#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hzx s HIS 8 N 0.00 1.03 0.14 -1.77 3.76 -1.26 -5.11 115.29 112.08 3hzx s HIS 8 Ca 0.00 -0.25 -0.30 0.00 -0.15 0.00 0.00 55.06 54.36 3hzx s HIS 8 Cb 0.00 -0.72 -0.07 0.00 1.11 0.00 0.00 32.58 32.91 3hzx s HIS 8 CO 0.00 -0.09 0.98 0.15 -0.85 0.00 0.00 174.74 174.93 3hzx s LYS 9 N 0.10 4.70 0.08 1.40 1.02 -1.26 -4.32 119.74 121.47 3hzx s LYS 9 Ca -0.02 1.50 0.07 0.00 0.02 0.00 0.00 55.97 57.54 3hzx s LYS 9 Cb -0.08 -3.34 -0.03 0.00 -0.52 0.00 0.00 37.83 33.85 3hzx s LYS 9 CO 0.00 0.24 -0.18 -1.21 -0.92 0.00 0.00 175.35 173.28 3hzx s GLU 10 N -0.24 1.06 0.69 1.68 2.02 0.88 -4.93 118.70 119.86 3hzx s GLU 10 Ca 0.46 -1.01 -0.13 0.00 0.02 0.00 0.00 54.97 54.31 3hzx s GLU 10 Cb -0.25 -1.20 0.01 0.00 0.10 0.00 0.00 34.13 32.79 3hzx s GLU 10 CO 0.31 0.28 1.08 -1.25 0.02 0.00 0.00 175.26 175.70 3hzx s PRO 11 N -1.64 2.78 0.16 0.39 0.04 -1.26 0.74 135.00 136.21 3hzx s PRO 11 Ca 0.04 1.17 -0.24 0.00 0.04 0.00 0.00 61.00 62.00 3hzx s PRO 11 Cb -0.09 -1.96 0.06 0.00 0.04 0.00 0.00 34.50 32.54 3hzx s PRO 11 CO 0.03 -1.24 0.84 0.00 0.04 0.00 0.00 177.00 176.67 3hzx s ALA 12 N -2.72 -1.56 0.04 8.56 0.00 -0.95 -4.57 121.76 120.56 3hzx s ALA 12 Ca 0.62 0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.84 3hzx s ALA 12 Cb -0.17 0.69 -0.02 0.00 0.00 0.00 0.00 23.12 23.62 3hzx s ALA 12 CO 0.48 -0.95 -0.16 0.95 0.00 0.00 0.00 175.76 176.09 3hzx s THR 13 N -3.49 1.28 0.13 0.00 -4.23 -0.67 -4.21 115.64 104.45 3hzx s THR 13 Ca 0.09 -1.09 -0.32 0.00 -1.18 0.00 0.00 61.69 59.19 3hzx s THR 13 Cb -0.03 -1.15 -0.11 0.00 1.34 0.00 0.00 72.50 72.55 3hzx s THR 13 CO -0.00 0.04 1.81 -0.11 -0.54 0.00 0.00 174.62 175.82 3hzx n LEU 14 N 1.81 3.96 -0.12 4.79 7.94 -1.26 -0.48 117.00 133.65 3hzx n LEU 14 Ca -0.18 1.00 -0.25 0.00 -1.11 0.00 0.00 56.01 55.48 3hzx n LEU 14 Cb 0.54 -1.54 -0.10 0.00 0.53 0.00 0.00 43.42 42.85 3hzx n LEU 14 CO 0.23 0.14 -0.94 -0.38 -1.11 0.00 0.00 177.39 175.33 3hzx n ILE 15 N 4.54 1.53 -3.64 1.96 5.41 0.36 -4.81 119.36 124.71 3hzx n ILE 15 Ca 0.18 -0.18 -0.08 0.00 1.00 0.00 0.00 62.75 63.67 3hzx n ILE 15 Cb 0.36 -1.99 -0.07 0.00 -0.71 0.00 0.00 39.64 37.23 3hzx n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 3hzx s LYS 16 N -2.44 0.65 0.52 0.38 2.20 -0.53 -5.01 119.74 115.50 3hzx s LYS 16 Ca -0.33 0.95 -0.23 0.00 -0.36 0.00 0.00 55.97 56.00 3hzx s LYS 16 Cb 0.10 0.22 -0.06 0.00 -1.51 0.00 0.00 37.83 36.58 3hzx s LYS 16 CO 0.53 -0.11 1.35 0.00 -0.36 0.00 0.00 175.35 176.77 3hzx s ALA 17 N 1.00 2.92 0.04 3.13 0.00 -1.26 -0.58 121.76 127.01 3hzx s ALA 17 Ca -0.05 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.23 3hzx s ALA 17 Cb -0.05 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.52 3hzx s ALA 17 CO -0.11 -1.26 0.00 -0.89 0.00 0.00 0.00 175.76 173.50 3hzx n ILE 18 N -0.80 0.48 -1.79 0.00 5.41 -1.18 -4.80 119.36 116.68 3hzx n ILE 18 Ca 0.09 0.16 0.00 0.00 1.00 0.00 0.00 62.75 64.00 3hzx n ILE 18 Cb 0.45 -1.19 0.00 0.00 -0.71 0.00 0.00 39.64 38.19 3hzx n ILE 18 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3hzx n ASP 19 N -2.90 0.00 -0.31 4.38 5.75 -0.82 -5.01 116.55 117.64 3hzx n ASP 19 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.80 3hzx n ASP 19 Cb 0.00 0.00 0.21 0.00 -1.03 0.00 0.00 41.12 40.30 3hzx n ASP 19 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3hzx h GLY 20 N 0.00 1.31 -0.22 6.12 0.00 -1.83 -3.30 103.07 105.16 3hzx h GLY 20 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3hzx h GLY 20 CO 0.00 0.36 -0.11 2.09 0.00 0.00 0.00 176.54 178.88 3hzx n ASP 21 N -4.46 0.47 -4.28 0.19 5.68 -1.26 -4.81 116.55 108.08 3hzx n ASP 21 Ca 0.13 -1.51 -0.22 0.00 -0.50 0.00 0.00 54.79 52.69 3hzx n ASP 21 Cb 0.13 -0.07 -0.12 0.00 -1.14 0.00 0.00 41.12 39.92 3hzx n ASP 21 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3hzx s THR 22 N -0.34 1.61 -0.08 2.12 -4.23 -1.24 -1.08 115.64 112.40 3hzx s THR 22 Ca 0.02 -1.63 -0.22 0.00 -1.18 0.00 0.00 61.69 58.68 3hzx s THR 22 Cb 0.02 -1.56 0.05 0.00 1.34 0.00 0.00 72.50 72.34 3hzx s THR 22 CO 0.00 -0.19 0.51 0.54 -0.54 0.00 0.00 174.62 174.93 3hzx s VAL 23 N -1.53 0.02 -0.29 2.29 0.11 -0.78 -1.94 120.40 118.29 3hzx s VAL 23 Ca 0.08 -0.17 -0.14 0.00 -2.93 0.00 0.00 61.98 58.82 3hzx s VAL 23 Cb -0.08 -0.79 -0.03 0.00 -1.53 0.00 0.00 36.38 33.94 3hzx s VAL 23 CO 0.04 -0.09 0.33 -0.75 -3.33 0.00 0.00 