#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z5f h TRP 3 N 0.00 0.10 0.00 1.24 -0.00 -1.87 0.21 115.95 115.63 1z5f h TRP 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1z5f h TRP 3 Cb 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 29.16 29.13 1z5f h TRP 3 CO 0.00 -0.03 0.00 0.39 -0.00 0.00 0.00 178.44 178.80 1z5f n GLU 4 N -4.16 0.00 -0.16 2.65 1.02 -1.26 -0.81 120.64 117.93 1z5f n GLU 4 Ca 0.36 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.47 1z5f n GLU 4 Cb 1.62 -0.90 0.03 0.00 -0.02 0.00 0.00 31.44 32.18 1z5f n GLU 4 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1z5f h THR 5 N 0.00 0.49 -0.51 2.62 1.03 -1.89 1.39 112.91 116.04 1z5f h THR 5 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 66.41 66.55 1z5f h THR 5 Cb 0.00 0.49 -0.02 0.00 -1.07 0.00 0.00 68.15 67.55 1z5f h THR 5 CO 0.00 0.00 0.67 0.15 -0.01 0.00 0.00 175.52 176.33 1z5f h PHE 6 N -0.01 0.00 0.00 0.00 3.57 -0.68 2.35 116.94 122.17 1z5f h PHE 6 Ca 0.24 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1z5f h PHE 6 Cb 0.37 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.11 1z5f h PHE 6 CO -0.43 0.00 -0.98 0.94 -2.23 0.00 0.00 178.31 175.61 1z5f n GLN 7 N -3.41 0.54 -0.08 1.11 0.00 0.46 -3.08 117.38 112.93 1z5f n GLN 7 Ca 0.10 0.10 -0.22 0.00 -0.00 0.00 0.00 57.00 56.98 1z5f n GLN 7 Cb 0.86 -1.78 -0.12 0.00 0.00 0.00 0.00 30.24 29.20 1z5f n GLN 7 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1z5f h LYS 8 N 0.00 0.06 0.17 3.69 1.79 0.53 -3.25 116.57 119.55 1z5f h LYS 8 Ca 0.00 -0.10 -0.35 0.00 -2.18 0.00 0.00 60.65 58.02 1z5f h LYS 8 Cb 0.94 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.63 1z5f h LYS 8 CO 0.00 1.05 -1.78 1.57 -1.08 0.00 0.00 179.45 179.21 1z5f h LYS 9 N -0.79 0.36 -0.00 3.15 2.10 -1.17 -3.36 116.57 116.86 1z5f h LYS 9 Ca -0.35 -0.62 0.00 0.00 -2.00 0.00 0.00 60.65 57.68 1z5f h LYS 9 Cb 1.44 0.23 0.00 0.00 -0.90 0.00 0.00 32.23 33.00 1z5f h LYS 9 CO -0.14 1.30 -0.31 0.72 -2.00 0.00 0.00 179.45 179.01 1z5f n HIS 10 N -3.60 0.00 -4.25 0.07 8.25 -1.18 -4.76 115.22 109.75 1z5f n HIS 10 Ca -0.26 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 56.99 1z5f n HIS 10 Cb 1.06 -0.28 -0.12 0.00 1.12 0.00 0.00 29.99 31.77 1z5f n HIS 10 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1z5f s LEU 11 N -2.88 2.34 0.00 2.41 1.02 -1.23 0.50 118.68 120.84 1z5f s LEU 11 Ca 0.15 -0.72 0.00 0.00 0.02 0.00 0.00 54.13 53.58 1z5f s LEU 11 Cb 0.18 -0.70 0.00 0.00 0.02 0.00 0.00 46.19 45.69 1z5f s LEU 11 CO 0.61 -0.04 0.00 1.07 0.02 0.00 0.00 176.35 178.02 1z5f n THR 12 N 0.90 0.00 -0.27 5.49 5.66 -1.10 -4.49 114.28 120.46 1z5f n THR 12 Ca -0.18 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 60.84 1z5f n THR 12 Cb 0.55 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.36 1z5f n THR 12 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1z5f n ASP 13 N -2.24 2.07 -3.71 1.09 8.00 -1.26 -4.51 116.55 115.99 1z5f n ASP 13 Ca 0.00 -2.26 -0.13 0.00 0.71 0.00 0.00 54.79 53.11 1z5f n ASP 13 Cb 0.00 -0.10 -0.07 0.00 -0.02 0.00 0.00 41.12 40.92 1z5f n ASP 13 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1z5f s THR 14 N -1.45 0.06 -0.12 -3.53 -1.32 -1.26 -5.02 115.64 103.01 1z5f s THR 14 Ca 0.08 -0.48 0.28 0.00 -1.21 0.00 0.00 61.69 60.35 1z5f s THR 14 Cb 0.07 -0.83 0.34 0.00 -1.51 0.00 0.00 72.50 70.57 1z5f s THR 14 CO 0.01 -0.26 1.80 0.07 -2.21 0.00 0.00 174.62 174.02 1z5f h LYS 15 N 3.37 0.00 -2.31 7.08 2.10 -1.96 -3.29 116.57 121.57 1z5f h LYS 15 Ca -0.30 0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 57.71 1z5f h LYS 15 Cb 1.19 0.00 -0.39 0.00 -0.90 0.00 0.00 32.23 32.13 1z5f h LYS 15 CO 0.42 0.04 -0.30 0.36 -2.00 0.00 0.00 179.45 177.98 1z5f n LYS 16 N -3.13 3.36 -0.68 0.07 2.85 -1.26 -4.45 118.16 114.92 1z5f n LYS 16 Ca 0.02 -4.75 -0.32 0.00 -1.05 0.00 0.00 58.31 52.21 1z5f n LYS 16 Cb 0.42 -2.30 0.17 0.00 -0.65 0.00 0.00 35.03 32.68 1z5f n LYS 16 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1z5f n VAL 17 N 0.32 0.00 -2.68 0.58 0.24 -1.24 -4.84 118.33 110.71 1z5f n VAL 17 Ca 0.32 -0.29 -0.42 0.00 -2.04 0.00 0.00 64.34 61.90 1z5f n VAL 17 Cb 0.38 -0.60 0.01 0.00 -1.47 0.00 0.00 33.84 32.16 1z5f n VAL 17 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1z5f n LYS 18 N -2.00 4.58 -0.23 7.34 2.85 -1.26 -4.84 118.16 124.60 1z5f n LYS 18 Ca 0.01 -4.27 0.22 0.00 -1.05 0.00 0.00 58.31 53.21 1z5f n LYS 18 Cb 0.62 -2.59 0.40 0.00 -0.65 0.00 0.00 35.03 32.81 1z5f n LYS 18 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1z5f h ASP 20 N 0.00 0.42 0.00 0.00 1.82 -1.90 -0.49 116.42 116.27 1z5f h ASP 20 Ca 0.56 0.16 -0.31 0.00 -0.39 0.00 0.00 57.03 57.06 1z5f h ASP 20 Cb 1.55 0.13 -0.06 0.00 0.68 0.00 0.00 39.33 41.63 1z5f h ASP 20 CO -0.47 -0.03 -2.16 0.52 -1.61 0.00 0.00 179.24 175.49 1z5f n VAL 21 N -5.03 1.16 0.00 2.25 0.31 0.41 -2.13 118.33 115.30 1z5f n VAL 21 Ca 0.26 -0.61 0.00 0.00 -0.01 0.00 0.00 64.34 63.97 1z5f n VAL 21 Cb 0.76 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.87 1z5f n VAL 21 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1z5f n GLU 22 N -2.80 0.00 0.00 5.55 4.07 0.45 -1.07 120.64 126.83 1z5f n GLU 22 Ca -0.31 0.21 0.00 0.00 -0.06 0.00 0.00 57.16 57.00 1z5f n GLU 22 Cb 0.99 -1.54 0.00 0.00 -0.06 0.00 0.00 31.44 30.83 1z5f n GLU 22 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 1z5f n MET 23 N -1.17 0.00 0.00 5.31 2.81 -0.24 -4.70 117.12 119.13 1z5f n MET 23 Ca 0.00 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 55.92 1z5f n MET 23 Cb 0.04 -0.43 0.19 0.00 -0.71 0.00 0.00 33.22 32.31 1z5f n MET 23 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1z5f n ALA 24 N -2.51 2.07 -1.00 3.04 0.00 -0.91 -1.45 120.51 119.75 1z5f n ALA 24 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1z5f n ALA 24 Cb 0.26 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1z5f n ALA 24 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1z5f n LYS 25 N -0.69 -0.01 -0.00 0.00 5.02 -0.23 -4.53 118.16 117.71 1z5f n LYS 25 Ca 0.05 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.44 1z5f n LYS 25 Cb 0.02 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 34.90 1z5f n LYS 25 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1z5f n ALA 26 N -2.00 4.12 1.04 7.82 0.00 -1.26 -3.27 120.51 126.96 1z5f n ALA 26 Ca 0.00 -0.57 0.12 0.00 0.00 0.00 0.00 53.44 52.99 1z5f n ALA 26 Cb 0.00 -0.76 0.13 0.00 0.00 0.00 0.00 19.45 18.82 1z5f n ALA 26 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1z5f n LEU 