#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 -1.89 0.14 115.95 115.44 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 0.39 -0.00 0.00 0.00 178.44 178.83 1z5f n GLU 4 N -4.15 0.00 -0.19 2.65 1.02 -1.26 -0.77 120.64 117.93 1z5f n GLU 4 Ca 0.27 0.01 -0.00 0.00 -0.02 0.00 0.00 57.16 57.42 1z5f n GLU 4 Cb 1.30 -0.94 0.08 0.00 -0.02 0.00 0.00 31.44 31.86 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 -0.48 2.62 1.03 -1.93 1.54 112.91 116.18 1z5f h THR 5 Ca 0.00 -0.03 0.14 0.00 -0.01 0.00 0.00 66.41 66.51 1z5f h THR 5 Cb 0.00 0.40 -0.02 0.00 -1.07 0.00 0.00 68.15 67.46 1z5f h THR 5 CO 0.00 0.01 0.61 0.15 -0.01 0.00 0.00 175.52 176.28 1z5f h PHE 6 N 0.08 0.00 0.00 0.00 3.57 -0.78 1.97 116.94 121.78 1z5f h PHE 6 Ca 0.30 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1z5f h PHE 6 Cb 0.47 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.21 1z5f h PHE 6 CO -0.39 0.00 -0.97 0.94 -2.23 0.00 0.00 178.31 175.66 1z5f n GLN 7 N -3.48 0.54 -0.10 1.11 0.00 0.51 -3.24 117.38 112.71 1z5f n GLN 7 Ca 0.09 0.10 -0.20 0.00 -0.00 0.00 0.00 57.00 56.99 1z5f n GLN 7 Cb 0.79 -1.78 -0.11 0.00 0.00 0.00 0.00 30.24 29.14 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 0.55 -0.09 3.69 4.76 0.65 -3.93 118.16 121.27 1z5f n LYS 8 Ca 0.01 0.57 -0.16 0.00 -2.87 0.00 0.00 58.31 55.86 1z5f n LYS 8 Cb 0.53 -1.74 -0.09 0.00 -1.84 0.00 0.00 35.03 31.89 1z5f n LYS 8 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 1z5f h LYS 9 N -1.00 0.00 0.00 1.97 2.10 -1.13 -3.37 116.57 115.13 1z5f h LYS 9 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1z5f h LYS 9 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1z5f h LYS 9 CO -0.19 0.70 0.00 0.45 -2.00 0.00 0.00 179.45 178.40 1z5f h HIS 10 N -1.00 0.00 -4.00 0.07 3.86 -1.70 -3.44 115.15 108.95 1z5f h HIS 10 Ca -0.21 0.00 -0.61 0.00 -1.16 0.00 0.00 60.37 58.39 1z5f h HIS 10 Cb 1.01 0.00 -0.23 0.00 1.06 0.00 0.00 27.41 29.25 1z5f h HIS 10 CO 0.03 0.00 -0.85 -0.51 0.86 0.00 0.00 177.93 177.46 1z5f s LEU 11 N -5.26 2.27 0.00 2.43 1.02 -1.20 0.61 118.68 118.54 1z5f s LEU 11 Ca 0.02 -0.66 0.00 0.00 0.02 0.00 0.00 54.13 53.50 1z5f s LEU 11 Cb 0.09 -1.02 0.00 0.00 0.02 0.00 0.00 46.19 45.28 1z5f s LEU 11 CO 0.43 0.13 0.00 1.07 0.02 0.00 0.00 176.35 178.00 1z5f n THR 12 N 1.25 0.00 -0.01 5.49 5.66 -1.10 -4.41 114.28 121.15 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 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 1z5f n THR 12 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1z5f n ASP 13 N -1.18 1.72 -3.90 1.09 2.03 -1.26 -4.56 116.55 110.49 1z5f n ASP 13 Ca 0.00 -1.73 -0.10 0.00 0.52 0.00 0.00 54.79 53.48 1z5f n ASP 13 Cb 0.00 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.31 1z5f n ASP 13 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1z5f s THR 14 N -0.73 0.13 -0.05 5.18 -1.32 -1.26 -5.02 115.64 112.56 1z5f s THR 14 Ca 0.00 -1.07 0.25 0.00 -1.21 0.00 0.00 61.69 59.66 1z5f s THR 14 Cb 0.00 -0.98 0.28 0.00 -1.51 0.00 0.00 72.50 70.29 1z5f s THR 14 CO 0.00 -0.59 1.77 0.11 -2.21 0.00 0.00 174.62 173.70 1z5f h LYS 15 N 3.47 0.00 -2.19 