#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 0.00 0.00 1.24 -0.00 -1.87 0.16 115.95 115.49 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 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.16 1z5f h TRP 3 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 178.44 176.53 1z5f n GLU 4 N -3.83 0.00 -0.14 2.65 2.13 -1.26 -0.85 120.64 119.35 1z5f n GLU 4 Ca 0.25 0.09 -0.04 0.00 0.66 0.00 0.00 57.16 58.12 1z5f n GLU 4 Cb 1.35 -0.99 0.02 0.00 0.27 0.00 0.00 31.44 32.10 1z5f n GLU 4 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1z5f h THR 5 N 0.00 0.49 -0.54 6.31 1.03 -1.87 1.16 112.91 119.50 1z5f h THR 5 Ca 0.00 0.00 0.16 0.00 -0.01 0.00 0.00 66.41 66.56 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 0.69 0.15 -0.01 0.00 0.00 175.52 176.35 1z5f h PHE 6 N -0.04 0.00 0.00 0.00 3.57 -0.76 2.24 116.94 121.94 1z5f h PHE 6 Ca 0.21 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.71 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 -0.41 0.00 -0.97 0.94 -2.23 0.00 0.00 178.31 175.64 1z5f n GLN 7 N -3.43 0.54 -0.09 1.11 0.00 0.39 -2.95 117.38 112.94 1z5f n GLN 7 Ca 0.11 0.10 -0.22 0.00 -0.00 0.00 0.00 57.00 56.99 1z5f n GLN 7 Cb 0.88 -1.78 -0.12 0.00 0.00 0.00 0.00 30.24 29.22 1z5f n GLN 7 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1z5f n LYS 8 N -2.53 0.59 -0.02 3.69 4.76 0.73 -3.75 118.16 121.64 1z5f n LYS 8 Ca 0.01 0.53 -0.22 0.00 -2.87 0.00 0.00 58.31 55.76 1z5f n LYS 8 Cb 0.53 -1.74 -0.13 0.00 -1.84 0.00 0.00 35.03 31.84 1z5f n LYS 8 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1z5f n LYS 9 N -4.30 0.71 0.00 1.97 2.85 0.15 -4.21 118.16 115.33 1z5f n LYS 9 Ca -0.32 0.35 0.14 0.00 -1.05 0.00 0.00 58.31 57.42 1z5f n LYS 9 Cb 0.74 -1.72 0.61 0.00 -0.65 0.00 0.00 35.03 34.01 1z5f n LYS 9 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1z5f n HIS 10 N -3.74 0.00 -3.98 5.58 8.25 -1.15 -4.58 115.22 115.59 1z5f n HIS 10 Ca -0.32 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.06 1z5f n HIS 10 Cb 0.95 -0.26 -0.10 0.00 1.12 0.00 0.00 29.99 31.70 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 -2.63 2.06 0.00 2.41 1.02 -1.21 -0.35 118.68 119.97 1z5f s LEU 11 Ca 0.25 -0.69 0.00 0.00 0.02 0.00 0.00 54.13 53.70 1z5f s LEU 11 Cb 0.20 0.43 0.00 0.00 0.02 0.00 0.00 46.19 46.84 1z5f s LEU 11 CO 0.50 -0.53 0.00 1.07 0.02 0.00 0.00 176.35 177.42 1z5f n THR 12 N 0.61 0.00 -0.01 5.49 5.66 -1.09 -4.30 114.28 120.63 1z5f n THR 12 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 1z5f n THR 12 Cb 0.59 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.37 1z5f n THR 12 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1z5f n ASP 13 N -0.74 1.19 -4.00 1.09 5.75 -1.26 -4.34 116.55 114.24 1z5f n ASP 13 Ca 0.00 -1.20 -0.09 0.00 -0.01 0.00 0.00 54.79 53.50 1z5f n ASP 13 Cb 0.00 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 39.98 1z5f n ASP 13 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1z5f s THR 14 N -0.20 0.14 -0.19 2.12 -1.32 -1.26 -4.97 115.64 109.96 1z5f s THR 14 Ca 0.00 -1.15 0.29 0.00 -1.21 0.00 0.00 61.69 59.62 1z5f s THR 14 Cb 0.00 -0.64 0.36 0.00 -1.51 0.00 0.00 