#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 0.11 0.00 1.24 -0.00 -1.90 0.16 115.95 115.56 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 0.02 0.00 -1.91 -0.00 0.00 0.00 178.44 176.55 1z5f n GLU 4 N -4.29 0.00 -0.19 2.65 2.13 -1.26 -0.84 120.64 118.84 1z5f n GLU 4 Ca 0.22 0.03 -0.00 0.00 0.66 0.00 0.00 57.16 58.07 1z5f n GLU 4 Cb 1.04 -1.00 0.08 0.00 0.27 0.00 0.00 31.44 31.84 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 0.51 -0.49 6.31 1.03 -1.94 1.43 112.91 119.76 1z5f h THR 5 Ca 0.00 -0.04 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 0.02 0.66 0.15 -0.01 0.00 0.00 175.52 176.34 1z5f h PHE 6 N 0.10 0.00 0.00 0.00 3.57 -0.71 2.23 116.94 122.12 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 0.48 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 1z5f h PHE 6 CO -0.36 0.00 -1.03 0.94 -2.23 0.00 0.00 178.31 175.62 1z5f n GLN 7 N -3.40 0.61 -0.10 1.11 0.00 0.48 -3.37 117.38 112.70 1z5f n GLN 7 Ca 0.10 0.12 -0.20 0.00 -0.00 0.00 0.00 57.00 57.02 1z5f n GLN 7 Cb 0.84 -1.82 -0.10 0.00 0.00 0.00 0.00 30.24 29.15 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 0.00 0.00 3.69 1.79 0.48 -3.30 116.57 119.23 1z5f h LYS 8 Ca -0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.41 1z5f h LYS 8 Cb 1.01 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.66 1z5f h LYS 8 CO 0.00 0.89 -0.34 1.57 -1.08 0.00 0.00 179.45 180.49 1z5f h LYS 9 N -1.00 0.00 0.00 3.15 2.10 -1.14 -3.36 116.57 116.32 1z5f h LYS 9 Ca -0.31 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.30 1z5f h LYS 9 Cb 1.22 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.54 1z5f h LYS 9 CO -0.19 0.69 -0.20 0.45 -2.00 0.00 0.00 179.45 178.20 1z5f h HIS 10 N -1.00 0.00 -3.51 0.07 3.86 -1.71 -3.44 115.15 109.42 1z5f h HIS 10 Ca -0.08 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.47 1z5f h HIS 10 Cb 0.81 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.12 1z5f h HIS 10 CO 0.13 0.20 -0.75 -0.51 0.86 0.00 0.00 177.93 177.85 1z5f s LEU 11 N -6.80 2.93 0.00 2.43 1.02 -1.22 0.68 118.68 117.72 1z5f s LEU 11 Ca 0.00 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 53.68 1z5f s LEU 11 Cb 0.11 -1.72 0.00 0.00 0.02 0.00 0.00 46.19 44.60 1z5f s LEU 11 CO 0.62 0.16 0.00 1.07 0.02 0.00 0.00 176.35 178.23 1z5f n THR 12 N 0.61 0.00 -0.65 5.49 5.66 -1.11 -4.44 114.28 119.84 1z5f n THR 12 Ca -0.14 0.00 0.06 0.00 -3.05 0.00 0.00 64.05 60.92 1z5f n THR 12 Cb 0.53 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 69.39 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 -2.05 2.18 -3.65 1.09 5.68 -1.26 -4.49 116.55 114.04 1z5f n ASP 13 Ca 0.00 -2.64 -0.15 0.00 -0.50 0.00 0.00 54.79 51.50 1z5f n ASP 13 Cb 0.00 -0.26 -0.07 0.00 -1.14 0.00 0.00 41.12 39.65 1z5f n ASP 13 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1z5f s THR 14 N -2.10 0.03 -0.78 2.12 -1.32 -1.26 -5.00 115.64 107.32 1z5f s THR 14 Ca 0.19 -0.23 0.22 0.00 -1.21 0.00 0.00 61.69 60.66 1z5f s THR 14 Cb 0.17 -0.79 0.21 0.00 -1.51 0.00 0.00 72.50 70.57 1z5f s THR 14 CO 0.02 -0.13 1.67 2.29 -2.21 0.00 0.00 174.62 176.26 1z5f n LYS 15 N 