7.08 1.57 -1.96 -3.32 116.57 121.22 1z5f h LYS 15 Ca -0.33 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 57.86 1z5f h LYS 15 Cb 1.19 0.00 -0.42 0.00 0.08 0.00 0.00 32.23 33.08 1z5f h LYS 15 CO 0.51 0.14 -0.60 1.63 -0.57 0.00 0.00 179.45 180.56 1z5f n LYS 16 N -3.21 2.51 -0.62 3.15 5.02 -1.26 -4.45 118.16 119.30 1z5f n LYS 16 Ca 0.01 -4.65 -0.29 0.00 -2.02 0.00 0.00 58.31 51.37 1z5f n LYS 16 Cb 0.46 -2.23 0.18 0.00 -0.02 0.00 0.00 35.03 33.41 1z5f n LYS 16 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1z5f n VAL 17 N 0.83 0.00 -2.90 -0.18 0.24 -1.25 -4.85 118.33 110.22 1z5f n VAL 17 Ca 0.30 -0.23 -0.42 0.00 -2.04 0.00 0.00 64.34 61.95 1z5f n VAL 17 Cb 0.41 -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 -2.21 4.73 -0.18 7.34 2.85 -1.26 -4.86 118.16 124.56 1z5f n LYS 18 Ca 0.02 -4.60 0.17 0.00 -1.05 0.00 0.00 58.31 52.85 1z5f n LYS 18 Cb 0.57 -2.49 0.31 0.00 -0.65 0.00 0.00 35.03 32.78 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 0.48 0.00 0.00 1.82 -1.90 -0.84 116.42 115.99 1z5f h ASP 20 Ca 0.46 0.14 -0.33 0.00 -0.39 0.00 0.00 57.03 56.91 1z5f h ASP 20 Cb 1.20 0.08 -0.06 0.00 0.68 0.00 0.00 39.33 41.24 1z5f h ASP 20 CO -0.44 0.06 -2.24 0.52 -1.61 0.00 0.00 179.24 175.53 1z5f n VAL 21 N -4.97 1.25 0.00 2.25 0.31 0.48 -2.15 118.33 115.49 1z5f n VAL 21 Ca 0.24 -0.65 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 1z5f n VAL 21 Cb 0.68 -0.83 0.00 0.00 -0.91 0.00 0.00 33.84 32.77 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 -2.85 0.00 0.00 5.55 0.00 0.54 -1.06 120.64 122.82 1z5f n GLU 22 Ca -0.33 0.28 0.00 0.00 0.00 0.00 0.00 57.16 57.11 1z5f n GLU 22 Cb 1.02 -1.57 0.00 0.00 0.00 0.00 0.00 31.44 30.88 1z5f n GLU 22 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1z5f n MET 23 N -1.25 0.00 0.00 5.31 2.81 -0.36 -4.68 117.12 118.95 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 0.07 -0.46 0.21 0.00 -0.71 0.00 0.00 33.22 32.33 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 -2.65 1.97 -1.00 3.04 0.00 -0.91 -1.16 120.51 119.79 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 0.33 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.76 0.32 -0.00 0.00 5.02 -0.22 -4.48 118.16 118.04 1z5f n LYS 25 Ca 0.05 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.43 1z5f n LYS 25 Cb 0.02 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 34.92 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 -2.43 3.55 1.10 7.82 0.00 -1.26 -3.51 120.51 125.77 1z5f n ALA 26 Ca 0.00 -0.47 0.12 0.00 0.00 0.00 0.00 53.44 53.09 1z5f n ALA 26 Cb 0.00 -0.63 0.16 0.00 0.00 0.00 0.00 19.45 18.98 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 2.33 -0.04 0.00 -0.00 -1.26 -4.39 117.00 111.89 1z5f n LEU 27 Ca 0.00 -0.79 -0.07 0.00 -0.00 0.00 0.00 56.01 55.15 1z5f n LEU 27 Cb 0.37 -0.01 -0.04 0.00 -0.00 0.00 0.00 43.42 43.74 1z5f n LEU 27 CO 0.37 0.40 -0.78 0.49 -0.00 0.00 0.00 177.39 177.87 1z5f n PHE 28 N 0.60 0.00 -2.40 1.47 3.72 -1.26 -5.05 117.46 114.54 1z5f n PHE 28 Ca 0.13 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.53 1z5f n PHE 28 Cb 0.50 