72.50 70.71 1z5f s THR 14 CO 0.00 -0.63 1.81 0.07 -2.21 0.00 0.00 174.62 173.66 1z5f h LYS 15 N 4.18 0.00 -2.23 7.08 2.10 -1.95 -3.31 116.57 122.44 1z5f h LYS 15 Ca -0.33 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 57.73 1z5f h LYS 15 Cb 1.19 0.00 -0.42 0.00 -0.90 0.00 0.00 32.23 32.10 1z5f h LYS 15 CO 0.48 0.00 -0.58 0.36 -2.00 0.00 0.00 179.45 177.71 1z5f n LYS 16 N -2.99 2.83 -0.67 0.07 2.85 -1.26 -4.29 118.16 114.69 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 0.39 -2.26 0.17 0.00 -0.65 0.00 0.00 35.03 32.69 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 0.46 0.00 -2.89 0.58 0.24 -1.25 -4.85 118.33 110.62 1z5f n VAL 17 Ca 0.30 -0.30 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 1z5f n VAL 17 Cb 0.40 -0.60 0.01 0.00 -1.47 0.00 0.00 33.84 32.19 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 -2.02 4.74 -0.44 7.34 2.85 -1.26 -4.84 118.16 124.53 1z5f n LYS 18 Ca 0.00 -4.57 0.34 0.00 -1.05 0.00 0.00 58.31 53.04 1z5f n LYS 18 Cb 0.63 -2.51 0.54 0.00 -0.65 0.00 0.00 35.03 33.05 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 0.82 0.00 0.00 1.82 -1.92 -0.97 116.42 116.17 1z5f h ASP 20 Ca 0.65 0.08 -0.29 0.00 -0.39 0.00 0.00 57.03 57.08 1z5f h ASP 20 Cb 2.43 -0.07 -0.05 0.00 0.68 0.00 0.00 39.33 42.32 1z5f h ASP 20 CO -0.13 0.34 -2.10 0.52 -1.61 0.00 0.00 179.24 176.25 1z5f n VAL 21 N -4.73 1.11 0.00 2.25 0.31 0.41 -2.10 118.33 115.57 1z5f n VAL 21 Ca 0.22 -0.59 0.00 0.00 -0.01 0.00 0.00 64.34 63.95 1z5f n VAL 21 Cb 0.50 -0.79 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 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 -2.75 0.00 0.00 5.55 4.07 -0.04 -1.14 120.64 126.33 1z5f n GLU 22 Ca -0.29 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 1z5f n GLU 22 Cb 0.97 -1.55 0.00 0.00 -0.06 0.00 0.00 31.44 30.80 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 -1.30 0.00 0.00 5.31 2.81 -0.39 -4.69 117.12 118.86 1z5f n MET 23 Ca 0.00 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.94 1z5f n MET 23 Cb 0.05 -0.53 0.32 0.00 -0.71 0.00 0.00 33.22 32.34 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 -0.89 -0.89 120.51 120.32 1z5f n ALA 24 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1z5f n ALA 24 Cb 0.31 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.83 0.20 -0.00 0.00 5.02 -0.29 -4.48 118.16 117.77 1z5f n LYS 25 Ca 0.08 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.46 1z5f n LYS 25 Cb 0.04 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 34.93 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 -2.67 3.82 1.13 7.82 0.00 -1.26 -3.40 120.51 125.94 1z5f n ALA 26 Ca 0.00 -0.49 0.12 0.00 0.00 0.00 0.00 53.44 53.07 1z5f n ALA 26 Cb 0.00 -0.66 0.20 0.00 0.00 0.00 0.00 19.45 18.99 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 -1.68 2.39 -0.02 0.00 -0.00 -1.26 -4.34 117.00 112.09 1z5f n LEU 27 Ca 0.01 -0.80 -0.03 0.00 -0.00 0.00 0.00 56.01 55.19 1z5f n LEU 27 Cb 0.35 -0.01 -0.02 0.00 -0.00 0.00 0.00 43.42 43.75 1z5f n LEU 27 CO 0.38 0.41 -0.62 0.49 -0.00 0.00 0.00 177.39 178.04 1z5f n PHE 28 N 0.75 0.00 -2.70 1.47 3.72 -1.26 -5.05 117.46 114.39 