#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 0.07 0.00 1.24 -0.00 -1.90 0.14 115.95 115.50 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 -0.02 0.00 0.00 -0.00 0.00 0.00 29.16 29.14 1z5f h TRP 3 CO 0.00 0.03 0.00 0.39 -0.00 0.00 0.00 178.44 178.86 1z5f n GLU 4 N -4.38 0.00 -0.18 2.65 4.71 -1.26 -0.82 120.64 121.36 1z5f n GLU 4 Ca 0.11 0.07 -0.01 0.00 -0.01 0.00 0.00 57.16 57.32 1z5f n GLU 4 Cb 0.63 -1.02 0.07 0.00 -1.01 0.00 0.00 31.44 30.11 1z5f n GLU 4 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1z5f h THR 5 N 0.00 0.51 -0.32 2.62 1.03 -1.97 1.44 112.91 116.23 1z5f h THR 5 Ca 0.00 -0.03 0.09 0.00 -0.01 0.00 0.00 66.41 66.46 1z5f h THR 5 Cb 0.00 0.43 -0.01 0.00 -1.07 0.00 0.00 68.15 67.49 1z5f h THR 5 CO 0.00 0.01 0.55 0.15 -0.01 0.00 0.00 175.52 176.23 1z5f h PHE 6 N 0.08 0.00 0.00 0.00 3.57 -0.76 2.22 116.94 122.05 1z5f h PHE 6 Ca 0.28 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.78 1z5f h PHE 6 Cb 0.45 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.19 1z5f h PHE 6 CO -0.38 0.00 -1.00 0.94 -2.23 0.00 0.00 178.31 175.64 1z5f n GLN 7 N -3.27 0.59 -0.11 1.11 0.00 0.48 -3.08 117.38 113.11 1z5f n GLN 7 Ca 0.06 0.12 -0.22 0.00 -0.00 0.00 0.00 57.00 56.95 1z5f n GLN 7 Cb 0.69 -1.82 -0.11 0.00 0.00 0.00 0.00 30.24 29.00 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 -2.65 0.56 -0.01 3.69 4.76 0.72 -3.62 118.16 121.62 1z5f n LYS 8 Ca 0.00 0.57 -0.21 0.00 -2.87 0.00 0.00 58.31 55.80 1z5f n LYS 8 Cb 0.55 -1.74 -0.14 0.00 -1.84 0.00 0.00 35.03 31.86 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 0.19 0.00 1.97 2.10 -0.95 -3.36 116.57 115.53 1z5f h LYS 9 Ca -0.36 -0.33 0.00 0.00 -2.00 0.00 0.00 60.65 57.96 1z5f h LYS 9 Cb 1.31 0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.76 1z5f h LYS 9 CO -0.22 1.16 -0.08 0.72 -2.00 0.00 0.00 179.45 179.03 1z5f n HIS 10 N -4.09 0.06 -4.28 0.07 8.25 -1.18 -4.72 115.22 109.33 1z5f n HIS 10 Ca -0.23 0.02 -0.20 0.00 -0.26 0.00 0.00 57.72 57.05 1z5f n HIS 10 Cb 0.82 -0.49 -0.11 0.00 1.12 0.00 0.00 29.99 31.33 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 -3.09 2.42 0.00 2.41 1.02 -1.22 0.55 118.68 120.76 1z5f s LEU 11 Ca 0.13 -0.83 0.00 0.00 0.02 0.00 0.00 54.13 53.45 1z5f s LEU 11 Cb 0.18 -0.69 0.00 0.00 0.02 0.00 0.00 46.19 45.71 1z5f s LEU 11 CO 0.56 -0.09 0.00 1.07 0.02 0.00 0.00 176.35 177.91 1z5f n THR 12 N 0.43 0.00 -0.77 5.49 5.66 -1.10 -4.44 114.28 119.55 1z5f n THR 12 Ca -0.14 0.00 0.07 0.00 -3.05 0.00 0.00 64.05 60.93 1z5f n THR 12 Cb 0.57 0.00 0.10 0.00 -1.55 0.00 0.00 70.33 69.45 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 -2.56 2.23 -3.56 1.09 8.00 -1.26 -4.53 116.55 115.96 1z5f n ASP 13 Ca 0.00 -2.77 -0.16 0.00 0.71 0.00 0.00 54.79 52.57 1z5f n ASP 13 Cb 0.00 -0.31 -0.06 0.00 -0.02 0.00 0.00 41.12 40.73 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 -2.33 0.02 0.09 -3.53 -1.32 -1.26 -5.02 115.64 102.29 1z5f s THR 14 Ca 0.23 -0.13 0.26 0.00 -1.21 0.00 0.00 61.69 60.84 1z5f s THR 14 Cb 0.20 -0.94 0.27 0.00 -1.51 0.00 0.00 72.50 70.52 1z5f s THR 14 CO 0.02 -0.07 1.83 0.11 -2.21 0.00 0.00 174.62 174.31 1z5f h LYS 15 N 3.02 0.00 -2.31 7.08 1.57 -1.96 -3.28 116.57 120.69 1z5f h LYS 15 Ca -0.29 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 57.85 1z5f h LYS 15 Cb 1.17 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 33.09 1z5f h LYS 15 CO 0.40 0.18 -0.31 0.36 -0.57 0.00 0.00 179.45 179.50 1z5f n LYS 16 N -3.31 3.25 -0.65 3.15 2.85 -1.26 -4.43 118.16 117.75 1z5f n LYS 16 Ca 0.00 -4.73 -0.31 0.00 -1.05 0.00 0.00 58.31 52.22 1z5f n LYS 16 Cb 0.42 -2.30 0.17 0.00 -0.65 0.00 0.00 35.03 32.67 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 0.45 0.00 -2.77 0.58 0.24 -1.24 -4.84 118.33 110.75 1z5f n VAL 17 Ca 0.31 -0.27 -0.42 0.00 -2.04 0.00 0.00 64.34 61.92 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 -2.12 4.68 -0.21 7.34 2.85 -1.26 -4.85 118.16 124.59 1z5f n LYS 18 Ca 0.01 -4.42 0.20 0.00 -1.05 0.00 0.00 58.31 53.05 1z5f n LYS 18 Cb 0.60 -2.55 0.37 0.00 -0.65 0.00 0.00 35.03 32.80 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 0.61 0.00 0.00 3.58 -1.89 -0.62 116.42 118.10 1z5f h ASP 20 Ca 0.54 0.13 -0.30 0.00 0.42 0.00 0.00 57.03 57.82 1z5f h ASP 20 Cb 1.42 0.04 -0.06 0.00 1.72 0.00 0.00 39.33 42.45 1z5f h ASP 20 CO -0.52 0.08 -2.13 0.52 -2.88 0.00 0.00 179.24 174.31 1z5f n VAL 21 N -4.84 1.14 0.00 2.25 0.31 0.42 -2.12 118.33 115.48 1z5f n VAL 21 Ca 0.27 -0.59 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 1z5f n VAL 21 Cb 0.80 -0.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.88 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 -2.81 0.00 0.00 5.55 4.07 0.55 -1.07 120.64 126.93 1z5f n GLU 22 Ca -0.31 0.24 0.00 0.00 -0.06 0.00 0.00 57.16 57.04 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 -1.20 0.00 0.00 5.31 2.81 -0.29 -4.69 117.12 119.05 1z5f n MET 23 Ca 0.00 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.93 1z5f n MET 23 Cb 0.05 -0.42 0.22 0.00 -0.71 0.00 0.00 33.22 32.36 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 -2.59 2.00 -0.98 3.04 0.00 -0.90 -1.31 120.51 119.76 1z5f n ALA 24 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 53.44 53.39 1z5f n ALA 24 Cb 0.29 -1.12 0.01 0.00 0.00 0.00 0.00 19.45 18.62 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 -0.51 0.00 0.00 5.02 -0.24 -4.45 118.16 117.23 1z5f n LYS 25 Ca 0.06 -0.04 0.10 0.00 -2.02 0.00 0.00 58.31 56.41 1z5f n LYS 25 Cb 0.03 -0.06 -0.10 0.00 -0.02 0.00 0.00 35.03 34.88 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 -1.95 4.41 1.11 7.82 0.00 -1.26 -3.08 120.51 127.57 1z5f n ALA 26 Ca -0.01 -0.57 0.12 0.00 0.00 0.00 0.00 53.44 52.99 1z5f n ALA 26 Cb 0.02 -0.80 0.17 0.00 0.00 0.00 0.00 19.45 18.84 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 -1.61 2.29 -0.01 0.00 -0.00 -1.26 -4.39 117.00 112.02 1z5f n LEU 27 Ca 0.03 -0.78 -0.01 0.00 -0.00 0.00 0.00 56.01 55.26 1z5f n LEU 27 Cb 0.36 -0.01 -0.01 0.00 -0.00 0.00 0.00 43.42 43.76 1z5f n LEU 27 CO 0.43 0.39 -0.54 0.49 -0.00 0.00 0.00 177.39 178.16 1z5f n PHE 28 N 0.58 0.00 -2.51 1.47 3.72 -1.26 -5.04 117.46 114.42 1z5f n PHE 28 Ca 0.13 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.48 1z5f n PHE 28 Cb 0.50 -0.05 0.01 0.00 -0.94 0.00 0.00 39.48 39.00 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 -2.49 -2.70 -3.36 4.37 8.00 -1.18 -4.07 116.55 115.12 1z5f n ASP 29 Ca -0.02 -0.08 -0.11 0.00 0.71 0.00 0.00 54.79 55.28 1z5f n ASP 29 Cb 0.52 -1.56 0.01 0.00 -0.02 0.00 0.00 41.12 40.07 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 -2.32 3.18 0.00 0.00 4.76 -1.26 -4.94 118.16 117.58 1z5f n LYS 31 Ca -0.12 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.32 1z5f n LYS 31 Cb 0.58 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.77 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 2.73 -4.00 1.97 -0.00 -1.26 -4.91 118.16 112.70 1z5f n LYS 32 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 58.31 58.22 1z5f n LYS 32 Cb 0.00 -0.68 -0.11 0.00 -0.00 0.00 0.00 35.03 34.24 1z5f n LYS 32 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1z5f s THR 33 N -1.02 0.14 -0.00 0.58 -1.32 -1.26 -0.02 115.64 112.74 1z5f s THR 33 Ca 0.00 -1.12 -0.27 0.00 -1.21 0.00 0.00 61.69 59.08 1z5f s THR 33 Cb 0.00 -0.59 0.06 0.00 -1.51 0.00 0.00 72.50 70.46 1z5f s THR 33 CO 0.00 -0.62 0.62 0.21 -2.21 0.00 0.00 174.62 172.62 1z5f s ASN 34 N -1.83 -0.58 0.03 8.08 3.84 -0.78 -4.96 114.94 118.73 1z5f s ASN 34 Ca -0.10 0.50 -0.00 0.00 0.21 0.00 0.00 52.86 53.46 1z5f s ASN 34 Cb -0.05 0.52 -0.02 0.00 -0.55 0.00 0.00 41.25 41.15 1z5f s ASN 34 CO -0.03 -0.66 -0.03 -0.89 -2.79 0.00 0.00 177.10 172.69 1z5f s THR 35 N -1.74 0.14 0.33 -5.21 2.01 -1.26 -0.41 115.64 109.49 1z5f s THR 35 Ca -0.09 -1.12 -0.07 0.00 0.31 0.00 0.00 61.69 60.72 1z5f s THR 35 Cb -0.01 -0.56 0.01 0.00 0.01 0.00 0.00 72.50 71.96 1z5f s THR 35 CO 0.05 -0.62 0.53 -0.36 -0.69 0.00 0.00 174.62 173.53 1z5f s PHE 36 N -2.04 0.75 -0.07 4.92 0.40 -0.96 -4.67 117.98 116.32 1z5f s PHE 36 Ca -0.11 -1.09 0.04 0.00 -0.60 0.00 0.00 56.93 55.17 1z5f s PHE 36 Cb -0.06 0.14 0.00 0.00 0.51 0.00 0.00 43.02 43.61 1z5f s PHE 36 CO -0.03 -1.18 -0.19 0.42 0.70 0.00 0.00 175.22 174.93 1z5f s ILE 37 N -3.12 1.63 -0.63 0.64 1.01 0.19 -3.55 121.20 117.37 1z5f s ILE 37 Ca 0.26 -0.80 -0.19 