175.10 171.30 3hzx s LYS 24 N -0.83 3.91 0.19 1.54 2.20 0.26 -0.57 119.74 126.44 3hzx s LYS 24 Ca -0.09 -0.13 0.09 0.00 -0.36 0.00 0.00 55.97 55.48 3hzx s LYS 24 Cb -0.03 -3.69 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 3hzx s LYS 24 CO 0.05 -0.31 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.05 3hzx s LEU 25 N 2.00 2.49 -0.26 5.43 1.43 -0.16 -0.49 118.68 129.13 3hzx s LEU 25 Ca 0.13 -0.93 -0.12 0.00 -1.03 0.00 0.00 54.13 52.17 3hzx s LEU 25 Cb -0.16 -0.84 -0.05 0.00 0.03 0.00 0.00 46.19 45.17 3hzx s LEU 25 CO 0.11 -0.05 0.24 -0.32 0.23 0.00 0.00 176.35 176.56 3hzx s MET 26 N -3.13 4.02 -0.07 1.70 -2.45 0.37 -0.85 119.30 118.90 3hzx s MET 26 Ca 0.20 -0.17 0.01 0.00 -1.25 0.00 0.00 55.69 54.49 3hzx s MET 26 Cb -0.04 -3.61 0.02 0.00 1.25 0.00 0.00 34.83 32.44 3hzx s MET 26 CO 0.08 -0.12 -0.09 -0.47 1.05 0.00 0.00 175.02 175.48 3hzx s TYR 27 N 1.57 1.22 -1.64 4.11 5.04 0.07 -1.66 117.35 126.06 3hzx s TYR 27 Ca 0.10 -0.45 -0.18 0.00 -2.44 0.00 0.00 57.07 54.10 3hzx s TYR 27 Cb -0.15 -0.96 0.15 0.00 0.35 0.00 0.00 41.96 41.35 3hzx s TYR 27 CO 0.09 -0.29 0.75 1.63 -1.34 0.00 0.00 175.55 176.39 3hzx n LYS 28 N 4.09 -3.12 -0.99 4.97 5.02 -1.26 -1.36 118.16 125.50 3hzx n LYS 28 Ca -0.21 0.37 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 3hzx n LYS 28 Cb 0.51 -5.10 0.00 0.00 -0.02 0.00 0.00 35.03 30.42 3hzx n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hzx n GLY 29 N -1.34 0.61 3.12 0.72 0.00 -1.26 -5.02 105.19 102.03 3hzx n GLY 29 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 3hzx n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hzx s GLN 30 N -0.01 1.66 0.36 1.61 -1.52 -0.47 -5.09 119.66 116.20 3hzx s GLN 30 Ca 0.00 -0.58 -0.28 0.00 -1.95 0.00 0.00 55.36 52.55 3hzx s GLN 30 Cb 0.00 -1.46 -0.10 0.00 -0.22 0.00 0.00 33.01 31.23 3hzx s GLN 30 CO 0.00 0.24 1.33 -1.25 -0.25 0.00 0.00 175.29 175.36 3hzx s PRO 31 N 0.01 4.20 -0.28 2.91 0.04 -1.26 -0.75 135.00 139.86 3hzx s PRO 31 Ca -0.03 2.25 -0.17 0.00 0.04 0.00 0.00 61.00 63.09 3hzx s PRO 31 Cb -0.11 -2.96 0.09 0.00 0.04 0.00 0.00 34.50 31.57 3hzx s PRO 31 CO 0.02 -0.33 0.76 1.41 0.04 0.00 0.00 177.00 178.90 3hzx s MET 32 N -1.98 0.65 -0.04 4.56 1.75 -0.03 -4.92 119.30 119.29 3hzx s MET 32 Ca 0.52 1.07 -0.29 0.00 -1.25 0.00 0.00 55.69 55.74 3hzx s MET 32 Cb -0.40 0.15 -0.02 0.00 2.84 0.00 0.00 34.83 37.40 3hzx s MET 32 CO 0.53 -0.13 0.97 0.99 -0.65 0.00 0.00 175.02 176.73 3hzx s THR 33 N 1.43 4.85 -0.10 10.11 2.01 -1.26 -0.98 115.64 131.69 3hzx s THR 33 Ca -0.09 2.02 -0.03 0.00 0.31 0.00 0.00 61.69 63.90 3hzx s THR 33 Cb -0.05 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 68.13 3hzx s THR 33 CO -0.17 0.11 0.01 -0.36 -0.69 0.00 0.00 174.62 173.52 3hzx s PHE 34 N 1.38 3.18 -0.19 4.92 0.40 0.26 -0.79 117.98 127.14 3hzx s PHE 34 Ca 0.50 0.16 -0.05 0.00 -0.60 0.00 0.00 56.93 56.93 3hzx s PHE 34 Cb -0.20 -1.84 -0.03 0.00 0.51 0.00 0.00 43.02 41.47 3hzx s PHE 34 CO 0.24 0.41 0.00 0.50 0.70 0.00 0.00 175.22 177.07 3hzx s ARG 35 N -0.67 3.65 0.20 0.44 6.06 0.10 -1.86 118.95 126.87 3hzx s ARG 35 Ca 0.11 -0.51 -0.31 0.00 -2.50 0.00 0.00 55.73 52.52 3hzx s ARG 35 Cb -0.12 -3.08 -0.10 0.00 0.06 0.00 0.00 34.95 31.72 3hzx s ARG 35 CO 0.02 0.05 1.51 -0.51 -2.50 0.00 0.00 175.30 173.87 3hzx s LEU 36 N 0.90 4.37 0.47 -0.88 1.02 -0.24 -3.08 118.68 121.24 3hzx s LEU 36 Ca 0.01 2.63 -0.22 0.00 0.02 0.00 0.00 54.13 56.56 3hzx s LEU 36 Cb -0.14 -3.61 -0.07 0.00 0.02 0.00 0.00 46.19 42.39 3hzx s LEU 36 CO 0.02 -0.77 1.16 -0.76 0.02 0.00 0.00 176.35 176.02 3hzx s LEU 37 N 0.52 3.97 0.00 1.79 1.43 -0.55 -3.92 118.68 121.93 3hzx s LEU 37 Ca 0.65 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 56.05 3hzx s LEU 37 Cb -0.43 -4.29 0.00 0.00 0.03 0.00 0.00 46.19 41.50 3hzx s LEU 37 CO 0.36 -0.97 0.00 0.18 0.23 0.00 0.00 176.35 176.15 3hzx n LEU 38 N -0.61 0.35 -4.30 1.79 4.77 -1.25 -4.93 117.00 112.82 3hzx n LEU 38 Ca 0.08 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.90 3hzx n LEU 38 Cb 0.48 -1.02 -0.10 0.00 -2.33 0.00 0.00 43.42 40.45 3hzx n LEU 38 CO 0.47 -0.30 -0.40 0.68 -1.33 0.00 0.00 177.39 176.51 3hzx s VAL 39 N -1.99 1.30 -0.16 4.08 -7.23 -1.23 -1.34 120.40 113.83 3hzx s VAL 39 Ca 0.00 -2.09 -0.04 0.00 -1.81 0.00 0.00 61.98 58.03 3hzx s VAL 39 Cb 0.00 -2.04 0.06 0.00 0.56 0.00 0.00 36.38 34.97 3hzx s VAL 39 CO 0.00 -0.59 0.12 -0.62 -0.31 