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 0.51 -0.15 0.03 0.00 -0.94 0.00 0.00 39.48 38.92 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 -2.53 -2.87 -3.79 4.37 8.00 -1.22 -3.87 116.55 114.64 1z5f n ASP 29 Ca -0.07 -0.18 -0.32 0.00 0.71 0.00 0.00 54.79 54.93 1z5f n ASP 29 Cb 0.58 -1.96 0.02 0.00 -0.02 0.00 0.00 41.12 39.73 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 -3.88 3.16 0.00 0.00 4.76 -1.25 -4.94 118.16 116.01 1z5f n LYS 31 Ca -0.15 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.29 1z5f n LYS 31 Cb 0.60 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.79 1z5f n LYS 31 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1z5f n LYS 32 N 0.00 1.57 -4.04 1.97 2.85 -1.26 -5.00 118.16 114.25 1z5f n LYS 32 Ca 0.00 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.15 1z5f n LYS 32 Cb 0.00 -0.66 -0.11 0.00 -0.65 0.00 0.00 35.03 33.61 1z5f n LYS 32 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1z5f s THR 33 N -1.24 0.36 0.00 0.58 2.01 -1.26 -0.37 115.64 115.73 1z5f s THR 33 Ca 0.00 -1.11 -0.26 0.00 0.31 0.00 0.00 61.69 60.63 1z5f s THR 33 Cb 0.00 -0.60 0.06 0.00 0.01 0.00 0.00 72.50 71.97 1z5f s THR 33 CO 0.00 -0.50 0.58 0.21 -0.69 0.00 0.00 174.62 174.22 1z5f s ASN 34 N -1.71 -0.53 0.02 3.53 3.84 -0.93 -4.95 114.94 114.22 1z5f s ASN 34 Ca -0.10 0.41 -0.00 0.00 0.21 0.00 0.00 52.86 53.38 1z5f s ASN 34 Cb -0.08 0.51 -0.02 0.00 -0.55 0.00 0.00 41.25 41.10 1z5f s ASN 34 CO -0.01 -0.66 -0.03 -0.89 -2.79 0.00 0.00 177.10 172.72 1z5f s THR 35 N -1.84 0.13 0.34 -5.21 2.01 -1.26 -0.38 115.64 109.43 1z5f s THR 35 Ca -0.08 -1.05 -0.10 0.00 0.31 0.00 0.00 61.69 60.77 1z5f s THR 35 Cb -0.01 -0.47 0.02 0.00 0.01 0.00 0.00 72.50 72.06 1z5f s THR 35 CO 0.04 -0.58 0.60 -0.36 -0.69 0.00 0.00 174.62 173.63 1z5f s PHE 36 N -1.86 0.55 -0.06 4.92 0.40 -0.96 -4.58 117.98 116.39 1z5f s PHE 36 Ca -0.12 -0.98 0.05 0.00 -0.60 0.00 0.00 56.93 55.28 1z5f s PHE 36 Cb -0.07 0.33 -0.01 0.00 0.51 0.00 0.00 43.02 43.78 1z5f s PHE 36 CO -0.02 -1.28 -0.22 0.42 0.70 0.00 0.00 175.22 174.82 1z5f s ILE 37 N -2.98 1.85 -0.77 0.64 1.01 0.52 -3.44 121.20 118.03 1z5f s ILE 37 Ca 0.23 -0.94 -0.21 0.00 0.00 0.00 0.00 60.65 59.73 1z5f s ILE 37 Cb -0.02 -1.57 0.09 0.00 0.01 0.00 0.00 42.46 40.97 1z5f s ILE 37 CO 0.15 0.52 1.02 -0.47 0.00 0.00 0.00 174.94 176.16 1z5f s TYR 38 N -0.02 2.85 -0.02 3.97 5.04 -0.97 -2.69 117.35 125.52 1z5f s TYR 38 Ca -0.06 -0.90 -0.17 0.00 -2.44 0.00 0.00 57.07 53.51 1z5f s TYR 38 Cb -0.14 -4.28 0.03 0.00 0.35 0.00 0.00 41.96 37.92 1z5f s TYR 38 CO 0.04 -1.58 0.36 0.00 -1.34 0.00 0.00 175.55 173.03 1z5f s ALA 39 N 3.49 -0.91 0.20 3.97 0.00 -1.26 -4.77 121.76 122.47 1z5f s ALA 39 Ca 0.26 0.49 -0.16 0.00 0.00 0.00 0.00 51.96 52.55 1z5f s ALA 39 Cb -0.12 0.03 -0.08 0.00 0.00 0.00 0.00 23.12 22.95 1z5f s ALA 39 CO 0.02 -0.27 0.63 -0.48 0.00 0.00 0.00 175.76 175.66 1z5f s LEU 40 N -1.23 4.30 0.19 0.00 0.05 -1.26 -4.80 118.68 115.93 1z5f s LEU 40 Ca -0.13 1.22 -0.18 0.00 0.05 0.00 0.00 54.13 55.09 1z5f s LEU 40 Cb -0.04 -3.50 0.15 0.00 -2.05 0.00 0.00 46.19 40.75 1z5f s LEU 40 CO 0.05 0.03 1.37 -2.65 -0.55 