#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hzb n VAL 2 N 0.00 0.00 -3.88 2.53 0.24 -0.44 -4.96 118.33 111.82 3hzb n VAL 2 Ca 0.00 -0.25 -0.14 0.00 -2.04 0.00 0.00 64.34 61.91 3hzb n VAL 2 Cb 0.00 0.83 -0.15 0.00 -1.47 0.00 0.00 33.84 33.05 3hzb n VAL 2 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3hzb s ILE 3 N -2.16 0.05 -0.11 1.34 1.01 -0.90 -0.48 121.20 119.95 3hzb s ILE 3 Ca 0.02 0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.75 3hzb s ILE 3 Cb 0.08 -0.11 0.01 0.00 0.01 0.00 0.00 42.46 42.45 3hzb s ILE 3 CO 0.43 0.07 -0.15 -0.89 0.00 0.00 0.00 174.94 174.40 3hzb s THR 4 N 0.53 1.49 -0.16 2.92 2.01 -0.86 0.50 115.64 122.08 3hzb s THR 4 Ca -0.05 -0.64 -0.06 0.00 0.31 0.00 0.00 61.69 61.25 3hzb s THR 4 Cb -0.07 -1.37 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 3hzb s THR 4 CO -0.01 0.44 0.05 0.68 -0.69 0.00 0.00 174.62 175.09 3hzb s VAL 5 N 1.01 4.74 0.06 3.82 -7.23 -0.05 -1.13 120.40 121.63 3hzb s VAL 5 Ca -0.06 -0.06 0.05 0.00 -1.81 0.00 0.00 61.98 60.10 3hzb s VAL 5 Cb -0.15 -3.10 -0.04 0.00 0.56 0.00 0.00 36.38 33.65 3hzb s VAL 5 CO -0.02 0.51 -0.06 -0.31 -0.31 0.00 0.00 175.10 174.91 3hzb s TYR 6 N -0.02 2.87 0.16 2.82 1.51 0.52 -0.89 117.35 124.32 3hzb s TYR 6 Ca 0.06 -0.08 -0.11 0.00 -1.01 0.00 0.00 57.07 55.94 3hzb s TYR 6 Cb -0.12 -1.53 0.03 0.00 -0.11 0.00 0.00 41.96 40.23 3hzb s TYR 6 CO 0.01 0.42 1.60 -0.22 -1.11 0.00 0.00 175.55 176.25 3hzb h LYS 7 N 3.89 0.98 -6.07 -0.62 3.64 -0.93 -0.14 116.57 117.32 3hzb h LYS 7 Ca -0.48 -0.35 -0.52 0.00 -1.27 0.00 0.00 60.65 58.03 3hzb h LYS 7 Cb 1.17 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.86 3hzb h LYS 7 CO 0.55 1.02 -0.41 -0.51 -2.27 0.00 0.00 179.45 177.83 3hzb s ASP 8 N -6.54 4.82 0.71 4.20 1.01 -0.31 -3.44 116.67 117.11 3hzb s ASP 8 Ca -0.12 -0.89 -0.11 0.00 0.71 0.00 0.00 52.55 52.15 3hzb s ASP 8 Cb 0.12 -0.47 0.02 0.00 1.01 0.00 0.00 42.92 43.60 3hzb s ASP 8 CO 0.85 -0.65 1.07 0.00 0.21 0.00 0.00 175.17 176.64 3hzb n ASN 10 N -3.19 -3.77 -3.70 0.00 5.03 0.22 -3.68 115.26 106.18 3hzb n ASN 10 Ca 0.08 -0.01 -0.22 0.00 0.87 0.00 0.00 54.58 55.29 3hzb n ASN 10 Cb 0.54 -2.98 0.04 0.00 -1.02 0.00 0.00 39.78 36.35 3hzb n ASN 10 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3hzb n TYR 11 N -4.00 -2.05 -4.41 3.10 4.02 -1.25 -5.01 117.16 107.56 3hzb n TYR 11 Ca -0.14 0.87 -0.20 0.00 -0.01 0.00 0.00 57.90 58.42 3hzb n TYR 11 Cb 0.60 -4.44 -0.10 0.00 -0.02 0.00 0.00 39.34 35.38 3hzb n TYR 11 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 3hzb s THR 12 N -3.56 0.97 0.00 -0.72 -4.23 -1.24 -5.05 115.64 101.81 3hzb s THR 12 Ca 0.13 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 3hzb s THR 12 Cb -0.07 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 71.04 3hzb s THR 12 CO 0.80 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.49 3hzb n GLY 13 N -0.62 -0.78 3.61 3.99 0.00 -1.26 -1.16 105.19 108.97 3hzb