0.00 0.00 175.10 173.70 3hzx s ASP 40 N -3.25 1.88 0.43 4.85 2.15 -0.01 -4.70 116.67 118.02 3hzx s ASP 40 Ca 0.21 -0.38 -0.09 0.00 0.43 0.00 0.00 52.55 52.73 3hzx s ASP 40 Cb 0.03 -0.04 -0.05 0.00 -0.30 0.00 0.00 42.92 42.55 3hzx s ASP 40 CO 0.04 -0.33 0.77 0.42 -0.17 0.00 0.00 175.17 175.91 3hzx s THR 41 N 2.20 4.83 0.69 1.71 -4.23 -1.26 -1.60 115.64 117.99 3hzx s THR 41 Ca 0.04 0.47 -0.15 0.00 -1.18 0.00 0.00 61.69 60.86 3hzx s THR 41 Cb -0.15 -3.78 0.02 0.00 1.34 0.00 0.00 72.50 69.93 3hzx s THR 41 CO -0.09 -0.64 1.17 -2.84 -0.54 0.00 0.00 174.62 171.68 3hzx s PRO 42 N -4.17 2.44 0.71 3.99 0.02 -1.26 -4.97 135.00 131.76 3hzx s PRO 42 Ca 0.50 1.64 -0.14 0.00 0.02 0.00 0.00 61.00 63.02 3hzx s PRO 42 Cb -0.10 -1.88 0.02 0.00 0.02 0.00 0.00 34.50 32.56 3hzx s PRO 42 CO 0.36 -1.58 1.12 -1.21 -0.33 0.00 0.00 177.00 175.37 3hzx s GLU 43 N -3.90 2.50 0.36 5.54 0.41 -1.26 -4.49 118.70 117.85 3hzx s GLU 43 Ca 0.72 1.41 0.13 0.00 -0.41 0.00 0.00 54.97 56.81 3hzx s GLU 43 Cb -0.26 -1.91 0.94 0.00 -1.78 0.00 0.00 34.13 31.11 3hzx s GLU 43 CO 0.43 -1.49 1.79 0.35 -0.49 0.00 0.00 175.26 175.85 3hzx h PHE 50 N -0.36 0.82 -0.01 1.61 3.57 -1.95 0.29 116.94 120.92 3hzx h PHE 50 Ca -0.46 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.07 3hzx h PHE 50 Cb 1.25 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.75 3hzx h PHE 50 CO 0.54 0.16 -0.05 0.27 -2.23 0.00 0.00 178.31 176.99 3hzx n ASN 51 N -4.67 0.57 -4.98 0.41 6.94 -1.26 -3.50 115.26 108.77 3hzx n ASN 51 Ca 0.23 -0.91 -0.20 0.00 -0.02 0.00 0.00 54.58 53.68 3hzx n ASN 51 Cb 0.70 -0.04 0.01 0.00 -2.36 0.00 0.00 39.78 38.09 3hzx n ASN 51 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 3hzx s GLU 52 N -2.22 2.97 0.20 -3.83 2.02 0.10 -5.00 118.70 112.94 3hzx s GLU 52 Ca 0.37 -0.85 -0.32 0.00 0.02 0.00 0.00 54.97 54.18 3hzx s GLU 52 Cb 0.21 -2.68 -0.12 0.00 0.10 0.00 0.00 34.13 31.63 3hzx s GLU 52 CO 0.41 -0.21 1.68 1.17 0.02 0.00 0.00 175.26 178.33 3hzx n LYS 53 N -1.92 2.61 -0.72 1.61 4.81 -1.26 -1.03 118.16 122.26 3hzx n LYS 53 Ca 0.03 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.41 3hzx n LYS 53 Cb 0.58 -2.76 0.00 0.00 0.02 0.00 0.00 35.03 32.87 3hzx n LYS 53 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3hzx n TYR 54 N 3.68 0.00 -0.11 5.64 4.01 -1.26 -4.76 117.16 124.36 3hzx n TYR 54 Ca 0.16 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.78 3hzx n TYR 54 Cb 0.33 -0.68 -0.03 0.00 -0.31 0.00 0.00 39.34 38.65 3hzx n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3hzx h GLY 55 N 0.00 0.71 1.75 2.72 0.00 -1.21 0.94 103.07 107.98 3hzx h GLY 55 Ca 0.00 -0.60 -0.13 0.00 0.00 0.00 0.00 47.33 46.60 3hzx h GLY 55 CO 0.00 0.55 -0.51 -2.55 0.00 0.00 0.00 176.54 174.03 3hzx h PRO 56 N 0.43 0.26 -0.47 4.80 0.11 -1.71 -2.16 132.00 133.26 3hzx h PRO 56 Ca 0.08 -0.15 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 3hzx h PRO 56 Cb 0.61 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.71 3hzx h PRO 56 CO 0.04 0.71 0.24 0.93 -0.21 0.00 0.00 178.00 179.71 3hzx h GLU 57 N 0.21 0.67 -0.02 1.05 3.07 -1.88 -1.46 114.58 116.21 3hzx h GLU 57 Ca 0.01 -0.09 0.03 0.00 -0.50 0.00 0.00 59.36 58.80 3hzx h GLU 57 Cb 0.97 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.72 3hzx h GLU 57 CO 0.08 0.55 -0.17 0.00 -1.40 0.00 0.00 179.01 178.08 3hzx h ALA 58 N 1.08 -0.18 -0.99 3.43 0.00 -0.75 -0.30 119.26 121.55 3hzx h ALA 58 Ca 0.16 0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.20 3hzx h ALA 58 Cb 0.09 0.30 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 3hzx h ALA 58 CO -0.02 -0.65 0.63 0.77 0.00 0.00 0.00 179.25 179.97 3hzx h SER 59 N -0.26 0.92 0.19 0.00 0.02 -1.23 -1.58 113.55 111.60 3hzx h SER 59 Ca 0.06 0.04 -0.24 0.00 -0.84 0.00 0.00 61.79 60.81 3hzx h SER 59 Cb 0.34 -0.15 0.01 0.00 0.14 0.00 0.00 62.40 62.75 3hzx h SER 59 CO -0.17 0.50 -0.95 0.00 -1.14 0.00 0.00 176.83 175.07 3hzx h ALA 60 N 1.53 0.29 -0.39 3.77 0.00 -0.92 -1.18 119.26 122.37 3hzx h ALA 60 Ca 0.48 -0.69 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3hzx h ALA 60 Cb 0.46 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3hzx h ALA 60 CO -0.24 0.76 0.10 0.35 0.00 0.00 0.00 179.25 180.22 3hzx h PHE 61 N 0.31 0.65 -0.40 0.00 3.57 -0.48 -1.85 116.94 118.74 3hzx h PHE 61 Ca -0.09 -0.08 -0.16 0.00 3.53 0.00 0.00 57.97 61.17 3hzx h PHE 61 Cb 1.59 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 