1.23 0.11 -3.14 7.08 0.00 -1.26 -3.56 118.16 118.61 1z5f n LYS 15 Ca -0.20 0.26 -0.25 0.00 -0.00 0.00 0.00 58.31 58.12 1z5f n LYS 15 Cb 0.56 -1.67 -0.05 0.00 -0.00 0.00 0.00 35.03 33.87 1z5f n LYS 15 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1z5f n LYS 16 N -1.87 2.45 -0.62 -1.58 5.02 -1.26 -4.42 118.16 115.88 1z5f n LYS 16 Ca 0.04 -4.43 -0.30 0.00 -2.02 0.00 0.00 58.31 51.60 1z5f n LYS 16 Cb 0.26 -2.07 0.18 0.00 -0.02 0.00 0.00 35.03 33.38 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 0.31 0.00 -2.88 -0.18 0.24 -1.23 -4.85 118.33 109.74 1z5f n VAL 17 Ca 0.29 -0.25 -0.42 0.00 -2.04 0.00 0.00 64.34 61.92 1z5f n VAL 17 Cb 0.45 -0.61 0.01 0.00 -1.47 0.00 0.00 33.84 32.22 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 -2.24 4.82 -0.29 7.34 2.85 -1.26 -4.85 118.16 124.53 1z5f n LYS 18 Ca 0.02 -4.60 0.26 0.00 -1.05 0.00 0.00 58.31 52.94 1z5f n LYS 18 Cb 0.58 -2.50 0.44 0.00 -0.65 0.00 0.00 35.03 32.91 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 0.41 0.00 0.00 1.82 -1.88 -1.28 116.42 115.49 1z5f h ASP 20 Ca 0.60 0.14 -0.31 0.00 -0.39 0.00 0.00 57.03 57.06 1z5f h ASP 20 Cb 1.81 0.10 -0.06 0.00 0.68 0.00 0.00 39.33 41.86 1z5f h ASP 20 CO -0.39 0.05 -2.18 0.52 -1.61 0.00 0.00 179.24 175.64 1z5f n VAL 21 N -4.99 1.18 0.00 2.25 0.31 0.42 -2.14 118.33 115.35 1z5f n VAL 21 Ca 0.22 -0.61 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1z5f n VAL 21 Cb 0.63 -0.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 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 -2.84 0.00 0.00 5.55 0.00 0.48 -1.08 120.64 122.75 1z5f n GLU 22 Ca -0.32 0.33 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1z5f n GLU 22 Cb 0.98 -1.65 0.00 0.00 0.00 0.00 0.00 31.44 30.78 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 -1.32 0.00 0.00 5.31 2.81 -0.52 -4.67 117.12 118.74 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 0.15 -0.44 0.18 0.00 -0.71 0.00 0.00 33.22 32.39 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 -2.62 1.86 -1.00 3.04 0.00 -0.91 -0.79 120.51 120.10 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 0.31 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.78 -0.03 -0.00 0.00 5.02 -0.24 -4.42 118.16 117.71 1z5f n LYS 25 Ca 0.04 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 34.91 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 -2.35 4.02 1.14 7.82 0.00 -1.26 -3.19 120.51 126.69 1z5f n ALA 26 Ca 0.00 -0.53 0.12 0.00 0.00 0.00 0.00 53.44 53.03 1z5f n ALA 26 Cb 0.00 -0.70 0.20 0.00 0.00 0.00 0.00 19.45 18.95 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 -1.67 1.93 -0.01 0.00 -0.00 -1.26 -4.43 117.00 111.55 1z5f n LEU 27 Ca 0.02 -0.65 -0.02 0.00 -0.00 0.00 0.00 56.01 55.35 1z5f n LEU 27 Cb 0.37 -0.03 -0.01 0.00 -0.00 0.00 0.00 43.42 43.75 1z5f n LEU 27 CO 0.40 0.34 -0.58 0.49 -0.00 0.00 0.00 177.39 178.04 1z5f n PHE 28 N 0.17 0.00 -2.10 1.47 3.72 -1.26 -5.05 117.46 114.41 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 0.45 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 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 -2.83 -1.53 -3.41 4.37 -0.08 -1.18 -4.28 116.55 107.61 1z5f n ASP 29 Ca -0.05 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.11 1z5f n ASP 29 Cb 0.54 -0.44 0.01 0.00 2.34 0.00 0.00 41.12 43.56 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 -2.36 3.36 0.00 0.00 4.76 -1.26 -4.84 118.16 117.81 1z5f n LYS 31 Ca -0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.31 1z5f n LYS 31 Cb 0.59 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.78 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 0.61 -4.22 1.97 2.85 -1.26 -4.83 118.16 113.28 1z5f n LYS 32 Ca 0.00 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 57.09 1z5f n LYS 32 Cb 0.00 -0.61 -0.13 0.00 -0.65 0.00 0.00 35.03 33.64 1z5f n LYS 32 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1z5f s THR 33 N -1.22 0.77 0.02 0.58 -1.32 -1.26 -0.83 115.64 112.38 1z5f s THR 33 Ca 0.00 -0.83 -0.24 0.00 -1.21 0.00 0.00 61.69 59.41 1z5f s THR 33 Cb 0.00 -0.73 0.05 0.00 -1.51 0.00 0.00 72.50 70.32 1z5f s THR 33 CO 0.00 -0.08 0.54 0.21 -2.21 0.00 0.00 174.62 173.08 1z5f s ASN 34 N -1.01 -0.47 0.04 8.08 3.84 -1.06 -4.96 114.94 119.39 1z5f s ASN 34 Ca -0.02 0.30 0.00 0.00 0.21 0.00 0.00 52.86 53.36 1z5f s ASN 34 Cb -0.07 0.49 -0.03 0.00 -0.55 0.00 0.00 41.25 41.09 1z5f s ASN 34 CO 0.01 -0.67 -0.04 -0.89 -2.79 0.00 0.00 177.10 172.72 1z5f s THR 35 N -2.03 0.27 0.36 -5.21 2.01 -1.26 -0.33 115.64 109.44 1z5f s THR 35 Ca -0.08 -1.32 -0.05 0.00 0.31 0.00 0.00 61.69 60.56 1z5f s THR 35 Cb -0.01 -0.85 0.01 0.00 0.01 0.00 0.00 72.50 71.67 1z5f s THR 35 CO 0.02 -0.68 0.54 -0.36 -0.69 0.00 0.00 174.62 173.46 1z5f s PHE 36 N -2.43 0.91 -0.05 4.92 0.08 -0.68 -4.74 117.98 115.99 1z5f s PHE 36 Ca -0.05 -1.23 0.03 0.00 0.12 0.00 0.00 56.93 55.80 1z5f s PHE 36 Cb -0.03 0.09 0.00 0.00 -0.57 0.00 0.00 43.02 42.52 1z5f s PHE 36 CO -0.04 -1.24 -0.14 0.42 -0.10 0.00 0.00 175.22 174.12 1z5f s ILE 37 N -2.82 1.22 -0.53 0.64 1.01 0.21 -3.80 121.20 117.13 1z5f s ILE 37 Ca 0.28 -0.57 -0.17 0.00 0.00 0.00 0.00 60.65 60.18 1z5f s ILE 37 Cb -0.01 -1.07 0.09 0.00 0.01 0.00 0.00 42.46 41.47 1z5f s ILE 37 CO 0.19 0.36 0.55 -0.47 0.00 0.00 0.00 174.94 175.58 1z5f s TYR 38 N 0.29 3.14 0.10 3.97 5.04 -0.98 -2.73 117.35 126.17 1z5f s TYR 38 Ca -0.08 -0.92 -0.22 0.00 -2.44 0.00 0.00 57.07 53.41 1z5f s TYR 38 Cb -0.13 -3.61 0.06 0.00 0.35 0.00 0.00 41.96 38.63 1z5f s TYR 38 CO 0.03 -1.03 0.54 0.00 -1.34 0.00 0.00 175.55 173.74 1z5f s ALA 39 N 2.14 -1.38 0.14 3.97 0.00 -1.26 -4.70 121.76 120.66 1z5f s ALA 39 Ca 0.08 0.48 -0.11 0.00 0.00 0.00 0.00 51.96 52.42 1z5f s ALA 39 Cb -0.24 0.60 -0.07 0.00 0.00 0.00 0.00 23.12 23.41 1z5f s ALA 39 CO 0.07 -0.62 0.49 -0.48 0.00 0.00 0.00 175.76 175.22 1z5f s LEU 40 N -2.36 4.30 0.19 0.00 0.05 -1.26 -4.89 118.68 114.70 1z5f s LEU 40 Ca -0.02 0.92 -0.18 0.00 0.05 0.00 0.00 54.13 54.91 1z5f s LEU 40 Cb -0.00 -3.26 0.16 0.00 -2.05 0.00 0.00 46.19 41.03 1z5f s LEU 40 CO -0.07 0.09 1.36 -2.65 -0.55 0.00 0.00 176.35 174.52 1z5f n PRO 41 N 0.60 -0.24 -0.13 1.48 -0.02 -1.26 -0.61 135.00 134.81 1z5f n PRO 41 Ca -0.05 1.35 -0.05 0.00 -2.02 0.00 0.00 63.50 62.73 1z5f