n GLY 13 Ca -0.01 -1.70 -0.49 0.00 0.00 0.00 0.00 46.02 43.82 3hzb n GLY 13 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3hzb n PHE 14 N -0.84 1.64 -4.40 1.61 7.35 -1.26 -4.37 117.46 117.19 3hzb n PHE 14 Ca 0.00 0.57 -0.23 0.00 -0.76 0.00 0.00 57.45 57.03 3hzb n PHE 14 Cb 0.00 -2.36 -0.11 0.00 0.35 0.00 0.00 39.48 37.36 3hzb n PHE 14 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 3hzb s SER 15 N 0.33 3.11 -0.02 -2.13 1.04 -1.26 -0.67 113.70 114.10 3hzb s SER 15 Ca 0.77 -0.93 0.02 0.00 0.48 0.00 0.00 55.95 56.29 3hzb s SER 15 Cb -0.83 -0.22 0.01 0.00 0.10 0.00 0.00 66.02 65.08 3hzb s SER 15 CO 0.48 0.01 -0.07 -0.83 0.98 0.00 0.00 173.24 173.80 3hzb s GLY 16 N -2.99 0.46 -0.16 7.32 0.00 -0.07 -4.95 107.32 106.93 3hzb s GLY 16 Ca 0.22 -0.26 -0.13 0.00 0.00 0.00 0.00 44.72 44.56 3hzb s GLY 16 CO 0.10 -0.01 0.25 -0.32 0.00 0.00 0.00 173.10 173.12 3hzb s GLY 17 N 0.27 2.18 0.14 0.20 0.00 -1.26 -0.87 107.32 107.98 3hzb s GLY 17 Ca -0.04 -0.50 0.11 0.00 0.00 0.00 0.00 44.72 44.28 3hzb s GLY 17 CO 0.00 0.31 -0.25 1.08 0.00 0.00 0.00 173.10 174.24 3hzb s LEU 18 N 0.28 2.41 0.50 0.66 1.43 0.18 -5.00 118.68 119.14 3hzb s LEU 18 Ca 0.15 -0.73 0.01 0.00 -1.03 0.00 0.00 54.13 52.53 3hzb s LEU 18 Cb -0.13 -1.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.82 3hzb s LEU 18 CO 0.03 0.17 0.03 0.42 0.23 0.00 0.00 176.35 177.23 3hzb s THR 19 N -1.17 0.92 0.24 5.49 -4.23 -1.26 -1.33 115.64 114.29 3hzb s THR 19 Ca 0.16 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.35 3hzb s THR 19 Cb -0.10 -2.09 -0.13 0.00 1.34 0.00 0.00 72.50 71.52 3hzb s THR 19 CO 0.07 0.00 1.42 -0.38 -0.54 0.00 0.00 174.62 175.19 3hzb n ILE 20 N -1.23 0.90 -0.48 2.99 2.08 -1.26 -4.66 119.36 117.71 3hzb n ILE 20 Ca -0.18 -0.23 0.00 0.00 0.56 0.00 0.00 62.75 62.90 3hzb n ILE 20 Cb 0.66 -1.49 0.00 0.00 -0.75 0.00 0.00 39.64 38.06 3hzb n ILE 20 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3hzb n GLY 21 N 2.22 0.62 3.63 7.39 0.00 -0.56 -4.96 105.19 113.54 3hzb n GLY 21 Ca 0.12 -1.82 -0.35 0.00 0.00 0.00 0.00 46.02 43.97 3hzb n GLY 21 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hzb s ASP 22 N -3.33 5.15 -0.36 1.61 1.01 -1.26 -0.67 116.67 118.83 3hzb s ASP 22 Ca 0.00 0.07 0.01 0.00 0.71 0.00 0.00 52.55 53.35 3hzb s ASP 22 Cb 0.00 -1.57 0.11 0.00 1.01 0.00 0.00 42.92 42.47 3hzb s ASP 22 CO 0.00 0.31 0.13 -0.31 0.21 0.00 0.00 175.17 175.51 3hzb s TYR 23 N -0.48 2.43 0.98 4.23 1.51 0.87 -5.02 117.35 121.86 3hzb s TYR 23 Ca 0.08 -2.33 -0.16 0.00 -1.01 0.00 0.00 57.07 53.66 3hzb s TYR 23 Cb -0.12 -2.16 0.22 0.00 -0.11 0.00 0.00 41.96 39.79 3hzb s TYR 23 CO 0.02 -0.87 1.33 0.54 -1.11 0.00 0.00 175.55 175.47 3hzb s ASN 24 N 1.01 2.89 0.19 2.29 6.03 -1.26 -0.70 114.94 125.39 3hzb s ASN 24 Ca 0.12 0.10 -0.12 0.00 -1.03 0.00 0.00 52.86 51.93 3hzb s ASN 24 Cb -0.20 -0.06 0.17 0.00 -3.03 0.00 0.00 41.25 38.14 3hzb s ASN 24 CO -0.13 -2.86 1.78 0.25 -2.03 0.00 0.00 177.10 174.11 3hzb h LEU 25 N -1.70 0.39 -0.72 3.54 6.46 -1.92 -1.75 115.31 119.60 3hzb h LEU 25 Ca -0.43 0.03 0.10 0.00 -0.12 0.00 0.00 57.88 57.47 3hzb h LEU 25 Cb 1.21 -0.04 -0.08 0.00 -0.73 0.00 0.00 40.66 41.03 3hzb h LEU 25 CO 0.32 0.26 0.34 0.00 -0.62 0.00 0.00 178.44 178.74 3hzb h ALA 26 N 1.30 0.99 -0.28 1.25 0.00 -1.92 -0.09 119.26 120.51 3hzb h ALA 26 Ca 0.25 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 3hzb h ALA 26 Cb 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3hzb h ALA 26 CO -0.18 -0.09 -0.37 -0.09 0.00 0.00 0.00 179.25 178.52 3hzb h ARG 27 N 0.56 0.65 -0.77 0.00 2.43 -1.75 -2.14 114.38 113.36 3hzb h ARG 27 Ca 0.36 -0.32 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 3hzb h ARG 27 Cb 0.43 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 3hzb h ARG 27 CO -0.30 0.92 0.27 -0.07 -1.51 0.00 0.00 179.97 179.27 3hzb h LEU 28 N 0.54 1.10 -1.60 3.80 3.38 -0.46 -2.35 115.31 119.72 3hzb h LEU 28 Ca 0.05 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 3hzb h LEU 28 Cb 0.89 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3hzb h LEU 28 CO 0.08 1.00 -0.08 0.78 0.09 0.00 0.00 178.44 180.31 3hzb h ASN 29 N 1.14 0.15 0.43 -0.43 4.21 -0.75 -0.67 115.58 119.65 3hzb h ASN 29 Ca 0.25 -0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.74 3hzb h ASN 29 Cb 0.28 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.44 3hzb h ASN 29 CO -0.01 0.25 0.00 -1.54 -1.29 0.00 0.00 177.43 174.84 3hzb n SER 30 N -4.36 0.64 -0.53 5.81 3.41 -0.83 -0.74 113.62 117.02 3hzb n SER 30 Ca -0.01 0.71 0.10 0.00 -0.26 0.00 0.00 58.87 59.41 3hzb n SER 30 Cb 0.21 -0.83 0.02 0.00 -0.26 0.00 0.00 64.21 63.35 3hzb n SER 30 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hzb n LEU 31 N -2.27 2.06 0.00 1.04 4.77 -0.38 -4.95 117.00 117.27 3hzb n LEU 31 Ca 0.01 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 55.16 3hzb n LEU 31 Cb 0.15 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 3hzb n LEU 31 CO 0.16 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3hzb n GLY 32 N 1.24 0.75 3.68 -0.72 0.00 0.08 -4.83 105.19 105.39 3hzb n GLY 32 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 3hzb n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hzb s VAL 33 N -2.56 4.92 0.44 1.61 1.01 -0.51 -4.95 120.40 120.37 3hzb s VAL 33 Ca 0.00 1.56 -0.06 0.00 0.00 0.00 0.00 61.98 63.48 3hzb s VAL 33 Cb 0.00 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3hzb s VAL 33 CO 0.00 0.08 0.76 -0.76 0.00 0.00 0.00 175.10 175.17 3hzb s LEU 34 N 1.88 3.72 0.57 3.92 1.43 -1.26 -2.86 118.68 126.08 3hzb s LEU 34 Ca 0.37 0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 54.24 3hzb s LEU 34 Cb -0.17 -3.87 -0.05 0.00 0.03 0.00 0.00 46.19 42.14 3hzb s LEU 34 CO 0.13 -0.50 1.10 0.21 0.23 0.00 0.00 176.35 177.53 3hzb s ASN 35 N -3.80 5.68 -1.36 2.29 3.84 -1.26 -3.71 114.94 116.61 3hzb s ASN 35 Ca 0.48 2.05 -0.19 0.00 0.21 0.00 0.00 52.86 55.41 3hzb s ASN 35 Cb -0.10 -2.57 0.03 0.00 -0.55 0.00 0.00 41.25 38.06 3hzb s ASN 35 CO 0.40 -1.24 0.39 0.47 -2.79 0.00 0.00 177.10 174.33 3hzb n ASP 36 N -1.60 -1.91 0.00 -4.21 8.00 -0.80 -4.80 116.55 111.24 3hzb n ASP 36 Ca 0.11 -1.28 0.00 0.00 0.71 0.00 0.00 54.79 54.33 3hzb n ASP 36 Cb 0.52 -1.71 0.00 0.00 -0.02 0.00 0.00 41.12 39.91 3hzb n ASP 36 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3hzb n ASP 37 N -2.49 0.00 -4.75 -2.24 4.64 -1.24 -4.45 116.55 106.02 3hzb n ASP 37 Ca -0.21 0.00 -0.41 0.00 -1.38 0.00 0.00 54.79 52.79 3hzb n ASP 37 Cb 0.62 0.00 -0.02 0.00 -1.04 0.00 0.00 41.12 40.68 3hzb n ASP 37 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 3hzb s ILE 38 N -0.60 2.53 0.00 5.18 1.01 -1.26 -4.59 121.20 123.47 3hzb s ILE 38 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.10 3hzb s ILE 38 Cb 0.00 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.18 3hzb s ILE 38 CO 0.00 0.07 0.00 -1.20 0.00 0.00 0.00 174.94 173.81 3hzb n SER 39 N 2.28 3.17 -3.59 3.58 7.64 -0.07 -2.26 113.62 124.37 3hzb n SER 39 Ca 0.07 -0.11 -0.11 0.00 1.01 0.00 0.00 58.87 59.74 3hzb n SER 39 Cb 0.40 0.85 -0.03 0.00 -1.01 0.00 0.00 64.21 64.42 3hzb n SER 39 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3hzb s SER 40 N -1.48 -0.38 -0.08 6.43 1.04 -1.19 -0.94 113.70 117.09 3hzb s SER 40 Ca 0.00 -0.26 -0.30 0.00 0.48 0.00 0.00 55.95 55.87 3hzb s SER 40 Cb 0.00 0.58 0.07 0.00 0.10 0.00 0.00 66.02 66.77 3hzb s SER 40 CO 0.00 -1.00 0.69 -1.48 0.98 0.00 0.00 173.24 172.43 3hzb s LEU 41 N -2.81 -0.67 -0.13 2.42 2.34 -0.56 -0.35 118.68 118.92 3hzb s LEU 41 Ca 0.05 0.82 -0.06 0.00 0.06 0.00 0.00 54.13 55.00 3hzb s LEU 41 Cb -0.01 2.52 -0.04 0.00 -0.56 0.00 0.00 46.19 48.10 3hzb s LEU 41 CO -0.08 -0.55 0.07 -0.13 -1.06 0.00 0.00 176.35 174.60 3hzb s ARG 42 N -0.97 3.48 -0.19 1.48 0.52 -0.29 -1.06 118.95 121.93 3hzb s ARG 42 Ca -0.09 -0.29 0.01 0.00 -0.52 0.00 0.00 55.73 54.84 3hzb s ARG 42 Cb -0.01 -3.08 0.03 0.00 0.52 0.00 0.00 34.95 32.41 3hzb s ARG 42 CO 0.09 0.59 -0.17 0.42 0.02 0.00 0.00 175.30 176.24 3hzb s ILE 43 N -0.51 1.99 0.27 1.52 -1.09 -1.26 -2.02 121.20 120.09 3hzb s ILE 43 Ca 0.11 -1.02 -0.30 0.00 -2.23 0.00 0.00 60.65 57.21 3hzb s ILE 43 Cb -0.12 -1.87 -0.09 0.00 -1.58 0.00 0.00 42.46 38.79 3hzb s ILE 43 CO 0.02 0.41 1.09 -0.89 -1.23 0.00 0.00 174.94 174.34 3hzb s THR 44 N 1.29 3.55 0.14 2.92 2.01 0.37 -4.37 115.64 121.55 3hzb s THR 44 Ca 0.02 1.54 -0.34 0.00 0.31 0.00 0.00 61.69 63.22 3hzb s THR 44 Cb -0.14 -3.98 -0.16 0.00 0.01 0.00 0.00 72.50 68.22 3hzb s THR 44 CO -0.11 0.36 1.18 0.00 -0.69 0.00 0.00 174.62 175.36 3hzb n GLN 45 N 1.31 1.04 0.00 4.92 6.02 -1.26 -2.09 117.38 127.32 3hzb n GLN 45 Ca -0.01 0.37 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 3hzb n GLN 45 Cb 0.45 -1.89 0.00 0.00 1.02 0.00 0.00 30.24 29.82 3hzb n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hzb