0.00 174.94 174.80 3gza s TRP 197 N 1.67 3.01 -0.11 3.50 -0.11 -0.54 -1.39 118.94 124.97 3gza s TRP 197 Ca 0.02 -1.58 -0.13 0.00 1.22 0.00 0.00 56.10 55.63 3gza s TRP 197 Cb -0.13 -2.02 -0.05 0.00 -1.50 0.00 0.00 33.47 29.77 3gza s TRP 197 CO -0.05 -0.74 0.30 -0.06 -4.62 0.00 0.00 176.95 171.78 3gza s PHE 198 N 1.31 3.55 -0.30 5.86 0.08 0.35 -0.34 117.98 128.49 3gza s PHE 198 Ca 0.01 0.69 -0.28 0.00 0.12 0.00 0.00 56.93 57.47 3gza s PHE 198 Cb -0.16 -2.27 -0.06 0.00 -0.57 0.00 0.00 43.02 39.96 3gza s PHE 198 CO -0.06 0.41 2.28 -3.47 -0.10 0.00 0.00 175.22 174.28 3gza n ASP 199 N 2.90 2.94 -0.87 1.36 2.03 -0.85 -0.82 116.55 123.24 3gza n ASP 199 Ca -0.14 0.03 -0.11 0.00 0.52 0.00 0.00 54.79 55.09 3gza n ASP 199 Cb 0.52 -1.55 -0.05 0.00 -0.72 0.00 0.00 41.12 39.33 3gza n ASP 199 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3gza n GLY 200 N 5.89 1.24 4.53 0.27 0.00 -1.26 -4.48 105.19 111.38 3gza n GLY 200 Ca 0.33 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3gza n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gza n GLY 201 N -1.37 -2.18 0.48 -0.02 0.00 0.00 -4.61 105.19 97.49 3gza n GLY 201 Ca -0.11 -1.50 0.07 0.00 0.00 0.00 0.00 46.02 44.48 3gza n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gza n ALA 202 N -0.28 3.06 -0.80 4.61 0.00 0.47 -4.78 120.51 122.78 3gza n ALA 202 Ca 0.00 -2.87 0.00 0.00 0.00 0.00 0.00 53.44 50.57 3gza n ALA 202 Cb 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 18.99 3gza n ALA 202 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3gza n ASP 203 N -1.18 0.00 -4.01 0.00 2.03 -1.26 -3.97 116.55 108.15 3gza n ASP 203 Ca 0.20 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.20 3gza n ASP 203 Cb 0.74 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.98 3gza n ASP 203 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3gza s ASP 204 N -4.00 3.25 0.15 1.67 -1.08 -1.26 -1.14 116.67 114.26 3gza s ASP 204 Ca 0.00 -0.80 0.18 0.00 -0.52 0.00 0.00 52.55 51.41 3gza s ASP 204 Cb 0.00 -1.25 0.78 0.00 -1.46 0.00 0.00 42.92 40.99 3gza s ASP 204 CO 0.00 -0.11 1.55 -0.81 0.52 0.00 0.00 175.17 176.32 3gza n PRO 205 N 4.69 0.10 0.00 4.34 -0.04 -1.26 -0.99 135.00 141.85 3gza n PRO 205 Ca -0.16 0.39 0.13 0.00 -0.04 0.00 0.00 63.50 63.83 3gza n PRO 205 Cb 0.47 -1.72 0.44 0.00 -0.04 0.00 0.00 33.50 32.66 3gza n PRO 205 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3gza n ARG 206 N -1.91 1.23 0.00 0.54 1.74 -1.26 -4.74 116.66 112.26 3gza n ARG 206 Ca 0.02 -0.73 0.00 0.00 -0.77 0.00 0.00 57.85 56.37 3gza n ARG 206 Cb 0.16 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 3gza n ARG 206 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gza n ALA 207 N -0.25 0.00 0.23 7.54 0.00 -0.27 -5.01 120.51 122.74 3gza n ALA 207 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.71 3gza n ALA 207 Cb 0.35 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.99 3gza n ALA 207 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3gza h ASP 208 N 0.00 0.00 -4.03 0.00 3.32 -1.89 -3.47 116.42 110.36 3gza h ASP 208 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 3gza h ASP 208 Cb 0.00 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.56 3gza h ASP 208 CO 0.00 0.00 0.29 -0.83 -1.72 0.00 0.00 179.24 176.98 3gza s GLY 209 N -4.20 2.07 0.53 2.75 0.00 -0.16 -4.84 107.32 103.48 3gza s GLY 209 Ca 0.07 0.09 -0.17 0.00 0.00 0.00 0.00 44.72 44.71 3gza s GLY 209 CO 0.67 0.34 1.02 2.56 0.00 0.00 0.00 173.10 177.69 3gza s PRO 210 N -3.88 3.72 -1.20 2.90 0.04 -1.25 -4.00 135.00 131.32 3gza s PRO 210 Ca 0.57 1.14 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 3gza s PRO 210 Cb -0.10 -2.09 0.19 0.00 0.04 0.00 0.00 34.50 32.53 3gza s PRO 210 CO 0.29 -0.47 1.45 -3.47 0.04 0.00 0.00 177.00 174.83 3gza n ASP 211 N -1.52 5.28 0.01 6.66 2.03 -1.26 -4.51 116.55 123.23 3gza n ASP 211 Ca 0.08 -3.01 0.07 0.00 0.52 0.00 0.00 54.79 52.44 3gza n ASP 211 Cb 0.53 -1.53 -0.11 0.00 -0.72 0.00 0.00 41.12 39.29 3gza n ASP 211 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 3gza n VAL 212 N 4.12 0.53 -0.27 5.18 0.24 -1.26 -4.38 118.33 122.49 3gza n VAL 212 Ca 0.35 -0.59 -0.06 0.00 -2.04 0.00 0.00 64.34 62.00 3gza n VAL 212 Cb 0.41 -0.26 0.05 0.00 -1.47 0.00 0.00 33.84 32.58 3gza n VAL 212 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3gza h GLU 213 N 0.00 1.05 -0.01 7.34 4.81 -2.00 -1.58 114.58 124.19 3gza h GLU 213 Ca -0.10 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 58.93 3gza h GLU 213 Cb 1.26 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 3gza h GLU 213 CO 0.01 0.82 -0.21 -1.35 -0.73 0.00 0.00 179.01 177.56 3gza h PRO 214 N 1.02 0.02 -0.17 0.92 0.11 -1.99 0.81 132.00 132.72 3gza h PRO 214 Ca 0.25 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.31 3gza h PRO 214 Cb 0.12 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.22 3gza h PRO 214 CO -0.03 0.23 -0.06 0.82 -0.21 0.00 0.00 178.00 178.75 3gza h ILE 215 N 0.02 1.30 -0.60 4.15 2.04 -1.57 -1.47 117.51 121.38 3gza h ILE 215 Ca 0.00 -1.06 -0.09 0.00 1.00 0.00 0.00 64.86 64.71 3gza h ILE 215 Cb 0.38 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 3gza h ILE 215 CO 0.03 0.31 0.02 0.58 0.00 0.00 0.00 178.15 179.09 3gza h VAL 216 N 0.04 1.26 -0.55 1.67 2.07 -0.97 -1.49 116.25 118.28 3gza h VAL 216 Ca 0.04 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.36 3gza h VAL 216 Cb 0.51 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 3gza h VAL 216 CO 0.02 0.41 0.01 0.78 0.02 0.00 0.00 177.57 178.81 3gza h ASN 217 N 0.96 0.91 0.04 0.57 2.35 -0.77 0.20 115.58 119.84 3gza h ASN 217 Ca 0.17 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.69 3gza h ASN 217 Cb 0.53 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.66 3gza h ASN 217 CO 0.03 0.96 -0.02 0.50 -1.65 0.00 0.00 177.43 177.24 3gza h LYS 218 N 0.87 -0.06 0.00 0.81 3.64 -1.01 -3.25 116.57 117.57 3gza h LYS 218 Ca 0.16 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 3gza h LYS 218 Cb 0.50 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 3gza h LYS 218 CO 0.02 0.47 -1.23 0.66 -2.27 0.00 0.00 179.45 177.11 3gza n TYR 219 N -4.85 0.80 -3.08 1.91 4.01 -0.58 -4.52 117.16 110.84 3gza n TYR 219 Ca -0.09 0.24 -0.19 0.00 -0.16 0.00 0.00 57.90 57.70 3gza n TYR 219 Cb 0.28 -0.89 -0.02 0.00 -0.31 0.00 0.00 39.34 38.39 3gza n TYR 219 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3gza n GLN 220 N -2.62 1.40 0.32 -0.72 1.13 0.69 -4.92 117.38 112.66 3gza n GLN 220 Ca -0.02 -3.63 0.20 0.00 -1.94 0.00 0.00 57.00 51.61 3gza n GLN 220 Cb 0.59 -1.76 1.07 0.00 0.11 0.00 0.00 30.24 30.25 3gza n GLN 220 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 3gza h PRO 221 N 2.99 0.00 -0.49 -1.09 0.13 -1.58 -1.39 132.00 130.57 3gza h PRO 221 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3gza h PRO 221 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 3gza h PRO 221 CO 0.56 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.42 3gza n ASN 222 N -3.27 3.30 -4.76 1.44 3.02 -1.26 -4.98 115.26 108.75 3gza n ASN 222 Ca -0.02 -1.99 -0.39 0.00 -0.03 0.00 0.00 54.58 52.14 3gza n ASN 222 Cb 0.14 -0.32 -0.05 0.00 -0.61 0.00 0.00 39.78 38.94 3gza n ASN 222 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gza s LEU 224 N -0.33 4.36 -0.36 0.00 1.43 -0.48 -4.89 118.68 118.41 3gza s LEU 224 Ca 0.36 2.32 -0.13 0.00 -1.03 0.00 0.00 54.13 55.64 3gza s LEU 224 Cb -0.20 -3.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.43 3gza s LEU 224 CO 0.22 -0.68 0.25 0.12 0.23 0.00 0.00 176.35 176.49 3gza s PHE 225 N 1.33 3.23 -0.31 0.29 5.36 -1.26 -1.14 117.98 125.48 3gza s PHE 225 Ca 0.65 -0.43 -0.02 0.00 -0.96 0.00 0.00 56.93 56.17 3gza s PHE 225 Cb -0.37 -2.50 0.11 0.00 -0.34 0.00 0.00 43.02 39.93 3gza s PHE 225 CO 0.30 -0.47 0.14 -0.47 -1.46 0.00 0.00 175.22 173.26 3gza s TYR 226 N 1.68 0.78 0.06 10.12 5.04 -0.48 -0.90 117.35 133.65 3gza s TYR 226 Ca 0.05 -1.27 -0.28 0.00 -2.44 0.00 0.00 57.07 53.13 3gza s TYR 226 Cb -0.18 -1.14 0.09 0.00 0.35 0.00 0.00 41.96 41.09 3gza s TYR 226 CO 0.10 -0.84 1.12 -3.38 -1.34 0.00 0.00 175.55 171.21 3gza s HIS 227 N 1.74 -0.10 0.05 4.97 -3.43 -1.26 -0.50 115.29 116.76 3gza s HIS 227 Ca 0.11 -0.10 -0.00 0.00 -0.80 0.00 0.00 55.06 54.27 3gza s HIS 227 Cb -0.18 0.59 0.00 0.00 -1.43 0.00 0.00 32.58 31.56 3gza s HIS 227 CO -0.26 -0.54 0.07 0.27 -2.00 0.00 0.00 174.74 172.27 3gza n ASN 228 N -0.46 -0.18 0.30 7.38 6.94 -0.02 -0.40 115.26 128.82 3gza n ASN 228 Ca -0.07 -1.27 0.17 0.00 -0.02 0.00 0.00 54.58 53.38 3gza n ASN 228 Cb 0.62 0.35 0.93 0.00 -2.36 0.00 0.00 39.78 39.31 3gza n ASN 228 CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 3gza h ILE 229 N 1.14 0.36 0.00 1.53 2.10 -1.46 -2.92 117.51 118.26 3gza h ILE 229 Ca -0.04 -0.20 -0.25 0.00 1.08 0.00 0.00 64.86 65.46 3gza h ILE 229 Cb 0.17 1.14 -0.04 0.00 -1.09 0.00 0.00 36.82 36.99 3gza h ILE 229 