0.00 0.00 176.35 174.60 1z5f n PRO 41 N 0.59 -0.25 -0.01 1.48 -0.02 -1.26 -0.90 135.00 134.63 1z5f n PRO 41 Ca -0.03 1.36 -0.09 0.00 -2.02 0.00 0.00 63.50 62.72 1z5f n PRO 41 Cb 0.52 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.96 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 -0.11 1.95 -1.23 0.00 -1.98 0.14 103.07 101.85 1z5f h GLY 42 Ca 0.27 0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.80 1z5f h GLY 42 CO -0.87 -0.17 -0.05 -0.09 0.00 0.00 0.00 176.54 175.36 1z5f h ARG 43 N -0.21 0.07 0.12 4.80 2.43 -1.40 0.30 114.38 120.48 1z5f h ARG 43 Ca 0.11 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1z5f h ARG 43 Cb 0.37 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1z5f h ARG 43 CO -0.28 0.13 -0.06 0.28 -1.51 0.00 0.00 179.97 178.53 1z5f h VAL 44 N 0.07 0.46 0.00 0.20 2.07 0.21 -2.35 116.25 116.90 1z5f h VAL 44 Ca 0.02 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1z5f h VAL 44 Cb 0.14 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1z5f h VAL 44 CO 0.01 0.14 0.00 0.07 0.02 0.00 0.00 177.57 177.81 1z5f h LYS 45 N -1.00 0.00 0.05 1.57 2.10 -0.73 -2.33 116.57 116.23 1z5f h LYS 45 Ca -0.02 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 58.37 1z5f h LYS 45 Cb 0.36 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.70 1z5f h LYS 45 CO 0.03 0.00 -1.09 0.00 -2.00 0.00 0.00 179.45 176.39 1z5f h ALA 46 N 2.00 0.18 0.00 0.07 0.00 -0.43 -3.04 119.26 118.05 1z5f h ALA 46 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1z5f h ALA 46 Cb 0.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1z5f h ALA 46 CO 0.00 0.77 0.00 1.28 0.00 0.00 0.00 179.25 181.30 1z5f n LEU 47 N -3.75 0.00 -1.91 0.00 4.77 -0.88 -1.90 117.00 113.33 1z5f n LEU 47 Ca -0.10 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.86 1z5f n LEU 47 Cb 0.91 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 42.06 1z5f n LEU 47 CO 0.54 0.00 0.11 0.00 -1.33 0.00 0.00 177.39 176.71 1z5f s LYS 49 N -2.56 4.37 0.00 0.00 -2.85 -0.80 -3.71 119.74 114.19 1z5f s LYS 49 Ca 0.36 0.72 0.00 0.00 -1.00 0.00 0.00 55.97 56.05 1z5f s LYS 49 Cb 0.37 -3.47 0.00 0.00 -2.06 0.00 0.00 37.83 32.66 1z5f s LYS 49 CO -0.07 0.02 0.00 -1.71 0.10 0.00 0.00 175.35 173.69 1z5f n ASN 50 N 4.04 -2.94 -3.76 0.03 4.05 -1.26 -5.02 115.26 110.40 1z5f n ASN 50 Ca -0.03 0.00 -0.28 0.00 0.45 0.00 0.00 54.58 54.72 1z5f n ASN 50 Cb 0.51 -0.62 0.25 0.00 1.23 0.00 0.00 39.78 41.15 1z5f n ASN 50 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1z5f n ILE 51 N -2.88 0.00 -0.06 -1.44 2.08 -1.15 -5.00 119.36 110.90 1z5f n ILE 51 Ca 0.00 -0.18 -0.07 0.00 0.56 0.00 0.00 62.75 63.05 1z5f n ILE 51 Cb 0.02 -0.87 -0.02 0.00 -0.75 0.00 0.00 39.64 38.02 1z5f n ILE 51 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 1z5f n ARG 52 N -4.54 0.43 0.00 0.38 0.63 -1.26 -4.78 116.66 107.53 1z5f n ARG 52 Ca 0.08 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 57.17 1z5f n ARG 52 Cb 0.55 -1.25 0.00 0.00 0.45 0.00 0.00 32.46 32.21 1z5f n ARG 52 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1z5f n ASP 53 N -4.26 0.48 -4.55 6.15 2.03 -1.23 -4.17 116.55 111.00 1z5f n