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 1z5f n PHE 28 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1z5f n ASP 29 N -2.92 -2.01 -3.91 4.37 -0.08 -1.22 -4.05 116.55 106.74 1z5f n ASP 29 Ca -0.15 -0.00 -0.37 0.00 -1.51 0.00 0.00 54.79 52.75 1z5f n ASP 29 Cb 0.65 -0.51 0.02 0.00 2.34 0.00 0.00 41.12 43.61 1z5f n ASP 29 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1z5f n LYS 31 N -4.59 2.97 0.00 0.00 5.02 -1.26 -4.93 118.16 115.37 1z5f n LYS 31 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1z5f n LYS 31 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.60 1z5f n LYS 31 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1z5f n LYS 32 N 0.00 0.39 -4.77 1.97 2.85 -1.26 -4.97 118.16 112.37 1z5f n LYS 32 Ca 0.00 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.02 1z5f n LYS 32 Cb 0.00 -0.56 -0.16 0.00 -0.65 0.00 0.00 35.03 33.66 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 -1.13 1.30 -0.02 0.58 2.01 -1.26 -1.21 115.64 115.91 1z5f s THR 33 Ca 0.00 -0.68 -0.19 0.00 0.31 0.00 0.00 61.69 61.13 1z5f s THR 33 Cb 0.00 -1.10 0.04 0.00 0.01 0.00 0.00 72.50 71.45 1z5f s THR 33 CO 0.00 0.37 0.41 0.21 -0.69 0.00 0.00 174.62 174.92 1z5f s ASN 34 N -0.19 -0.31 0.03 3.53 3.84 -1.03 -4.99 114.94 115.82 1z5f s ASN 34 Ca 0.02 0.24 -0.00 0.00 0.21 0.00 0.00 52.86 53.32 1z5f s ASN 34 Cb -0.08 0.38 -0.03 0.00 -0.55 0.00 0.00 41.25 40.97 1z5f s ASN 34 CO 0.00 -0.50 -0.03 -0.89 -2.79 0.00 0.00 177.10 172.89 1z5f s THR 35 N -1.38 0.16 0.32 -5.21 2.01 -1.26 -0.89 115.64 109.39 1z5f s THR 35 Ca -0.12 -1.28 -0.08 0.00 0.31 0.00 0.00 61.69 60.52 1z5f s THR 35 Cb -0.04 -0.78 0.01 0.00 0.01 0.00 0.00 72.50 71.70 1z5f s THR 35 CO 0.05 -0.71 0.53 -0.36 -0.69 0.00 0.00 174.62 173.44 1z5f s PHE 36 N -2.48 0.70 -0.04 4.92 0.08 -0.74 -4.70 117.98 115.72 1z5f s PHE 36 Ca -0.06 -1.05 0.05 0.00 0.12 0.00 0.00 56.93 55.99 1z5f s PHE 36 Cb -0.03 0.15 -0.01 0.00 -0.57 0.00 0.00 43.02 42.57 1z5f s PHE 36 CO -0.05 -1.17 -0.18 0.42 -0.10 0.00 0.00 175.22 174.15 1z5f s ILE 37 N -3.21 1.44 -0.53 0.64 1.01 0.20 -3.59 121.20 117.16 1z5f s ILE 37 Ca 0.26 -0.74 -0.18 0.00 0.00 0.00 0.00 60.65 59.99 1z5f s ILE 37 Cb -0.01 -1.23 0.09 0.00 0.01 0.00 0.00 42.46 41.31 1z5f s ILE 37 CO 0.15 0.41 0.59 -0.47 0.00 0.00 0.00 174.94 175.63 1z5f s TYR 38 N -0.09 3.10 -0.01 3.97 5.04 -0.98 -2.72 117.35 125.65 1z5f s TYR 38 Ca -0.01 -0.87 -0.28 0.00 -2.44 0.00 0.00 57.07 53.47 1z5f s TYR 38 Cb -0.10 -3.67 0.07 0.00 0.35 0.00 0.00 41.96 38.60 1z5f s TYR 38 CO 0.01 -1.07 0.63 0.00 -1.34 0.00 0.00 175.55 173.78 1z5f s ALA 39 N 2.30 -1.65 0.20 3.97 0.00 -1.26 -4.73 121.76 120.58 1z5f s ALA 39 Ca 0.10 1.08 -0.21 0.00 0.00 0.00 0.00 51.96 52.93 1z5f s ALA 39 Cb -0.24 0.16 -0.08 0.00 0.00 0.00 0.00 23.12 22.97 1z5f s ALA 39 CO 0.08 -0.43 0.72 -0.48 0.00 0.00 0.00 175.76 175.64 1z5f s LEU 40 N -1.49 4.41 0.21 0.00 0.05 -1.26 -4.89 118.68 115.71 1z5f s LEU 40 Ca -0.09 1.44 -0.20 0.00 0.05 0.00 0.00 54.13 55.33 1z5f s LEU 40 Cb -0.00 -3.47 0.16 0.00 -2.05 0.00 0.00 46.19 40.83 1z5f s LEU 40 CO 0.05 0.09 1.52 -2.65 -0.55 0.00 0.00 176.35 174.82 1z5f