CO 0.05 0.04 -1.75 0.47 -1.08 0.00 0.00 178.15 175.87 3gza n ASP 230 N -3.52 0.65 -3.67 2.19 8.00 -1.26 -4.83 116.55 114.11 3gza n ASP 230 Ca -0.02 0.30 -0.12 0.00 0.71 0.00 0.00 54.79 55.65 3gza n ASP 230 Cb 0.14 0.32 -0.08 0.00 -0.02 0.00 0.00 41.12 41.48 3gza n ASP 230 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3gza s ARG 231 N -2.74 0.67 -0.03 -1.24 3.52 -1.10 -4.58 118.95 113.44 3gza s ARG 231 Ca -0.05 0.89 -0.01 0.00 -0.13 0.00 0.00 55.73 56.42 3gza s ARG 231 Cb 0.08 0.27 0.03 0.00 -1.56 0.00 0.00 34.95 33.77 3gza s ARG 231 CO 0.83 -0.10 0.05 0.00 -0.81 0.00 0.00 175.30 175.26 3gza s ALA 232 N 0.63 0.17 -1.28 6.12 0.00 -0.69 -0.84 121.76 125.88 3gza s ALA 232 Ca -0.03 0.24 0.29 0.00 0.00 0.00 0.00 51.96 52.46 3gza s ALA 232 Cb -0.05 -0.46 1.25 0.00 0.00 0.00 0.00 23.12 23.86 3gza s ALA 232 CO -0.04 -0.33 1.90 -0.25 0.00 0.00 0.00 175.76 177.04 3gza n ASP 233 N 4.82 0.16 -3.85 0.00 8.00 -0.08 -4.56 116.55 121.05 3gza n ASP 233 Ca -0.14 -0.02 -0.07 0.00 0.71 0.00 0.00 54.79 55.27 3gza n ASP 233 Cb 0.50 -0.26 -0.02 0.00 -0.02 0.00 0.00 41.12 41.32 3gza n ASP 233 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3gza s PHE 234 N -2.75 -0.09 0.05 1.24 -0.12 -1.26 -4.22 117.98 110.82 3gza s PHE 234 Ca 0.22 -0.36 0.07 0.00 -0.05 0.00 0.00 56.93 56.81 3gza s PHE 234 Cb 0.19 0.64 -0.03 0.00 -0.63 0.00 0.00 43.02 43.19 3gza s PHE 234 CO 0.51 -1.22 -0.20 -0.98 -0.05 0.00 0.00 175.22 173.29 3gza s ARG 235 N -3.87 1.27 0.08 1.99 1.70 0.59 -4.84 118.95 115.86 3gza s ARG 235 Ca 0.13 -0.96 -0.31 0.00 -0.47 0.00 0.00 55.73 54.12 3gza s ARG 235 Cb -0.05 -1.39 -0.08 0.00 -0.57 0.00 0.00 34.95 32.86 3gza s ARG 235 CO 0.08 0.35 1.46 -0.46 -1.08 0.00 0.00 175.30 175.64 3gza s TRP 236 N -0.88 2.97 -0.99 5.89 -0.00 -1.26 -4.48 118.94 120.18 3gza s TRP 236 Ca 0.06 0.76 0.00 0.00 -0.00 0.00 0.00 56.10 56.93 3gza s TRP 236 Cb -0.09 -3.76 0.00 0.00 -0.00 0.00 0.00 33.47 29.62 3gza s TRP 236 CO 0.02 -2.79 0.36 0.41 -0.00 0.00 0.00 176.95 174.95 3gza n GLY 237 N 3.66 1.08 1.47 5.86 0.00 -1.26 -4.77 105.19 111.23 3gza n GLY 237 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3gza n GLY 237 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gza n GLY 238 N 0.14 0.90 3.69 -0.02 0.00 -1.26 -3.77 105.19 104.87 3gza n GLY 238 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3gza n GLY 238 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gza s SER 239 N -3.00 -0.35 -0.50 1.61 1.04 -1.26 -4.98 113.70 106.27 3gza s SER 239 Ca 0.00 -0.36 0.02 0.00 0.48 0.00 0.00 55.95 56.09 3gza s SER 239 Cb 0.00 0.64 0.47 0.00 0.10 0.00 0.00 66.02 67.22 3gza s SER 239 CO 0.00 -1.13 1.69 -0.62 0.98 0.00 0.00 173.24 174.16 3gza n GLU 240 N -0.42 2.96 0.00 4.02 1.02 -1.26 -4.40 120.64 122.56 3gza n GLU 240 Ca -0.08 -3.60 0.13 0.00 -0.02 0.00 0.00 57.16 53.59 3gza n GLU 240 Cb 0.61 -2.25 0.34 0.00 -0.02 0.00 0.00 31.44 30.12 3gza n GLU 240 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3gza n THR 241 N -0.86 0.00 -1.55 2.62 -2.24 -1.17 -4.30 114.28 106.78 3gza n THR 241 Ca 0.54 -0.14 -0.08 0.00 -2.27 0.00 0.00 64.05 62.11 3gza n THR 241 Cb 0.83 0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 69.51 3gza n THR 241 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gza n GLY 242 N 1.35 0.66 3.18 3.38 0.00 -0.09 -4.89 105.19 108.78 3gza n GLY 242 Ca 0.12 -0.64 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 3gza n GLY 242 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gza s THR 243 N -2.33 0.32 0.42 2.61 -4.23 -1.26 -4.37 115.64 106.80 3gza s THR 243 Ca 0.00 -1.93 0.04 0.00 -1.18 0.00 0.00 61.69 58.62 3gza s THR 243 Cb 0.00 -2.04 -0.05 0.00 1.34 0.00 0.00 72.50 71.75 3gza s THR 243 CO 0.00 -0.50 0.04 0.68 -0.54 0.00 0.00 174.62 174.30 3gza s VAL 244 N -3.90 1.33 0.77 2.29 -7.23 -0.66 -4.75 120.40 108.25 3gza s VAL 244 Ca 0.23 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.37 3gza s VAL 244 Cb 0.07 -2.58 0.16 0.00 0.56 0.00 0.00 36.38 34.59 3gza s VAL 244 CO 0.02 0.00 1.06 -0.62 -0.31 0.00 0.00 175.10 175.24 3gza n GLU 245 N -1.00 -0.31 -4.22 4.82 -0.58 -0.95 -4.83 120.64 113.57 3gza n GLU 245 Ca -0.09 -2.61 -0.19 0.00 -0.42 0.00 0.00 57.16 53.85 3gza n GLU 245 Cb 0.67 -0.78 -0.16 0.00 -0.57 0.00 0.00 31.44 30.60 3gza n GLU 245 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 3gza s TYR 246 N -3.23 0.71 0.77 -0.32 5.04 -1.26 -3.94 117.35 115.12 3gza s TYR 246 Ca 0.68 -0.17 -0.12 0.00 -2.44 0.00 0.00 57.07 55.02 3gza s TYR 246 Cb -0.03 -0.57 0.06 0.00 0.35 0.00 0.00 41.96 41.77 3gza s TYR 246 CO 0.45 -0.12 1.12 -1.25 -1.34 0.00 0.00 175.55 174.41 3gza s PRO 247 N 0.48 2.13 -0.21 4.97 0.04 -1.26 -5.09 135.00 136.06 3gza s PRO 247 Ca -0.06 1.34 -0.02 0.00 0.04 0.00 0.00 61.00 62.29 3gza s PRO 247 Cb -0.10 -1.87 0.06 0.00 0.04 0.00 0.00 34.50 32.63 3gza s PRO 247 CO 0.00 -1.76 0.03 0.00 0.04 0.00 0.00 177.00 175.31 3gza s TRP 249 N 1.81 3.40 -0.31 0.00 0.52 0.16 -4.77 118.94 119.75 3gza s TRP 249 Ca -0.01 0.08 0.23 0.00 0.02 0.00 0.00 56.10 56.42 3gza s TRP 249 Cb -0.17 -1.63 0.12 0.00 -1.15 0.00 0.00 33.47 30.64 3gza s TRP 249 CO -0.09 0.52 1.24 0.77 0.02 0.00 0.00 176.95 179.41 3gza h SER 250 N 2.19 0.00 -4.18 2.95 0.02 -1.88 -3.38 113.55 109.27 3gza h SER 250 Ca -0.48 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 59.99 3gza h SER 250 Cb 1.20 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.77 3gza h SER 250 CO 0.67 0.01 0.38 0.42 -1.14 0.00 0.00 176.83 177.17 3gza s THR 251 N -3.30 4.26 -0.05 -2.27 -4.23 -1.26 -1.03 115.64 107.76 3gza s THR 251 Ca 0.02 1.11 -0.19 0.00 -1.18 0.00 0.00 61.69 61.44 3gza s THR 251 Cb 0.08 -3.59 0.04 0.00 1.34 0.00 0.00 72.50 70.37 3gza s THR 251 CO 0.75 -0.59 0.44 0.12 -0.54 0.00 0.00 174.62 174.79 3gza s PHE 252 N -2.52 -0.37 -0.16 3.99 5.36 0.55 -1.03 117.98 123.81 3gza s PHE 252 Ca 0.61 0.67 0.29 0.00 -0.96 0.00 0.00 56.93 57.54 3gza s PHE 252 Cb -0.12 0.20 1.14 0.00 -0.34 0.00 0.00 43.02 43.89 3gza s PHE 252 CO 0.32 -0.43 1.86 -1.00 -1.46 0.00 0.00 175.22 174.51 3gza h PRO 253 N 3.88 0.00 -4.15 10.12 0.13 -1.86 -2.09 132.00 138.02 3gza h PRO 253 Ca -0.29 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.71 3gza h PRO 253 Cb 1.17 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.13 3gza h PRO 253 CO 0.37 0.00 -0.68 0.14 -0.23 0.00 0.00 178.00 177.60 3gza s VAL 254 N -3.50 0.19 -0.62 1.56 -7.23 -1.26 -4.68 120.40 104.86 3gza s VAL 254 Ca 0.03 -1.54 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 3gza s VAL 254 Cb 0.09 -1.16 0.00 0.00 0.56 0.00 0.00 36.38 35.87 3gza s VAL 254 CO 0.51 -0.85 0.67 -0.81 -0.31 0.00 0.00 175.10 174.32 3gza n PRO 255 N 0.53 0.98 -3.98 4.82 -0.04 -1.26 -4.79 135.00 131.26 3gza n PRO 255 Ca -0.17 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.18 3gza n PRO 255 Cb 0.59 -1.31 -0.03 0.00 -0.04 0.00 0.00 33.50 32.72 3gza n PRO 255 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gza n SER 257 N -1.04 2.82 -4.72 0.00 3.41 -1.26 -4.86 113.62 107.97 3gza n SER 257 Ca -0.02 -1.98 -0.42 0.00 -0.26 0.00 0.00 58.87 56.19 3gza n SER 257 Cb 0.61 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 3gza n SER 257 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3gza s HIS 258 N -1.00 3.34 0.58 7.33 5.04 -1.26 -4.92 115.29 124.40 3gza s HIS 258 Ca 0.21 1.17 0.27 0.00 -1.54 0.00 0.00 55.06 55.17 3gza s HIS 258 Cb 0.11 -3.54 1.68 0.00 0.04 0.00 0.00 32.58 30.87 3gza s HIS 258 CO 0.15 -1.76 2.21 1.12 -2.34 0.00 0.00 174.74 174.11 3gza h HIS 259 N 6.45 0.00 0.00 3.88 2.07 -1.96 -0.58 115.15 125.01 3gza h HIS 259 Ca -0.42 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.10 3gza h HIS 259 Cb 1.21 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.19 3gza h HIS 259 CO 0.65 0.00 0.00 1.63 -3.07 0.00 0.00 177.93 177.14 3gza n LYS 260 N -3.99 0.03 -0.05 5.12 5.02 -1.26 -3.69 118.16 119.34 3gza n LYS 260 Ca -0.02 0.08 -0.01 0.00 -2.02 0.00 0.00 58.31 56.34 3gza n LYS 260 Cb 0.13 -1.54 -0.13 0.00 -0.02 0.00 0.00 35.03 33.47 3gza n LYS 260 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3gza n ARG 261 N -1.58 0.98 -2.41 1.97 5.12 -0.25 -4.97 116.66 115.52 3gza n ARG 261 Ca 0.06 -0.07 -0.41 0.00 -1.93 0.00 0.00 57.85 55.50 3gza n ARG 261 Cb 0.31 -1.43 -0.04 0.00 -1.16 0.00 0.00 32.46 30.15 3gza n ARG 261 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3gza s ILE 262 N -2.75 3.53 0.24 0.55 1.01 -1.08 -4.95 121.20 117.76 3gza s ILE 262 Ca -0.08 1.38 -0.31 0.00 0.00 0.00 0.00 60.65 61.65 3gza s ILE 262 Cb 0.08 -3.88 -0.14 0.00 0.01 0.00 0.00 42.46 38.53 3gza s ILE 262 CO 0.71 0.27 1.33 1.21 0.00 0.00 0.00 174.94 178.45 3gza n GLU 263 N 1.93 1.85 0.25 2.79 0.00 -1.26 -4.86 120.64 121.34 3gza n GLU 263 Ca 0.02 0.66 0.17 0.00 0.00 0.00 0.00 57.16 58.01 3gza n GLU 263 Cb 0.45 -2.26 0.90 0.00 0.00 0.00 0.00 31.44 30.52 3gza n GLU 263 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3gza