n PRO 41 Cb 0.52 -1.99 0.02 0.00 -0.02 0.00 0.00 33.50 32.03 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 0.18 2.00 -1.23 0.00 -1.98 0.25 103.07 102.29 1z5f h GLY 42 Ca 0.27 0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.79 1z5f h GLY 42 CO -0.86 -0.20 -0.16 3.21 0.00 0.00 0.00 176.54 178.53 1z5f h ARG 43 N -0.08 0.00 0.13 4.80 3.08 -1.25 0.20 114.38 121.26 1z5f h ARG 43 Ca 0.21 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 1z5f h ARG 43 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1z5f h ARG 43 CO -0.50 0.16 -0.06 0.28 -1.07 0.00 0.00 179.97 178.79 1z5f h VAL 44 N 0.00 0.31 0.00 2.04 2.07 0.29 -2.39 116.25 118.57 1z5f h VAL 44 Ca -0.00 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.46 1z5f h VAL 44 Cb 0.29 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1z5f h VAL 44 CO 0.02 0.10 0.00 0.07 0.02 0.00 0.00 177.57 177.78 1z5f h LYS 45 N -1.02 0.00 -0.06 1.57 2.10 -0.64 -1.73 116.57 116.80 1z5f h LYS 45 Ca -0.02 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.40 1z5f h LYS 45 Cb 0.29 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.63 1z5f h LYS 45 CO 0.03 0.00 -0.91 0.00 -2.00 0.00 0.00 179.45 176.57 1z5f h ALA 46 N 2.00 0.28 0.00 0.07 0.00 -0.62 -2.90 119.26 118.10 1z5f h ALA 46 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1z5f h ALA 46 Cb 0.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1z5f h ALA 46 CO 0.00 0.72 0.00 1.28 0.00 0.00 0.00 179.25 181.25 1z5f n LEU 47 N -3.86 0.31 -1.44 0.00 4.77 -0.65 -1.87 117.00 114.26 1z5f n LEU 47 Ca -0.08 0.61 -0.08 0.00 -0.03 0.00 0.00 56.01 56.42 1z5f n LEU 47 Cb 0.81 -0.61 0.10 0.00 -2.33 0.00 0.00 43.42 41.40 1z5f n LEU 47 CO 0.53 -0.58 0.24 0.00 -1.33 0.00 0.00 177.39 176.25 1z5f s LYS 49 N -3.26 4.16 0.00 0.00 -2.85 -0.78 -3.95 119.74 113.06 1z5f s LYS 49 Ca 0.43 0.25 0.00 0.00 -1.00 0.00 0.00 55.97 55.65 1z5f s LYS 49 Cb 0.39 -3.56 0.00 0.00 -2.06 0.00 0.00 37.83 32.60 1z5f s LYS 49 CO -0.02 -0.11 0.00 -1.71 0.10 0.00 0.00 175.35 173.61 1z5f n ASN 50 N 4.69 -2.93 -3.80 0.03 4.05 -1.26 -5.03 115.26 111.01 1z5f n ASN 50 Ca -0.07 0.00 -0.27 0.00 0.45 0.00 0.00 54.58 54.69 1z5f n ASN 50 Cb 0.51 -0.49 0.23 0.00 1.23 0.00 0.00 39.78 41.26 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 -2.98 0.00 -0.08 -1.44 2.08 -1.25 -4.99 119.36 110.70 1z5f n ILE 51 Ca 0.00 -0.18 -0.15 0.00 0.56 0.00 0.00 62.75 62.98 1z5f n ILE 51 Cb 0.00 -0.80 -0.05 0.00 -0.75 0.00 0.00 39.64 38.04 1z5f n ILE 51 CO 0.00 0.00 0.00 -2.11 0.56 0.00 0.00 176.55 175.00 1z5f n ARG 52 N -3.99 0.39 0.00 0.38 1.85 -1.26 -4.82 116.66 109.21 1z5f n ARG 52 Ca 0.07 0.17 0.00 0.00 -1.00 0.00 0.00 57.85 57.08 1z5f n ARG 52 Cb 0.53 -1.17 0.00 0.00 -1.05 0.00 0.00 32.46 30.78 1z5f n ARG 52 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1z5f n ASP 53 N -3.99 0.00 -4.59 2.89 -0.08 -1.25 -4.88 116.55 104.65 1z5f n ASP 53 Ca -0.26 0.00 -0.41 0.00 -1.51 0.00 0.00 54.79 52.60 1z5f n ASP 53 Cb 0.60 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 44.03 1z5f n ASP 53 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1z5f s ASN 54 N 2.00 