n PRO 41 N 0.98 -0.28 -0.12 1.48 -0.02 -1.26 -1.02 135.00 134.75 1z5f n PRO 41 Ca -0.04 1.51 -0.05 0.00 -2.02 0.00 0.00 63.50 62.90 1z5f n PRO 41 Cb 0.51 -2.23 0.01 0.00 -0.02 0.00 0.00 33.50 31.76 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 0.10 2.00 -1.23 0.00 -1.98 0.23 103.07 102.20 1z5f h GLY 42 Ca 0.30 0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.86 1z5f h GLY 42 CO -0.96 -0.20 -0.09 -0.09 0.00 0.00 0.00 176.54 175.20 1z5f h ARG 43 N -0.12 0.00 0.14 4.80 2.43 -1.47 0.29 114.38 120.45 1z5f h ARG 43 Ca 0.20 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1z5f h ARG 43 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1z5f h ARG 43 CO -0.49 0.09 -0.07 0.28 -1.51 0.00 0.00 179.97 178.28 1z5f h VAL 44 N 0.00 0.33 0.00 0.20 2.07 0.27 -0.27 116.25 118.86 1z5f h VAL 44 Ca -0.00 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1z5f h VAL 44 Cb 0.17 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1z5f h VAL 44 CO 0.01 0.10 0.00 0.11 0.02 0.00 0.00 177.57 177.81 1z5f h LYS 45 N -1.02 0.00 0.00 1.57 1.57 -0.67 -0.18 116.57 117.84 1z5f h LYS 45 Ca -0.02 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1z5f h LYS 45 Cb 0.31 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 1z5f h LYS 45 CO 0.03 0.00 -0.80 0.00 -0.57 0.00 0.00 179.45 178.12 1z5f h ALA 46 N 2.00 0.61 0.00 3.86 0.00 -0.42 -3.28 119.26 122.03 1z5f h ALA 46 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1z5f h ALA 46 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1z5f h ALA 46 CO 0.00 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.56 1z5f n LEU 47 N -2.78 0.00 0.00 0.00 4.77 -0.08 -2.80 117.00 116.11 1z5f n LEU 47 Ca 0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1z5f n LEU 47 Cb 0.55 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1z5f n LEU 47 CO 0.39 -0.01 0.21 0.00 -1.33 0.00 0.00 177.39 176.65 1z5f s LYS 49 N -0.10 3.53 0.00 0.00 -2.85 -1.12 -1.84 119.74 117.35 1z5f s LYS 49 Ca 0.00 2.21 0.00 0.00 -1.00 0.00 0.00 55.97 57.18 1z5f s LYS 49 Cb 0.00 -2.48 0.00 0.00 -2.06 0.00 0.00 37.83 33.29 1z5f s LYS 49 CO 0.00 -0.87 0.00 0.27 0.10 0.00 0.00 175.35 174.85 1z5f n ASN 50 N -0.51 0.00 -4.41 0.03 6.94 -1.26 -4.99 115.26 111.06 1z5f n ASN 50 Ca 0.07 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.34 1z5f n ASN 50 Cb 0.44 -0.59 0.15 0.00 -2.36 0.00 0.00 39.78 37.43 1z5f n ASN 50 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1z5f s ILE 51 N -2.87 1.99 0.00 1.53 -1.09 -0.77 -5.08 121.20 114.91 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 -2.97 0.00 0.00 -1.58 0.00 0.00 42.46 37.91 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 -3.65 1.76 0.00 2.79 1.74 -1.26 -4.66 116.66 113.38 1z5f n ARG 52 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 1z5f n ARG 52 Cb 0.60 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.04 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 -1.03 0.00 -4.63 0.55 8.00 -1.26 -2.04 116.55 116.13 1z5f n ASP 53 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1z5f n ASP 53 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 