h SER 264 N 3.74 0.00 0.77 4.31 4.64 -1.92 -2.34 113.55 122.75 3gza h SER 264 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3gza h SER 264 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3gza h SER 264 CO 0.72 0.00 -0.35 -1.54 -0.87 0.00 0.00 176.83 174.79 3gza n SER 265 N -3.62 0.42 -4.76 4.97 3.41 -1.26 -4.90 113.62 107.88 3gza n SER 265 Ca -0.00 0.08 -0.39 0.00 -0.26 0.00 0.00 58.87 58.30 3gza n SER 265 Cb 0.26 -0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.12 3gza n SER 265 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3gza s ILE 266 N -3.04 3.57 -0.73 -1.33 -1.09 -0.88 -4.96 121.20 112.74 3gza s ILE 266 Ca 0.11 1.47 -0.27 0.00 -2.23 0.00 0.00 60.65 59.73 3gza s ILE 266 Cb 0.17 -3.89 0.03 0.00 -1.58 0.00 0.00 42.46 37.18 3gza s ILE 266 CO 0.65 0.27 1.32 -0.62 -1.23 0.00 0.00 174.94 175.33 3gza s ASP 267 N -1.08 6.11 0.23 3.58 -1.08 -1.26 -4.90 116.67 118.26 3gza s ASP 267 Ca 0.48 -0.38 -0.06 0.00 -0.52 0.00 0.00 52.55 52.07 3gza s ASP 267 Cb -0.29 -2.56 0.22 0.00 -1.46 0.00 0.00 42.92 38.83 3gza s ASP 267 CO 0.37 -1.86 1.75 1.56 0.52 0.00 0.00 175.17 177.51 3gza h GLN 268 N 10.34 1.03 -0.75 4.34 4.20 -1.93 -1.56 115.11 130.78 3gza h GLN 268 Ca -0.28 -0.24 -0.05 0.00 0.06 0.00 0.00 58.65 58.15 3gza h GLN 268 Cb 1.06 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.66 3gza h GLN 268 CO 1.27 0.91 0.27 -0.07 -0.67 0.00 0.00 178.83 180.55 3gza h LEU 269 N 0.98 1.06 -0.89 1.46 3.38 -1.97 -0.11 115.31 119.21 3gza h LEU 269 Ca 0.21 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3gza h LEU 269 Cb 0.35 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 3gza h LEU 269 CO 0.00 0.96 0.35 -0.33 0.09 0.00 0.00 178.44 179.51 3gza h GLU 270 N 1.11 1.15 -0.71 1.13 4.39 -1.86 -1.56 114.58 118.23 3gza h GLU 270 Ca 0.25 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.72 3gza h GLU 270 Cb 0.25 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.67 3gza h GLU 270 CO -0.02 0.91 0.26 1.25 -1.16 0.00 0.00 179.01 180.25 3gza h LEU 271 N 1.14 1.00 -0.72 1.33 5.85 -0.75 -1.83 115.31 121.32 3gza h LEU 271 Ca 0.27 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 3gza h LEU 271 Cb 0.16 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 3gza h LEU 271 CO -0.03 0.92 0.26 -0.07 -0.34 0.00 0.00 178.44 179.18 3gza h LEU 272 N 1.02 1.02 -1.01 2.25 3.38 -0.61 0.33 115.31 121.70 3gza h LEU 272 Ca 0.23 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 3gza h LEU 272 Cb 0.25 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3gza h LEU 272 CO -0.01 0.94 -0.46 0.11 0.09 0.00 0.00 178.44 179.10 3gza h LYS 273 N 1.05 0.00 0.00 1.13 1.57 -1.12 -3.37 116.57 115.83 3gza h LYS 273 Ca 0.24 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.99 3gza h LYS 273 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 3gza h LYS 273 CO -0.01 0.46 -1.18 0.72 -0.57 0.00 0.00 179.45 178.86 3gza n HIS 274 N -3.82 0.00 -4.32 -1.35 8.25 -0.70 -2.25 115.22 111.02 3gza n HIS 274 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3gza n HIS 274 Cb 0.51 -0.12 -0.00 0.00 1.12 0.00 0.00 29.99 31.50 3gza n HIS 274 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gza n GLY 275 N 2.61 -1.67 2.65 -1.41 0.00 0.11 -0.67 105.19 106.81 3gza n GLY 275 Ca -0.03 -1.27 -0.27 0.00 0.00 0.00 0.00 46.02 44.45 3gza n GLY 275 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gza s ASP 276 N -4.00 2.84 0.59 1.61 -1.08 -0.19 -4.82 116.67 111.63 3gza s ASP 276 Ca 0.00 -0.86 0.29 0.00 -0.52 0.00 0.00 52.55 51.46 3gza s ASP 276 Cb 0.00 -0.42 1.61 0.00 -1.46 0.00 0.00 42.92 42.64 3gza s ASP 276 CO 0.00 -0.35 2.03 0.07 0.52 0.00 0.00 175.17 177.44 3gza h LYS 277 N 8.33 0.00 -0.16 4.34 2.10 -1.88 -0.20 116.57 129.10 3gza h LYS 277 Ca -0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.49 3gza h LYS 277 Cb 1.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.44 3gza h LYS 277 CO 0.34 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.88 3gza n ASN 278 N -3.74 2.80 -4.76 7.07 3.02 -1.26 -4.96 115.26 113.43 3gza n ASN 278 Ca 0.03 -1.90 -0.38 0.00 -0.03 0.00 0.00 54.58 52.30 3gza n ASN 278 Cb 0.43 -0.10 0.01 0.00 -0.61 0.00 0.00 39.78 39.51 3gza n ASN 278 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3gza s GLY 279 N -1.78 2.86 0.00 7.41 0.00 -0.09 -4.94 107.32 110.78 3gza s GLY 279 Ca 0.33 1.16 0.25 0.00 0.00 0.00 0.00 44.72 46.46 3gza s GLY 279 CO 0.31 1.68 1.38 0.54 0.00 0.00 0.00 173.10 177.01 3gza n ARG 280 N -0.43 0.04 -4.25 2.90 1.74 -1.08 -4.27 116.66 111.30 3gza n ARG 280 Ca 0.07 -0.02 -0.33 0.00 -0.77 0.00 0.00 57.85 56.80 3gza n ARG 280 Cb 0.46 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.31 3gza n ARG 280 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3gza s TYR 281 N -2.98 3.11 -0.60 -1.55 2.02 -0.81 -4.75 117.35 111.79 3gza s TYR 281 Ca 0.11 0.10 -0.18 0.00 -0.37 0.00 0.00 57.07 56.73 3gza s TYR 281 Cb 0.17 -1.68 0.12 0.00 -0.40 0.00 0.00 41.96 40.17 3gza s TYR 281 CO 0.70 0.48 0.67 -0.46 -1.57 0.00 0.00 175.55 175.37 3gza s TRP 282 N -1.11 3.09 -0.51 2.71 -0.11 -1.26 -0.33 118.94 121.42 3gza s TRP 282 Ca 0.20 -1.09 0.06 0.00 1.22 0.00 0.00 56.10 56.49 3gza s TRP 282 Cb -0.12 -3.97 0.21 0.00 -1.50 0.00 0.00 33.47 28.10 3gza s TRP 282 CO 0.11 -1.23 0.52 0.28 -4.62 0.00 0.00 176.95 172.01 3gza n VAL 283 N 5.41 0.31 -1.24 5.86 0.31 -0.19 -4.82 118.33 123.97 3gza n VAL 283 Ca -0.09 -4.30 -0.31 0.00 -0.01 0.00 0.00 64.34 59.64 3gza n VAL 283 Cb 0.42 -1.95 0.09 0.00 -0.91 0.00 0.00 33.84 31.49 3gza n VAL 283 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3gza s PRO 284 N -1.21 2.20 0.43 5.55 0.04 -1.17 -4.18 135.00 136.67 3gza s PRO 284 Ca 0.34 1.19 -0.07 0.00 0.04 0.00 0.00 61.00 62.49 3gza s PRO 284 Cb 0.09 -1.89 0.10 0.00 0.04 0.00 0.00 34.50 32.84 3gza s PRO 284 CO -0.12 -1.69 0.46 0.00 0.04 0.00 0.00 177.00 175.69 3gza n ALA 285 N -3.55 -1.00 -3.59 8.56 0.00 -1.26 -0.30 120.51 119.37 3gza n ALA 285 Ca 0.09 -0.64 -0.11 0.00 0.00 0.00 0.00 53.44 52.78 3gza n ALA 285 Cb 0.53 -0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.88 3gza n ALA 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gza s ALA 287 N -3.43 -1.92 0.06 0.00 0.00 -0.26 -2.47 121.76 113.75 3gza s ALA 287 Ca 0.28 1.65 -0.13 0.00 0.00 0.00 0.00 51.96 53.76 3gza s ALA 287 Cb -0.02 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.28 3gza s ALA 287 CO 0.21 -0.30 0.30 0.16 0.00 0.00 0.00 175.76 176.13 3gza s ASP 288 N -0.68 -0.11 -0.21 0.00 -4.77 -1.26 -0.42 116.67 109.23 3gza s ASP 288 Ca -0.02 -0.27 -0.27 0.00 -3.30 0.00 0.00 52.55 48.69 3gza s ASP 288 Cb -0.02 0.37 0.10 0.00 -1.09 0.00 0.00 42.92 42.29 3gza s ASP 288 CO 0.00 -0.66 0.90 0.28 0.70 0.00 0.00 175.17 176.39 3gza s THR 289 N -2.90 0.00 0.54 2.11 -1.32 -0.85 -0.91 115.64 112.31 3gza s THR 289 Ca -0.03 0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.25 3gza s THR 289 Cb 0.00 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.94 3gza s THR 289 CO -0.06 0.00 1.21 -2.16 -2.21 0.00 0.00 174.62 171.40 3gza s PRO 290 N -0.34 3.27 0.25 7.08 0.04 -1.26 -0.42 135.00 143.62 3gza s PRO 290 Ca -0.01 1.85 -0.02 0.00 0.04 0.00 0.00 61.00 62.85 3gza s PRO 290 Cb -0.03 -2.12 0.30 0.00 0.04 0.00 0.00 34.50 32.69 3gza s PRO 290 CO 0.00 -0.97 1.72 1.25 0.04 0.00 0.00 177.00 179.04 3gza h LEU 291 N 1.34 0.73 -6.49 -3.56 5.85 -1.34 -3.35 115.31 108.50 3gza h LEU 291 Ca -0.50 -0.21 -0.74 0.00 0.84 0.00 0.00 57.88 57.27 3gza h LEU 291 Cb 1.28 -0.20 -0.13 0.00 0.37 0.00 0.00 40.66 41.98 3gza h LEU 291 CO 0.57 0.86 2.22 0.54 -0.34 0.00 0.00 178.44 182.29 3gza n ARG 292 N -4.17 3.42 -0.02 1.25 1.74 -1.26 -0.90 116.66 116.72 3gza n ARG 292 Ca 0.01 -3.34 0.01 0.00 -0.77 0.00 0.00 57.85 53.76 3gza n ARG 292 Cb 0.35 -3.03 0.02 0.00 -1.02 0.00 0.00 32.46 28.78 3gza n ARG 292 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gza n GLY 293 N 3.26 2.20 3.95 -0.13 0.00 -0.96 -0.74 105.19 112.77 3gza n GLY 293 Ca 0.42 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 46.08 3gza n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gza s ALA 294 N -1.03 3.70 -1.70 4.61 0.00 -0.39 -4.40 121.76 122.55 3gza s ALA 294 Ca 0.04 -1.03 -0.01 0.00 0.00 0.00 0.00 51.96 50.95 3gza s ALA 294 Cb 0.03 -2.21 0.00 0.00 0.00 0.00 0.00 23.12 20.95 3gza s ALA 294 CO 0.00 -0.49 0.16 0.09 0.00 0.00 0.00 175.76 175.52 3gza n ASN 295 N -2.19 -5.87 0.00 0.00 3.02 -1.26 -1.71 115.26 107.25 3gza n ASN 295 Ca 0.03 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 3gza n ASN 295 Cb 0.58 -4.85 0.00 0.00 -0.61 0.00 0.00 39.78 34.90 3gza n ASN 295 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gza n GLY 296 N -1.13 0.74 3.98 7.41 0.00 -1.26 -5.06 105.19 109.87 3gza n GLY 296 Ca -0.21 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.61 3gza n GLY 296 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gza