27 N -1.75 2.81 -0.02 0.00 -0.00 -1.26 -4.43 117.00 112.35 1z5f n LEU 27 Ca 0.01 -0.94 -0.04 0.00 -0.00 0.00 0.00 56.01 55.05 1z5f n LEU 27 Cb 0.41 -0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.81 1z5f n LEU 27 CO 0.44 0.47 -0.65 0.49 -0.00 0.00 0.00 177.39 178.14 1z5f n PHE 28 N 1.16 0.00 -2.67 1.47 3.72 -1.26 -5.04 117.46 114.84 1z5f n PHE 28 Ca 0.14 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.47 1z5f n PHE 28 Cb 0.57 -0.17 0.02 0.00 -0.94 0.00 0.00 39.48 38.96 1z5f n PHE 28 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1z5f n ASP 29 N -2.76 -3.11 -3.30 4.37 8.00 -1.20 -4.07 116.55 114.49 1z5f n ASP 29 Ca -0.08 -0.12 -0.08 0.00 0.71 0.00 0.00 54.79 55.21 1z5f n ASP 29 Cb 0.58 -1.82 0.00 0.00 -0.02 0.00 0.00 41.12 39.86 1z5f n ASP 29 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1z5f n LYS 31 N -2.08 2.81 0.00 0.00 4.76 -1.26 -4.97 118.16 117.42 1z5f n LYS 31 Ca -0.10 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.34 1z5f n LYS 31 Cb 0.56 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.75 1z5f n LYS 31 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1z5f n LYS 32 N 0.00 2.42 -3.94 1.97 4.81 -1.26 -4.99 118.16 117.17 1z5f n LYS 32 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.32 1z5f n LYS 32 Cb 0.00 -0.84 -0.13 0.00 0.02 0.00 0.00 35.03 34.08 1z5f n LYS 32 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1z5f s THR 33 N -1.55 0.11 -0.03 3.15 2.01 -1.26 -1.96 115.64 116.10 1z5f s THR 33 Ca 0.00 -0.33 -0.14 0.00 0.31 0.00 0.00 61.69 61.52 1z5f s THR 33 Cb 0.00 -0.15 0.02 0.00 0.01 0.00 0.00 72.50 72.39 1z5f s THR 33 CO 0.00 -0.14 0.31 0.21 -0.69 0.00 0.00 174.62 174.31 1z5f s ASN 34 N -0.50 -0.22 0.03 3.53 3.84 -1.05 -4.98 114.94 115.60 1z5f s ASN 34 Ca -0.05 0.18 -0.00 0.00 0.21 0.00 0.00 52.86 53.20 1z5f s ASN 34 Cb -0.03 0.37 -0.03 0.00 -0.55 0.00 0.00 41.25 41.01 1z5f s ASN 34 CO -0.00 -0.40 -0.03 -0.89 -2.79 0.00 0.00 177.10 172.99 1z5f s THR 35 N -1.09 0.15 0.35 -5.21 2.01 -1.26 -0.64 115.64 109.95 1z5f s THR 35 Ca -0.11 -1.27 -0.08 0.00 0.31 0.00 0.00 61.69 60.54 1z5f s THR 35 Cb -0.05 -0.77 0.02 0.00 0.01 0.00 0.00 72.50 71.71 1z5f s THR 35 CO 0.04 -0.70 0.58 -0.36 -0.69 0.00 0.00 174.62 173.48 1z5f s PHE 36 N -2.45 0.70 -0.06 4.92 0.40 -0.95 -4.68 117.98 115.86 1z5f s PHE 36 Ca -0.07 -1.08 0.04 0.00 -0.60 0.00 0.00 56.93 55.22 1z5f s PHE 36 Cb -0.03 0.23 -0.00 0.00 0.51 0.00 0.00 43.02 43.73 1z5f s PHE 36 CO -0.05 -1.26 -0.19 0.42 0.70 0.00 0.00 175.22 174.85 1z5f s ILE 37 N -2.91 1.58 -0.67 0.64 1.01 0.18 -3.55 121.20 117.49 1z5f s ILE 37 Ca 0.25 -0.78 -0.18 0.00 0.00 0.00 0.00 60.65 59.95 1z5f s ILE 37 Cb -0.02 -1.37 0.13 0.00 0.01 0.00 0.00 42.46 41.21 1z5f s ILE 37 CO 0.17 0.45 0.74 -0.47 0.00 0.00 0.00 174.94 175.83 1z5f s TYR 38 N 0.20 3.17 -0.01 3.97 5.04 -0.98 -2.72 117.35 126.02 1z5f s TYR 38 Ca -0.09 -1.22 -0.19 0.00 -2.44 0.00 0.00 57.07 53.12 1z5f s TYR 38 Cb -0.14 -3.99 0.04 0.00 0.35 0.00 0.00 41.96 38.21 1z5f s TYR 38 CO 0.04 -1.24 0.42 0.00 -1.34 0.00 0.00 175.55 173.43 1z5f s ALA 39 N 2.15 -1.06 0.32 3.97 0.00 -1.26 -4.69 121.76 121.18 1z5f s ALA 39 Ca 0.14 0.57 -0.25 0.00 0.00 0.00 0.00 51.96 52.42 1z5f s ALA 39 Cb -0.20 0.10 -0.10 0.00 0.00 0.00 0.00 23.12 