1z5f n ASP 53 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1z5f s ASN 54 N -1.73 6.17 0.22 -2.24 4.22 -1.24 -3.92 114.94 116.40 1z5f s ASN 54 Ca 0.00 2.02 -0.14 0.00 -2.14 0.00 0.00 52.86 52.60 1z5f s ASN 54 Cb 0.00 -2.53 0.01 0.00 1.28 0.00 0.00 41.25 40.01 1z5f s ASN 54 CO 0.00 -1.37 0.47 -0.89 -2.04 0.00 0.00 177.10 173.27 1z5f s THR 55 N 5.76 0.02 -0.32 0.54 2.01 -0.76 -4.98 115.64 117.91 1z5f s THR 55 Ca 0.84 -1.16 -0.16 0.00 0.31 0.00 0.00 61.69 61.53 1z5f s THR 55 Cb -0.33 -1.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.26 1z5f s THR 55 CO 0.34 -0.10 0.39 -1.81 -0.69 0.00 0.00 174.62 172.76 1z5f s ASP 56 N -2.95 6.23 0.55 3.53 1.11 -1.26 -2.30 116.67 121.58 1z5f s ASP 56 Ca 0.16 0.01 0.04 0.00 0.18 0.00 0.00 52.55 52.94 1z5f s ASP 56 Cb -0.00 -2.22 0.03 0.00 1.07 0.00 0.00 42.92 41.80 1z5f s ASP 56 CO 0.03 -0.31 0.34 0.68 1.18 0.00 0.00 175.17 177.09 1z5f s VAL 57 N 2.11 1.51 -0.24 -1.27 -7.23 0.53 -4.96 120.40 110.85 1z5f s VAL 57 Ca 0.14 -1.58 -0.25 0.00 -1.81 0.00 0.00 61.98 58.48 1z5f s VAL 57 Cb -0.16 -2.09 0.07 0.00 0.56 0.00 0.00 36.38 34.76 1z5f s VAL 57 CO 0.11 0.00 0.70 -0.22 -0.31 0.00 0.00 175.10 175.39 1z5f s LEU 58 N -4.22 -0.69 0.66 1.32 2.96 -1.26 -1.53 118.68 115.91 1z5f s LEU 58 Ca 0.28 1.35 -0.17 0.00 -0.22 0.00 0.00 54.13 55.36 1z5f s LEU 58 Cb -0.02 2.44 -0.03 0.00 0.50 0.00 0.00 46.19 49.08 1z5f s LEU 58 CO 0.17 -0.29 0.86 -0.24 -1.32 0.00 0.00 176.35 175.54 1z5f n SER 59 N 2.50 0.21 -0.75 3.68 2.88 -1.09 -4.86 113.62 116.18 1z5f n SER 59 Ca -0.15 0.72 0.08 0.00 -1.33 0.00 0.00 58.87 58.19 1z5f n SER 59 Cb 0.55 -1.35 0.23 0.00 -0.75 0.00 0.00 64.21 62.90 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 -1.20 1.96 0.00 -1.46 5.12 -1.26 -4.72 116.66 115.10 1z5f n ARG 60 Ca 0.13 -1.47 0.00 0.00 -1.93 0.00 0.00 57.85 54.58 1z5f n ARG 60 Cb 0.49 -1.36 0.00 0.00 -1.16 0.00 0.00 32.46 30.43 1z5f n ARG 60 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1z5f n ASP 61 N 0.69 0.00 -3.94 0.55 8.00 -1.26 -5.11 116.55 115.48 1z5f n ASP 61 Ca 0.15 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.57 1z5f n ASP 61 Cb 0.37 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.43 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 -1.00 -0.62 -0.18 2.24 0.00 -1.26 -2.62 121.76 118.32 1z5f s ALA 62 Ca 0.00 -0.65 -0.14 0.00 0.00 0.00 0.00 51.96 51.17 1z5f s ALA 62 Cb 0.00 0.98 0.05 0.00 0.00 0.00 0.00 23.12 24.16 1z5f s ALA 62 CO 0.00 -0.92 0.47 -0.06 0.00 0.00 0.00 175.76 175.25 1z5f s PHE 63 N -3.98 -0.59 -0.40 0.00 0.40 -0.67 -4.72 117.98 108.02 1z5f s PHE 63 Ca 0.18 1.33 -0.29 0.00 -0.60 0.00 0.00 56.93 57.55 1z5f s PHE 63 Cb -0.03 0.24 0.02 0.00 0.51 0.00 0.00 43.02 43.77 1z5f s PHE 63 CO 0.08 -0.30 1.15 -1.17 0.70 0.00 0.00 175.22 175.68 1z5f s LEU 64 N 0.75 3.77 -0.12 -0.37 0.20 -1.26 -2.48 118.68 119.17 1z5f s LEU 64 Ca -0.04 0.78 0.03 0.00 0.69 0.00 0.00 54.13 55.59 1z5f s LEU 64 Cb -0.05 -3.55 0.01 0.00 -0.43 0.00 0.00 46.19 42.17 1z5f s LEU 64 CO -0.06 -1.11 -0.21 -1.48 -0.29 0.00 0.00 176.35 173.20 1z5f s LEU 65 N 4.21 2.03 0.42 -0.68 2.34 -1.01 -2.33 118.68 123.67 1z5f s LEU 65 Ca 0.49 -0.55 -0.23 0.00 0.06 0.00 0.00 54.13 53.89 1z5f s LEU 65 Cb -0.10 -1.36 -0.09 0.00 -0.56 0.00 0.00 46.19 44.08 1z5f s LEU 65 CO 0.25 0.10 1.05 -2.16 -1.06 0.00 0.00 176.35 174.53 1z5f s PRO 66 N 0.65 4.07 0.01 1.48 0.04 -1.24 -3.44 135.00 136.58 1z5f s PRO 66 Ca -0.12 1.49 -0.09 0.00 0.04 0.00 0.00 61.00 62.32 1z5f s PRO 66 Cb -0.16 -2.44 0.01 0.00 0.04 0.00 0.00 34.50 31.94 1z5f s PRO 66 CO 0.02 -0.22 0.18 -0.65 0.04 0.00 0.00 177.00 176.38 1z5f s GLN 67 N -2.66 0.57 -0.05 4.56 -0.21 0.47 -1.79 119.66 120.54 1z5f s GLN 67 Ca 0.60 -0.41 0.00 0.00 0.02 0.00 0.00 55.36 55.57 1z5f s GLN 67 Cb -0.21 0.24 -0.03 0.00 1.00 0.00 0.00 33.01 34.01 1z5f s GLN 67 CO 0.26 -0.15 -0.03 0.00 -2.12 0.00 0.00 175.29 173.26 1z5f s ASP 69 N -1.07 2.00 0.64 0.00 2.15 -0.95 -2.46 116.67 116.98 1z5f s ASP 69 Ca 0.15 -0.35 -0.17 0.00 0.43 0.00 0.00 52.55 52.61 1z5f s ASP 69 Cb -0.11 -0.39 -0.01 0.00 -0.30 0.00 0.00 42.92 42.11 1z5f s ASP 69 CO 0.04 -0.26 1.19 -0.60 -0.17 0.00 0.00 175.17 175.38 1z5f s ARG 70 N 2.01 2.69 0.00 4.34 3.52 -0.35 -0.62 118.95 130.54 1z5f s ARG 70 Ca 0.03 1.75 0.00 0.00 -0.13 0.00 0.00 55.73 57.38 1z5f s ARG 70 Cb -0.14 -1.90 0.00 0.00 -1.56 0.00 0.00 34.95 31.35 1z5f s ARG 70 CO -0.06 -1.41 0.00 1.51 -0.81 0.00 0.00 175.30 174.53 1z5f n ILE 71 N -2.06 0.00 -4.35 4.11 3.06 -1.26 -4.86 119.36 114.00 1z5f n ILE 71 Ca 0.13 0.00 -0.18 0.00 -2.50 0.00 0.00 62.75 60.20 1z5f n ILE 71 Cb 0.50 0.00 -0.10 0.00 0.54 0.00 0.00 39.64 40.58 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 -0.94 1.42 0.28 9.51 2.20 -1.26 -5.09 119.74 125.86 1z5f s LYS 72 Ca 0.00 -1.75 0.00 0.00 -0.36 0.00 0.00 55.97 53.86 1z5f s LYS 72 Cb 0.00 -0.57 0.00 0.00 -1.51 0.00 0.00 37.83 35.75 1z5f s LYS 72 CO 0.00 -0.17 0.00 1.28 -0.36 0.00 0.00 175.35 176.10 1z5f n LEU 73 N -0.49 -0.53 0.02 5.43 4.32 -1.26 -3.76 117.00 120.73 1z5f n LEU 73 Ca -0.03 1.19 -0.10 0.00 -0.02 0.00 0.00 56.01 57.05 1z5f n LEU 73 Cb 0.65 -3.36 -0.13 0.00 -1.62 0.00 0.00 43.42 38.96 1z5f n LEU 73 CO 0.38 -2.22 -0.29 1.55 -1.22 0.00 0.00 177.39 175.58 1z5f h PRO 74 N -1.10 0.05 -0.66 3.23 0.13 -2.02 -3.38 132.00 128.25 1z5f h PRO 74 Ca -0.03 -0.09 -0.40 0.00 -0.87 0.00 0.00 66.00 64.62 1z5f h PRO 74 Cb 1.24 0.03 -0.41 0.00 0.13 0.00 0.00 31.00 31.98 1z5f h PRO 74 CO 0.02 0.78 -0.97 0.00 -0.23 0.00 0.00 178.00 177.60 1z5f s HIS 76 N -3.67 2.51 0.16 0.00 5.04 -1.25 -4.96 115.29 113.14 1z5f s HIS 76 Ca 0.38 -0.28 0.01 0.00 -1.54 0.00 0.00 55.06 53.63 1z5f s HIS 76 Cb 0.37 -1.40 -0.04 0.00 0.04 0.00 0.00 32.58 31.55 1z5f s HIS 76 CO -0.01 0.30 0.03 0.71 -2.34 0.00 0.00 174.74 173.43 1z5f s TYR 77 N -1.01 1.11 -0.01 3.88 1.51 -1.26 -3.99 117.35 117.58 1z5f s TYR 77 Ca 0.16 -1.10 0.01 0.00 -1.01 0.00 0.00 57.07 55.12 1z5f s TYR 77 Cb -0.10 -0.63 -0.04 0.00 -0.11 0.00 0.00 41.96 41.08 1z5f s TYR 77 CO 0.07 -0.33 0.02 0.21 -1.11 0.00 0.00 175.55 174.42 1z5f s LYS 78 N -3.97 2.87 -0.15 -0.62 2.47 0.21 -4.83 119.74 115.72 1z5f s LYS 78 Ca 0.25 -0.57 -0.23 0.00 -1.56 0.00 0.00 55.97 53.86 1z5f s LYS 78 Cb 0.07 -2.73 -0.02 0.00 -1.46 