n GLY 46 N 2.11 0.33 3.31 1.08 0.00 -1.26 -5.07 105.19 105.70 3hzb n GLY 46 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 3hzb n GLY 46 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hzb s TYR 47 N -2.00 1.49 0.01 1.61 2.02 -0.89 -0.42 117.35 119.18 3hzb s TYR 47 Ca 0.00 -0.95 -0.02 0.00 -0.37 0.00 0.00 57.07 55.73 3hzb s TYR 47 Cb 0.00 -0.86 -0.01 0.00 -0.40 0.00 0.00 41.96 40.69 3hzb s TYR 47 CO 0.00 -0.09 0.02 -0.65 -1.57 0.00 0.00 175.55 173.27 3hzb s GLN 48 N -3.88 0.32 -0.15 -0.62 -0.21 -0.34 -4.75 119.66 110.03 3hzb s GLN 48 Ca 0.28 -0.46 0.00 0.00 0.02 0.00 0.00 55.36 55.21 3hzb s GLN 48 Cb 0.06 0.12 -0.00 0.00 1.00 0.00 0.00 33.01 34.19 3hzb s GLN 48 CO 0.08 -0.06 -0.16 0.00 -2.12 0.00 0.00 175.29 173.03 3hzb s ALA 49 N -1.22 2.47 -0.35 6.09 0.00 -0.63 -1.77 121.76 126.35 3hzb s ALA 49 Ca -0.13 -1.05 -0.14 0.00 0.00 0.00 0.00 51.96 50.64 3hzb s ALA 49 Cb -0.08 -1.20 -0.01 0.00 0.00 0.00 0.00 23.12 21.83 3hzb s ALA 49 CO -0.00 -0.04 0.28 0.42 0.00 0.00 0.00 175.76 176.42 3hzb s ILE 50 N 0.82 5.25 -0.02 0.00 -1.09 0.87 -0.46 121.20 126.58 3hzb s ILE 50 Ca -0.05 -0.20 -0.12 0.00 -2.23 0.00 0.00 60.65 58.05 3hzb s ILE 50 Cb -0.15 -3.77 -0.05 0.00 -1.58 0.00 0.00 42.46 36.91 3hzb s ILE 50 CO -0.00 -0.07 0.34 -0.76 -1.23 0.00 0.00 174.94 173.22 3hzb s LEU 51 N 1.80 4.44 -0.01 2.97 1.43 0.05 -1.12 118.68 128.24 3hzb s LEU 51 Ca 0.07 0.82 0.07 0.00 -1.03 0.00 0.00 54.13 54.07 3hzb s LEU 51 Cb -0.17 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.50 3hzb s LEU 51 CO 0.11 0.32 -0.22 -0.31 0.23 0.00 0.00 176.35 176.48 3hzb s TYR 52 N -1.12 2.01 0.22 0.29 2.02 -0.57 -1.80 117.35 118.40 3hzb s TYR 52 Ca 0.23 -0.38 -0.04 0.00 -0.37 0.00 0.00 57.07 56.51 3hzb s TYR 52 Cb -0.15 -1.28 0.22 0.00 -0.40 0.00 0.00 41.96 40.35 3hzb s TYR 52 CO 0.12 -0.01 1.67 1.96 -1.57 0.00 0.00 175.55 177.71 3hzb h GLN 53 N 5.47 0.80 -6.07 -0.62 1.08 -1.18 -1.55 115.11 113.04 3hzb h GLN 53 Ca -0.41 -0.29 -0.52 0.00 -1.45 0.00 0.00 58.65 55.98 3hzb h GLN 53 Cb 1.14 -0.06 -0.06 0.00 -0.05 0.00 0.00 27.48 28.45 3hzb h GLN 53 CO 0.47 0.90 -0.44 -0.51 -0.95 0.00 0.00 178.83 178.30 3hzb s ASP 54 N -6.71 4.80 0.96 1.46 1.01 -0.64 -3.79 116.67 113.76 3hzb s ASP 54 Ca -0.09 -0.85 -0.12 0.00 0.71 0.00 0.00 52.55 52.19 3hzb s ASP 54 Cb 0.13 -0.58 0.17 0.00 1.01 0.00 0.00 42.92 43.66 3hzb s ASP 54 CO 0.83 -0.56 1.09 -0.62 0.21 0.00 0.00 175.17 176.12 3hzb s ASP 55 N -4.01 2.84 -1.37 0.27 -1.08 -1.26 -3.56 116.67 108.50 3hzb s ASP 55 Ca 0.44 1.47 -0.11 0.00 -0.52 0.00 0.00 52.55 53.83 3hzb s ASP 55 Cb -0.01 -2.14 0.09 0.00 -1.46 0.00 0.00 42.92 39.40 3hzb s ASP 55 CO 0.25 -3.04 0.58 0.59 0.52 0.00 0.00 175.17 174.08 3hzb n ASN 56 N -4.14 -3.74 -3.74 -0.34 3.02 -1.26 -2.34 115.26 102.71 3hzb n ASN 56 Ca 0.06 -0.52 -0.27 0.00 -0.03 0.00 0.00 54.58 53.83 3hzb n ASN 56 Cb 0.55 -3.08 0.06 0.00 -0.61 0.00 0.00 39.78 36.70 3hzb n ASN 56 