22.92 1z5f s ALA 39 CO 0.01 -0.32 0.93 -0.48 0.00 0.00 0.00 175.76 175.91 1z5f s LEU 40 N -1.39 4.31 0.19 0.00 0.05 -1.26 -4.87 118.68 115.70 1z5f s LEU 40 Ca -0.12 1.79 -0.18 0.00 0.05 0.00 0.00 54.13 55.68 1z5f s LEU 40 Cb -0.03 -4.02 0.15 0.00 -2.05 0.00 0.00 46.19 40.24 1z5f s LEU 40 CO 0.05 -0.08 1.35 -2.65 -0.55 0.00 0.00 176.35 174.46 1z5f n PRO 41 N 0.48 -0.24 -0.29 1.48 -0.02 -1.26 -0.03 135.00 135.12 1z5f n PRO 41 Ca 0.02 1.33 0.03 0.00 -2.02 0.00 0.00 63.50 62.86 1z5f n PRO 41 Cb 0.50 -1.97 0.17 0.00 -0.02 0.00 0.00 33.50 32.18 1z5f n PRO 41 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1z5f h GLY 42 N 0.00 1.28 1.77 -1.23 0.00 -1.98 -0.23 103.07 102.67 1z5f h GLY 42 Ca 0.27 -0.31 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1z5f h GLY 42 CO -0.85 0.12 0.01 -0.09 0.00 0.00 0.00 176.54 175.73 1z5f h ARG 43 N 0.78 0.29 0.11 4.80 2.43 -0.82 0.23 114.38 122.20 1z5f h ARG 43 Ca 0.40 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.52 1z5f h ARG 43 Cb 0.37 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1z5f h ARG 43 CO -0.25 0.32 -0.05 0.28 -1.51 0.00 0.00 179.97 178.75 1z5f h VAL 44 N 0.29 0.31 0.00 0.20 2.07 -0.60 -1.35 116.25 117.18 1z5f h VAL 44 Ca 0.07 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1z5f h VAL 44 Cb 0.19 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1z5f h VAL 44 CO 0.00 0.10 0.02 0.11 0.02 0.00 0.00 177.57 177.82 1z5f h LYS 45 N -1.02 0.00 0.00 1.57 1.57 -1.20 0.18 116.57 117.68 1z5f h LYS 45 Ca -0.01 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.57 1z5f h LYS 45 Cb 0.27 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 1z5f h LYS 45 CO 0.02 0.00 -1.08 0.00 -0.57 0.00 0.00 179.45 177.82 1z5f h ALA 46 N 1.95 0.54 0.00 3.86 0.00 -0.52 -3.22 119.26 121.87 1z5f h ALA 46 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1z5f h ALA 46 Cb 0.05 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1z5f h ALA 46 CO 0.00 1.14 0.00 -0.11 0.00 0.00 0.00 179.25 180.28 1z5f n LEU 47 N -3.21 0.16 -2.68 0.00 7.94 0.63 -2.86 117.00 116.98 1z5f n LEU 47 Ca -0.04 0.56 -0.08 0.00 -1.11 0.00 0.00 56.01 55.34 1z5f n LEU 47 Cb 0.91 -0.56 0.04 0.00 0.53 0.00 0.00 43.42 44.34 1z5f n LEU 47 CO 0.45 -0.50 -0.03 0.00 -1.11 0.00 0.00 177.39 176.19 1z5f s LYS 49 N -2.79 3.91 0.00 0.00 -2.85 -1.13 -3.94 119.74 112.93 1z5f s LYS 49 Ca 0.26 0.37 0.00 0.00 -1.00 0.00 0.00 55.97 55.61 1z5f s LYS 49 Cb 0.44 -3.23 0.00 0.00 -2.06 0.00 0.00 37.83 32.98 1z5f s LYS 49 CO 0.02 0.67 0.00 0.09 0.10 0.00 0.00 175.35 176.22 1z5f n ASN 50 N 1.94 -2.08 -3.97 0.03 5.03 -1.26 -4.99 115.26 109.95 1z5f n ASN 50 Ca -0.14 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.01 1z5f n ASN 50 Cb 0.52 -1.27 0.24 0.00 -1.02 0.00 0.00 39.78 38.25 1z5f n ASN 50 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1z5f s ILE 51 N -2.25 1.64 0.00 2.41 -1.09 -1.25 -5.05 121.20 115.60 1z5f s ILE 51 Ca 0.00 0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.42 1z5f s ILE 51 Cb 0.00 -2.34 0.00 0.00 -1.58 0.00 0.00 42.46 38.54 1z5f s ILE 51 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 174.94 174.25 1z5f n ARG 52 N -4.88 0.00 0.00 2.79 1.74 -1.26 -4.60 116.66 110.44 1z5f n ARG 52 Ca 0.10 