5.45 0.20 1.67 2.20 -1.25 -3.87 114.94 121.35 1z5f s ASN 54 Ca 0.00 1.33 -0.16 0.00 -0.94 0.00 0.00 52.86 53.09 1z5f s ASN 54 Cb 0.00 -2.52 0.02 0.00 -2.00 0.00 0.00 41.25 36.75 1z5f s ASN 54 CO 0.00 -2.05 0.50 -0.89 -2.94 0.00 0.00 177.10 171.72 1z5f s THR 55 N 8.42 0.03 0.07 0.54 2.01 -1.03 -5.00 115.64 120.68 1z5f s THR 55 Ca 0.87 -0.94 -0.11 0.00 0.31 0.00 0.00 61.69 61.82 1z5f s THR 55 Cb -0.24 -1.70 -0.06 0.00 0.01 0.00 0.00 72.50 70.51 1z5f s THR 55 CO 0.31 -0.12 0.43 -1.81 -0.69 0.00 0.00 174.62 172.74 1z5f s ASP 56 N -2.90 6.70 0.30 3.53 1.11 -1.26 -2.11 116.67 122.04 1z5f s ASP 56 Ca 0.12 0.87 0.05 0.00 0.18 0.00 0.00 52.55 53.77 1z5f s ASP 56 Cb -0.01 -2.21 -0.06 0.00 1.07 0.00 0.00 42.92 41.71 1z5f s ASP 56 CO -0.01 0.19 0.00 0.68 1.18 0.00 0.00 175.17 177.22 1z5f s VAL 57 N -1.35 1.40 -0.02 -1.27 -7.23 0.50 -4.97 120.40 107.47 1z5f s VAL 57 Ca 0.32 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 58.45 1z5f s VAL 57 Cb -0.15 -2.62 0.01 0.00 0.56 0.00 0.00 36.38 34.18 1z5f s VAL 57 CO 0.17 -0.16 -0.04 -0.22 -0.31 0.00 0.00 175.10 174.54 1z5f s LEU 58 N -3.46 1.71 0.88 1.32 1.98 -1.26 -2.48 118.68 117.36 1z5f s LEU 58 Ca 0.33 -0.09 -0.13 0.00 -2.89 0.00 0.00 54.13 51.34 1z5f s LEU 58 Cb 0.07 -0.31 0.05 0.00 0.66 0.00 0.00 46.19 46.66 1z5f s LEU 58 CO 0.13 0.01 0.69 -0.24 -1.89 0.00 0.00 176.35 175.05 1z5f n SER 59 N 3.40 -0.97 -0.15 3.68 2.88 -0.47 -4.89 113.62 117.10 1z5f n SER 59 Ca -0.18 0.44 -0.11 0.00 -1.33 0.00 0.00 58.87 57.69 1z5f n SER 59 Cb 0.55 -1.31 0.01 0.00 -0.75 0.00 0.00 64.21 62.71 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 -1.27 0.98 0.00 -1.46 2.47 -1.98 -3.44 114.38 109.68 1z5f h ARG 60 Ca -0.44 -0.42 0.00 0.00 -1.26 0.00 0.00 59.98 57.86 1z5f h ARG 60 Cb 1.30 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 1z5f h ARG 60 CO 0.39 1.09 0.00 -0.25 0.56 0.00 0.00 179.97 181.76 1z5f n ASP 61 N -4.11 0.00 -4.04 7.04 8.00 -1.26 -5.07 116.55 117.10 1z5f n ASP 61 Ca 0.00 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 1z5f n ASP 61 Cb 0.46 0.10 -0.08 0.00 -0.02 0.00 0.00 41.12 41.57 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 -1.60 0.38 -0.17 2.24 0.00 -1.26 -2.46 121.76 118.89 1z5f s ALA 62 Ca 0.00 -1.14 -0.14 0.00 0.00 0.00 0.00 51.96 50.69 1z5f s ALA 62 Cb 0.00 0.82 0.05 0.00 0.00 0.00 0.00 23.12 23.99 1z5f s ALA 62 CO 0.00 -0.56 0.44 -0.06 0.00 0.00 0.00 175.76 175.58 1z5f s PHE 63 N -4.00 -0.53 -0.44 0.00 0.40 -0.47 -4.74 117.98 108.21 1z5f s PHE 63 Ca 0.19 1.23 -0.29 0.00 -0.60 0.00 0.00 56.93 57.46 1z5f s PHE 63 Cb 0.05 0.20 0.02 0.00 0.51 0.00 0.00 43.02 43.81 1z5f s PHE 63 CO -0.00 -0.27 1.18 -1.17 0.70 0.00 0.00 175.22 175.66 1z5f s LEU 64 N 0.58 3.68 -0.13 -0.37 0.20 -1.26 -2.48 118.68 118.91 1z5f s LEU 64 Ca -0.03 0.64 0.02 0.00 0.69 0.00 0.00 54.13 55.46 1z5f s LEU 64 Cb -0.05 -3.55 0.01 0.00 -0.43 0.00 0.00 46.19 42.18 1z5f s LEU 64 CO -0.03 -1.22 -0.21 -1.48 -0.29 0.00 0.00 176.35 173.12 1z5f s LEU 65 N 4.48 2.01 0.40 -0.68 2.34 -1.05 -2.31 118.68 123.87 1z5f s LEU 65 Ca 0.50 -0.56 -0.24 0.00 0.06 0.00 0.00 54.13 53.89 1z5f s LEU 65 Cb -0.09 -1.35 -0.09 0.00 -0.56 0.00 0.00 46.19 44.09 1z5f s LEU 65 CO 0.29 0.07 1.06 -2.16 -1.06 0.00 0.00 176.35 174.55 1z5f s PRO 66 N 0.81 4.16 0.01 1.48 0.04 -1.25 -3.39 135.00 136.86 1z5f s PRO 66 Ca -0.08 1.53 -0.09 0.00 0.04 0.00 0.00 61.00 62.40 1z5f s PRO 66 Cb -0.16 -2.55 0.01 0.00 0.04 0.00 0.00 34.50 31.84 1z5f s PRO 66 CO -0.01 -0.15 0.18 -0.65 0.04 0.00 0.00 177.00 176.41 1z5f s GLN 67 N -2.48 0.58 0.05 4.56 -0.21 0.56 -1.69 119.66 121.02 1z5f s GLN 67 Ca 0.58 -0.45 0.02 0.00 0.02 0.00 0.00 55.36 55.53 1z5f s GLN 67 Cb -0.23 0.24 -0.04 0.00 1.00 0.00 0.00 33.01 33.99 1z5f s GLN 67 CO 0.28 -0.15 0.06 0.00 -2.12 0.00 0.00 175.29 173.36 1z5f s ASP 69 N -2.08 1.92 -0.04 0.00 -1.08 -0.89 -2.57 116.67 111.93 1z5f s ASP 69 Ca 0.26 -0.45 -0.30 0.00 -0.52 0.00 0.00 52.55 51.54 1z5f s ASP 69 Cb -0.12 0.05 -0.06 0.00 -1.46 0.00 0.00 42.92 41.33 1z5f s ASP 69 CO 0.18 -0.34 1.76 -0.60 0.52 0.00 0.00 175.17 176.68 1z5f s ARG 70 N 2.23 4.13 0.00 4.34 3.00 -0.01 -1.27 118.95 131.36 1z5f s ARG 70 Ca 0.04 2.28 0.00 0.00 -1.00 0.00 0.00 55.73 57.06 1z5f s ARG 70 Cb -0.16 -4.05 0.00 0.00 0.00 0.00 0.00 34.95 30.74 1z5f s ARG 70 CO -0.11 -0.93 0.00 -0.89 0.00 0.00 0.00 175.30 173.37 1z5f n ILE 71 N 5.60 0.00 -4.66 4.11 5.41 -1.26 -4.95 119.36 123.60 1z5f n ILE 71 Ca 0.18 0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.60 1z5f n ILE 71 Cb 0.42 -0.28 -0.12 0.00 -0.71 0.00 0.00 39.64 38.95 1z5f n ILE 71 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1z5f s LYS 72 N -1.45 2.93 0.19 0.38 1.02 -1.26 -5.02 119.74 116.53 1z5f s LYS 72 Ca 0.00 -0.59 0.00 0.00 0.02 0.00 0.00 55.97 55.40 1z5f s LYS 72 Cb 0.00 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 1z5f s LYS 72 CO 0.00 0.53 0.00 1.28 -0.92 0.00 0.00 175.35 176.24 1z5f n LEU 73 N 2.61 -0.38 0.00 3.17 4.77 -1.26 -4.35 117.00 121.56 1z5f n LEU 73 Ca -0.18 0.85 0.00 0.00 -0.03 0.00 0.00 56.01 56.65 1z5f n LEU 73 Cb 0.53 -2.63 0.00 0.00 -2.33 0.00 0.00 43.42 38.99 1z5f n LEU 73 CO 0.28 -1.92 0.00 -0.81 -1.33 0.00 0.00 177.39 173.61 1z5f n PRO 74 N -2.58 0.00 0.13 3.23 -0.04 -1.26 -4.38 135.00 130.10 1z5f n PRO 74 Ca -0.00 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.48 1z5f n PRO 74 Cb 0.59 -0.01 0.09 0.00 -0.04 0.00 0.00 33.50 34.12 1z5f n PRO 74 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1z5f s HIS 76 N -2.90 3.53 0.23 0.00 5.04 -1.26 -4.83 115.29 115.10 1z5f s HIS 76 Ca -0.00 1.05 0.00 0.00 -1.54 0.00 0.00 55.06 54.57 1z5f s HIS 76 Cb 0.01 -2.38 -0.05 0.00 0.04 0.00 0.00 32.58 30.20 1z5f s HIS 76 CO 0.03 0.33 0.11 0.71 -2.34 0.00 0.00 174.74 173.59 1z5f s TYR 77 N -1.64 1.36 0.03 3.88 2.02 -1.26 -4.48 117.35 117.26 1z5f s TYR 77 Ca 0.43 -1.28 0.02 0.00 -0.37 0.00 0.00 57.07 55.87 1z5f s TYR 77 Cb -0.13 -0.73 -0.04 0.00 -0.40 0.00 0.00 41.96 40.66 1z5f s TYR 77 CO 0.20 -0.49 0.03 0.21 -1.57 0.00 0.00 175.55 173.92 1z5f s LYS 78 N -4.09 2.81 -0.19 -0.62 2.47 -0.40 -4.87 119.74 114.85 1z5f s LYS 78 Ca 0.38 -0.64 -0.19 0.00 -1.56 0.00 0.00 55.97 53.96 1z5f s LYS 78 Cb 0.07 -2.69 -0.03 0.00 -1.46 0.00 0.00 37.83 33.72 1z5f s LYS 78 CO 0.13 