ASP 53 Ca -0.11 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 54.90 1z5f n ASP 53 Cb 0.42 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.77 1z5f n ASP 53 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1z5f s ASN 54 N 2.00 4.64 0.05 1.67 0.02 -1.21 -3.64 114.94 118.46 1z5f s ASN 54 Ca 0.00 0.34 0.03 0.00 -1.02 0.00 0.00 52.86 52.21 1z5f s ASN 54 Cb 0.00 -2.53 -0.02 0.00 0.02 0.00 0.00 41.25 38.72 1z5f s ASN 54 CO 0.00 -2.97 -0.10 -0.89 0.02 0.00 0.00 177.10 173.16 1z5f s THR 55 N 11.67 0.71 -0.35 1.60 2.01 -1.00 -4.97 115.64 125.31 1z5f s THR 55 Ca 0.84 -1.10 -0.23 0.00 0.31 0.00 0.00 61.69 61.51 1z5f s THR 55 Cb -0.13 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.65 1z5f s THR 55 CO 0.16 -0.30 0.77 -1.81 -0.69 0.00 0.00 174.62 172.75 1z5f s ASP 56 N -1.53 6.56 0.55 3.53 1.11 -1.26 -2.37 116.67 123.26 1z5f s ASP 56 Ca -0.07 0.40 0.05 0.00 0.18 0.00 0.00 52.55 53.11 1z5f s ASP 56 Cb -0.10 -2.39 0.04 0.00 1.07 0.00 0.00 42.92 41.54 1z5f s ASP 56 CO 0.01 -0.70 0.40 0.68 1.18 0.00 0.00 175.17 176.74 1z5f s VAL 57 N 3.04 1.59 -0.24 -1.27 -7.23 0.81 -4.95 120.40 112.16 1z5f s VAL 57 Ca 0.31 -1.51 -0.26 0.00 -1.81 0.00 0.00 61.98 58.72 1z5f s VAL 57 Cb -0.13 -2.10 0.08 0.00 0.56 0.00 0.00 36.38 34.78 1z5f s VAL 57 CO 0.16 0.00 0.76 -0.22 -0.31 0.00 0.00 175.10 175.49 1z5f s LEU 58 N -4.28 -0.69 0.62 1.32 2.96 -1.26 -1.58 118.68 115.76 1z5f s LEU 58 Ca 0.33 1.26 -0.18 0.00 -0.22 0.00 0.00 54.13 55.32 1z5f s LEU 58 Cb -0.02 2.40 -0.05 0.00 0.50 0.00 0.00 46.19 49.02 1z5f s LEU 58 CO 0.20 -0.29 0.90 -0.24 -1.32 0.00 0.00 176.35 175.61 1z5f n SER 59 N 2.36 0.46 -0.82 3.68 2.88 -1.09 -4.85 113.62 116.23 1z5f n SER 59 Ca -0.14 0.77 0.06 0.00 -1.33 0.00 0.00 58.87 58.22 1z5f n SER 59 Cb 0.55 -1.36 0.18 0.00 -0.75 0.00 0.00 64.21 62.83 1z5f n SER 59 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1z5f n ARG 60 N -1.02 2.14 0.00 -1.46 5.12 -1.26 -4.72 116.66 115.46 1z5f n ARG 60 Ca 0.14 -1.43 0.00 0.00 -1.93 0.00 0.00 57.85 54.63 1z5f n ARG 60 Cb 0.48 -1.43 0.00 0.00 -1.16 0.00 0.00 32.46 30.35 1z5f n ARG 60 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1z5f n ASP 61 N 0.55 0.00 -3.92 0.55 2.03 -1.26 -5.12 116.55 109.38 1z5f n ASP 61 Ca 0.13 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.36 1z5f n ASP 61 Cb 0.42 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.78 1z5f n ASP 61 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1z5f s ALA 62 N -1.00 -0.67 -0.18 -1.67 0.00 -1.26 -2.60 121.76 114.39 1z5f s ALA 62 Ca 0.00 -0.63 -0.14 0.00 0.00 0.00 0.00 51.96 51.19 1z5f s ALA 62 Cb 0.00 0.97 0.05 0.00 0.00 0.00 0.00 23.12 24.14 1z5f s ALA 62 CO 0.00 -0.94 0.46 -0.06 0.00 0.00 0.00 175.76 175.22 1z5f s PHE 63 N -3.95 -0.56 -0.35 0.00 0.40 -0.69 -4.72 117.98 108.11 1z5f s PHE 63 Ca 0.17 1.29 -0.29 0.00 -0.60 0.00 0.00 56.93 57.51 1z5f s PHE 63 Cb -0.03 0.22 0.02 0.00 0.51 0.00 0.00 43.02 43.74 1z5f s PHE 63 CO 0.08 -0.29 1.14 -1.17 0.70 0.00 0.00 175.22 175.68 1z5f s LEU 64 N 0.67 3.86 -0.06 -0.37 0.20 -1.26 -2.46 118.68 119.26 1z5f s LEU 64 Ca -0.03 0.96 0.06 0.00 0.69 0.00 0.00 54.13 55.80 1z5f s LEU 