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1z5f n ARG 52 Cb 0.59 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.03 1z5f n ARG 52 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1z5f n ASP 53 N 0.00 0.00 -4.59 0.55 9.92 -1.26 -3.73 116.55 117.44 1z5f n ASP 53 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.84 1z5f n ASP 53 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 1z5f n ASP 53 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1z5f s ASN 54 N -0.85 5.55 0.12 -2.24 4.22 -1.24 -3.88 114.94 116.62 1z5f s ASN 54 Ca 0.00 1.44 -0.11 0.00 -2.14 0.00 0.00 52.86 52.05 1z5f s ASN 54 Cb 0.00 -2.52 0.01 0.00 1.28 0.00 0.00 41.25 40.02 1z5f s ASN 54 CO 0.00 -1.96 0.28 -0.89 -2.04 0.00 0.00 177.10 172.49 1z5f s THR 55 N 8.06 0.10 0.20 0.54 2.01 -1.00 -4.98 115.64 120.57 1z5f s THR 55 Ca 0.88 -1.08 -0.14 0.00 0.31 0.00 0.00 61.69 61.67 1z5f s THR 55 Cb -0.25 -1.44 -0.07 0.00 0.01 0.00 0.00 72.50 70.74 1z5f s THR 55 CO 0.33 -0.46 0.60 -1.81 -0.69 0.00 0.00 174.62 172.59 1z5f s ASP 56 N -2.88 6.81 0.25 3.53 1.11 -1.26 -1.99 116.67 122.24 1z5f s ASP 56 Ca 0.08 1.12 0.04 0.00 0.18 0.00 0.00 52.55 53.97 1z5f s ASP 56 Cb 0.03 -2.30 -0.05 0.00 1.07 0.00 0.00 42.92 41.67 1z5f s ASP 56 CO -0.08 0.01 -0.01 0.68 1.18 0.00 0.00 175.17 176.95 1z5f s VAL 57 N -1.63 1.17 -0.02 -1.27 -7.23 0.17 -4.94 120.40 106.65 1z5f s VAL 57 Ca 0.43 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 1z5f s VAL 57 Cb -0.14 -2.43 0.02 0.00 0.56 0.00 0.00 36.38 34.39 1z5f s VAL 57 CO 0.20 -0.27 -0.00 -0.22 -0.31 0.00 0.00 175.10 174.49 1z5f s LEU 58 N -3.36 1.49 1.10 1.32 1.98 -1.26 -2.43 118.68 117.52 1z5f s LEU 58 Ca 0.30 -0.02 -0.15 0.00 -2.89 0.00 0.00 54.13 51.36 1z5f s LEU 58 Cb 0.06 -0.16 0.15 0.00 0.66 0.00 0.00 46.19 46.90 1z5f s LEU 58 CO 0.10 -0.05 0.44 -0.24 -1.89 0.00 0.00 176.35 174.71 1z5f n SER 59 N 3.70 -1.97 0.04 3.68 2.88 -0.75 -4.91 113.62 116.28 1z5f n SER 59 Ca -0.21 -0.03 -0.13 0.00 -1.33 0.00 0.00 58.87 57.17 1z5f n SER 59 Cb 0.54 -1.12 -0.09 0.00 -0.75 0.00 0.00 64.21 62.79 1z5f n SER 59 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1z5f h ARG 60 N -2.17 -0.11 0.00 -1.46 3.08 -1.99 -3.46 114.38 108.27 1z5f h ARG 60 Ca -0.54 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.52 1z5f h ARG 60 Cb 1.33 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.41 1z5f h ARG 60 CO 0.41 0.30 0.00 -0.25 -1.07 0.00 0.00 179.97 179.36 1z5f n ASP 61 N -4.94 -0.34 -3.97 7.04 8.00 -1.26 -5.07 116.55 116.02 1z5f n ASP 61 Ca -0.08 0.27 -0.10 0.00 0.71 0.00 0.00 54.79 55.59 1z5f n ASP 61 Cb 0.24 0.45 -0.07 0.00 -0.02 0.00 0.00 41.12 41.71 1z5f n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1z5f s ALA 62 N -1.94 0.06 -0.12 2.24 0.00 -1.26 -2.45 121.76 118.29 1z5f s ALA 62 Ca 0.00 -0.92 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 1z5f s ALA 62 Cb 0.00 0.85 0.04 0.00 0.00 0.00 0.00 23.12 24.02 1z5f s ALA 62 CO 0.00 -0.63 0.31 -0.06 0.00 0.00 0.00 175.76 175.37 1z5f s PHE 63 N -3.97 -0.40 -0.39 0.00 0.40 -0.65 -4.72 117.98 108.24 1z5f s PHE 63 Ca 0.17 0.92 -0.29 0.00 -0.60 0.00 0.00 56.93 57.13 1z5f s PHE 63 Cb 0.04 0.13 0.02 0.00 0.51 0.00 0.00 43.02 43.71 1z5f s PHE 63 CO -0.00 -0.23 1.13 -1.17 0.70 0.00 0.00 175.22 175.65 1z5f s LEU 64 N 0.88 