0.60 0.53 -1.17 0.16 0.00 0.00 175.35 175.60 1z5f s LEU 79 N -1.85 4.17 -0.08 5.43 0.20 -1.26 -2.09 118.68 123.19 1z5f s LEU 79 Ca 0.23 0.72 -0.04 0.00 0.69 0.00 0.00 54.13 55.72 1z5f s LEU 79 Cb -0.12 -2.73 0.04 0.00 -0.43 0.00 0.00 46.19 42.95 1z5f s LEU 79 CO 0.14 -0.17 0.19 -0.55 -0.29 0.00 0.00 176.35 175.68 1z5f s SER 80 N 1.09 -0.18 0.06 3.68 0.15 -0.65 -5.01 113.70 112.83 1z5f s SER 80 Ca 0.25 0.40 -0.02 0.00 0.70 0.00 0.00 55.95 57.28 1z5f s SER 80 Cb -0.15 0.30 -0.03 0.00 -1.71 0.00 0.00 66.02 64.42 1z5f s SER 80 CO 0.10 -0.14 0.00 -0.44 1.20 0.00 0.00 173.24 173.96 1z5f s SER 81 N 1.07 0.44 0.19 5.45 0.01 -1.26 -0.32 113.70 119.27 1z5f s SER 81 Ca -0.08 -0.95 -0.23 0.00 1.31 0.00 0.00 55.95 55.99 1z5f s SER 81 Cb -0.10 0.22 0.05 0.00 0.21 0.00 0.00 66.02 66.40 1z5f s SER 81 CO -0.06 -0.62 0.76 -0.55 0.41 0.00 0.00 173.24 173.18 1z5f s SER 82 N -2.91 -0.32 -0.27 2.44 0.15 -1.22 -4.98 113.70 106.58 1z5f s SER 82 Ca 0.07 -0.36 -0.09 0.00 0.70 0.00 0.00 55.95 56.27 1z5f s SER 82 Cb 0.08 0.61 -0.03 0.00 -1.71 0.00 0.00 66.02 64.96 1z5f s SER 82 CO -0.10 -1.09 0.11 0.42 1.20 0.00 0.00 173.24 173.79 1z5f s THR 83 N -3.65 4.61 0.16 6.45 -4.23 -1.26 -2.53 115.64 115.18 1z5f s THR 83 Ca 0.08 -0.13 -0.23 0.00 -1.18 0.00 0.00 61.69 60.23 1z5f s THR 83 Cb -0.03 -3.20 0.07 0.00 1.34 0.00 0.00 72.50 70.68 1z5f s THR 83 CO -0.00 0.27 0.61 0.54 -0.54 0.00 0.00 174.62 175.50 1z5f s ASN 84 N 1.65 -0.56 1.25 3.99 4.22 -1.03 -4.64 114.94 119.81 1z5f s ASN 84 Ca 0.06 -0.01 -0.18 0.00 -2.14 0.00 0.00 52.86 50.59 1z5f s ASN 84 Cb -0.16 0.60 0.30 0.00 1.28 0.00 0.00 41.25 43.28 1z5f s ASN 84 CO 0.06 -0.97 1.02 -0.89 -2.04 0.00 0.00 177.10 174.28 1z5f s THR 85 N -3.74 1.62 0.00 0.54 2.01 -1.03 -1.37 115.64 113.66 1z5f s THR 85 Ca 0.01 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 61.90 1z5f s THR 85 Cb -0.01 -2.24 0.01 0.00 0.01 0.00 0.00 72.50 70.27 1z5f s THR 85 CO -0.13 0.00 0.22 0.27 -0.69 0.00 0.00 174.62 174.30 1z5f s ILE 86 N -2.61 0.08 -0.14 1.82 -4.36 -1.24 -2.38 121.20 112.37 1z5f s ILE 86 Ca 0.69 -0.63 -0.01 0.00 -0.26 0.00 0.00 60.65 60.44 1z5f s ILE 86 Cb -0.16 -0.58 -0.02 0.00 1.25 0.00 0.00 42.46 42.95 1z5f s ILE 86 CO 0.59 -0.34 -0.11 0.00 0.24 0.00 0.00 174.94 175.32 1z5f s ILE 88 N 0.43 0.11 -0.14 0.00 2.07 -1.04 -1.25 121.20 121.39 1z5f s ILE 88 Ca -0.08 -0.93 -0.03 0.00 -1.41 0.00 0.00 60.65 58.20 1z5f s ILE 88 Cb -0.15 -1.17 -0.03 0.00 0.13 0.00 0.00 42.46 41.24 1z5f s ILE 88 CO 0.04 -0.51 -0.03 -0.89 -1.91 0.00 0.00 174.94 171.64 1z5f s THR 89 N -3.41 3.94 0.51 4.00 2.01 -0.96 -0.37 115.64 121.36 1z5f s THR 89 Ca 0.01 -0.35 0.03 0.00 0.31 0.00 0.00 61.69 61.69 1z5f s THR 89 Cb 0.02 -2.71 -0.00 0.00 0.01 0.00 0.00 72.50 69.82 1z5f s THR 89 CO -0.09 0.51 0.14 0.00 -0.69 0.00 0.00 174.62 174.49 1z5f n VAL 91 N -1.41 0.00 -0.55 0.00 3.14 -1.20 -2.46 118.33 115.84 1z5f n VAL 91 Ca -0.12 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.20 1z5f n VAL 91 Cb 0.66 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.36 1z5f n VAL 91 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1z5f n ASN 92 