64 Cb -0.05 -3.54 -0.01 0.00 -0.43 0.00 0.00 46.19 42.16 1z5f s LEU 64 CO -0.05 -1.01 -0.23 -1.48 -0.29 0.00 0.00 176.35 173.30 1z5f s LEU 65 N 3.99 2.04 0.51 -0.68 2.34 -1.01 -2.28 118.68 123.58 1z5f s LEU 65 Ca 0.48 -0.48 -0.19 0.00 0.06 0.00 0.00 54.13 54.00 1z5f s LEU 65 Cb -0.12 -1.29 -0.07 0.00 -0.56 0.00 0.00 46.19 44.15 1z5f s LEU 65 CO 0.21 0.22 1.04 -2.16 -1.06 0.00 0.00 176.35 174.60 1z5f s PRO 66 N -0.10 3.70 -0.10 1.48 0.04 -1.22 -3.33 135.00 135.47 1z5f s PRO 66 Ca -0.04 1.32 -0.05 0.00 0.04 0.00 0.00 61.00 62.26 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 -0.51 0.23 -0.65 0.04 0.00 0.00 177.00 176.14 1z5f s GLN 67 N -3.44 0.19 -0.06 4.56 -0.21 0.53 -2.28 119.66 118.96 1z5f s GLN 67 Ca 0.66 0.50 -0.17 0.00 0.02 0.00 0.00 55.36 56.38 1z5f s GLN 67 Cb -0.16 -0.12 -0.05 0.00 1.00 0.00 0.00 33.01 33.68 1z5f s GLN 67 CO 0.24 -0.16 0.45 0.00 -2.12 0.00 0.00 175.29 173.70 1z5f s ASP 69 N -0.19 3.43 0.61 0.00 -1.08 -0.98 -2.19 116.67 116.27 1z5f s ASP 69 Ca 0.25 -1.09 -0.13 0.00 -0.52 0.00 0.00 52.55 51.07 1z5f s ASP 69 Cb -0.16 -0.85 -0.04 0.00 -1.46 0.00 0.00 42.92 40.41 1z5f s ASP 69 CO 0.12 -0.30 1.03 -0.60 0.52 0.00 0.00 175.17 175.94 1z5f s ARG 70 N 1.65 3.50 0.00 4.34 3.52 0.50 -0.91 118.95 131.55 1z5f s ARG 70 Ca -0.01 0.89 0.00 0.00 -0.13 0.00 0.00 55.73 56.48 1z5f s ARG 70 Cb -0.18 -2.07 0.00 0.00 -1.56 0.00 0.00 34.95 31.15 1z5f s ARG 70 CO -0.10 -0.65 0.00 1.51 -0.81 0.00 0.00 175.30 175.25 1z5f n ILE 71 N -2.51 0.00 -4.13 4.11 3.06 -1.26 -4.94 119.36 113.69 1z5f n ILE 71 Ca 0.07 0.00 -0.13 0.00 -2.50 0.00 0.00 62.75 60.18 1z5f n ILE 71 Cb 0.54 0.00 -0.07 0.00 0.54 0.00 0.00 39.64 40.65 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 -0.41 1.58 0.38 9.51 2.20 -1.26 -5.12 119.74 126.63 1z5f s LYS 72 Ca 0.00 -1.65 0.00 0.00 -0.36 0.00 0.00 55.97 53.96 1z5f s LYS 72 Cb 0.00 0.38 0.00 0.00 -1.51 0.00 0.00 37.83 36.70 1z5f s LYS 72 CO 0.00 -0.61 0.00 1.28 -0.36 0.00 0.00 175.35 175.66 1z5f n LEU 73 N -0.44 -0.73 -0.02 5.43 4.77 -1.26 -4.35 117.00 120.40 1z5f n LEU 73 Ca 0.02 1.64 -0.00 0.00 -0.03 0.00 0.00 56.01 57.63 1z5f n LEU 73 Cb 0.63 -4.12 -0.00 0.00 -2.33 0.00 0.00 43.42 37.60 1z5f n LEU 73 CO 0.29 -3.12 -0.01 1.55 -1.33 0.00 0.00 177.39 174.77 1z5f h PRO 74 N -1.24 0.00 -2.06 3.23 0.14 -2.04 -3.41 132.00 126.62 1z5f h PRO 74 Ca -0.03 0.00 -0.61 0.00 0.14 0.00 0.00 66.00 65.50 1z5f h PRO 74 Cb 1.22 0.00 -0.41 0.00 0.14 0.00 0.00 31.00 31.95 1z5f h PRO 74 CO 0.03 0.00 -0.51 0.00 0.14 0.00 0.00 178.00 177.66 1z5f s HIS 76 N -3.57 1.98 0.18 0.00 5.04 -1.26 -4.95 115.29 112.71 1z5f s HIS 76 Ca 0.48 -0.42 0.00 0.00 -1.54 0.00 0.00 55.06 53.59 1z5f s HIS 76 Cb 0.31 -1.03 -0.04 0.00 0.04 0.00 0.00 32.58 31.86 1z5f s HIS 76 CO -0.16 0.33 0.05 0.71 -2.34 0.00 0.00 174.74 173.32 1z5f s TYR 77 N -1.53 1.14 -0.01 3.88 1.51 -1.26 -4.45 117.35 116.63 1z5f s TYR 77 Ca 0.13 -1.15 0.01 0.00 -1.01 0.00 0.00 57.07 55.05 1z5f s TYR 77 Cb -0.08 -0.64 -0.04 0.00 -0.11 0.00 0.00 41.96 41.09 1z5f s TYR 77 CO 0.06 -0.38 0.02 0.21 -1.11 0.00 0.00 175.55 174.36 1z5f s LYS 78 N -4.00 2.88 -0.26 -0.62 2.47 -0.09 -4.84 119.74 115.28 