s ARG 297 N -0.52 2.92 -0.47 1.61 1.81 -0.69 -5.08 118.95 118.52 3gza s ARG 297 Ca 0.00 -0.90 0.04 0.00 -1.72 0.00 0.00 55.73 53.15 3gza s ARG 297 Cb 0.00 -2.68 0.21 0.00 -0.45 0.00 0.00 34.95 32.03 3gza s ARG 297 CO 0.00 -0.25 0.85 1.58 -0.68 0.00 0.00 175.30 176.79 3gza n HIS 298 N -1.93 -3.07 -3.91 -0.53 -0.00 -1.21 -3.98 115.22 100.60 3gza n HIS 298 Ca 0.04 -1.27 -0.35 0.00 -0.00 0.00 0.00 57.72 56.13 3gza n HIS 298 Cb 0.59 1.42 -0.14 0.00 -0.00 0.00 0.00 29.99 31.85 3gza n HIS 298 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3gza s GLU 299 N 0.82 2.82 0.34 1.57 0.41 0.09 -4.95 118.70 119.80 3gza s GLU 299 Ca 0.29 -1.00 0.20 0.00 -0.41 0.00 0.00 54.97 54.05 3gza s GLU 299 Cb 0.07 -3.10 0.19 0.00 -1.78 0.00 0.00 34.13 29.51 3gza s GLU 299 CO -0.10 -0.45 1.46 -1.49 -0.49 0.00 0.00 175.26 174.20 3gza h TRP 300 N 8.06 0.00 -2.93 1.61 4.06 -1.92 -3.39 115.95 121.44 3gza h TRP 300 Ca -0.30 0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.03 3gza h TRP 300 Cb 1.10 0.00 -0.12 0.00 -1.00 0.00 0.00 29.16 29.14 3gza h TRP 300 CO 0.59 0.22 -0.69 -0.06 -3.56 0.00 0.00 178.44 174.94 3gza s PHE 301 N -3.12 2.75 0.21 0.49 0.08 -1.26 -4.31 117.98 112.83 3gza s PHE 301 Ca 0.05 -0.17 -0.30 0.00 0.12 0.00 0.00 56.93 56.62 3gza s PHE 301 Cb 0.06 -1.34 -0.09 0.00 -0.57 0.00 0.00 43.02 41.08 3gza s PHE 301 CO 0.71 0.52 1.40 -0.46 -0.10 0.00 0.00 175.22 177.29 3gza s TRP 302 N -1.72 3.13 0.04 0.36 -0.00 -1.26 -4.99 118.94 114.50 3gza s TRP 302 Ca 0.26 1.05 -0.03 0.00 -0.00 0.00 0.00 56.10 57.38 3gza s TRP 302 Cb -0.09 -3.74 -0.02 0.00 -0.00 0.00 0.00 33.47 29.62 3gza s TRP 302 CO 0.17 -2.42 0.04 -1.21 -0.00 0.00 0.00 176.95 173.53 3gza s GLU 303 N 0.01 0.54 0.61 5.86 2.02 -1.26 -4.69 118.70 121.79 3gza s GLU 303 Ca 0.60 -0.86 -0.18 0.00 0.02 0.00 0.00 54.97 54.55 3gza s GLU 303 Cb -0.40 0.20 -0.03 0.00 0.10 0.00 0.00 34.13 34.01 3gza s GLU 303 CO 0.39 -0.12 1.21 -2.14 0.02 0.00 0.00 175.26 174.62 3gza s PRO 304 N -2.76 2.87 -1.63 0.39 0.02 -1.26 -3.72 135.00 128.91 3gza s PRO 304 Ca -0.04 1.83 -0.02 0.00 0.02 0.00 0.00 61.00 62.80 3gza s PRO 304 Cb -0.00 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.60 3gza s PRO 304 CO -0.05 -1.29 0.21 -0.25 -0.33 0.00 0.00 177.00 175.29 3gza n ASP 305 N -1.72 -5.80 -0.87 2.53 8.00 -1.26 -4.90 116.55 112.53 3gza n ASP 305 Ca 0.14 -0.11 0.07 0.00 0.71 0.00 0.00 54.79 55.60 3gza n ASP 305 Cb 0.50 -4.75 0.21 0.00 -0.02 0.00 0.00 41.12 37.05 3gza n ASP 305 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3gza n ASP 306 N -2.00 3.36 -0.21 -2.24 8.00 -1.24 -4.66 116.55 117.56 3gza n ASP 306 Ca -0.19 -2.15 0.11 0.00 0.71 0.00 0.00 54.79 53.27 3gza n ASP 306 Cb 0.66 -0.34 0.41 0.00 -0.02 0.00 0.00 41.12 41.83 3gza n ASP 306 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3gza h GLU 307 N 2.56 0.61 -0.56 -1.24 3.07 -1.90 -1.10 114.58 116.02 3gza h GLU 307 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3gza h GLU 307 Cb 0.91 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 3gza h GLU 307 CO 0.04 0.41 0.00 0.09 -1.40 0.00 0.00 179.01 178.15 3gza n ASN 308 N -4.51 3.00 -1.17 1.42 3.02 -1.26 -4.07 115.26 111.68 3gza n ASN 308 Ca 0.14 -2.00 0.09 0.00 -0.03 0.00 0.00 54.58 52.78 3gza n ASN 308 Cb 0.40 -0.37 0.28 0.00 -0.61 0.00 0.00 39.78 39.48 3gza n ASN 308 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3gza n ASN 309 N 1.14 3.85 -4.77 6.41 3.02 -0.41 -4.93 115.26 119.57 3gza n ASN 309 Ca 0.19 -2.17 -0.40 0.00 -0.03 0.00 0.00 54.58 52.17 3gza n ASN 309 Cb 0.47 -0.44 -0.02 0.00 -0.61 0.00 0.00 39.78 39.18 3gza n ASN 309 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3gza s ILE 310 N -1.31 2.95 0.31 2.41 -4.36 -1.26 -1.27 121.20 118.67 3gza s ILE 310 Ca 0.42 0.91 -0.29 0.00 -0.26 0.00 0.00 60.65 61.42 3gza s ILE 310 Cb 0.24 -3.56 -0.11 0.00 1.25 0.00 0.00 42.46 40.28 3gza s ILE 310 CO 0.25 0.18 1.53 -0.31 0.24 0.00 0.00 174.94 176.83 3gza s TYR 311 N -1.22 2.76 0.74 1.37 2.02 -0.07 -4.60 117.35 118.34 3gza s TYR 311 Ca 0.51 0.95 -0.15 0.00 -0.37 0.00 0.00 57.07 58.01 3gza s TYR 311 Cb -0.36 -4.00 0.02 0.00 -0.40 0.00 0.00 41.96 37.22 3gza s TYR 311 CO 0.47 -3.22 1.01 -2.30 -1.57 0.00 0.00 175.55 169.94 3gza n PRO 312 N 1.65 0.46 -0.35 -1.71 -0.02 -1.26 -4.81 135.00 128.95 3gza n PRO 312 Ca 0.06 0.22 0.04 0.00 -2.02 0.00 0.00 63.50 61.79 3gza n PRO 312 Cb 0.38 -2.27 0.19 0.00 -0.02 0.00 0.00 33.50 31.79 3gza n PRO 312 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3gza h LEU 313 N -0.37 0.94 -0.79 2.45 5.85 -1.93 -1.58 115.31 119.88 3gza h LEU 313 Ca -0.47 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.24 3gza h LEU 313 Cb 1.33 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 3gza h LEU 313 CO 0.47 0.56 0.34 0.78 -0.34 0.00 0.00 178.44 180.24 3gza h ASN 314 N 1.05 1.08 -0.53 1.25 2.35 -2.02 -2.49 115.58 116.27 3gza h ASN 314 Ca 0.45 -0.16 -0.07 0.00 -0.55 0.00 0.00 56.30 55.97 3gza h ASN 314 Cb 0.31 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 3gza h ASN 314 CO -0.22 0.94 0.06 0.74 -1.65 0.00 0.00 177.43 177.31 3gza h THR 315 N 1.14 1.26 0.00 2.81 2.02 -1.78 -1.95 112.91 116.42 3gza h THR 315 Ca 0.27 -1.00 0.00 0.00 0.77 0.00 0.00 66.41 66.45 3gza h THR 315 Cb 0.18 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 3gza h THR 315 CO -0.03 0.36 0.00 0.18 0.37 0.00 0.00 175.52 176.40 3gza n LEU 316 N -4.35 0.08 0.00 2.58 4.77 -0.65 -1.23 117.00 118.19 3gza n LEU 316 Ca 0.02 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3gza n LEU 316 Cb 0.28 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 3gza n LEU 316 CO 0.42 0.01 0.00 -0.67 -1.33 0.00 0.00 177.39 175.82 3gza n ASP 318 N 0.83 0.00 -0.13 -1.43 2.03 -0.73 -0.76 116.55 116.36 3gza n ASP 318 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 3gza n ASP 318 Cb 0.01 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.40 3gza n ASP 318 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 3gza h LYS 319 N 0.00 0.64 -0.47 -0.67 1.57 -1.45 -2.05 116.57 114.15 3gza h LYS 319 Ca 0.00 -0.17 0.09 0.00 -1.87 0.00 0.00 60.65 58.69 3gza h LYS 319 Cb 0.00 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.16 3gza h LYS 319 CO 0.00 0.70 0.04 -0.92 -0.57 0.00 0.00 179.45 178.70 3gza h TYR 320 N 0.49 0.05 0.00 -1.35 3.20 -1.19 -1.31 116.97 116.86 3gza h TYR 320 Ca 0.12 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 3gza h TYR 320 Cb 0.37 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 3gza h TYR 320 CO 0.03 -0.06 -0.21 0.93 -1.64 0.00 0.00 178.16 177.21 3gza h GLU 321 N 0.16 0.00 -0.65 1.82 5.08 -1.77 -1.25 114.58 117.98 3gza h GLU 321 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3gza h GLU 321 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3gza h GLU 321 CO -0.35 0.21 0.00 1.63 -1.00 0.00 0.00 179.01 179.49 3gza n LYS 322 N -3.65 3.95 0.00 2.33 5.02 -0.69 -3.20 118.16 121.92 3gza n LYS 322 Ca -0.01 -2.95 0.00 0.00 -2.02 0.00 0.00 58.31 53.32 3gza n LYS 322 Cb 0.33 -1.97 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 3gza n LYS 322 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3gza n SER 323 N 1.06 0.00 -0.28 4.39 3.41 -0.58 -1.65 113.62 119.97 3gza n SER 323 Ca 0.26 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.98 3gza n SER 323 Cb 0.95 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 65.25 3gza n SER 323 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3gza h VAL 324 N 0.00 0.87 -0.00 -3.33 2.07 -0.89 0.91 116.25 115.88 3gza h VAL 324 Ca 0.00 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3gza h VAL 324 Cb 0.00 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.81 3gza h VAL 324 CO 0.00 0.14 0.00 0.61 0.02 0.00 0.00 177.57 178.34 3gza n GLY 325 N -1.42 -0.95 0.93 2.17 0.00 -0.96 -3.12 105.19 101.84 3gza n GLY 325 Ca 0.17 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.03 3gza n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gza n ARG 326 N -0.91 1.33 -3.02 1.61 1.74 0.22 -1.39 116.66 116.25 3gza n ARG 326 Ca 0.22 -3.05 -0.19 0.00 -0.77 0.00 0.00 57.85 54.06 3gza n ARG 326 Cb 0.11 -1.28 0.04 0.00 -1.02 0.00 0.00 32.46 30.32 3gza n ARG 326 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3gza n ASN 327 N -0.71 -5.36 -4.07 0.55 5.15 -0.90 -4.57 115.26 105.34 3gza n ASN 327 Ca 0.17 -0.29 -0.21 0.00 -0.60 0.00 0.00 54.58 53.65 3gza n ASN 327 Cb 0.82 -4.14 -0.15 0.00 -0.53 0.00 0.00 39.78 35.77 3gza n ASN 327 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gza s ALA 328 N -3.11 1.01 0.06 5.20 0.00 -0.63 -4.46 121.76 119.83 3gza s ALA 328 Ca 0.31 -0.51 -0.28 0.00 0.00 0.00 0.00 51.96 51.47 3gza s ALA 328 Cb -0.14 -0.27 -0.05 0.00 0.00 0.00 0.00 23.12 22.66 3gza s ALA 328 CO 0.38 0.24 0.90 0.99 0.00 0.00 0.00 175.76 178.28 3gza s THR 329 N -0.24 4.66 -0.18 0.00 2.01 -1.03 -2.43 115.64 118.43 3gza s THR 329 Ca 0.04 1.93 -0.08 0.00 0.31 0.00 