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3hzb n PHE 57 N -4.07 -2.60 -3.72 3.10 3.01 -1.24 -5.00 117.46 106.94 3hzb n PHE 57 Ca 0.01 0.96 -0.22 0.00 1.01 0.00 0.00 57.45 59.21 3hzb n PHE 57 Cb 0.53 -4.56 -0.04 0.00 -0.01 0.00 0.00 39.48 35.40 3hzb n PHE 57 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3hzb s GLY 58 N -3.37 2.21 0.00 1.37 0.00 -0.99 -5.00 107.32 101.54 3hzb s GLY 58 Ca 0.59 -1.88 0.00 0.00 0.00 0.00 0.00 44.72 43.44 3hzb s GLY 58 CO 0.78 -1.78 0.00 0.61 0.00 0.00 0.00 173.10 172.71 3hzb n GLY 59 N -1.51 -1.77 3.72 0.20 0.00 -1.26 -1.62 105.19 102.94 3hzb n GLY 59 Ca 0.02 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.37 3hzb n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hzb s ALA 60 N -1.27 2.24 0.17 4.61 0.00 -1.26 -4.68 121.76 121.58 3hzb s ALA 60 Ca 0.00 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.09 3hzb s ALA 60 Cb 0.00 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 3hzb s ALA 60 CO 0.00 -1.77 0.05 -1.54 0.00 0.00 0.00 175.76 172.50 3hzb s SER 61 N -1.58 0.73 -0.06 0.00 1.04 -1.26 -1.08 113.70 111.49 3hzb s SER 61 Ca 0.80 -1.25 -0.20 0.00 0.48 0.00 0.00 55.95 55.79 3hzb s SER 61 Cb -0.35 0.23 0.04 0.00 0.10 0.00 0.00 66.02 66.03 3hzb s SER 61 CO 0.42 -0.69 0.45 0.28 0.98 0.00 0.00 173.24 174.68 3hzb s THR 62 N -3.89 0.03 -0.19 2.02 -1.32 -0.75 -4.99 115.64 106.56 3hzb s THR 62 Ca 0.28 -0.24 -0.04 0.00 -1.21 0.00 0.00 61.69 60.48 3hzb s THR 62 Cb 0.07 -0.73 -0.02 0.00 -1.51 0.00 0.00 72.50 70.31 3hzb s THR 62 CO 0.06 -0.13 -0.02 -0.69 -2.21 0.00 0.00 174.62 171.62 3hzb s VAL 63 N -0.94 3.81 -0.30 5.08 1.01 -1.26 -0.77 120.40 127.03 3hzb s VAL 63 Ca -0.10 -0.37 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 3hzb s VAL 63 Cb -0.03 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 3hzb s VAL 63 CO 0.05 0.45 0.16 -0.63 0.00 0.00 0.00 175.10 175.13 3hzb s ILE 64 N 0.85 4.78 -1.58 2.22 -1.09 0.39 -4.96 121.20 121.81 3hzb s ILE 64 Ca -0.00 -0.26 0.22 0.00 -2.23 0.00 0.00 60.65 58.38 3hzb s ILE 64 Cb -0.14 -3.38 -0.11 0.00 -1.58 0.00 0.00 42.46 37.25 3hzb s ILE 64 CO 0.02 0.12 1.01 0.59 -1.23 0.00 0.00 174.94 175.45 3hzb n ASN 65 N 5.00 1.57 -3.75 3.58 5.03 -1.26 -1.60 115.26 123.83 3hzb n ASN 65 Ca -0.14 -1.28 -0.09 0.00 0.87 0.00 0.00 54.58 53.93 3hzb n ASN 65 Cb 0.50 0.71 -0.03 0.00 -1.02 0.00 0.00 39.78 39.93 3hzb n ASN 65 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 3hzb s SER 66 N -2.71 -0.28 0.13 6.41 1.04 -1.26 -4.92 113.70 112.11 3hzb s SER 66 Ca 0.14 -0.50 -0.34 0.00 0.48 0.00 0.00 55.95 55.73 3hzb s SER 66 Cb 0.17 0.62 -0.16 0.00 0.10 0.00 0.00 66.02 66.75 3hzb s SER 66 CO 0.70 -1.12 1.21 0.47 0.98 0.00 0.00 173.24 175.48 3hzb n ASP 67 N -0.38 1.34 -3.98 7.02 8.00 -1.26 -4.63 116.55 122.66 3hzb n ASP 67 Ca -0.09 1.13 -0.31 0.00 0.71 0.00 0.00 54.79 56.24 3hzb n ASP 67 Cb 0.62 -1.19 -0.16 0.00 -0.02 0.00 0.00 41.12 40.37 3hzb n ASP 