3.78 -0.06 -0.37 0.20 -1.26 -2.42 118.68 119.42 1z5f s LEU 64 Ca -0.06 0.78 0.05 0.00 0.69 0.00 0.00 54.13 55.60 1z5f s LEU 64 Cb -0.07 -3.55 -0.01 0.00 -0.43 0.00 0.00 46.19 42.14 1z5f s LEU 64 CO -0.06 -1.09 -0.23 -1.48 -0.29 0.00 0.00 176.35 173.20 1z5f s LEU 65 N 4.14 2.04 0.52 -0.68 2.34 -1.02 -2.30 118.68 123.71 1z5f s LEU 65 Ca 0.48 -0.49 -0.19 0.00 0.06 0.00 0.00 54.13 53.99 1z5f s LEU 65 Cb -0.10 -1.30 -0.07 0.00 -0.56 0.00 0.00 46.19 44.16 1z5f s LEU 65 CO 0.24 0.21 1.04 -2.16 -1.06 0.00 0.00 176.35 174.63 1z5f s PRO 66 N -0.03 3.65 -0.10 1.48 0.04 -1.23 -3.23 135.00 135.58 1z5f s PRO 66 Ca -0.06 1.30 -0.05 0.00 0.04 0.00 0.00 61.00 62.22 1z5f s PRO 66 Cb -0.14 -2.08 0.04 0.00 0.04 0.00 0.00 34.50 32.37 1z5f s PRO 66 CO 0.04 -0.55 0.23 -0.65 0.04 0.00 0.00 177.00 176.12 1z5f s GLN 67 N -3.54 0.20 -0.06 4.56 -0.21 0.56 -2.23 119.66 118.95 1z5f s GLN 67 Ca 0.66 0.48 -0.12 0.00 0.02 0.00 0.00 55.36 56.41 1z5f s GLN 67 Cb -0.16 -0.10 -0.05 0.00 1.00 0.00 0.00 33.01 33.70 1z5f s GLN 67 CO 0.26 -0.15 0.30 0.00 -2.12 0.00 0.00 175.29 173.58 1z5f s ASP 69 N -0.97 2.03 0.56 0.00 1.01 -0.97 -2.52 116.67 115.81 1z5f s ASP 69 Ca 0.20 -0.32 -0.17 0.00 0.71 0.00 0.00 52.55 52.97 1z5f s ASP 69 Cb -0.15 -0.53 -0.05 0.00 1.01 0.00 0.00 42.92 43.20 1z5f s ASP 69 CO 0.09 -0.22 1.06 -0.60 0.21 0.00 0.00 175.17 175.71 1z5f s ARG 70 N 1.91 3.45 0.00 8.23 3.52 -0.83 -0.50 118.95 134.73 1z5f s ARG 70 Ca 0.03 1.27 0.00 0.00 -0.13 0.00 0.00 55.73 56.90 1z5f s ARG 70 Cb -0.14 -2.05 0.00 0.00 -1.56 0.00 0.00 34.95 31.21 1z5f s ARG 70 CO -0.06 -0.71 0.00 1.51 -0.81 0.00 0.00 175.30 175.22 1z5f n ILE 71 N -1.71 0.00 -4.47 4.11 3.06 -1.26 -4.92 119.36 114.17 1z5f n ILE 71 Ca 0.09 0.00 -0.28 0.00 -2.50 0.00 0.00 62.75 60.06 1z5f n ILE 71 Cb 0.53 0.00 -0.09 0.00 0.54 0.00 0.00 39.64 40.61 1z5f n ILE 71 CO 0.00 0.00 0.00 -0.75 -2.50 0.00 0.00 176.55 173.30 1z5f s LYS 72 N -1.05 2.07 0.14 9.51 2.20 -1.26 -5.06 119.74 126.30 1z5f s LYS 72 Ca 0.00 -2.06 0.00 0.00 -0.36 0.00 0.00 55.97 53.55 1z5f s LYS 72 Cb 0.00 -1.74 0.00 0.00 -1.51 0.00 0.00 37.83 34.58 1z5f s LYS 72 CO 0.00 -0.12 0.00 1.28 -0.36 0.00 0.00 175.35 176.15 1z5f n LEU 73 N -1.11 -0.27 0.08 5.43 7.99 -1.26 -4.13 117.00 123.73 1z5f n LEU 73 Ca -0.05 0.62 -0.22 0.00 -0.01 0.00 0.00 56.01 56.35 1z5f n LEU 73 Cb 0.66 -2.25 -0.15 0.00 -0.11 0.00 0.00 43.42 41.58 1z5f n LEU 73 CO 0.47 -1.16 -0.47 1.55 -1.51 0.00 0.00 177.39 176.26 1z5f h PRO 74 N -0.83 0.37 -2.17 3.23 0.14 -2.04 -3.40 132.00 127.30 1z5f h PRO 74 Ca -0.01 -0.64 -0.56 0.00 0.14 0.00 0.00 66.00 64.93 1z5f h PRO 74 Cb 1.12 0.24 -0.41 0.00 0.14 0.00 0.00 31.00 32.09 1z5f h PRO 74 CO 0.01 1.28 -0.83 0.00 0.14 0.00 0.00 178.00 178.60 1z5f s HIS 76 N -2.87 0.34 0.17 0.00 5.04 -1.26 -4.99 115.29 111.71 1z5f s HIS 76 Ca 0.44 -0.48 0.01 0.00 -1.54 0.00 0.00 55.06 53.48 1z5f s HIS 76 Cb 0.27 -0.23 -0.04 0.00 0.04 0.00 0.00 32.58 32.62 1z5f s HIS 76 CO -0.10 -0.15 0.04 0.71 -2.34 0.00 0.00 174.74 172.89 1z5f s TYR 77 N -1.33 1.12 0.13 3.88 1.51 -1.26 -4.05 117.35 117.34 1z5f s TYR 77 Ca -0.13 -1.14 0.05 0.00 -1.01 0.00 0.00 57.07 54.83 1z5f s TYR 77 Cb -0.09 -0.63 -0.04 0.00 -0.11 0.00 0.00 41.96 41.09 1z5f s TYR 77 CO -0.01 -0.37 0.08 0.15 -1.11 0.00 0.00 