0.00 0.00 0.00 0.00 60.65 59.92 1z5f s ILE 37 Cb -0.01 -1.42 0.11 0.00 0.01 0.00 0.00 42.46 41.15 1z5f s ILE 37 CO 0.16 0.46 0.75 -0.47 0.00 0.00 0.00 174.94 175.85 1z5f s TYR 38 N 0.23 3.02 -0.00 3.97 5.04 -0.98 -2.72 117.35 125.92 1z5f s TYR 38 Ca -0.10 -1.02 -0.20 0.00 -2.44 0.00 0.00 57.07 53.30 1z5f s TYR 38 Cb -0.15 -4.04 0.04 0.00 0.35 0.00 0.00 41.96 38.16 1z5f s TYR 38 CO 0.05 -1.32 0.44 0.00 -1.34 0.00 0.00 175.55 173.38 1z5f s ALA 39 N 2.64 -1.13 0.25 3.97 0.00 -1.26 -4.70 121.76 121.53 1z5f s ALA 39 Ca 0.14 0.58 -0.20 0.00 0.00 0.00 0.00 51.96 52.47 1z5f s ALA 39 Cb -0.22 0.16 -0.09 0.00 0.00 0.00 0.00 23.12 22.98 1z5f s ALA 39 CO 0.05 -0.36 0.77 -0.48 0.00 0.00 0.00 175.76 175.73 1z5f s LEU 40 N -1.55 4.31 0.20 0.00 0.05 -1.26 -4.89 118.68 115.54 1z5f s LEU 40 Ca -0.10 1.49 -0.19 0.00 0.05 0.00 0.00 54.13 55.38 1z5f s LEU 40 Cb -0.02 -3.72 0.15 0.00 -2.05 0.00 0.00 46.19 40.55 1z5f s LEU 40 CO 0.03 -0.01 1.44 -2.65 -0.55 0.00 0.00 176.35 174.61 1z5f n PRO 41 N 0.58 -0.27 -0.21 1.48 -0.02 -1.26 -0.46 135.00 134.85 1z5f n PRO 41 Ca -0.01 1.43 0.02 0.00 -2.02 0.00 0.00 63.50 62.91 1z5f n PRO 41 Cb 0.51 -2.11 0.12 0.00 -0.02 0.00 0.00 33.50 32.00 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 0.80 1.90 -1.23 0.00 -1.97 0.23 103.07 102.80 1z5f h GLY 42 Ca 0.28 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.55 1z5f h GLY 42 CO -0.91 -0.14 -0.15 -0.09 0.00 0.00 0.00 176.54 175.25 1z5f h ARG 43 N 0.24 0.12 0.07 4.80 2.43 -1.14 0.21 114.38 121.12 1z5f h ARG 43 Ca 0.33 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.47 1z5f h ARG 43 Cb 0.52 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1z5f h ARG 43 CO -0.44 0.28 -0.03 0.28 -1.51 0.00 0.00 179.97 178.55 1z5f h VAL 44 N 0.12 0.32 0.00 0.20 2.07 0.01 -2.41 116.25 116.55 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 0.33 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1z5f h VAL 44 CO 0.02 0.10 0.00 0.11 0.02 0.00 0.00 177.57 177.83 1z5f h LYS 45 N -1.01 0.00 0.02 1.57 1.57 -0.69 -0.74 116.57 117.28 1z5f h LYS 45 Ca -0.01 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.50 1z5f h LYS 45 Cb 0.24 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.57 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 2.00 0.10 0.00 3.86 0.00 -0.57 -2.75 119.26 121.90 1z5f h ALA 46 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1z5f h ALA 46 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1z5f h ALA 46 CO 0.00 0.68 0.00 -0.07 0.00 0.00 0.00 179.25 179.86 1z5f h LEU 47 N 0.38 0.00 -3.06 0.00 3.38 -0.60 -1.24 115.31 114.16 1z5f h LEU 47 Ca -0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1z5f h LEU 47 Cb 1.73 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.47 1z5f h LEU 47 CO 0.21 0.00 -0.14 0.00 0.09 0.00 0.00 178.44 178.60 1z5f s LYS 49 N -3.00 4.01 -1.13 0.00 1.02 -0.47 -4.19 119.74 115.97 1z5f s LYS 49 Ca 0.36 0.61 -0.10 0.00 0.02 0.00 0.00 55.97 56.86 1z5f s LYS 49 Cb 0.32 -3.71 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 1z5f s LYS 49 CO 0.01 -0.61 0.84 0.09 -0.92 0.00 0.00 175.35 174.76 1z5f n ASN 50 N 6.09 -4.97 0.00 2.83 3.02 -1.26 -4.99 115.26 115.97 1z5f n ASN 50 Ca 0.03 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 1z5f n ASN 50 Cb 0.48 -4.35 0.00 0.00 -0.61 0.00 0.00 39.78 35.30 1z5f n ASN 50 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1z5f n ILE 51 N -3.80 0.00 -2.74 2.41 -5.35 -1.25 -5.13 119.36 103.48 1z5f n ILE 51 Ca -0.13 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 1z5f n ILE 51 Cb 0.62 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.52 1z5f n ILE 51 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1z5f n ARG 52 N 0.00 0.00 0.00 6.28 1.74 -1.26 -5.06 116.66 118.36 1z5f n ARG 52 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1z5f n ARG 52 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1z5f n ARG 52 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1z5f n ASP 53 N -0.18 0.00 -4.60 0.55 5.75 -1.26 -2.29 116.55 114.52 1z5f n ASP 53 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.35 1z5f n ASP 53 Cb 0.00 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 1z5f n ASP 53 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1z5f s ASN 54 N -1.00 5.65 0.24 -1.12 0.01 -1.22 -3.91 114.94 113.59 1z5f s ASN 54 Ca 0.00 1.54 -0.21 0.00 -0.71 0.00 0.00 52.86 53.48 1z5f s ASN 54 Cb 0.00 -2.52 0.03 0.00 0.41 0.00 0.00 41.25 39.17 1z5f s ASN 54 CO 0.00 -1.86 0.66 -0.89 -1.51 0.00 0.00 177.10 173.50 1z5f s THR 55 N 7.67 0.00 0.24 1.60 2.01 -0.94 -4.98 115.64 121.25 1z5f s THR 55 Ca 0.89 -0.73 -0.10 0.00 0.31 0.00 0.00 61.69 62.06 1z5f s THR 55 Cb -0.27 -1.70 -0.07 0.00 0.01 0.00 0.00 72.50 70.47 1z5f s THR 55 CO 0.34 -0.01 0.57 -0.62 -0.69 0.00 0.00 174.62 174.21 1z5f s ASP 56 N -2.87 6.64 0.20 3.53 -1.08 -1.26 -2.23 116.67 119.60 1z5f s ASP 56 Ca 0.09 0.96 0.01 0.00 -0.52 0.00 0.00 52.55 53.09 1z5f s ASP 56 Cb -0.04 -2.24 -0.05 0.00 -1.46 0.00 0.00 42.92 39.13 1z5f s ASP 56 CO 0.01 -0.09 0.06 0.68 0.52 0.00 0.00 175.17 176.35 1z5f s VAL 57 N -1.84 0.45 -0.03 1.11 -7.23 0.36 -4.96 120.40 108.26 1z5f s VAL 57 Ca 0.48 -1.98 0.01 0.00 -1.81 0.00 0.00 61.98 58.69 1z5f s VAL 57 Cb -0.11 -2.35 0.01 0.00 0.56 0.00 0.00 36.38 34.50 1z5f s VAL 57 CO 0.21 -0.24 -0.06 -0.22 -0.31 0.00 0.00 175.10 174.49 1z5f s LEU 58 N -3.20 1.54 0.80 1.32 1.98 -1.26 -2.51 118.68 117.35 1z5f s LEU 58 Ca 0.31 -0.13 -0.15 0.00 -2.89 0.00 0.00 54.13 51.27 1z5f s LEU 58 Cb 0.07 -0.44 0.02 0.00 0.66 0.00 0.00 46.19 46.50 1z5f s