40.14 3hzx h PHE 61 CO 0.08 0.63 -0.37 1.15 -2.23 0.00 0.00 178.31 177.57 3hzx h THR 62 N 0.49 1.27 -0.19 4.41 2.02 -1.25 -1.69 112.91 117.98 3hzx h THR 62 Ca 0.12 -1.54 0.00 0.00 0.77 0.00 0.00 66.41 65.77 3hzx h THR 62 Cb 0.30 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 3hzx h THR 62 CO 0.00 0.52 0.12 0.50 0.37 0.00 0.00 175.52 177.03 3hzx h LYS 63 N 0.78 0.24 -0.41 6.66 3.64 -1.12 -2.10 116.57 124.26 3hzx h LYS 63 Ca 0.07 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.30 3hzx h LYS 63 Cb 0.96 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 3hzx h LYS 63 CO 0.09 0.16 -0.26 -0.22 -2.27 0.00 0.00 179.45 176.95 3hzx h LYS 64 N 0.25 0.91 -0.69 1.90 3.64 -1.31 0.75 116.57 122.01 3hzx h LYS 64 Ca 0.07 -0.42 -0.03 0.00 -1.27 0.00 0.00 60.65 59.00 3hzx h LYS 64 Cb -0.02 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 3hzx h LYS 64 CO -0.02 1.08 0.33 1.98 -2.27 0.00 0.00 179.45 180.54 3hzx h MET 65 N 0.73 0.98 0.20 1.90 4.05 -1.17 -1.13 114.93 120.49 3hzx h MET 65 Ca 0.08 -0.13 -0.34 0.00 -0.28 0.00 0.00 59.70 59.03 3hzx h MET 65 Cb 0.84 -0.18 0.01 0.00 -0.80 0.00 0.00 31.60 31.47 3hzx h MET 65 CO 0.07 0.76 -1.67 0.87 0.23 0.00 0.00 176.91 177.18 3hzx h LYS 66 N 0.97 0.42 0.00 0.39 6.56 -1.31 -3.15 116.57 120.45 3hzx h LYS 66 Ca 0.24 -0.71 -0.02 0.00 -1.06 0.00 0.00 60.65 59.10 3hzx h LYS 66 Cb 0.11 0.26 -0.00 0.00 -0.57 0.00 0.00 32.23 32.03 3hzx h LYS 66 CO -0.03 1.33 -0.09 0.93 -2.06 0.00 0.00 179.45 179.53 3hzx h GLU 67 N 0.11 0.00 0.00 3.15 5.08 -0.65 -2.56 114.58 119.72 3hzx h GLU 67 Ca -0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3hzx h GLU 67 Cb 2.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.36 3hzx h GLU 67 CO 0.20 0.09 -0.83 0.09 -1.00 0.00 0.00 179.01 177.56 3hzx n ASN 68 N -3.24 0.63 -4.77 1.42 4.13 -0.44 -4.91 115.26 108.08 3hzx n ASN 68 Ca 0.00 -0.14 -0.39 0.00 1.68 0.00 0.00 54.58 55.73 3hzx n ASN 68 Cb 0.33 0.53 -0.03 0.00 -1.54 0.00 0.00 39.78 39.07 3hzx n ASN 68 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3hzx s ALA 69 N -3.15 3.32 -0.48 5.41 0.00 -0.96 -4.90 121.76 120.98 3hzx s ALA 69 Ca 0.06 1.00 0.24 0.00 0.00 0.00 0.00 51.96 53.26 3hzx s ALA 69 Cb 0.15 -3.38 0.29 0.00 0.00 0.00 0.00 23.12 20.18 3hzx s ALA 69 CO 0.76 -0.42 1.35 1.57 0.00 0.00 0.00 175.76 179.02 3hzx h LYS 70 N 3.19 0.00 -2.98 0.00 2.10 -1.91 -3.45 116.57 113.52 3hzx h LYS 70 Ca -0.48 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 57.89 3hzx h LYS 70 Cb 1.22 0.00 -0.35 0.00 -0.90 0.00 0.00 32.23 32.20 3hzx h LYS 70 CO 0.65 0.00 -0.61 0.21 -2.00 0.00 0.00 179.45 177.69 3hzx s LYS 71 N -3.23 0.07 -0.14 0.07 2.20 -1.26 -5.02 119.74 112.43 3hzx s LYS 71 Ca 0.05 0.56 -0.07 0.00 -0.36 0.00 0.00 55.97 56.15 3hzx s LYS 71 Cb 0.10 -0.34 -0.04 0.00 -1.51 0.00 0.00 37.83 36.04 3hzx s LYS 71 CO 0.72 -0.34 0.09 0.42 -0.36 0.00 0.00 175.35 175.87 3hzx s ILE 72 N 2.32 5.05 0.04 5.43 -1.09 -1.26 -0.41 121.20 131.28 3hzx s ILE 72 Ca 0.03 0.05 0.05 0.00 -2.23 0.00 0.00 60.65 58.55 3hzx s ILE 72 Cb -0.12 -3.22 -0.02 0.00 -1.58 0.00 0.00 42.46 37.51 3hzx s ILE 72 CO -0.07 0.55 -0.15 -1.61 -1.23 0.00 0.00 174.94 172.43 3hzx s GLU 73 N -0.40 0.97 -0.09 2.79 2.02 -0.80 -2.24 118.70 120.95 3hzx s GLU 73 Ca 0.10 -0.78 0.00 0.00 0.02 0.00 0.00 54.97 54.31 3hzx s GLU 73 Cb -0.12 -0.99 -0.03 0.00 0.10 0.00 0.00 34.13 33.09 3hzx s GLU 73 CO 0.02 0.25 -0.07 0.14 0.02 0.00 0.00 175.26 175.61 3hzx s VAL 74 N -0.85 3.64 -0.27 2.63 -7.23 0.23 -1.36 120.40 117.19 3hzx s VAL 74 Ca 0.02 -0.49 -0.00 0.00 -1.81 0.00 0.00 61.98 59.70 3hzx s VAL 74 Cb -0.08 -2.51 0.08 0.00 0.56 0.00 0.00 36.38 34.43 3hzx s VAL 74 CO 0.01 0.57 0.03 -0.70 -0.31 0.00 0.00 175.10 174.71 3hzx s GLU 75 N -0.47 1.05 0.54 4.82 2.12 0.10 -0.08 118.70 126.79 3hzx s GLU 75 Ca 0.07 -0.99 -0.17 0.00 0.36 0.00 0.00 54.97 54.24 3hzx s GLU 75 Cb -0.12 -2.32 -0.06 0.00 0.26 0.00 0.00 34.13 31.89 3hzx s GLU 75 CO 0.02 -0.79 1.04 -0.06 -0.54 0.00 0.00 175.26 174.93 3hzx s PHE 76 N 1.53 3.08 0.00 5.30 0.40 -1.26 -1.08 117.98 125.95 3hzx s PHE 76 Ca 0.03 1.52 0.00 0.00 -0.60 0.00 0.00 56.93 57.88 3hzx s PHE 76 Cb -0.18 -2.98 0.00 0.00 0.51 0.00 0.00 43.02 40.37 3hzx s PHE 76 CO -0.14 -0.87 0.00 -3.47 0.70 0.00 0.00 175.22 171.44 3hzx n ASP 77 N -1.61 0.00 0.16 1.36 -0.08 -1.26 -4.59 116.55 110.53 3hzx n ASP 77 Ca 0.08 -0.29 0.05 0.00 -1.51 0.00 0.00 54.79 53.12 3hzx n ASP 77 Cb 0.53 0.00 0.06 0.00 2.34 0.00 0.00 41.12 44.05 3hzx n ASP 77 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3hzx h LYS 78 N 0.00 0.00 0.00 -0.67 1.79 -1.95 -3.47 116.57 112.27 3hzx h LYS 78 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3hzx h LYS 78 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3hzx h LYS 78 CO 0.00 0.39 0.00 0.41 -1.08 0.00 0.00 179.45 179.17 3hzx n GLY 79 N 1.19 1.78 3.72 3.86 0.00 0.05 -5.00 105.19 110.80 3hzx n GLY 79 Ca 0.02 -1.19 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 3hzx n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hzx s GLN 80 N 4.69 4.13 0.00 1.61 -0.21 -1.26 -4.90 119.66 123.71 3hzx s GLN 80 Ca 0.00 2.60 0.22 0.00 0.02 0.00 0.00 55.36 58.20 3hzx s GLN 80 Cb 0.00 -3.07 -0.15 0.00 1.00 0.00 0.00 33.01 30.79 3hzx s GLN 80 CO 0.00 -0.73 0.88 0.54 -2.12 0.00 0.00 175.29 173.86 3hzx n ARG 81 N 3.69 0.18 -4.16 2.91 1.74 -1.26 -4.75 116.66 115.02 3hzx n ARG 81 Ca 0.15 -0.04 -0.19 0.00 -0.77 0.00 0.00 57.85 57.00 3hzx n ARG 81 Cb 0.36 -1.52 -0.16 0.00 -1.02 0.00 0.00 32.46 30.12 3hzx n ARG 81 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3hzx s THR 82 N -3.14 0.48 0.61 0.55 2.01 -1.26 -0.26 115.64 114.63 3hzx s THR 82 Ca 0.04 -0.14 -0.03 0.00 0.31 0.00 0.00 61.69 61.87 3hzx s THR 82 Cb 0.15 -0.48 0.13 0.00 0.01 0.00 0.00 72.50 72.31 3hzx s THR 82 CO 0.85 0.19 0.83 -0.90 -0.69 0.00 0.00 174.62 174.90 3hzx n ASP 83 N 3.71 0.79 0.23 3.53 5.68 0.76 -4.92 116.55 126.33 3hzx n ASP 83 Ca -0.22 -1.74 0.16 0.00 -0.50 0.00 0.00 54.79 52.48 3hzx n ASP 83 Cb 0.53 -0.57 0.69 0.00 -1.14 0.00 0.00 41.12 40.63 3hzx n ASP 83 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 3hzx h LYS 84 N 0.00 0.00 -0.40 0.11 2.10 -2.02 -0.33 116.57 116.03 3hzx h LYS 84 Ca -0.27 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.38 3hzx h LYS 84 Cb 0.93 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.26 3hzx h LYS 84 CO 0.26 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.37 3hzx n TYR 85 N -2.72 0.52 -0.97 0.07 4.02 -1.26 -4.93 117.16 111.89 3hzx n TYR 85 Ca 0.00 -0.26 0.00 0.00 -0.01 0.00 0.00 57.90 57.63 3hzx n TYR 85 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 3hzx n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3hzx n GLY 86 N 1.23 0.73 3.73 2.72 0.00 -0.13 -5.02 105.19 108.46 3hzx n GLY 86 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3hzx n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hzx s ARG 87 N -0.03 4.61 0.36 1.61 0.52 -1.26 -4.77 118.95 120.00 3hzx s ARG 87 Ca 0.00 1.58 -0.28 0.00 -0.52 0.00 0.00 55.73 56.51 3hzx s ARG 87 Cb 0.00 -3.35 -0.11 0.00 0.52 0.00 0.00 34.95 32.02 3hzx s ARG 87 CO 0.00 0.08 1.45 0.20 0.02 0.00 0.00 175.30 177.05 3hzx s GLY 88 N 0.20 2.93 -0.23 -3.53 0.00 0.03 -0.17 107.32 106.55 3hzx s GLY 88 Ca 0.50 1.51 -0.02 0.00 0.00 0.00 0.00 44.72 46.70 3hzx s GLY 88 CO 0.31 2.20 -0.08 1.08 0.00 0.00 0.00 173.10 176.61 3hzx s LEU 89 N -1.97 2.94 0.19 0.66 1.43 0.64 0.01 118.68 122.58 3hzx s LEU 89 Ca 0.52 -0.69 -0.20 0.00 -1.03 0.00 0.00 54.13 52.74 3hzx s LEU 89 Cb -0.45 -1.66 0.04 0.00 0.03 0.00 0.00 46.19 44.15 3hzx s LEU 89 CO 0.60 -0.08 0.57 0.00 0.23 0.00 0.00 176.35 177.68 3hzx s ALA 90 N 1.37 -1.22 -0.10 4.21 0.00 -1.18 -4.54 121.76 120.30 3hzx s ALA 90 Ca 0.03 0.04 -0.24 0.00 0.00 0.00 0.00 51.96 51.79 3hzx s ALA 90 Cb -0.15 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 3hzx s ALA 90 CO -0.05 -0.81 0.73 0.71 0.00 0.00 0.00 175.76 176.33 3hzx s TYR 91 N -3.83 3.52 -0.10 0.00 2.02 -0.24 -1.48 117.35 117.24 3hzx s TYR 91 Ca 0.06 1.22 0.01 0.00 -0.37 0.00 0.00 57.07 57.99 3hzx s TYR 91 Cb -0.01 -2.86 -0.02 0.00 -0.40 0.00 0.00 41.96 38.67 3hzx s TYR 91 CO -0.06 -0.02 -0.13 0.42 -1.57 0.00 0.00 175.55 174.19 3hzx s ILE 92 N 1.26 3.09 0.02 2.71 -1.09 -1.26 -0.72 121.20 125.21 3hzx s ILE 92 Ca 0.37 -0.67 0.07 0.00 -2.23 0.00 0.00 60.65 58.19 3hzx s ILE 92 Cb -0.17 -2.27 -0.03 0.00 -1.58 0.00 0.00 42.46 38.41 3hzx s ILE 92 CO 0.16 0.55 -0.18 -0.31 -1.23 0.00 0.00 174.94 173.92 3hzx s TYR 93 N -0.01 2.56 -0.23 3.97 2.02 -0.47 0.11 117.35 125.29 3hzx s TYR 93 Ca -0.03 -0.26 0.01 0.00 -0.37 0.00 0.00 57.07 56.42 3hzx s TYR 93 Cb -0.14 -1.49 0.06 0.00 -0.40 0.00 0.00 41.96 39.98 3hzx s TYR 93 CO 0.04 0.21 -0.07 0.00 -1.57 0.00 0.00 175.55 174.17 3hzx s ALA 94 N -0.86 2.01 -1.36 3.71 0.00 0.99 -1.91 121.76 124.32 3hzx s ALA 94 Ca 0.14 -1.35 -0.01 0.00 0.00 0.00 0.00 51.96 50.73 3hzx s ALA 94 Cb -0.10 -1.41 -0.00 0.00 0.00 0.00 0.00 23.12 21.60 3hzx s ALA 94 CO 0.04 -1.12 0.50 -0.25 0.00 0.00 0.00 175.76 174.93 3hzx n ASP 95 N 4.66 -0.81 0.00 0.00 8.00 0.45 -1.39 116.55 127.45 3hzx n ASP 95 Ca -0.13 -0.96 0.00 0.00 0.71 0.00 0.00 54.79 54.41 3hzx n ASP 95 Cb 0.44 -3.31 0.00 0.00 -0.02 0.00 0.00 41.12 38.24 3hzx n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hzx n GLY 96 N -1.87 1.56 3.64 0.44 0.00 -1.26 -5.00 105.19 102.69 3hzx n GLY 96 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 3hzx n GLY 96 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hzx s LYS 97 N -0.06 3.75 -0.18 1.61 2.20 -0.49 -5.03 119.74 121.55 3hzx s LYS 97 Ca 0.00 -0.36 -0.29 0.00 -0.36 0.00 0.00 55.97 54.96 3hzx s LYS 97 Cb 0.00 -3.11 -0.01 0.00 -1.51 0.00 0.00 37.83 33.21 3hzx s LYS 97 CO 0.00 0.37 1.18 1.41 -0.36 0.00 0.00 175.35 177.95 3hzx s MET 98 N 0.08 4.25 0.21 4.03 -2.45 -1.26 -0.01 119.30 124.15 3hzx s MET 98 Ca 0.04 1.56 -0.09 0.00 -1.25 0.00 0.00 55.69 55.95 3hzx s MET 98 Cb -0.12 -3.71 0.15 0.00 1.25 0.00 0.00 34.83 32.40 3hzx s MET 98 CO 0.01 -0.66 1.79 0.28 1.05 0.00 0.00 175.02 177.49 3hzx h VAL 99 N 5.45 1.25 -0.48 10.11 2.07 -0.69 -1.84 116.25 132.12 3hzx h VAL 99 Ca -0.24 -0.71 0.04 0.00 0.82 0.00 0.00 66.70 66.60 3hzx h VAL 99 Cb 1.09 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 3hzx h VAL 99 CO 0.97 0.30 0.24 0.78 0.02 0.00 0.00 177.57 179.87 3hzx h ASN 100 N 1.10 0.34 -0.30 0.57 4.21 -1.91 -0.45 115.58 119.12 3hzx h ASN 100 Ca 0.26 0.03 -0.07 0.00 1.21 0.00 0.00 56.30 57.73 3hzx h ASN 100 Cb 0.14 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.29 3hzx h ASN 100 CO -0.03 0.24 -0.10 -0.08 -1.29 0.00 0.00 177.43 176.17 3hzx h GLU 101 N 0.47 0.61 -0.94 0.81 4.81 -1.90 -2.81 114.58 115.63 3hzx h GLU 101 Ca 0.21 -0.25 0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3hzx h GLU 101 Cb 0.12 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.43 3hzx h GLU 101 CO -0.15 0.81 0.62 0.00 -0.73 0.00 0.00 179.01 179.56 3hzx h ALA 102 N 0.78 1.19 -0.37 2.92 0.00 -1.04 0.13 119.26 122.87 3hzx h ALA 102 Ca 0.07 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3hzx h ALA 102 Cb 0.60 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3hzx h ALA 102 CO 0.04 0.59 0.16 -0.07 0.00 0.00 0.00 179.25 179.97 3hzx h LEU 103 N 1.27 0.22 -0.37 0.00 3.38 -1.03 -2.27 115.31 116.52 3hzx h LEU 103 Ca 0.34 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.25 3hzx h LEU 103 Cb -0.14 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3hzx h LEU 103 CO -0.07 0.17 -0.14 0.58 0.09 0.00 0.00 178.44 179.06 3hzx h VAL 104 N 0.34 1.28 0.00 1.22 2.07 -1.16 -0.60 116.25 119.40 3hzx h VAL 104 Ca 0.16 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 3hzx h VAL 104 Cb 0.10 1.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 3hzx h VAL 104 CO -0.14 0.41 -0.14 -0.09 0.02 0.00 0.00 177.57 177.64 3hzx h ARG 105 N 0.54 0.00 -0.16 1.57 9.65 -0.58 -0.29 114.38 125.11 3hzx h ARG 105 Ca 0.09 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 3hzx h ARG 105 Cb 0.68 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.26 3hzx h ARG 105 CO 0.05 0.14 0.00 1.04 2.80 0.00 0.00 179.97 184.00 3hzx n GLN 106 N -4.05 1.89 -1.82 0.20 1.13 -0.87 -4.25 117.38 109.60 3hzx n GLN 106 Ca -0.02 -1.32 -0.11 0.00 -1.94 0.00 0.00 57.00 53.61 3hzx n GLN 106 Cb 0.22 -1.44 -0.02 0.00 0.11 0.00 0.00 30.24 29.12 3hzx n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hzx n GLY 107 N 1.22 0.47 0.45 1.08 0.00 -0.12 -4.43 105.19 103.86 3hzx n GLY 107 Ca 0.17 -0.48 0.09 0.00 0.00 0.00 0.00 46.02 45.80 3hzx n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hzx n LEU 108 N -1.41 1.86 -3.87 0.99 4.77 -0.26 -1.65 117.00 117.43 3hzx n LEU 108 Ca -0.12 -0.81 -0.11 0.00 -0.03 0.00 0.00 56.01 54.95 3hzx n LEU 108 Cb 0.49 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.49 3hzx n LEU 108 CO 0.16 0.35 -0.14 0.00 -1.33 0.00 0.00 177.39 176.42 3hzx s ALA 109 N -1.93 -0.31 0.05 -1.18 0.00 -1.16 -4.32 121.76 112.92 3hzx s ALA 109 Ca 0.16 -0.25 -0.05 0.00 0.00 0.00 0.00 51.96 51.81 3hzx s ALA 109 Cb 0.14 0.20 -0.05 0.00 0.00 0.00 0.00 23.12 23.41 3hzx s ALA 109 CO 0.40 -0.29 0.29 0.15 0.00 0.00 0.00 175.76 176.31 3hzx s