175.55 174.30 1z5f s LYS 78 N -3.99 2.76 -0.19 -0.62 -0.14 0.35 -4.79 119.74 113.11 1z5f s LYS 78 Ca 0.27 -0.86 -0.21 0.00 -1.36 0.00 0.00 55.97 53.81 1z5f s LYS 78 Cb 0.07 -2.60 -0.03 0.00 -1.68 0.00 0.00 37.83 33.59 1z5f s LYS 78 CO 0.05 0.51 0.62 -1.17 -0.76 0.00 0.00 175.35 174.59 1z5f s LEU 79 N -2.79 4.15 -0.10 3.17 2.96 -1.26 -2.29 118.68 122.52 1z5f s LEU 79 Ca 0.29 0.83 -0.04 0.00 -0.22 0.00 0.00 54.13 54.99 1z5f s LEU 79 Cb -0.11 -2.88 0.05 0.00 0.50 0.00 0.00 46.19 43.76 1z5f s LEU 79 CO 0.22 -0.25 0.21 -0.55 -1.32 0.00 0.00 176.35 174.65 1z5f s SER 80 N 1.17 0.44 0.13 3.68 0.15 -0.59 -4.98 113.70 113.70 1z5f s SER 80 Ca 0.28 0.45 0.03 0.00 0.70 0.00 0.00 55.95 57.41 1z5f s SER 80 Cb -0.16 0.44 -0.04 0.00 -1.71 0.00 0.00 66.02 64.55 1z5f s SER 80 CO 0.10 -0.23 -0.07 -0.94 1.20 0.00 0.00 173.24 173.31 1z5f s SER 81 N 2.16 1.45 0.21 5.45 1.04 -1.26 -0.32 113.70 122.42 1z5f s SER 81 Ca 0.00 -1.04 -0.23 0.00 0.48 0.00 0.00 55.95 55.17 1z5f s SER 81 Cb -0.12 0.05 0.05 0.00 0.10 0.00 0.00 66.02 66.10 1z5f s SER 81 CO -0.07 -0.42 0.71 -0.55 0.98 0.00 0.00 173.24 173.88 1z5f s SER 82 N -3.12 -0.38 -0.25 7.02 0.15 -1.20 -4.97 113.70 110.96 1z5f s SER 82 Ca 0.16 -0.32 -0.08 0.00 0.70 0.00 0.00 55.95 56.40 1z5f s SER 82 Cb 0.04 0.64 -0.04 0.00 -1.71 0.00 0.00 66.02 64.95 1z5f s SER 82 CO -0.01 -1.12 0.10 0.42 1.20 0.00 0.00 173.24 173.83 1z5f s THR 83 N -3.75 4.62 -0.03 6.45 -4.23 -1.26 -2.44 115.64 115.00 1z5f s THR 83 Ca 0.07 -0.07 -0.30 0.00 -1.18 0.00 0.00 61.69 60.21 1z5f s THR 83 Cb -0.03 -3.16 0.07 0.00 1.34 0.00 0.00 72.50 70.71 1z5f s THR 83 CO -0.02 0.33 0.67 0.54 -0.54 0.00 0.00 174.62 175.60 1z5f s ASN 84 N 1.53 -0.65 0.87 3.99 4.22 -1.02 -4.64 114.94 119.25 1z5f s ASN 84 Ca 0.06 0.65 -0.10 0.00 -2.14 0.00 0.00 52.86 51.33 1z5f s ASN 84 Cb -0.15 0.54 0.12 0.00 1.28 0.00 0.00 41.25 43.04 1z5f s ASN 84 CO 0.05 -0.64 1.11 -0.89 -2.04 0.00 0.00 177.10 174.70 1z5f s THR 85 N -1.42 2.61 0.02 0.54 2.01 -1.02 -1.64 115.64 116.74 1z5f s THR 85 Ca -0.10 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.10 1z5f s THR 85 Cb -0.00 -2.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.05 1z5f s THR 85 CO 0.08 -0.26 -0.04 0.27 -0.69 0.00 0.00 174.62 173.98 1z5f s ILE 86 N -2.76 0.19 -0.13 1.82 -4.36 -1.21 -1.71 121.20 113.04 1z5f s ILE 86 Ca 0.64 -0.86 -0.02 0.00 -0.26 0.00 0.00 60.65 60.15 1z5f s ILE 86 Cb -0.20 -0.31 -0.03 0.00 1.25 0.00 0.00 42.46 43.17 1z5f s ILE 86 CO 0.57 -0.43 -0.06 0.00 0.24 0.00 0.00 174.94 175.27 1z5f s ILE 88 N -0.02 0.08 -0.13 0.00 2.07 -1.02 -1.50 121.20 120.68 1z5f s ILE 88 Ca 0.00 -0.63 -0.09 0.00 -1.41 0.00 0.00 60.65 58.51 1z5f s ILE 88 Cb -0.13 -0.76 -0.04 0.00 0.13 0.00 0.00 42.46 41.65 1z5f s ILE 88 CO 0.03 -0.35 0.18 -0.89 -1.91 0.00 0.00 174.94 172.00 1z5f s THR 89 N -1.96 5.41 0.47 4.00 2.01 -0.46 -0.66 115.64 124.45 1z5f s THR 89 Ca -0.09 0.31 0.03 0.00 0.31 0.00 0.00 61.69 62.25 1z5f s THR 89 Cb -0.03 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 1z5f s THR 89 CO 0.00 0.55 0.01 0.00 -0.69 0.00 0.00 174.62 174.49 1z5f n VAL 91 N -1.15 0.00 -0.27 0.00 0.31 -1.23 -2.37 118.33 113.62 1z5f n VAL 91 Ca -0.14 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1z5f n VAL 91 Cb 0.67 