0.00 61.69 63.88 3gza s THR 329 Cb -0.05 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.16 3gza s THR 329 CO -0.00 0.29 0.10 -0.22 -0.69 0.00 0.00 174.62 174.10 3gza s LEU 330 N 0.23 4.08 -0.20 4.42 2.96 -0.24 -1.10 118.68 128.83 3gza s LEU 330 Ca 0.45 0.21 -0.03 0.00 -0.22 0.00 0.00 54.13 54.55 3gza s LEU 330 Cb -0.22 -2.04 -0.00 0.00 0.50 0.00 0.00 46.19 44.43 3gza s LEU 330 CO 0.27 0.22 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.81 3gza s ILE 331 N 0.13 3.09 -0.10 6.68 1.01 0.43 -0.64 121.20 131.81 3gza s ILE 331 Ca 0.07 -0.59 -0.15 0.00 0.00 0.00 0.00 60.65 59.98 3gza s ILE 331 Cb -0.12 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 3gza s ILE 331 CO -0.00 0.45 0.38 -0.76 0.00 0.00 0.00 174.94 175.01 3gza s LEU 332 N 1.34 4.33 -0.40 2.97 1.43 -0.13 -2.01 118.68 126.22 3gza s LEU 332 Ca 0.04 0.75 -0.22 0.00 -1.03 0.00 0.00 54.13 53.67 3gza s LEU 332 Cb -0.14 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.56 3gza s LEU 332 CO -0.04 0.15 0.70 -0.83 0.23 0.00 0.00 176.35 176.55 3gza s GLY 333 N -0.00 1.69 0.17 -3.19 0.00 0.43 -0.85 107.32 105.57 3gza s GLY 333 Ca 0.22 -0.92 0.06 0.00 0.00 0.00 0.00 44.72 44.08 3gza s GLY 333 CO 0.09 1.62 0.08 1.08 0.00 0.00 0.00 173.10 175.97 3gza s LEU 334 N 2.94 3.62 -0.39 0.66 1.43 0.46 -1.02 118.68 126.38 3gza s LEU 334 Ca 0.27 -0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 3gza s LEU 334 Cb -0.14 -2.24 0.13 0.00 0.03 0.00 0.00 46.19 43.97 3gza s LEU 334 CO 0.18 0.07 0.19 0.42 0.23 0.00 0.00 176.35 177.45 3gza s THR 335 N -1.76 1.15 0.50 5.49 -4.23 -1.26 -3.04 115.64 112.49 3gza s THR 335 Ca 0.30 -2.16 -0.23 0.00 -1.18 0.00 0.00 61.69 58.42 3gza s THR 335 Cb -0.10 -1.82 -0.06 0.00 1.34 0.00 0.00 72.50 71.86 3gza s THR 335 CO 0.22 -0.84 1.28 -2.84 -0.54 0.00 0.00 174.62 171.90 3gza s PRO 336 N 0.77 3.46 0.70 3.99 0.02 -1.26 -4.47 135.00 138.21 3gza s PRO 336 Ca 0.15 2.07 0.01 0.00 0.02 0.00 0.00 61.00 63.25 3gza s PRO 336 Cb -0.22 -2.37 0.13 0.00 0.02 0.00 0.00 34.50 32.05 3gza s PRO 336 CO -0.06 -0.88 0.97 0.16 -0.33 0.00 0.00 177.00 176.86 3gza s ASP 337 N -1.07 4.42 0.00 2.53 1.47 0.07 -4.43 116.67 119.66 3gza s ASP 337 Ca 0.67 -0.48 0.13 0.00 1.18 0.00 0.00 52.55 54.05 3gza s ASP 337 Cb -0.36 0.10 0.62 0.00 -0.34 0.00 0.00 42.92 42.94 3gza s ASP 337 CO 0.43 -1.81 1.39 -2.65 0.68 0.00 0.00 175.17 173.21 3gza n PRO 338 N -2.76 0.10 0.06 2.11 -0.02 -1.26 -1.18 135.00 132.06 3gza n PRO 338 Ca 0.16 0.21 0.12 0.00 -2.02 0.00 0.00 63.50 61.97 3gza n PRO 338 Cb 0.61 -1.50 0.19 0.00 -0.02 0.00 0.00 33.50 32.78 3gza n PRO 338 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3gza n THR 339 N -1.39 0.36 -0.30 3.45 -2.24 -1.26 -3.97 114.28 108.93 3gza n THR 339 Ca 0.05 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 3gza n THR 339 Cb 0.13 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 3gza n THR 339 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gza n GLY 340 N 1.34 1.30 3.20 3.38 0.00 -0.32 -0.48 105.19 113.61 3gza n GLY 340 Ca 0.04 -0.20 -0.17 0.00 0.00 0.00 0.00 46.02 45.69 3gza n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gza s LEU 341 N 0.00 2.38 0.01 0.99 1.43 -1.26 -2.24 118.68 119.99 3gza s LEU 341 Ca 0.00 -0.77 -0.30 0.00 -1.03 0.00 0.00 54.13 52.03 3gza s LEU 341 Cb 0.00 -0.44 -0.05 0.00 0.03 0.00 0.00 46.19 45.73 3gza s LEU 341 CO 0.00 -0.18 1.27 -0.63 0.23 0.00 0.00 176.35 177.04 3gza s ILE 342 N -2.08 3.96 0.53 -0.59 -1.09 -1.26 -0.75 121.20 119.91 3gza s ILE 342 Ca 0.05 1.35 -0.21 0.00 -2.23 0.00 0.00 60.65 59.61 3gza s ILE 342 Cb -0.05 -3.87 -0.07 0.00 -1.58 0.00 0.00 42.46 36.89 3gza s ILE 342 CO 0.02 0.04 1.11 -2.65 -1.23 0.00 0.00 174.94 172.22 3gza n PRO 343 N 4.78 1.32 -0.26 2.79 -0.02 -1.26 -4.74 135.00 137.61 3gza n PRO 343 Ca 0.11 0.49 0.03 0.00 -2.02 0.00 0.00 63.50 62.11 3gza n PRO 343 Cb 0.45 -2.26 0.16 0.00 -0.02 0.00 0.00 33.50 31.83 3gza n PRO 343 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gza h ALA 344 N 1.14 1.07 -0.65 3.55 0.00 -1.99 -1.53 119.26 120.85 3gza h ALA 344 Ca -0.48 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 3gza h ALA 344 Cb 1.34 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 3gza h ALA 344 CO 0.55 -0.05 0.27 0.78 0.00 0.00 0.00 179.25 180.79 3gza h GLY 345 N 0.61 1.04 0.95 0.00 0.00 -1.94 -0.99 103.07 102.75 3gza h GLY 345 Ca 0.38 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.16 3gza h GLY 345 CO -0.30 0.53 0.01 -0.55 0.00 0.00 0.00 176.54 176.23 3gza h ASP 346 N 0.91 0.00 -0.95 0.19 5.19 -1.75 -1.50 116.42 118.51 3gza h ASP 346 Ca 0.22 0.01 0.04 0.00 -0.62 0.00 0.00 57.03 56.67 3gza h ASP 346 Cb 0.19 0.01 -0.06 0.00 0.18 0.00 0.00 39.33 39.66 3gza h ASP 346 CO -0.02 0.01 0.62 0.00 -3.12 0.00 0.00 179.24 176.73 3gza h ALA 347 N 1.03 1.26 -0.35 3.45 0.00 -1.13 -1.16 119.26 122.36 3gza h ALA 347 Ca 0.02 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3gza h ALA 347 Cb 0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 3gza h ALA 347 CO -0.03 0.50 0.02 0.37 0.00 0.00 0.00 179.25 180.12 3gza h GLN 348 N 1.20 0.60 -0.82 0.00 5.75 -0.98 -1.40 115.11 119.45 3gza h GLN 348 Ca 0.38 -0.18 -0.01 0.00 -0.15 0.00 0.00 58.65 58.68 3gza h GLN 348 Cb -0.00 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.45 3gza h GLN 348 CO -0.12 0.70 0.46 -0.09 -2.65 0.00 0.00 178.83 177.13 3gza h ARG 349 N 0.42 1.14 -0.49 1.69 9.65 -0.88 -0.70 114.38 125.20 3gza h ARG 349 Ca 0.10 -0.13 0.02 0.00 -1.10 0.00 0.00 59.98 58.88 3gza h ARG 349 Cb 0.42 -0.23 -0.03 0.00 -1.39 0.00 0.00 29.97 28.74 3gza h ARG 349 CO 0.01 0.83 0.29 -0.07 2.80 0.00 0.00 179.97 183.83 3gza h LEU 350 N 1.14 0.46 -0.47 3.80 3.38 -1.09 -2.79 115.31 119.74 3gza h LEU 350 Ca 0.29 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 3gza h LEU 350 Cb 0.02 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3gza h LEU 350 CO -0.05 0.33 0.26 0.50 0.09 0.00 0.00 178.44 179.56 3gza h LYS 351 N 0.57 0.66 -1.10 1.13 3.64 -0.77 -2.15 116.57 118.55 3gza h LYS 351 Ca 0.20 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3gza h LYS 351 Cb 0.03 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 3gza h LYS 351 CO -0.09 0.52 0.00 0.39 -2.27 0.00 0.00 179.45 178.00 3gza n GLU 352 N -4.67 0.00 0.00 1.90 1.02 -0.31 -0.67 120.64 117.91 3gza n GLU 352 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3gza n GLU 352 Cb 0.09 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 3gza n GLU 352 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gza n GLY 354 N 0.72 0.00 0.30 0.62 0.00 -0.81 -1.29 105.19 104.73 3gza n GLY 354 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3gza n GLY 354 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gza h ASP 355 N 0.00 0.58 0.55 1.61 3.32 -1.08 -1.68 116.42 119.72 3gza h ASP 355 Ca 0.00 -0.06 -0.27 0.00 0.02 0.00 0.00 57.03 56.72 3gza h ASP 355 Cb 0.00 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.41 3gza h ASP 355 CO 0.00 0.52 -1.22 -0.08 -1.72 0.00 0.00 179.24 176.74 3gza h GLU 356 N 0.65 0.32 -0.52 3.56 4.57 -1.44 0.13 114.58 121.86 3gza h GLU 356 Ca 0.16 -0.51 -0.00 0.00 -1.18 0.00 0.00 59.36 57.83 3gza h GLU 356 Cb 0.11 0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 3gza h GLU 356 CO -0.02 1.22 0.32 0.82 -1.18 0.00 0.00 179.01 180.17 3gza h ILE 357 N 0.11 1.15 -0.51 2.32 2.04 -1.77 -1.04 117.51 119.80 3gza h ILE 357 Ca -0.14 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.33 3gza h ILE 357 Cb 1.93 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 3gza h ILE 357 CO 0.20 0.16 0.09 0.78 0.00 0.00 0.00 178.15 179.38 3gza h ASN 358 N 0.69 0.81 -0.74 1.72 2.35 -1.19 -0.96 115.58 118.27 3gza h ASN 358 Ca 0.19 -0.26 0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3gza h ASN 358 Cb -0.02 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.08 3gza h ASN 358 CO -0.04 0.86 0.45 -0.09 -1.65 0.00 0.00 177.43 176.97 3gza h ARG 359 N 0.73 0.83 0.03 0.81 2.43 -0.39 -1.45 114.38 117.38 3gza h ARG 359 Ca 0.16 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 59.08 3gza h ARG 359 Cb 0.39 -0.19 0.02 0.00 -0.42 0.00 0.00 29.97 29.77 3gza h ARG 359 CO 0.01 0.55 -0.78 0.00 -1.51 0.00 0.00 179.97 178.24 3gza h ARG 360 N 0.86 0.47 0.00 0.20 3.08 -1.06 -3.42 114.38 114.50 3gza h ARG 360 Ca 0.31 -0.55 0.00 0.00 0.07 0.00 0.00 59.98 59.81 3gza h ARG 360 Cb 0.09 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.31 3gza h ARG 360 CO -0.14 1.19 0.00 1.19 -1.07 0.00 0.00 179.97 181.14 3gza n PHE 361 N -4.10 0.00 0.10 3.04 3.72 -0.38 -4.72 117.46 115.13 3gza n PHE 361 Ca -0.11 -0.13 -0.02 0.00 -0.05 0.00 0.00 57.45 57.14 3gza n PHE 361 Cb 0.77 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 39.25 3gza n PHE 361 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3gza h SER 362 N 0.00 0.00 -3.56 4.37 4.64 -1.40 -3.41 113.55 114.18 3gza h SER 362 Ca 0.00 