67 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3hzb s ASN 68 N 0.15 3.82 0.00 -2.24 3.84 -0.23 -4.97 114.94 115.32 3hzb s ASN 68 Ca 0.78 -1.13 0.23 0.00 0.21 0.00 0.00 52.86 52.95 3hzb s ASN 68 Cb -0.91 -1.27 1.01 0.00 -0.55 0.00 0.00 41.25 39.54 3hzb s ASN 68 CO 0.51 -0.20 1.75 -1.54 -2.79 0.00 0.00 177.10 174.82 3hzb n SER 69 N 4.63 0.00 -3.15 -4.21 3.41 -1.26 -1.49 113.62 111.55 3hzb n SER 69 Ca -0.13 0.44 0.05 0.00 -0.26 0.00 0.00 58.87 58.97 3hzb n SER 69 Cb 0.44 -0.48 -0.01 0.00 -0.26 0.00 0.00 64.21 63.91 3hzb n SER 69 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hzb s LEU 71 N 2.94 3.62 0.00 0.00 1.43 -0.11 -5.00 118.68 121.56 3hzb s LEU 71 Ca 0.08 2.63 -0.16 0.00 -1.03 0.00 0.00 54.13 55.64 3hzb s LEU 71 Cb -0.08 -4.56 0.23 0.00 0.03 0.00 0.00 46.19 41.80 3hzb s LEU 71 CO -0.15 -1.91 1.06 -0.46 0.23 0.00 0.00 176.35 175.12 3hzb n ASN 72 N -1.74 -0.89 -0.31 2.29 2.04 -1.26 -4.29 115.26 111.10 3hzb n ASN 72 Ca 0.15 -1.26 0.10 0.00 -0.44 0.00 0.00 54.58 53.13 3hzb n ASN 72 Cb 0.48 -0.88 0.32 0.00 -2.53 0.00 0.00 39.78 37.17 3hzb n ASN 72 CO 0.00 0.00 0.00 0.74 -0.44 0.00 0.00 177.26 177.56 3hzb h THR 73 N -2.10 0.86 -0.03 5.53 2.02 -1.94 0.43 112.91 117.68 3hzb h THR 73 Ca -0.37 -0.28 -0.14 0.00 0.77 0.00 0.00 66.41 66.39 3hzb h THR 73 Cb 1.06 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 3hzb h THR 73 CO 0.25 0.15 -0.62 0.74 0.37 0.00 0.00 175.52 176.41 3hzb h THR 74 N 0.82 1.42 0.00 3.16 2.02 -2.03 -3.36 112.91 114.94 3hzb h THR 74 Ca 0.48 -2.08 0.00 0.00 0.77 0.00 0.00 66.41 65.58 3hzb h THR 74 Cb 0.64 2.09 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 3hzb h THR 74 CO -0.24 0.60 -1.51 0.79 0.37 0.00 0.00 175.52 175.53 3hzb n TRP 75 N -3.83 0.00 -2.17 3.16 7.02 -0.68 -4.82 117.44 116.13 3hzb n TRP 75 Ca -0.02 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.04 3hzb n TRP 75 Cb 0.62 -0.28 -0.03 0.00 -2.42 0.00 0.00 31.31 29.21 3hzb n TRP 75 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 3hzb s ASN 76 N -3.44 6.83 -1.46 -0.99 2.47 0.14 -2.76 114.94 115.73 3hzb s ASN 76 Ca -0.04 2.37 -0.10 0.00 0.42 0.00 0.00 52.86 55.52 3hzb s ASN 76 Cb 0.09 -2.60 0.05 0.00 -1.45 0.00 0.00 41.25 37.34 3hzb s ASN 76 CO 0.57 -0.63 0.86 0.47 -3.72 0.00 0.00 177.10 174.66 3hzb n ASP 77 N 3.50 -5.37 0.00 -4.21 8.00 -0.96 -4.84 116.55 112.67 3hzb n ASP 77 Ca 0.10 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 55.06 3hzb n ASP 77 Cb 0.42 -4.30 0.00 0.00 -0.02 0.00 0.00 41.12 37.22 3hzb n ASP 77 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3hzb n LYS 78 N -4.46 2.25 -2.24 -1.24 4.76 -1.11 -4.29 118.16 111.83 3hzb n LYS 78 Ca -0.01 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.01 3hzb n LYS 78 Cb 0.56 -0.20 -0.03 0.00 -1.84 0.00 0.00 35.03 33.52 3hzb n LYS 78 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3hzb s VAL 79 N -0.32 3.54 -0.05 -0.18 1.01 -1.25 -4.57 120.40 