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.60 1z5f n VAL 91 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1z5f n ASN 92 N 0.00 2.80 -1.45 4.52 4.13 -1.24 -4.04 115.26 119.98 1z5f n ASN 92 Ca 0.00 -1.75 -0.03 0.00 1.68 0.00 0.00 54.58 54.48 1z5f n ASN 92 Cb 0.00 -0.60 0.01 0.00 -1.54 0.00 0.00 39.78 37.66 1z5f n ASN 92 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1z5f n GLN 93 N 1.78 -1.02 -3.22 3.52 3.00 -1.26 -4.98 117.38 115.19 1z5f n GLN 93 Ca 0.01 0.14 -0.02 0.00 -0.01 0.00 0.00 57.00 57.12 1z5f n GLN 93 Cb 0.27 -2.96 -0.03 0.00 0.00 0.00 0.00 30.24 27.52 1z5f n GLN 93 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1z5f s LEU 94 N -2.81 -1.22 0.18 1.08 2.96 -1.26 -4.84 118.68 112.77 1z5f s LEU 94 Ca 0.01 -0.04 -0.32 0.00 -0.22 0.00 0.00 54.13 53.57 1z5f s LEU 94 Cb -0.00 1.60 -0.11 0.00 0.50 0.00 0.00 46.19 48.18 1z5f s LEU 94 CO 0.12 -0.32 1.77 -2.84 -1.32 0.00 0.00 176.35 173.76 1z5f s PRO 95 N 2.70 4.13 0.00 0.98 0.02 -1.26 -3.53 135.00 138.03 1z5f s PRO 95 Ca 0.10 2.61 0.00 0.00 0.02 0.00 0.00 61.00 63.74 1z5f s PRO 95 Cb -0.11 -3.27 0.00 0.00 0.02 0.00 0.00 34.50 31.13 1z5f s PRO 95 CO -0.27 -0.79 0.00 0.44 -0.33 0.00 0.00 177.00 176.05 1z5f n ILE 96 N 4.28 0.00 -4.41 2.83 -6.64 -1.08 -4.09 119.36 110.25 1z5f n ILE 96 Ca 0.17 0.00 -0.32 0.00 -1.77 0.00 0.00 62.75 60.82 1z5f n ILE 96 Cb 0.36 1.13 -0.16 0.00 -1.44 0.00 0.00 39.64 39.52 1z5f n ILE 96 CO 0.00 0.00 0.00 -1.00 -1.77 0.00 0.00 176.55 173.78 1z5f s HIS 97 N 0.00 2.63 -0.52 4.28 3.76 -1.08 -4.38 115.29 119.99 1z5f s HIS 97 Ca 0.00 -1.43 -0.22 0.00 -0.15 0.00 0.00 55.06 53.27 1z5f s HIS 97 Cb 0.00 -1.81 0.05 0.00 1.11 0.00 0.00 32.58 31.92 1z5f s HIS 97 CO 0.00 -0.68 0.79 0.12 -0.85 0.00 0.00 174.74 174.12 1z5f s PHE 98 N 1.04 2.92 0.00 1.40 2.19 -1.26 -1.36 117.98 122.91 1z5f s PHE 98 Ca -0.02 -0.23 0.00 0.00 0.33 0.00 0.00 56.93 57.01 1z5f s PHE 98 Cb -0.14 -3.81 0.00 0.00 -1.31 0.00 0.00 43.02 37.76 1z5f s PHE 98 CO -0.07 -1.19 0.65 0.00 1.83 0.00 0.00 175.22 176.45 1z5f n ALA 99 N 6.85 -0.13 -2.00 11.12 0.00 -0.57 -4.98 120.51 130.80 1z5f n ALA 99 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1z5f n ALA 99 Cb 0.47 0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1z5f n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1z5f n GLY 100 N -0.69 1.08 3.17 0.00 0.00 -1.24 -5.06 105.19 102.46 1z5f n GLY 100 Ca 0.00 0.38 -0.11 0.00 0.00 0.00 0.00 46.02 46.29 1z5f n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1z5f s VAL 101 N 2.10 0.75 0.00 1.61 0.11 -1.26 -4.72 120.40 118.99 1z5f s VAL 101 Ca 0.00 -1.87 0.00 0.00 -2.93 0.00 0.00 61.98 57.18 1z5f s VAL 101 Cb 0.00 -1.60 0.00 0.00 -1.53 0.00 0.00 36.38 33.25 1z5f s VAL 101 CO 0.00 -0.80 0.00 0.61 -3.33 0.00 0.00 175.10 171.58 1z5f n GLY 102 N 0.09 0.70 0.75 6.54 0.00 -0.69 -4.76 105.19 107.81 1z5f n GLY 102 Ca -0.13 -0.87 -0.06 0.00 0.00 0.00 0.00 46.02 44.96 1z5f n GLY 102 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1z5f n SER 103 N -2.79 0.02 -3.12 1.61 2.88 -1.25 -2.64 113.62 108.33 1z5f n SER 103 Ca 0.00 -1.10 -0.18 0.00 -1.33 0.00 0.00 58.87 56.26 1z5f n SER 103 Cb 0.00 -0.20 -0.02 0.00 -0.75 0.00 0.00 64.21 63.24 1z5f n SER 103 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81