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.70 3gza h SER 362 Cb 0.16 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.85 3gza h SER 362 CO 0.00 0.74 -0.72 -0.55 -0.87 0.00 0.00 176.83 175.42 3gza s SER 363 N -6.58 4.08 0.76 4.97 0.15 -1.26 -5.12 113.70 110.69 3gza s SER 363 Ca 0.03 -2.30 -0.11 0.00 0.70 0.00 0.00 55.95 54.27 3gza s SER 363 Cb 0.09 -1.19 0.05 0.00 -1.71 0.00 0.00 66.02 63.26 3gza s SER 363 CO 0.78 -0.33 1.08 -2.16 1.20 0.00 0.00 173.24 173.81 3gza s PRO 364 N 0.74 2.38 0.14 5.44 0.04 -1.26 -4.95 135.00 137.53 3gza s PRO 364 Ca 0.14 0.80 -0.14 0.00 0.04 0.00 0.00 61.00 61.84 3gza s PRO 364 Cb -0.22 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.40 3gza s PRO 364 CO -0.09 -1.45 1.63 0.82 0.04 0.00 0.00 177.00 177.95 3gza h ILE 365 N -0.97 1.24 -3.07 0.56 2.04 -0.63 -3.46 117.51 113.22 3gza h ILE 365 Ca -0.46 -0.88 -0.02 0.00 1.00 0.00 0.00 64.86 64.50 3gza h ILE 365 Cb 1.24 0.93 -0.12 0.00 -0.74 0.00 0.00 36.82 38.13 3gza h ILE 365 CO 0.58 0.31 0.16 0.00 0.00 0.00 0.00 178.15 179.20 3gza s ALA 366 N -5.23 -1.47 0.02 1.87 0.00 -1.24 -5.00 121.76 110.70 3gza s ALA 366 Ca -0.13 0.38 -0.09 0.00 0.00 0.00 0.00 51.96 52.12 3gza s ALA 366 Cb 0.11 0.86 0.00 0.00 0.00 0.00 0.00 23.12 24.09 3gza s ALA 366 CO 0.79 -0.75 0.18 0.50 0.00 0.00 0.00 175.76 176.47 3gza s ARG 367 N -3.76 0.59 0.11 0.00 3.52 -1.26 -1.84 118.95 116.30 3gza s ARG 367 Ca 0.02 -0.49 -0.16 0.00 -0.13 0.00 0.00 55.73 54.97 3gza s ARG 367 Cb -0.01 0.25 0.03 0.00 -1.56 0.00 0.00 34.95 33.66 3gza s ARG 367 CO -0.12 -0.16 0.40 -1.50 -0.81 0.00 0.00 175.30 173.11 3gza s ILE 368 N -1.90 0.07 0.14 4.11 2.07 -0.23 -4.99 121.20 120.47 3gza s ILE 368 Ca -0.10 -0.56 -0.06 0.00 -1.41 0.00 0.00 60.65 58.52 3gza s ILE 368 Cb -0.04 -1.13 -0.02 0.00 0.13 0.00 0.00 42.46 41.39 3gza s ILE 368 CO -0.00 -0.31 0.18 -0.94 -1.91 0.00 0.00 174.94 171.96 3gza s SER 369 N -2.66 0.16 0.00 4.50 1.04 -1.26 -0.64 113.70 114.84 3gza s SER 369 Ca 0.02 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.47 3gza s SER 369 Cb 0.01 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.50 3gza s SER 369 CO -0.10 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 173.92 3gza n GLY 370 N -0.14 2.37 3.29 7.32 0.00 -0.12 -5.02 105.19 112.89 3gza n GLY 370 Ca -0.08 -0.79 -0.44 0.00 0.00 0.00 0.00 46.02 44.71 3gza n GLY 370 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3gza n GLN 371 N -0.68 3.66 -3.81 1.61 6.02 -1.26 -1.40 117.38 121.53 3gza n GLN 371 Ca 0.00 -4.31 -0.09 0.00 -0.01 0.00 0.00 57.00 52.59 3gza n GLN 371 Cb 0.00 -2.66 -0.07 0.00 1.02 0.00 0.00 30.24 28.53 3gza n GLN 371 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3gza s LYS 372 N -0.88 0.87 0.07 -1.09 3.01 -1.12 -4.88 119.74 115.72 3gza s LYS 372 Ca 0.34 -0.87 0.25 0.00 -1.01 0.00 0.00 55.97 54.68 3gza s LYS 372 Cb -0.05 0.36 0.51 0.00 -1.01 0.00 0.00 37.83 37.64 3gza s LYS 372 CO -0.03 -0.29 1.44 1.63 0.51 0.00 0.00 175.35 178.61 3gza n LYS 373 N -0.01 0.16 -3.84 1.68 5.02 -1.26 -4.44 118.16 115.48 3gza n LYS 373 Ca -0.16 0.05 -0.14 0.00 -2.02 0.00 0.00 58.31 56.05 3gza n LYS 373 Cb 0.62 -1.61 -0.15 0.00 -0.02 0.00 0.00 35.03 33.87 3gza n LYS 373 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3gza s SER 374 N -3.70 0.06 -0.04 4.39 0.15 -1.26 0.12 113.70 113.43 3gza s SER 374 Ca 0.09 0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.75 3gza s SER 374 Cb 0.15 -0.04 0.03 0.00 -1.71 0.00 0.00 66.02 64.45 3gza s SER 374 CO 0.69 -0.06 -0.01 -0.76 1.20 0.00 0.00 173.24 174.30 3gza s LEU 375 N 0.52 1.02 -0.19 3.45 1.43 -0.40 -5.00 118.68 119.51 3gza s LEU 375 Ca -0.04 -0.07 -0.05 0.00 -1.03 0.00 0.00 54.13 52.94 3gza s LEU 375 Cb -0.06 -0.34 -0.03 0.00 0.03 0.00 0.00 46.19 45.79 3gza s LEU 375 CO -0.01 -0.12 -0.00 -0.89 0.23 0.00 0.00 176.35 175.56 3gza s THR 376 N 1.28 4.02 -0.41 5.49 2.01 -1.26 -0.67 115.64 126.10 3gza s THR 376 Ca -0.06 -0.30 -0.12 0.00 0.31 0.00 0.00 61.69 61.52 3gza s THR 376 Cb -0.13 -2.80 0.04 0.00 0.01 0.00 0.00 72.50 69.62 3gza s THR 376 CO -0.02 0.45 0.27 -0.76 -0.69 0.00 0.00 174.62 173.86 3gza s LEU 377 N 0.78 5.03 0.17 4.42 1.43 0.19 -4.97 118.68 125.73 3gza s LEU 377 Ca 0.00 -1.11 -0.29 0.00 -1.03 0.00 0.00 54.13 51.70 3gza s LEU 377 Cb -0.14 -2.08 -0.07 0.00 0.03 0.00 0.00 46.19 43.93 3gza s LEU 377 CO 0.02 -0.47 0.90 -0.54 0.23 0.00 0.00 176.35 176.49 3gza s LYS 378 N 1.58 4.72 0.00 1.70 3.01 -1.26 -0.41 119.74 129.08 3gza s LYS 378 Ca 0.03 1.38 0.23 0.00 -1.01 0.00 0.00 55.97 56.60 3gza s LYS 378 Cb -0.21 -3.31 0.15 0.00 -1.01 0.00 0.00 37.83 33.45 3gza s LYS 378 CO 0.07 0.41 1.17 1.28 0.51 0.00 0.00 175.35 178.79 3gza n LEU 379 N 2.03 0.74 0.00 3.17 4.77 -0.42 -4.86 117.00 122.43 3gza n LEU 379 Ca -0.01 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 3gza n LEU 379 Cb 0.48 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 3gza n LEU 379 CO 0.49 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 3gza n GLY 380 N 1.50 2.55 3.44 -0.72 0.00 -1.26 -4.92 105.19 105.79 3gza n GLY 380 Ca 0.05 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 3gza n GLY 380 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gza s LYS 381 N 0.00 1.18 0.16 1.61 -2.85 -1.26 -5.12 119.74 113.45 3gza s LYS 381 Ca 0.00 -0.24 -0.31 0.00 -1.00 0.00 0.00 55.97 54.42 3gza s LYS 381 Cb 0.00 0.54 -0.11 0.00 -2.06 0.00 0.00 37.83 36.21 3gza s LYS 381 CO 0.00 -0.46 1.78 -2.00 0.10 0.00 0.00 175.35 174.76 3gza s GLU 382 N -2.85 4.14 0.26 1.78 2.12 -1.26 -4.68 118.70 118.21 3gza s GLU 382 Ca -0.03 2.59 -0.21 0.00 0.36 0.00 0.00 54.97 57.67 3gza s GLU 382 Cb -0.01 -3.38 0.04 0.00 0.26 0.00 0.00 34.13 31.04 3gza s GLU 382 CO -0.05 -0.80 0.79 1.14 -0.54 0.00 0.00 175.26 175.80 3gza s GLN 383 N 2.10 1.69 0.35 4.30 -2.07 -0.42 -4.90 119.66 120.71 3gza s GLN 383 Ca 0.78 -0.96 -0.27 0.00 -1.82 0.00 0.00 55.36 53.09 3gza s GLN 383 Cb -0.47 0.56 -0.09 0.00 -1.09 0.00 0.00 33.01 31.92 3gza s GLN 383 CO 0.34 -0.78 1.16 -1.12 -1.32 0.00 0.00 175.29 173.58 3gza s SER 384 N -2.96 6.82 -0.09 12.60 0.01 -1.26 -0.12 113.70 128.70 3gza s SER 384 Ca 0.12 2.36 -0.07 0.00 1.31 0.00 0.00 55.95 59.67 3gza s SER 384 Cb -0.05 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.59 3gza s SER 384 CO 0.06 -0.47 0.23 0.68 0.41 0.00 0.00 173.24 174.16 3gza s VAL 385 N -1.31 -0.01 0.00 3.43 -7.23 -0.03 -4.55 120.40 110.70 3gza s VAL 385 Ca 0.52 0.05 0.00 0.00 -1.81 0.00 0.00 61.98 60.74 3gza s VAL 385 Cb -0.32 -0.34 0.00 0.00 0.56 0.00 0.00 36.38 36.28 3gza s VAL 385 CO 0.41 0.02 0.05 -0.46 -0.31 0.00 0.00 175.10 174.81 3gza n ASN 386 N 3.42 0.00 -3.88 4.85 6.94 -0.67 -1.55 115.26 124.37 3gza n ASN 386 Ca -0.17 -1.00 -0.11 0.00 -0.02 0.00 0.00 54.58 53.28 3gza n ASN 386 Cb 0.56 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.89 3gza n ASN 386 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 3gza s TYR 387 N 0.00 0.06 0.05 -2.53 2.02 -0.99 -0.72 117.35 115.25 3gza s TYR 387 Ca 0.00 -0.18 -0.05 0.00 -0.37 0.00 0.00 57.07 56.47 3gza s TYR 387 Cb 0.00 -0.06 -0.02 0.00 -0.40 0.00 0.00 41.96 41.48 3gza s TYR 387 CO 0.00 -0.29 0.09 0.00 -1.57 0.00 0.00 175.55 173.77 3gza s ILE 389 N -3.17 1.53 -0.03 0.00 1.01 -0.46 -0.90 121.20 119.18 3gza s ILE 389 Ca -0.00 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.88 3gza s ILE 389 Cb 0.02 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.21 3gza s ILE 389 CO -0.07 0.43 -0.12 -0.63 0.00 0.00 0.00 174.94 174.55 3gza s ILE 390 N -0.26 1.04 -0.03 2.92 1.01 -0.45 -1.32 121.20 124.12 3gza s ILE 390 Ca 0.03 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.18 3gza s ILE 390 Cb -0.09 -0.91 0.02 0.00 0.01 0.00 0.00 42.46 41.48 3gza s ILE 390 CO 0.01 0.31 -0.02 -1.10 0.00 0.00 0.00 174.94 174.13 3gza s GLN 391 N 0.11 0.46 0.38 2.79 -0.21 0.16 -0.94 119.66 122.40 3gza s GLN 391 Ca -0.03 -0.03 -0.04 0.00 0.02 0.00 0.00 55.36 55.28 3gza s GLN 391 Cb -0.10 -0.54 -0.04 0.00 1.00 0.00 0.00 33.01 33.34 3gza s GLN 391 CO 0.01 -0.06 0.65 -1.21 -2.12 0.00 0.00 175.29 172.56 3gza s GLU 392 N 0.69 3.58 -0.98 2.91 2.02 0.10 -0.97 118.70 126.05 3gza s GLU 392 Ca -0.08 0.02 -0.24 0.00 0.02 0.00 0.00 54.97 54.69 3gza s GLU 392 Cb -0.11 -2.54 0.03 0.00 0.10 0.00 0.00 34.13 31.61 3gza s GLU 392 CO -0.01 0.04 1.54 1.21 0.02 0.00 0.00 175.26 178.06 3gza s ASN 393 N -3.70 6.21 0.55 -0.19 2.47 0.67 -4.57 114.94 116.39 3gza s ASN 393 Ca 0.45 -1.22 0.27 0.00 0.42 0.00 0.00 52.86 52.78 3gza s ASN 393 Cb -0.10 -2.57 1.46 0.00 -1.45 0.00 0.00 41.25 38.59 3gza s ASN 393 CO 0.36 -1.77 1.98 -0.29 -3.72 0.00 0.00 177.10 173.66 3gza h ILE 394 N 6.84 0.60 -0.14 -5.21 6.09 -1.87 -0.70 117.51 123.12 3gza h ILE 394 Ca 0.15 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.68 3gza h ILE 394 Cb 1.01 0.70 -0.01 0.00 0.47 0.00 0.00 36.82 39.00 3gza h ILE 394 CO 1.38 0.00 0.13 0.07 -3.07 0.00 0.00 178.15 176.65 3gza h LYS 395 N 0.00 0.00 -0.55 2.19 2.10 -1.95 -1.24 116.57 117.12 3gza h LYS 395 Ca 0.24 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.89 3gza h LYS 395 Cb 1.