1z5f s LYS 78 Ca 0.28 -0.55 -0.23 0.00 -1.56 0.00 0.00 55.97 53.91 1z5f s LYS 78 Cb 0.07 -2.73 -0.01 0.00 -1.46 0.00 0.00 37.83 33.70 1z5f s LYS 78 CO 0.06 0.64 0.74 -1.17 0.16 0.00 0.00 175.35 175.78 1z5f s LEU 79 N -1.52 4.08 -0.07 5.43 1.98 -1.26 -2.33 118.68 124.99 1z5f s LEU 79 Ca 0.20 0.81 -0.03 0.00 -2.89 0.00 0.00 54.13 52.22 1z5f s LEU 79 Cb -0.12 -3.03 0.04 0.00 0.66 0.00 0.00 46.19 43.74 1z5f s LEU 79 CO 0.10 -0.49 0.15 -0.55 -1.89 0.00 0.00 176.35 173.67 1z5f s SER 80 N 1.46 0.00 0.09 3.68 0.15 -0.94 -5.00 113.70 113.15 1z5f s SER 80 Ca 0.31 0.30 -0.03 0.00 0.70 0.00 0.00 55.95 57.23 1z5f s SER 80 Cb -0.15 0.20 -0.03 0.00 -1.71 0.00 0.00 66.02 64.33 1z5f s SER 80 CO 0.09 -0.16 0.07 -0.94 1.20 0.00 0.00 173.24 173.50 1z5f s SER 81 N 1.32 0.32 0.16 5.45 1.04 -1.26 -0.35 113.70 120.39 1z5f s SER 81 Ca -0.08 -0.99 -0.24 0.00 0.48 0.00 0.00 55.95 55.12 1z5f s SER 81 Cb -0.12 0.28 0.06 0.00 0.10 0.00 0.00 66.02 66.34 1z5f s SER 81 CO -0.06 -0.69 0.79 -0.44 0.98 0.00 0.00 173.24 173.82 1z5f s SER 82 N -2.95 -0.33 -0.26 7.02 0.01 -1.21 -4.97 113.70 111.01 1z5f s SER 82 Ca 0.13 -0.28 -0.09 0.00 1.31 0.00 0.00 55.95 57.02 1z5f s SER 82 Cb 0.07 0.56 -0.04 0.00 0.21 0.00 0.00 66.02 66.82 1z5f s SER 82 CO -0.06 -0.99 0.11 0.42 0.41 0.00 0.00 173.24 173.14 1z5f s THR 83 N -3.54 4.68 0.05 1.44 -4.23 -1.26 -2.39 115.64 110.38 1z5f s THR 83 Ca 0.08 -0.05 -0.27 0.00 -1.18 0.00 0.00 61.69 60.27 1z5f s THR 83 Cb -0.02 -3.20 0.07 0.00 1.34 0.00 0.00 72.50 70.69 1z5f s THR 83 CO -0.02 0.31 0.65 0.54 -0.54 0.00 0.00 174.62 175.56 1z5f s ASN 84 N 1.61 -0.61 0.89 3.99 4.22 -1.03 -4.63 114.94 119.37 1z5f s ASN 84 Ca 0.06 0.38 -0.11 0.00 -2.14 0.00 0.00 52.86 51.06 1z5f s ASN 84 Cb -0.15 0.57 0.13 0.00 1.28 0.00 0.00 41.25 43.07 1z5f s ASN 84 CO 0.06 -0.77 1.11 -0.89 -2.04 0.00 0.00 177.10 174.57 1z5f s THR 85 N -2.39 2.53 -0.12 0.54 2.01 -1.07 -1.70 115.64 115.45 1z5f s THR 85 Ca -0.05 0.17 -0.06 0.00 0.31 0.00 0.00 61.69 62.06 1z5f s THR 85 Cb -0.00 -2.40 0.05 0.00 0.01 0.00 0.00 72.50 70.16 1z5f s THR 85 CO -0.01 -0.23 0.28 0.27 -0.69 0.00 0.00 174.62 174.24 1z5f s ILE 86 N -2.75 -0.09 0.09 1.82 -0.00 -1.26 0.50 121.20 119.53 1z5f s ILE 86 Ca 0.65 0.15 -0.27 0.00 -0.00 0.00 0.00 60.65 61.18 1z5f s ILE 86 Cb -0.21 -0.43 -0.06 0.00 -0.00 0.00 0.00 42.46 41.76 1z5f s ILE 86 CO 0.58 0.06 0.82 0.00 -0.00 0.00 0.00 174.94 176.41 1z5f s ILE 88 N -0.30 0.09 -0.08 0.00 2.07 -0.62 -0.53 121.20 121.83 1z5f s ILE 88 Ca 0.40 -0.73 0.00 0.00 -1.41 0.00 0.00 60.65 58.92 1z5f s ILE 88 Cb -0.22 -1.02 -0.03 0.00 0.13 0.00 0.00 42.46 41.32 1z5f s ILE 88 CO 0.26 -0.40 -0.06 -0.89 -1.91 0.00 0.00 174.94 171.93 1z5f s THR 89 N -2.87 3.73 0.40 4.00 2.01 -0.45 -0.13 115.64 122.33 1z5f s THR 89 Ca -0.03 -0.46 0.06 0.00 0.31 0.00 0.00 61.69 61.57 1z5f s THR 89 Cb 0.00 -2.54 -0.07 0.00 0.01 0.00 0.00 72.50 69.90 1z5f s THR 89 CO -0.05 0.58 0.02 0.00 -0.69 0.00 0.00 174.62 174.48 1z5f n VAL 91 N -0.94 0.00 -0.32 0.00 0.31 -1.24 -2.38 118.33 113.76 1z5f n VAL 91 Ca -0.06 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.33 1z5f n VAL 91 Cb 0.67 0.00 0.21 0.00 -0.91 0.00 