N 0.00 3.41 -2.84 6.55 4.13 -1.26 -3.93 115.26 121.32 1z5f n ASN 92 Ca 0.00 -2.07 -0.19 0.00 1.68 0.00 0.00 54.58 54.00 1z5f n ASN 92 Cb 0.00 -0.86 0.05 0.00 -1.54 0.00 0.00 39.78 37.43 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 2.38 -5.73 -3.67 3.52 3.00 -1.26 -5.00 117.38 110.62 1z5f n GLN 93 Ca 0.20 0.69 -0.14 0.00 -0.01 0.00 0.00 57.00 57.73 1z5f n GLN 93 Cb 0.51 -5.22 -0.14 0.00 0.00 0.00 0.00 30.24 25.39 1z5f n GLN 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1z5f s LEU 94 N -5.90 -0.19 -0.03 1.08 1.43 -1.26 -4.73 118.68 109.09 1z5f s LEU 94 Ca 0.41 0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 53.73 1z5f s LEU 94 Cb -0.18 0.59 -0.04 0.00 0.03 0.00 0.00 46.19 46.59 1z5f s LEU 94 CO 0.51 -0.24 1.22 -2.16 0.23 0.00 0.00 176.35 175.91 1z5f s PRO 95 N 2.30 4.36 0.00 1.29 0.04 -1.26 -3.27 135.00 138.45 1z5f s PRO 95 Ca 0.01 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.76 1z5f s PRO 95 Cb -0.12 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 30.90 1z5f s PRO 95 CO -0.08 -0.42 0.00 0.44 0.04 0.00 0.00 177.00 176.98 1z5f n ILE 96 N 4.49 0.00 -4.91 0.56 -6.64 -1.20 -3.89 119.36 107.77 1z5f n ILE 96 Ca 0.11 -0.00 -0.33 0.00 -1.77 0.00 0.00 62.75 60.76 1z5f n ILE 96 Cb 0.46 0.74 -0.14 0.00 -1.44 0.00 0.00 39.64 39.26 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 2.69 -0.46 4.28 3.76 -1.08 -4.39 115.29 120.10 1z5f s HIS 97 Ca 0.00 -0.34 -0.09 0.00 -0.15 0.00 0.00 55.06 54.48 1z5f s HIS 97 Cb 0.00 -1.68 0.11 0.00 1.11 0.00 0.00 32.58 32.13 1z5f s HIS 97 CO 0.00 0.04 0.32 0.12 -0.85 0.00 0.00 174.74 174.37 1z5f s PHE 98 N -0.40 3.43 0.00 1.40 5.36 -1.26 -2.26 117.98 124.25 1z5f s PHE 98 Ca 0.04 -1.89 0.00 0.00 -0.96 0.00 0.00 56.93 54.12 1z5f s PHE 98 Cb -0.12 -3.41 0.00 0.00 -0.34 0.00 0.00 43.02 39.15 1z5f s PHE 98 CO 0.02 -0.98 0.87 0.00 -1.46 0.00 0.00 175.22 173.68 1z5f n ALA 99 N 4.88 -0.33 -3.00 11.12 0.00 -0.38 -4.99 120.51 127.81 1z5f n ALA 99 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1z5f n ALA 99 Cb 0.41 0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.91 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 -0.89 0.96 3.88 0.00 0.00 -1.20 -5.04 105.19 102.91 1z5f n GLY 100 Ca 0.00 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 1z5f n GLY 100 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1z5f s VAL 101 N -2.25 4.74 0.00 1.61 -7.23 -1.26 -3.88 120.40 112.13 1z5f s VAL 101 Ca 0.00 0.76 0.00 0.00 -1.81 0.00 0.00 61.98 60.93 1z5f s VAL 101 Cb 0.00 -3.85 0.00 0.00 0.56 0.00 0.00 36.38 33.09 1z5f s VAL 101 CO 0.00 -1.00 0.00 0.61 -0.31 0.00 0.00 175.10 174.40 1z5f n GLY 102 N -2.44 0.10 3.78 2.32 0.00 -1.00 -4.66 105.19 103.29 1z5f n GLY 102 Ca 0.05 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 1z5f n GLY 102 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1z5f s SER 103 N -4.00 5.01 1.01 1.61 0.01 -1.26 -2.62 113.70 113.47 1z5f s SER 103 Ca 0.00 1.88 -0.14 0.00 1.31 0.00 0.00 55.95 58.99 1z5f s SER 103 Cb 0.00 -2.53 0.08 0.00 0.21 0.00 0.00 66.02 63.77 1z5f s SER 103 CO 0.00 -1.69 0.34 0.00 0.41 0.00 0.00 173.24 172.30