0.00 0.00 37.83 33.69 1z5f s LYS 78 CO 0.04 0.63 0.74 -1.17 0.16 0.00 0.00 175.35 175.75 1z5f s LEU 79 N -1.57 4.20 -0.09 5.43 0.20 -1.26 -2.23 118.68 123.36 1z5f s LEU 79 Ca 0.20 1.08 -0.04 0.00 0.69 0.00 0.00 54.13 56.06 1z5f s LEU 79 Cb -0.12 -3.09 0.04 0.00 -0.43 0.00 0.00 46.19 42.59 1z5f s LEU 79 CO 0.11 -0.29 0.20 -0.55 -0.29 0.00 0.00 176.35 175.53 1z5f s SER 80 N 1.08 -0.08 0.05 3.68 0.15 -0.77 -5.00 113.70 112.80 1z5f s SER 80 Ca 0.35 0.42 -0.02 0.00 0.70 0.00 0.00 55.95 57.40 1z5f s SER 80 Cb -0.17 0.32 -0.03 0.00 -1.71 0.00 0.00 66.02 64.43 1z5f s SER 80 CO 0.13 -0.17 -0.00 -0.55 1.20 0.00 0.00 173.24 173.85 1z5f s SER 81 N 1.38 0.40 0.13 5.45 0.15 -1.26 -0.40 113.70 119.56 1z5f s SER 81 Ca -0.08 -0.87 -0.25 0.00 0.70 0.00 0.00 55.95 55.46 1z5f s SER 81 Cb -0.11 0.20 0.07 0.00 -1.71 0.00 0.00 66.02 64.47 1z5f s SER 81 CO -0.07 -0.56 0.84 -0.44 1.20 0.00 0.00 173.24 174.20 1z5f s SER 82 N -2.66 -0.30 -0.27 5.45 0.01 -1.22 -4.97 113.70 109.74 1z5f s SER 82 Ca 0.03 -0.27 -0.09 0.00 1.31 0.00 0.00 55.95 56.93 1z5f s SER 82 Cb 0.05 0.52 -0.04 0.00 0.21 0.00 0.00 66.02 66.76 1z5f s SER 82 CO -0.08 -0.92 0.13 0.42 0.41 0.00 0.00 173.24 173.20 1z5f s THR 83 N -3.43 4.79 0.06 1.44 -4.23 -1.26 -2.41 115.64 110.61 1z5f s THR 83 Ca 0.08 -0.02 -0.27 0.00 -1.18 0.00 0.00 61.69 60.30 1z5f s THR 83 Cb -0.02 -3.27 0.07 0.00 1.34 0.00 0.00 72.50 70.62 1z5f s THR 83 CO -0.02 0.28 0.64 0.54 -0.54 0.00 0.00 174.62 175.52 1z5f s ASN 84 N 1.68 -0.61 0.89 3.99 4.22 -1.04 -4.63 114.94 119.45 1z5f s ASN 84 Ca 0.07 0.33 -0.11 0.00 -2.14 0.00 0.00 52.86 51.01 1z5f s ASN 84 Cb -0.16 0.57 0.13 0.00 1.28 0.00 0.00 41.25 43.07 1z5f s ASN 84 CO 0.07 -0.80 1.11 -0.89 -2.04 0.00 0.00 177.10 174.55 1z5f s THR 85 N -2.58 2.52 -0.13 0.54 2.01 -1.08 -1.67 115.64 115.26 1z5f s THR 85 Ca -0.04 0.17 -0.06 0.00 0.31 0.00 0.00 61.69 62.06 1z5f s THR 85 Cb -0.01 -2.40 0.05 0.00 0.01 0.00 0.00 72.50 70.16 1z5f s THR 85 CO -0.03 -0.22 0.30 0.27 -0.69 0.00 0.00 174.62 174.25 1z5f s ILE 86 N -2.75 -0.09 0.13 1.82 -0.00 -1.26 0.23 121.20 119.28 1z5f s ILE 86 Ca 0.65 0.14 -0.29 0.00 -0.00 0.00 0.00 60.65 61.15 1z5f s ILE 86 Cb -0.21 -0.46 -0.06 0.00 -0.00 0.00 0.00 42.46 41.73 1z5f s ILE 86 CO 0.58 0.06 0.92 0.00 -0.00 0.00 0.00 174.94 176.49 1z5f s ILE 88 N -0.28 0.07 -0.09 0.00 2.07 -0.58 -0.45 121.20 121.93 1z5f s ILE 88 Ca 0.44 -0.56 -0.03 0.00 -1.41 0.00 0.00 60.65 59.09 1z5f s ILE 88 Cb -0.23 -0.80 -0.03 0.00 0.13 0.00 0.00 42.46 41.52 1z5f s ILE 88 CO 0.29 -0.31 0.03 -0.89 -1.91 0.00 0.00 174.94 172.15 1z5f s THR 89 N -1.98 4.58 0.11 4.00 2.01 -0.26 -0.34 115.64 123.75 1z5f s THR 89 Ca -0.09 -0.16 -0.01 0.00 0.31 0.00 0.00 61.69 61.74 1z5f s THR 89 Cb -0.03 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.49 1z5f s THR 89 CO 0.00 0.59 0.01 0.00 -0.69 0.00 0.00 174.62 174.54 1z5f n VAL 91 N -0.04 0.00 -0.26 0.00 3.14 -0.77 -1.84 118.33 118.57 1z5f n VAL 91 Ca -0.09 0.00 0.24 0.00 -2.96 0.00 0.00 64.34 61.53 1z5f n VAL 91 Cb 0.63 0.00 0.58 0.00 -1.06 0.00 0.00 33.84 33.99 1z5f n VAL 91 CO 0.00 0.00 0.00 -1.13 -6.46 0.00 0.00 176.83 