0.00 33.84 33.81 1z5f n VAL 91 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 1z5f h ASN 92 N 0.00 0.76 0.00 4.52 -0.73 -1.79 -3.27 115.58 115.07 1z5f h ASN 92 Ca 0.00 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.23 1z5f h ASN 92 Cb 0.00 -0.09 0.00 0.00 0.27 0.00 0.00 38.32 38.50 1z5f h ASN 92 CO 0.00 0.40 0.00 0.00 -0.37 0.00 0.00 177.43 177.46 1z5f n GLN 93 N -4.72 0.00 -3.17 6.67 10.64 -1.26 -2.94 117.38 122.61 1z5f n GLN 93 Ca 0.17 0.00 0.02 0.00 -1.83 0.00 0.00 57.00 55.36 1z5f n GLN 93 Cb 0.34 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.72 1z5f n GLN 93 CO 0.00 0.00 0.00 -1.17 -1.83 0.00 0.00 177.06 174.06 1z5f s LEU 94 N 0.00 -1.51 0.29 2.61 2.96 -1.26 -4.89 118.68 116.88 1z5f s LEU 94 Ca 0.00 0.17 -0.30 0.00 -0.22 0.00 0.00 54.13 53.78 1z5f s LEU 94 Cb 0.00 1.93 -0.12 0.00 0.50 0.00 0.00 46.19 48.50 1z5f s LEU 94 CO 0.00 -0.30 1.47 -2.65 -1.32 0.00 0.00 176.35 173.54 1z5f n PRO 95 N 5.41 2.37 0.00 0.98 -0.02 -1.26 -3.68 135.00 138.80 1z5f n PRO 95 Ca 0.04 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1z5f n PRO 95 Cb 0.53 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1z5f n PRO 95 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1z5f n ILE 96 N 1.58 0.00 -5.10 4.25 -6.64 -1.20 -3.91 119.36 108.33 1z5f n ILE 96 Ca 0.08 0.00 -0.30 0.00 -1.77 0.00 0.00 62.75 60.76 1z5f n ILE 96 Cb 0.35 0.63 -0.17 0.00 -1.44 0.00 0.00 39.64 39.01 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 2.33 -0.48 4.28 3.76 -1.09 -4.42 115.29 119.67 1z5f s HIS 97 Ca 0.00 -0.91 -0.13 0.00 -0.15 0.00 0.00 55.06 53.88 1z5f s HIS 97 Cb 0.00 -1.57 0.10 0.00 1.11 0.00 0.00 32.58 32.22 1z5f s HIS 97 CO 0.00 -0.36 0.38 0.12 -0.85 0.00 0.00 174.74 174.02 1z5f s PHE 98 N 0.33 3.31 0.00 1.40 5.36 -1.26 -1.34 117.98 125.78 1z5f s PHE 98 Ca -0.16 -1.39 0.00 0.00 -0.96 0.00 0.00 56.93 54.42 1z5f s PHE 98 Cb -0.17 -3.35 0.00 0.00 -0.34 0.00 0.00 43.02 39.16 1z5f s PHE 98 CO 0.07 -0.91 0.53 0.00 -1.46 0.00 0.00 175.22 173.45 1z5f n ALA 99 N 5.07 -0.03 -3.23 11.12 0.00 0.32 -4.96 120.51 128.80 1z5f n ALA 99 Ca -0.11 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.35 1z5f n ALA 99 Cb 0.42 0.02 0.01 0.00 0.00 0.00 0.00 19.45 19.89 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 -0.56 1.14 3.87 0.00 0.00 -1.09 -4.99 105.19 103.55 1z5f n GLY 100 Ca 0.00 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.45 4.69 0.17 1.61 0.11 -1.26 -2.80 120.40 120.47 1z5f s VAL 101 Ca 0.06 0.88 0.00 0.00 -2.93 0.00 0.00 61.98 59.99 1z5f s VAL 101 Cb -0.01 -3.81 0.00 0.00 -1.53 0.00 0.00 36.38 31.03 1z5f s VAL 101 CO 0.01 -0.91 0.00 0.61 -3.33 0.00 0.00 175.10 171.48 1z5f n GLY 102 N -2.19 -1.27 3.77 6.54 0.00 0.18 -4.63 105.19 107.59 1z5f n GLY 102 Ca 0.05 -0.91 -0.39 0.00 0.00 0.00 0.00 46.02 44.78 1z5f n GLY 102 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1z5f s SER 103 N -5.35 6.44 0.45 1.61 1.04 -1.26 -2.92 113.70 113.71 1z5f s SER 103 Ca 0.00 2.47 -0.15 0.00 0.48 0.00 0.00 55.95 58.75 1z5f s SER 103 Cb 0.00 -2.62 -0.08 0.00 0.10 0.00 0.00 66.02 63.42 1z5f s SER 103 CO 0.00 -0.74 0.88 0.00 0.98 0.00 0.00 173.24 174.36