118.58 3hzb s VAL 79 Ca 0.00 1.09 0.02 0.00 0.00 0.00 0.00 61.98 63.09 3hzb s VAL 79 Cb 0.00 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 3hzb s VAL 79 CO 0.00 0.08 0.06 -1.20 0.00 0.00 0.00 175.10 174.04 3hzb n SER 80 N 4.10 2.08 -3.49 3.32 7.64 -0.58 -1.90 113.62 124.79 3hzb n SER 80 Ca 0.11 -0.30 -0.16 0.00 1.01 0.00 0.00 58.87 59.53 3hzb n SER 80 Cb 0.43 1.04 -0.05 0.00 -1.01 0.00 0.00 64.21 64.63 3hzb n SER 80 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3hzb s SER 81 N -1.64 -0.61 -0.01 6.43 1.04 -1.23 -2.99 113.70 114.69 3hzb s SER 81 Ca 0.00 0.42 -0.03 0.00 0.48 0.00 0.00 55.95 56.82 3hzb s SER 81 Cb 0.01 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.69 3hzb s SER 81 CO 0.08 -0.74 0.08 -0.63 0.98 0.00 0.00 173.24 173.00 3hzb s ILE 82 N -2.17 0.04 -0.10 -1.02 1.01 0.13 -1.52 121.20 117.57 3hzb s ILE 82 Ca -0.06 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.27 3hzb s ILE 82 Cb -0.00 -0.23 0.01 0.00 0.01 0.00 0.00 42.46 42.25 3hzb s ILE 82 CO 0.01 -0.19 -0.18 -0.13 0.00 0.00 0.00 174.94 174.46 3hzb s ARG 83 N -0.58 2.45 -0.15 2.79 0.52 -0.28 -0.09 118.95 123.61 3hzb s ARG 83 Ca -0.07 -0.66 -0.04 0.00 -0.52 0.00 0.00 55.73 54.44 3hzb s ARG 83 Cb -0.04 -1.99 -0.03 0.00 0.52 0.00 0.00 34.95 33.41 3hzb s ARG 83 CO 0.00 0.02 -0.02 0.08 0.02 0.00 0.00 175.30 175.40 3hzb s VAL 84 N 0.74 4.07 0.13 3.52 1.01 0.16 -0.09 120.40 129.94 3hzb s VAL 84 Ca -0.11 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.58 3hzb s VAL 84 Cb -0.16 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 3hzb s VAL 84 CO 0.02 0.50 -0.02 0.27 0.00 0.00 0.00 175.10 175.87 3hzb s ILE 85 N 0.26 0.56 0.62 2.22 -4.36 -0.73 -1.49 121.20 118.28 3hzb s ILE 85 Ca -0.02 -1.94 -0.14 0.00 -0.26 0.00 0.00 60.65 58.30 3hzb s ILE 85 Cb -0.14 -1.90 -0.03 0.00 1.25 0.00 0.00 42.46 41.65 3hzb s ILE 85 CO 0.02 -0.67 1.04 0.00 0.24 0.00 0.00 174.94 175.58 3hzb s ALA 86 N -3.72 2.80 -2.25 2.27 0.00 -1.26 -1.20 121.76 118.40 3hzb s ALA 86 Ca 0.18 0.21 0.19 0.00 0.00 0.00 0.00 51.96 52.54 3hzb s ALA 86 Cb 0.06 -3.18 0.64 0.00 0.00 0.00 0.00 23.12 20.64 3hzb s ALA 86 CO -0.01 -0.86 1.48 0.27 0.00 0.00 0.00 175.76 176.65 3hzb n ASN 87 N -2.42 1.93 0.00 0.00 0.23 0.45 -4.66 115.26 110.79 3hzb n ASN 87 Ca 0.08 -1.79 0.00 0.00 -0.53 0.00 0.00 54.58 52.33 3hzb n ASN 87 Cb 0.53 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 3hzb n ASN 87 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hzb n GLY 88 N 1.17 2.25 3.76 4.83 0.00 -1.26 -5.02 105.19 110.92 3hzb n GLY 88 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3hzb n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hzb s THR 89 N -2.70 3.01 0.00 2.61 -4.23 -1.26 -5.24 115.64 107.83 3hzb s THR 89 Ca 0.00 0.53 0.00 0.00 -1.18 0.00 0.00 61.69 61.04 3hzb s THR 89 Cb 0.00 -3.10 0.00 0.00 1.34 0.00 0.00 72.50 70.74 3hzb s THR 89 CO 0.00 -0.23 0.29 1.07 -0.54 0.00 0.00 174.62 175.21