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.40 3gza h LYS 395 CO -0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 3gza n ASN 396 N -4.09 3.18 0.00 7.07 3.02 -0.27 -4.51 115.26 119.66 3gza n ASN 396 Ca 0.00 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.57 3gza n ASN 396 Cb 0.24 -0.37 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 3gza n ASN 396 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gza n GLY 397 N 1.45 0.01 3.37 7.41 0.00 -0.47 -4.79 105.19 112.17 3gza n GLY 397 Ca 0.20 -1.95 -0.45 0.00 0.00 0.00 0.00 46.02 43.82 3gza n GLY 397 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gza s GLU 398 N -1.12 3.28 -0.12 1.61 2.02 -1.26 -4.63 118.70 118.47 3gza s GLU 398 Ca 0.00 -1.74 0.07 0.00 0.02 0.00 0.00 54.97 53.32 3gza s GLU 398 Cb 0.00 -4.43 -0.24 0.00 0.10 0.00 0.00 34.13 29.57 3gza s GLU 398 CO 0.00 -1.49 0.38 0.54 0.02 0.00 0.00 175.26 174.71 3gza n ARG 399 N 5.63 0.68 -2.33 1.61 1.74 -1.26 -4.85 116.66 117.89 3gza n ARG 399 Ca 0.02 0.22 -0.42 0.00 -0.77 0.00 0.00 57.85 56.90 3gza n ARG 399 Cb 0.44 -1.69 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 3gza n ARG 399 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gza s ILE 400 N -2.56 3.84 -0.04 0.55 1.01 -1.26 -1.34 121.20 121.39 3gza s ILE 400 Ca -0.14 1.28 0.04 0.00 0.00 0.00 0.00 60.65 61.84 3gza s ILE 400 Cb 0.07 -3.82 -0.06 0.00 0.01 0.00 0.00 42.46 38.66 3gza s ILE 400 CO 0.79 0.06 0.03 0.54 0.00 0.00 0.00 174.94 176.35 3gza n ARG 401 N 4.44 2.88 -3.73 2.79 5.12 -0.13 -4.55 116.66 123.48 3gza n ARG 401 Ca 0.11 -0.01 -0.12 0.00 -1.93 0.00 0.00 57.85 55.90 3gza n ARG 401 Cb 0.45 -1.12 -0.12 0.00 -1.16 0.00 0.00 32.46 30.51 3gza n ARG 401 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 3gza s GLN 402 N -2.14 0.30 0.08 5.56 0.74 -0.85 -4.42 119.66 118.93 3gza s GLN 402 Ca -0.02 0.55 -0.07 0.00 0.05 0.00 0.00 55.36 55.87 3gza s GLN 402 Cb 0.02 0.01 -0.01 0.00 1.10 0.00 0.00 33.01 34.12 3gza s GLN 402 CO 0.20 -0.12 0.14 1.52 -0.55 0.00 0.00 175.29 176.48 3gza s TYR 403 N 0.90 0.23 0.04 1.67 -0.85 -0.52 -1.39 117.35 117.42 3gza s TYR 403 Ca -0.06 -0.67 0.02 0.00 -0.52 0.00 0.00 57.07 55.84 3gza s TYR 403 Cb -0.07 -0.13 -0.02 0.00 0.38 0.00 0.00 41.96 42.12 3gza s TYR 403 CO -0.06 -0.50 -0.08 -0.65 -1.52 0.00 0.00 175.55 172.74 3gza s GLN 404 N -3.78 0.54 -0.11 -3.49 1.11 0.01 -1.28 119.66 112.66 3gza s GLN 404 Ca 0.05 -0.68 0.03 0.00 0.01 0.00 0.00 55.36 54.77 3gza s GLN 404 Cb 0.05 -0.36 -0.00 0.00 -1.01 0.00 0.00 33.01 31.69 3gza s GLN 404 CO -0.10 0.07 -0.22 0.42 0.01 0.00 0.00 175.29 175.47 3gza s ILE 405 N -1.16 2.26 0.12 1.08 1.01 0.02 -1.45 121.20 123.07 3gza s ILE 405 Ca -0.07 -0.95 0.09 0.00 0.00 0.00 0.00 60.65 59.72 3gza s ILE 405 Cb -0.09 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 3gza s ILE 405 CO 0.00 0.55 -0.20 -1.61 0.00 0.00 0.00 174.94 173.69 3gza s GLU 406 N 0.37 1.70 -0.05 2.79 2.02 0.11 -0.54 118.70 125.11 3gza s GLU 406 Ca -0.17 -1.23 0.06 0.00 0.02 0.00 0.00 54.97 53.65 3gza s GLU 406 Cb -0.17 -2.06 -0.02 0.00 0.10 0.00 0.00 34.13 31.98 3gza s GLU 406 CO 0.08 0.47 -0.24 0.00 0.02 0.00 0.00 175.26 175.59 3gza s ALA 407 N -1.16 2.23 -0.50 5.21 0.00 0.92 -0.15 121.76 128.31 3gza s ALA 407 Ca 0.17 -1.06 -0.23 0.00 0.00 0.00 0.00 51.96 50.84 3gza s ALA 407 Cb -0.10 -0.68 0.04 0.00 0.00 0.00 0.00 23.12 22.38 3gza s ALA 407 CO 0.09 0.47 0.83 0.21 0.00 0.00 0.00 175.76 177.36 3gza s LYS 408 N -0.37 3.33 -0.18 0.00 2.20 -0.03 -0.75 119.74 123.94 3gza s LYS 408 Ca 0.03 -0.30 0.01 0.00 -0.36 0.00 0.00 55.97 55.34 3gza s LYS 408 Cb -0.12 -4.02 0.03 0.00 -1.51 0.00 0.00 37.83 32.21 3gza s LYS 408 CO 0.02 -1.30 -0.16 0.08 -0.36 0.00 0.00 175.35 173.63 3gza s VAL 409 N 3.48 1.84 -1.46 4.02 1.01 0.11 -1.25 120.40 128.16 3gza s VAL 409 Ca 0.28 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 3gza s VAL 409 Cb -0.13 -1.75 0.05 0.00 0.00 0.00 0.00 36.38 34.55 3gza s VAL 409 CO 0.19 0.40 1.08 0.59 0.00 0.00 0.00 175.10 177.36 3gza n ASN 410 N 4.66 -5.56 0.00 3.32 3.02 -1.26 -1.91 115.26 117.53 3gza n ASN 410 Ca -0.18 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 3gza n ASN 410 Cb 0.49 -4.40 0.00 0.00 -0.61 0.00 0.00 39.78 35.26 3gza n ASN 410 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gza n GLY 411 N -1.84 0.55 3.12 7.41 0.00 -1.26 -5.01 105.19 108.17 3gza n GLY 411 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 3gza n GLY 411 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gza s LYS 412 N -0.37 1.83 0.15 1.61 0.00 -0.80 -5.08 119.74 117.07 3gza s LYS 412 Ca 0.00 -0.60 -0.30 0.00 0.00 0.00 0.00 55.97 55.07 3gza s LYS 412 Cb 0.00 -1.57 -0.07 0.00 0.00 0.00 0.00 37.83 36.19 3gza s LYS 412 CO 0.00 0.21 1.13 -1.58 0.00 0.00 0.00 175.35 175.12 3gza s TRP 413 N 0.13 3.53 0.03 1.78 0.52 -1.26 -0.71 118.94 122.96 3gza s TRP 413 Ca -0.06 1.51 0.03 0.00 0.02 0.00 0.00 56.10 57.60 3gza s TRP 413 Cb -0.12 -3.33 -0.02 0.00 -1.15 0.00 0.00 33.47 28.85 3gza s TRP 413 CO 0.03 -0.83 -0.09 1.14 0.02 0.00 0.00 176.95 177.22 3gza s GLN 414 N 0.01 0.60 0.01 4.98 -2.07 0.07 -4.95 119.66 118.31 3gza s GLN 414 Ca 0.52 -0.59 -0.30 0.00 -1.82 0.00 0.00 55.36 53.17 3gza s GLN 414 Cb -0.30 -0.49 -0.03 0.00 -1.09 0.00 0.00 33.01 31.10 3gza s GLN 414 CO 0.34 0.11 0.99 0.99 -1.32 0.00 0.00 175.29 176.40 3gza s THR 415 N -0.88 4.82 -0.13 3.63 2.01 -1.26 -0.05 115.64 123.78 3gza s THR 415 Ca -0.04 2.04 0.15 0.00 0.31 0.00 0.00 61.69 64.15 3gza s THR 415 Cb -0.07 -4.31 -0.21 0.00 0.01 0.00 0.00 72.50 67.92 3gza s THR 415 CO 0.00 0.17 0.11 1.33 -0.69 0.00 0.00 174.62 175.54 3gza n VAL 416 N 3.85 0.90 -3.62 3.82 0.24 0.30 -4.91 118.33 118.91 3gza n VAL 416 Ca 0.06 -0.62 -0.08 0.00 -2.04 0.00 0.00 64.34 61.65 3gza n VAL 416 Cb 0.51 -0.45 -0.02 0.00 -1.47 0.00 0.00 33.84 32.41 3gza n VAL 416 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gza s LYS 418 N -3.58 0.33 0.00 0.00 3.01 -1.26 -0.80 119.74 117.44 3gza s LYS 418 Ca 0.07 -0.35 0.00 0.00 -1.01 0.00 0.00 55.97 54.67 3gza s LYS 418 Cb -0.02 0.13 0.00 0.00 -1.01 0.00 0.00 37.83 36.93 3gza s LYS 418 CO -0.04 -0.07 0.00 0.41 0.51 0.00 0.00 175.35 176.16 3gza n GLY 419 N 1.88 2.55 0.00 -3.33 0.00 -0.40 -5.00 105.19 100.88 3gza n GLY 419 Ca -0.21 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3gza n GLY 419 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gza n GLU 420 N 0.00 0.00 -2.48 1.61 1.02 -1.26 -1.44 120.64 118.08 3gza n GLU 420 Ca 0.00 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.78 3gza n GLU 420 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 3gza n GLU 420 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3gza s SER 421 N 1.00 6.55 0.01 1.62 1.04 -1.26 -3.85 113.70 118.80 3gza s SER 421 Ca 0.00 2.07 0.00 0.00 0.48 0.00 0.00 55.95 58.50 3gza s SER 421 Cb 0.00 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3gza s SER 421 CO 0.00 -0.64 0.00 0.52 0.98 0.00 0.00 173.24 174.10 3gza n VAL 422 N -0.34 0.06 -4.49 5.02 0.31 -1.26 -4.90 118.33 112.73 3gza n VAL 422 Ca 0.06 0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3gza n VAL 422 Cb 0.50 -0.78 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 3gza n VAL 422 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gza n GLY 423 N 2.99 1.54 0.30 2.92 0.00 -1.26 -3.56 105.19 108.12 3gza n GLY 423 Ca 0.00 -0.67 -0.08 0.00 0.00 0.00 0.00 46.02 45.27 3gza n GLY 423 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3gza h HIS 424 N 0.00 1.10 -2.07 1.61 -0.00 -1.91 0.31 115.15 114.19 3gza h HIS 424 Ca 0.00 -0.15 -0.03 0.00 -0.00 0.00 0.00 60.37 60.19 3gza h HIS 424 Cb 0.00 -0.30 -0.21 0.00 -0.00 0.00 0.00 27.41 26.89 3gza h HIS 424 CO 0.00 0.93 0.07 0.21 -0.00 0.00 0.00 177.93 179.14 3gza s LYS 425 N -5.21 0.77 -0.07 5.26 2.20 -1.23 -4.10 119.74 117.35 3gza s LYS 425 Ca -0.12 1.02 0.01 0.00 -0.36 0.00 0.00 55.97 56.52 3gza s LYS 425 Cb 0.13 0.32 0.02 0.00 -1.51 0.00 0.00 37.83 36.79 3gza s LYS 425 CO 0.84 -0.11 -0.10 0.50 -0.36 0.00 0.00 175.35 176.12 3gza s ARG 426 N 0.70 1.51 -0.19 4.03 6.06 -0.11 -2.12 118.95 128.83 3gza s ARG 426 Ca -0.03 -0.32 -0.03 0.00 -2.50 0.00 0.00 55.73 52.85 3gza s ARG 426 Cb -0.05 -1.36 -0.02 0.00 0.06 0.00 0.00 34.95 33.58 3gza s ARG 426 CO -0.04 -0.07 -0.05 0.42 -2.50 0.00 0.00 175.30 173.06 3gza s ILE 427 N 0.99 3.56 -0.08 4.11 1.01 -0.48 -1.34 121.20 128.96 3gza s ILE 427 Ca -0.09 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.14 3gza s ILE 427 Cb -0.15 -2.59 -0.02 0.00 0.01 0.00 0.00 42.46 39.72 3gza s ILE 427 CO -0.00 0.45 -0.16 -1.61 0.00 0.00 0.00 174.94 173.62 3gza s GLU 428 N 0.95 2.88 -0.03 2.79 0.41 -0.07 -4.88 118.70 120.76 3gza s GLU 428 Ca -0.00 -0.74 0.05 0.00 -0.41 0.00 0.00 54.97 53.87 3gza