169.24 1z5f h ASN 92 N 0.00 0.29 0.00 6.55 -0.73 -1.55 -3.37 115.58 116.77 1z5f h ASN 92 Ca 0.00 0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.19 1z5f h ASN 92 Cb 0.00 -0.01 -0.02 0.00 0.27 0.00 0.00 38.32 38.56 1z5f h ASN 92 CO 0.00 0.09 0.06 0.00 -0.37 0.00 0.00 177.43 177.21 1z5f n GLN 93 N -4.46 0.04 -3.54 6.67 10.64 -1.26 -3.71 117.38 121.76 1z5f n GLN 93 Ca 0.21 -0.15 -0.14 0.00 -1.83 0.00 0.00 57.00 55.09 1z5f n GLN 93 Cb 0.85 0.01 -0.12 0.00 -0.86 0.00 0.00 30.24 30.12 1z5f n GLN 93 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1z5f s LEU 94 N -0.57 -0.31 0.07 2.61 1.43 -1.26 -4.66 118.68 115.99 1z5f s LEU 94 Ca 0.00 0.25 -0.30 0.00 -1.03 0.00 0.00 54.13 53.06 1z5f s LEU 94 Cb 0.01 0.70 -0.05 0.00 0.03 0.00 0.00 46.19 46.88 1z5f s LEU 94 CO -0.00 -0.28 1.04 -2.16 0.23 0.00 0.00 176.35 175.18 1z5f s PRO 95 N 2.42 4.57 0.00 1.29 0.04 -1.26 -1.85 135.00 140.21 1z5f s PRO 95 Ca 0.05 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1z5f s PRO 95 Cb -0.14 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.01 1z5f s PRO 95 CO -0.11 -0.01 0.00 0.44 0.04 0.00 0.00 177.00 177.35 1z5f n ILE 96 N 3.40 0.00 -4.67 0.56 -6.64 -1.11 -3.93 119.36 106.97 1z5f n ILE 96 Ca 0.05 0.00 -0.25 0.00 -1.77 0.00 0.00 62.75 60.78 1z5f n ILE 96 Cb 0.49 1.32 -0.16 0.00 -1.44 0.00 0.00 39.64 39.84 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 1.54 -0.46 4.28 3.76 -1.07 -4.28 115.29 119.07 1z5f s HIS 97 Ca 0.00 -0.54 -0.14 0.00 -0.15 0.00 0.00 55.06 54.23 1z5f s HIS 97 Cb 0.00 -1.10 0.07 0.00 1.11 0.00 0.00 32.58 32.66 1z5f s HIS 97 CO 0.00 -0.25 0.36 0.12 -0.85 0.00 0.00 174.74 174.12 1z5f s PHE 98 N 0.47 3.26 0.01 1.40 5.36 -1.26 -1.11 117.98 126.12 1z5f s PHE 98 Ca -0.12 -1.05 -0.07 0.00 -0.96 0.00 0.00 56.93 54.73 1z5f s PHE 98 Cb -0.14 -3.10 -0.03 0.00 -0.34 0.00 0.00 43.02 39.40 1z5f s PHE 98 CO 0.04 -0.80 1.10 0.00 -1.46 0.00 0.00 175.22 174.10 1z5f h ALA 99 N 8.67 -0.97 -2.45 11.12 0.00 -1.09 -3.48 119.26 131.05 1z5f h ALA 99 Ca -0.27 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1z5f h ALA 99 Cb 1.10 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1z5f h ALA 99 CO 0.84 -0.96 0.00 0.41 0.00 0.00 0.00 179.25 179.55 1z5f n GLY 100 N -1.11 0.76 3.78 0.00 0.00 -1.13 -5.00 105.19 102.49 1z5f n GLY 100 Ca -0.03 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.07 5.22 0.01 1.61 0.11 -1.26 -3.55 120.40 120.47 1z5f s VAL 101 Ca 0.00 0.66 0.00 0.00 -2.93 0.00 0.00 61.98 59.71 1z5f s VAL 101 Cb 0.00 -3.65 0.00 0.00 -1.53 0.00 0.00 36.38 31.20 1z5f s VAL 101 CO 0.00 0.48 0.00 0.61 -3.33 0.00 0.00 175.10 172.86 1z5f n GLY 102 N 2.64 -2.23 3.71 6.54 0.00 0.14 -4.85 105.19 111.13 1z5f n GLY 102 Ca -0.13 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.01 1z5f n GLY 102 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1z5f n SER 103 N -0.88 1.77 -4.87 1.61 3.41 -1.26 -2.81 113.62 110.59 1z5f n SER 103 Ca 0.00 0.80 -0.31 0.00 -0.26 0.00 0.00 58.87 59.11 1z5f n SER 103 Cb 0.03 -1.53 -0.03 0.00 -0.26 0.00 0.00 64.21 62.41 1z5f n SER 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88