LYS 110 N -2.06 3.57 0.23 0.00 1.02 -0.62 -4.43 119.74 117.44 3hzx s LYS 110 Ca -0.09 -0.13 -0.30 0.00 0.02 0.00 0.00 55.97 55.46 3hzx s LYS 110 Cb -0.04 -3.01 -0.10 0.00 -0.52 0.00 0.00 37.83 34.16 3hzx s LYS 110 CO -0.01 0.59 1.51 0.08 -0.92 0.00 0.00 175.35 176.59 3hzx s VAL 111 N -1.43 2.53 0.10 3.17 1.01 -1.26 -0.83 120.40 123.68 3hzx s VAL 111 Ca 0.32 0.43 -0.26 0.00 0.00 0.00 0.00 61.98 62.47 3hzx s VAL 111 Cb -0.13 -3.27 0.08 0.00 0.00 0.00 0.00 36.38 33.06 3hzx s VAL 111 CO 0.20 0.06 0.85 0.00 0.00 0.00 0.00 175.10 176.21 3hzx s ALA 112 N 0.32 -1.68 -1.28 5.51 0.00 -0.45 -4.84 121.76 119.33 3hzx s ALA 112 Ca 0.63 0.53 -0.01 0.00 0.00 0.00 0.00 51.96 53.11 3hzx s ALA 112 Cb -0.44 0.60 -0.00 0.00 0.00 0.00 0.00 23.12 23.28 3hzx s ALA 112 CO 0.41 -0.84 0.73 0.66 0.00 0.00 0.00 175.76 176.71 3hzx n TYR 113 N -0.36 -1.94 -3.13 0.00 4.01 -1.26 -3.47 117.16 111.00 3hzx n TYR 113 Ca -0.09 0.83 -0.45 0.00 -0.16 0.00 0.00 57.90 58.03 3hzx n TYR 113 Cb 0.62 -4.37 -0.04 0.00 -0.31 0.00 0.00 39.34 35.23 3hzx n TYR 113 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3hzx s VAL 114 N -3.64 4.89 -0.03 -0.72 1.01 -1.26 -4.31 120.40 116.34 3hzx s VAL 114 Ca 0.04 -1.12 -0.01 0.00 0.00 0.00 0.00 61.98 60.89 3hzx s VAL 114 Cb -0.01 -4.48 -0.04 0.00 0.00 0.00 0.00 36.38 31.85 3hzx s VAL 114 CO 0.81 -1.11 0.06 -0.31 0.00 0.00 0.00 175.10 174.55 3hzx s TYR 115 N 2.48 3.26 0.20 5.22 2.02 -1.26 -5.05 117.35 124.22 3hzx s TYR 115 Ca 0.11 0.22 -0.32 0.00 -0.37 0.00 0.00 57.07 56.71 3hzx s TYR 115 Cb -0.24 -1.76 -0.15 0.00 -0.40 0.00 0.00 41.96 39.42 3hzx s TYR 115 CO 0.05 0.54 1.22 1.17 -1.57 0.00 0.00 175.55 176.96 3hzx n LYS 116 N 1.48 1.44 -0.48 -0.62 4.81 -1.26 -1.76 118.16 121.77 3hzx n LYS 116 Ca -0.15 0.51 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 3hzx n LYS 116 Cb 0.53 -2.04 0.00 0.00 0.02 0.00 0.00 35.03 33.54 3hzx n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hzx n GLY 117 N 1.97 2.01 2.66 3.14 0.00 -1.26 -4.80 105.19 108.91 3hzx n GLY 117 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 3hzx n GLY 117 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hzx n ASN 118 N 0.00 3.27 -1.23 1.61 3.02 -0.72 -0.77 115.26 120.44 3hzx n ASN 118 Ca 0.00 -3.44 0.03 0.00 -0.03 0.00 0.00 54.58 51.14 3hzx n ASN 118 Cb 0.00 -0.57 0.01 0.00 -0.61 0.00 0.00 39.78 38.62 3hzx n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 3hzx n ASN 119 N -0.10 0.68 -0.24 6.41 6.94 -1.25 -4.39 115.26 123.31 3hzx n ASN 119 Ca 0.29 -1.99 0.02 0.00 -0.02 0.00 0.00 54.58 52.88 3hzx n ASN 119 Cb 0.52 -0.26 0.15 0.00 -2.36 0.00 0.00 39.78 37.83 3hzx n ASN 119 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 3hzx h THR 120 N 6.92 0.76 -0.61 5.53 2.02 -1.94 -2.19 112.91 123.41 3hzx h THR 120 Ca -0.18 -0.17 -0.10 0.00 0.77 0.00 0.00 66.41 66.72 3hzx h THR 120 Cb 1.75 0.21 -0.06 0.00 -1.74 0.00 0.00 68.15 68.31 3hzx h THR 120 CO 0.06 0.09 0.13 1.41 0.37 0.00 0.00 175.52 177.59 3hzx n HIS 121 N -4.94 2.10 -0.01 3.16 8.25 -1.26 -4.50 115.22 118.02 3hzx n HIS 121 Ca 0.12 -0.89 -0.10 0.00 -0.26 0.00 0.00 57.72 56.58 3hzx n HIS 121 Cb 0.32 -0.57 -0.04 0.00 1.12 0.00 0.00 29.99 30.82 3hzx n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 3hzx h GLU 122 N 3.06 0.09 -0.28 -0.41 4.81 -1.77 -1.76 114.58 118.32 3hzx h GLU 122 Ca 0.13 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.20 3hzx h GLU 122 Cb 2.04 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.39 3hzx h GLU 122 CO 0.57 0.06 -0.43 1.96 -0.73 0.00 0.00 179.01 180.44 3hzx h GLN 123 N 0.10 0.70 -0.38 1.92 1.08 -1.83 0.17 115.11 116.87 3hzx h GLN 123 Ca 0.06 -0.38 0.07 0.00 -1.45 0.00 0.00 58.65 56.95 3hzx h GLN 123 Cb 0.04 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.42 3hzx h GLN 123 CO -0.07 0.99 -0.03 1.25 -0.95 0.00 0.00 178.83 180.03 3hzx h LEU 124 N 0.56 -0.21 -0.62 1.46 5.85 -1.85 -1.42 115.31 119.08 3hzx h LEU 124 Ca 0.04 0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.73 3hzx h LEU 124 Cb 0.98 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 3hzx h LEU 124 CO 0.09 -0.07 -0.26 -0.07 -0.34 0.00 0.00 178.44 177.80 3hzx h LEU 125 N 0.07 0.84 -1.48 2.25 3.38 -0.74 -2.26 115.31 117.36 3hzx h LEU 125 Ca 0.19 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 3hzx h LEU 125 Cb 0.27 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3hzx h LEU 125 CO -0.33 1.05 -0.18 0.03 0.09 0.00 0.00 178.44 179.09 3hzx h ARG 126 N 0.70 0.11 -0.12 1.13 3.08 -0.39 -0.46 114.38 118.43 3hzx h ARG 126 Ca 0.09 -0.02 -0.18 0.00 0.07 0.00 0.00 59.98 59.94 3hzx h ARG 126 Cb 0.79 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 3hzx h ARG 126 CO 0.07 0.29 -0.67 -0.22 -1.07 0.00 0.00 179.97 178.37 3hzx h LYS 127 N 0.10 0.47 -0.61 0.04 1.63 -1.00 -0.39 116.57 116.82 3hzx h LYS 127 Ca 0.02 -0.35 -0.03 0.00 -0.85 0.00 0.00 60.65 59.43 3hzx h LYS 127 Cb 0.39 0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.05 3hzx h LYS 127 CO 0.03 0.98 0.25 0.00 -3.45 0.00 0.00 179.45 177.25 3hzx h ALA 128 N 0.93 0.79 -0.42 5.00 0.00 -0.89 -2.12 119.26 122.55 3hzx h ALA 128 Ca -0.02 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3hzx h ALA 128 Cb 1.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3hzx h ALA 128 CO 0.12 0.40 -0.04 1.49 0.00 0.00 0.00 179.25 181.22 3hzx h GLU 129 N 0.84 0.76 -0.56 0.00 4.81 -0.81 -0.00 114.58 119.62 3hzx h GLU 129 Ca 0.20 -0.26 0.11 0.00 -0.13 0.00 0.00 59.36 59.28 3hzx h GLU 129 Cb 0.20 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 29.43 3hzx h GLU 129 CO -0.02 0.86 0.06 0.00 -0.73 0.00 0.00 179.01 179.19 3hzx h ALA 130 N 0.88 0.60 -0.32 2.92 0.00 -0.86 0.23 119.26 122.70 3hzx h ALA 130 Ca 0.11 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 3hzx h ALA 130 Cb 0.54 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3hzx h ALA 130 CO 0.03 -0.35 -0.07 1.96 0.00 0.00 0.00 179.25 180.82 3hzx h GLN 131 N 0.18 0.62 -0.64 0.00 4.20 -1.08 -0.72 115.11 117.67 3hzx h GLN 131 Ca 0.29 -0.23 0.08 0.00 0.06 0.00 0.00 58.65 58.85 3hzx h GLN 131 Cb 0.44 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.12 3hzx h GLN 131 CO -0.42 0.79 0.31 0.00 -0.67 0.00 0.00 178.83 178.84 3hzx h ALA 132 N 0.81 0.86 -0.22 3.87 0.00 -0.49 -0.68 119.26 123.42 3hzx h ALA 132 Ca 0.08 0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 3hzx h ALA 132 Cb 0.56 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3hzx h ALA 132 CO 0.03 -0.07 -0.55 -0.22 0.00 0.00 0.00 179.25 178.44 3hzx h LYS 133 N 0.55 0.68 -0.31 0.00 3.64 -0.33 -1.18 116.57 119.62 3hzx h LYS 133 Ca 0.31 -0.43 0.04 0.00 -1.27 0.00 0.00 60.65 59.29 3hzx h LYS 133 Cb 0.30 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 3hzx h LYS 133 CO -0.24 1.05 0.10 -0.22 -2.27 0.00 0.00 179.45 177.87 3hzx h LYS 134 N 0.52 0.22 0.00 1.90 3.64 -0.68 -0.39 116.57 121.79 3hzx h LYS 134 Ca 0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hzx h LYS 134 Cb 1.12 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 3hzx h LYS 134 CO 0.11 0.15 0.00 0.39 -2.27 0.00 0.00 179.45 177.83 3hzx n GLU 135 N -5.04 0.72 -4.07 1.90 1.02 -0.30 -4.89 120.64 109.99 3hzx n GLU 135 Ca -0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 3hzx n GLU 135 Cb 0.11 -1.48 -0.01 0.00 -0.02 0.00 0.00 31.44 30.05 3hzx n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hzx n LYS 136 N -0.98 -3.88 -2.56 3.49 4.76 -0.16 -4.90 118.16 113.94 3hzx n LYS 136 Ca 0.17 0.45 -0.42 0.00 -2.87 0.00 0.00 58.31 55.63 3hzx n LYS 136 Cb 0.08 -5.08 -0.03 0.00 -1.84 0.00 0.00 35.03 28.15 3hzx n LYS 136 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3hzx s LEU 137 N -7.19 4.40 0.00 -0.35 1.43 -0.52 -3.22 118.68 113.23 3hzx s LEU 137 Ca 0.53 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 55.52 3hzx s LEU 137 Cb -0.28 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.36 3hzx s LEU 137 CO 0.89 -0.34 0.00 0.59 0.23 0.00 0.00 176.35 177.72 3hzx n ASN 138 N 3.62 0.00 0.27 2.29 3.02 -1.26 -0.40 115.26 122.80 3hzx n ASN 138 Ca 0.07 0.00 0.15 0.00 -0.03 0.00 0.00 54.58 54.76 3hzx n ASN 138 Cb 0.48 0.00 0.86 0.00 -0.61 0.00 0.00 39.78 40.51 3hzx n ASN 138 CO 0.00 0.00 0.00 0.16 -2.62 0.00 0.00 177.26 174.80 3hzx h ILE 139 N 0.00 0.58 -0.19 2.41 3.07 -1.62 -1.52 117.51 120.23 3hzx h ILE 139 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 3hzx h ILE 139 Cb 0.00 0.96 0.00 0.00 -0.27 0.00 0.00 36.82 37.51 3hzx h ILE 139 CO 0.00 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 177.89 3hzx n TRP 140 N -3.93 0.25 1.78 0.16 7.02 0.46 -5.14 117.44 118.03 3hzx n TRP 140 Ca -0.02 -0.12 0.15 0.00 -1.02 0.00 0.00 57.50 56.49 3hzx n TRP 140 Cb 0.14 0.00 0.76 0.00 -2.42 0.00 0.00 31.31 29.79 3hzx n TRP 140 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54