s GLU 428 Cb -0.15 -2.44 -0.01 0.00 -1.78 0.00 0.00 34.13 29.76 3gza s GLU 428 CO 0.01 0.40 -0.17 0.21 -0.49 0.00 0.00 175.26 175.22 3gza s LYS 429 N -0.15 1.61 0.21 1.61 2.20 -1.26 -1.05 119.74 122.91 3gza s LYS 429 Ca -0.01 -0.61 -0.10 0.00 -0.36 0.00 0.00 55.97 54.89 3gza s LYS 429 Cb -0.14 -1.46 -0.01 0.00 -1.51 0.00 0.00 37.83 34.71 3gza s LYS 429 CO 0.03 0.30 0.35 -0.59 -0.36 0.00 0.00 175.35 175.08 3gza s PHE 430 N -0.14 0.51 0.24 4.03 -0.12 0.11 -5.00 117.98 117.61 3gza s PHE 430 Ca 0.01 -0.84 -0.31 0.00 -0.05 0.00 0.00 56.93 55.73 3gza s PHE 430 Cb -0.09 -0.02 -0.12 0.00 -0.63 0.00 0.00 43.02 42.15 3gza s PHE 430 CO 0.01 -0.84 1.64 -1.91 -0.05 0.00 0.00 175.22 174.07 3gza n GLU 431 N -0.31 2.67 -1.85 1.99 4.07 -1.26 -4.67 120.64 121.29 3gza n GLU 431 Ca -0.03 0.96 -0.39 0.00 -0.06 0.00 0.00 57.16 57.64 3gza n GLU 431 Cb 0.63 -2.76 0.03 0.00 -0.06 0.00 0.00 31.44 29.28 3gza n GLU 431 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 3gza s PRO 432 N 0.34 3.42 0.06 5.31 0.02 -1.26 -4.84 135.00 138.04 3gza s PRO 432 Ca 0.70 2.25 0.03 0.00 0.02 0.00 0.00 61.00 63.99 3gza s PRO 432 Cb -0.52 -2.43 -0.03 0.00 0.02 0.00 0.00 34.50 31.54 3gza s PRO 432 CO 0.41 -0.97 -0.09 0.14 -0.33 0.00 0.00 177.00 176.16 3gza s VAL 433 N -1.29 0.66 -0.42 3.83 -7.23 -0.60 -4.94 120.40 110.41 3gza s VAL 433 Ca 0.67 -1.25 -0.20 0.00 -1.81 0.00 0.00 61.98 59.38 3gza s VAL 433 Cb -0.40 -0.85 0.02 0.00 0.56 0.00 0.00 36.38 35.71 3gza s VAL 433 CO 0.49 -0.44 0.62 -1.61 -0.31 0.00 0.00 175.10 173.85 3gza s GLU 434 N -1.97 3.35 0.12 4.82 0.41 -1.26 -0.85 118.70 123.33 3gza s GLU 434 Ca -0.05 -0.32 0.06 0.00 -0.41 0.00 0.00 54.97 54.24 3gza s GLU 434 Cb -0.08 -3.92 -0.04 0.00 -1.78 0.00 0.00 34.13 28.32 3gza s GLU 434 CO -0.00 -0.93 -0.13 0.00 -0.49 0.00 0.00 175.26 173.71 3gza s ALA 435 N 2.72 1.47 -0.62 5.21 0.00 0.83 -4.41 121.76 126.97 3gza s ALA 435 Ca 0.22 -1.31 0.15 0.00 0.00 0.00 0.00 51.96 51.02 3gza s ALA 435 Cb -0.14 -0.06 -0.18 0.00 0.00 0.00 0.00 23.12 22.74 3gza s ALA 435 CO 0.18 0.07 0.61 0.25 0.00 0.00 0.00 175.76 176.86 3gza n THR 436 N 0.44 0.00 -3.54 0.00 -2.24 -0.38 -1.30 114.28 107.26 3gza n THR 436 Ca -0.15 -0.17 -0.10 0.00 -2.27 0.00 0.00 64.05 61.36 3gza n THR 436 Cb 0.57 0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 69.63 3gza n THR 436 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gza s ALA 437 N -2.57 -1.87 0.18 6.98 0.00 -1.26 -1.30 121.76 121.93 3gza s ALA 437 Ca 0.04 1.28 0.11 0.00 0.00 0.00 0.00 51.96 53.39 3gza s ALA 437 Cb 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 3gza s ALA 437 CO 0.64 -0.51 -0.24 -0.51 0.00 0.00 0.00 175.76 175.14 3gza s LEU 438 N -1.85 2.42 -0.02 0.00 1.43 0.46 -0.85 118.68 120.26 3gza s LEU 438 Ca 0.01 -0.85 -0.00 0.00 -1.03 0.00 0.00 54.13 52.26 3gza s LEU 438 Cb -0.01 -1.15 0.03 0.00 0.03 0.00 0.00 46.19 45.09 3gza s LEU 438 CO -0.03 0.12 0.03 -0.60 0.23 0.00 0.00 176.35 176.09 3gza s ARG 439 N -2.61 -0.01 -0.24 1.70 3.52 0.78 0.57 118.95 122.66 3gza s ARG 439 Ca 0.20 0.21 -0.09 0.00 -0.13 0.00 0.00 55.73 55.91 3gza s ARG 439 Cb -0.08 -0.32 -0.04 0.00 -1.56 0.00 0.00 34.95 32.95 3gza s ARG 439 CO 0.09 -0.19 0.12 -1.17 -0.81 0.00 0.00 175.30 173.34 3gza s LEU 440 N 1.26 3.82 -0.15 -0.88 2.96 0.16 -0.71 118.68 125.13 3gza s LEU 440 Ca -0.07 -0.03 0.01 0.00 -0.22 0.00 0.00 54.13 53.83 3gza s LEU 440 Cb -0.13 -2.03 0.01 0.00 0.50 0.00 0.00 46.19 44.54 3gza s LEU 440 CO -0.03 0.02 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.94 3gza s THR 441 N 1.31 2.26 -0.54 3.68 2.01 -0.53 -1.28 115.64 122.55 3gza s THR 441 Ca 0.06 -0.90 -0.17 0.00 0.31 0.00 0.00 61.69 60.98 3gza s THR 441 Cb -0.15 -1.93 0.10 0.00 0.01 0.00 0.00 72.50 70.53 3gza s THR 441 CO 0.05 0.53 0.56 -0.69 -0.69 0.00 0.00 174.62 174.39 3gza s VAL 442 N 0.93 5.04 -0.27 3.82 1.01 0.12 -0.81 120.40 130.23 3gza s VAL 442 Ca -0.04 -1.09 0.18 0.00 0.00 0.00 0.00 61.98 61.03 3gza s VAL 442 Cb -0.15 -4.34 0.16 0.00 0.00 0.00 0.00 36.38 32.05 3gza s VAL 442 CO -0.04 -0.89 1.48 0.77 0.00 0.00 0.00 175.10 176.43 3gza h SER 443 N 8.98 0.00 -3.61 3.32 4.64 -1.52 -3.45 113.55 121.91 3gza h SER 443 Ca -0.29 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.70 3gza h SER 443 Cb 1.10 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.87 3gza h SER 443 CO 1.02 0.30 -0.75 -0.70 -0.87 0.00 0.00 176.83 175.83 3gza s GLU 444 N -3.06 0.31 -0.03 4.77 2.12 -1.15 -4.96 118.70 116.70 3gza s GLU 444 Ca 0.05 0.00 -0.26 0.00 0.36 0.00 0.00 54.97 55.12 3gza s GLU 444 Cb 0.07 -0.42 0.06 0.00 0.26 0.00 0.00 34.13 34.10 3gza s GLU 444 CO 0.72 -0.06 0.57 -1.54 -0.54 0.00 0.00 175.26 174.40 3gza s SER 445 N 0.64 -0.52 0.00 -1.70 1.04 -1.26 -0.95 113.70 110.95 3gza s SER 445 Ca -0.06 0.49 0.25 0.00 0.48 0.00 0.00 55.95 57.10 3gza s SER 445 Cb -0.10 0.48 0.42 0.00 0.10 0.00 0.00 66.02 66.92 3gza s SER 445 CO -0.01 -0.59 1.35 2.30 0.98 0.00 0.00 173.24 177.27 3gza n ILE 446 N 0.92 0.00 -3.64 -1.02 -5.35 -0.45 -4.94 119.36 104.87 3gza n ILE 446 Ca -0.20 -0.07 -0.07 0.00 -0.27 0.00 0.00 62.75 62.14 3gza n ILE 446 Cb 0.57 0.53 -0.02 0.00 -1.74 0.00 0.00 39.64 38.99 3gza n ILE 446 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3gza s ALA 447 N -2.77 -1.60 -0.05 -1.28 0.00 -1.26 -5.08 121.76 109.72 3gza s ALA 447 Ca 0.16 0.35 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 3gza s ALA 447 Cb 0.18 0.68 -0.09 0.00 0.00 0.00 0.00 23.12 23.89 3gza s ALA 447 CO 0.65 -0.89 2.03 -0.11 0.00 0.00 0.00 175.76 177.44 3gza n LEU 448 N -0.39 3.80 -4.70 0.00 7.94 -1.26 -4.78 117.00 117.62 3gza n LEU 448 Ca -0.09 0.73 -0.40 0.00 -1.11 0.00 0.00 56.01 55.14 3gza n LEU 448 Cb 0.62 -1.51 0.03 0.00 0.53 0.00 0.00 43.42 43.09 3gza n LEU 448 CO 0.13 -0.07 0.85 -2.65 -1.11 0.00 0.00 177.39 174.53 3gza n PRO 449 N 7.74 1.68 -3.91 1.96 -0.02 -1.26 -4.91 135.00 136.28 3gza n PRO 449 Ca 0.23 0.61 -0.29 0.00 -2.02 0.00 0.00 63.50 62.03 3gza n PRO 449 Cb 0.40 -2.40 -0.13 0.00 -0.02 0.00 0.00 33.50 31.35 3gza n PRO 449 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3gza s ASP 450 N -0.76 4.65 -0.39 2.55 -1.08 -1.26 -2.81 116.67 117.56 3gza s ASP 450 Ca 0.67 -3.45 -0.20 0.00 -0.52 0.00 0.00 52.55 49.04 3gza s ASP 450 Cb -0.47 -1.65 0.01 0.00 -1.46 0.00 0.00 42.92 39.35 3gza s ASP 450 CO 0.54 -0.16 0.64 -0.63 0.52 0.00 0.00 175.17 176.07 3gza s ILE 451 N -0.90 4.87 -0.74 4.11 1.01 -0.49 -0.24 121.20 128.82 3gza s ILE 451 Ca 0.21 0.40 0.24 0.00 0.00 0.00 0.00 60.65 61.51 3gza s ILE 451 Cb -0.15 -4.12 0.03 0.00 0.01 0.00 0.00 42.46 38.23 3gza s ILE 451 CO -0.09 -0.42 1.33 2.30 0.00 0.00 0.00 174.94 178.07 3gza n ILE 452 N 5.69 0.23 -3.64 2.92 -5.35 -0.14 -0.94 119.36 118.13 3gza n ILE 452 Ca -0.01 -0.19 -0.04 0.00 -0.27 0.00 0.00 62.75 62.23 3gza n ILE 452 Cb 0.48 -0.01 -0.06 0.00 -1.74 0.00 0.00 39.64 38.32 3gza n ILE 452 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3gza s ASN 453 N -3.84 -1.02 -0.20 7.28 2.47 -1.16 -4.68 114.94 113.79 3gza s ASN 453 Ca 0.07 1.51 -0.03 0.00 0.42 0.00 0.00 52.86 54.84 3gza s ASN 453 Cb 0.15 1.80 0.06 0.00 -1.45 0.00 0.00 41.25 41.81 3gza s ASN 453 CO 0.72 -0.23 0.04 0.12 -3.72 0.00 0.00 177.10 174.03 3gza s PHE 454 N 2.22 1.06 0.07 0.43 5.36 0.19 -0.67 117.98 126.64 3gza s PHE 454 Ca -0.08 -0.91 0.03 0.00 -0.96 0.00 0.00 56.93 55.01 3gza s PHE 454 Cb -0.08 -1.06 -0.03 0.00 -0.34 0.00 0.00 43.02 41.50 3gza s PHE 454 CO -0.19 -0.63 -0.09 -1.54 -1.46 0.00 0.00 175.22 171.31 3gza s SER 455 N 1.84 1.16 0.05 6.13 1.04 -0.43 -1.07 113.70 122.43 3gza s SER 455 Ca -0.00 -0.68 0.07 0.00 0.48 0.00 0.00 55.95 55.82 3gza s SER 455 Cb -0.17 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 65.94 3gza s SER 455 CO -0.09 -0.23 -0.18 0.00 0.98 0.00 0.00 173.24 173.71 3gza s ALA 456 N -1.90 2.59 0.04 5.32 0.00 -0.77 -1.35 121.76 125.70 3gza s ALA 456 Ca -0.02 -1.22 -0.00 0.00 0.00 0.00 0.00 51.96 50.71 3gza s ALA 456 Cb -0.06 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.32 3gza s ALA 456 CO -0.00 0.57 -0.04 0.71 0.00 0.00 0.00 175.76 177.00 3gza s TYR 457 N -0.96 0.46 -0.21 0.00 1.51 -0.35 0.20 117.35 118.01 3gza s TYR 457 Ca 0.15 -0.78 0.02 0.00 -1.01 0.00 0.00 57.07 55.45 3gza s TYR 457 Cb -0.10 -0.32 0.04 0.00 -0.11 0.00 0.00 41.96 41.46 3gza s TYR 457 CO 0.06 -0.25 -0.14 0.45 -1.11 0.00 0.00 175.55 174.55 3gza s SER 458 N -2.20 3.61 -0.10 2.29 0.15 -1.26 -1.68 113.70 114.51 3gza s SER 458 Ca -0.04 -0.94 0.01 0.00 0.70 0.00 0.00 55.95 55.68 3gza s SER 458 Cb -0.01 -1.43 0.02 0.00 -1.71 0.00 0.00 66.02 62.88 3gza s SER 458 CO -0.05 -0.10 -0.13 -0.69 1.20 0.00 0.00 173.24 173.48 3gza s VAL 459 N 1.26 1.30 -2.92 4.45 1.01 -1.26 -4.99 120.40 119.26 3gza s VAL 459 Ca -0.01 -0.52 0.25 0.00 0.00 0.00 0.00 61.98 61.69 3gza s VAL 459 Cb -0.16 -1.22 0.25 0.00 0.00 0.00 0.00 36.38 35.25 3gza s VAL 459 CO -0.09 0.40 1.34 2.29 0.00 0.00 0.00 175.10 179.04