LEU 58 CO 0.08 -0.01 0.77 -1.20 -1.89 0.00 0.00 176.35 174.10 1z5f n SER 59 N 3.69 -0.48 -0.13 3.68 7.64 -1.00 -4.85 113.62 122.18 1z5f n SER 59 Ca -0.22 0.55 0.14 0.00 1.01 0.00 0.00 58.87 60.34 1z5f n SER 59 Cb 0.53 -1.33 0.75 0.00 -1.01 0.00 0.00 64.21 63.15 1z5f n SER 59 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1z5f n ARG 60 N -1.86 1.17 0.00 1.43 1.74 -1.26 -4.82 116.66 113.07 1z5f n ARG 60 Ca 0.11 -0.25 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 1z5f n ARG 60 Cb 0.51 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 1z5f n ARG 60 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1z5f n ASP 61 N -0.65 0.00 -3.97 0.55 2.03 -1.26 -5.12 116.55 108.13 1z5f n ASP 61 Ca 0.20 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.42 1z5f n ASP 61 Cb 0.16 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.49 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 0.05 -0.13 -1.67 0.00 -1.26 -2.54 121.76 115.21 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 0.88 0.05 0.00 0.00 0.00 0.00 23.12 24.05 1z5f s ALA 62 CO 0.00 -0.65 0.32 -0.06 0.00 0.00 0.00 175.76 175.37 1z5f s PHE 63 N -3.98 -0.42 -0.47 0.00 0.40 -0.66 -4.72 117.98 108.15 1z5f s PHE 63 Ca 0.18 0.96 -0.29 0.00 -0.60 0.00 0.00 56.93 57.18 1z5f s PHE 63 Cb 0.03 0.14 0.03 0.00 0.51 0.00 0.00 43.02 43.73 1z5f s PHE 63 CO 0.01 -0.25 1.13 -1.17 0.70 0.00 0.00 175.22 175.64 1z5f s LEU 64 N 0.98 3.66 -0.06 -0.37 0.20 -1.26 -2.50 118.68 119.32 1z5f s LEU 64 Ca -0.07 0.51 0.05 0.00 0.69 0.00 0.00 54.13 55.32 1z5f s LEU 64 Cb -0.07 -3.55 -0.01 0.00 -0.43 0.00 0.00 46.19 42.13 1z5f s LEU 64 CO -0.07 -1.22 -0.23 -1.48 -0.29 0.00 0.00 176.35 173.05 1z5f s LEU 65 N 4.39 2.04 0.52 -0.68 2.34 -1.01 -2.32 118.68 123.97 1z5f s LEU 65 Ca 0.48 -0.49 -0.18 0.00 0.06 0.00 0.00 54.13 53.99 1z5f s LEU 65 Cb -0.07 -1.31 -0.07 0.00 -0.56 0.00 0.00 46.19 44.18 1z5f s LEU 65 CO 0.30 0.21 1.04 -2.16 -1.06 0.00 0.00 176.35 174.69 1z5f s PRO 66 N -0.04 3.65 -0.09 1.48 0.04 -1.23 -3.15 135.00 135.66 1z5f s PRO 66 Ca -0.06 1.27 -0.06 0.00 0.04 0.00 0.00 61.00 62.19 1z5f s PRO 66 Cb -0.14 -2.08 0.04 0.00 0.04 0.00 0.00 34.50 32.36 1z5f s PRO 66 CO 0.04 -0.54 0.23 -1.14 0.04 0.00 0.00 177.00 175.63 1z5f s GLN 67 N -3.58 0.22 -0.11 4.56 0.74 0.53 -2.26 119.66 119.76 1z5f s GLN 67 Ca 0.65 0.43 -0.07 0.00 0.05 0.00 0.00 55.36 56.43 1z5f s GLN 67 Cb -0.16 -0.02 -0.04 0.00 1.10 0.00 0.00 33.01 33.89 1z5f s GLN 67 CO 0.26 -0.11 0.15 0.00 -0.55 0.00 0.00 175.29 175.04 1z5f s ASP 69 N -1.11 1.26 -0.10 0.00 2.15 -0.96 -1.87 116.67 116.04 1z5f s ASP 69 Ca 0.16 0.03 -0.25 0.00 0.43 0.00 0.00 52.55 52.92 1z5f s ASP 69 Cb -0.12 -0.22 -0.03 0.00 -0.30 0.00 0.00 42.92 42.26 1z5f s ASP 69 CO 0.05 -0.24 0.81 -0.60 -0.17 0.00 0.00 175.17 175.03 1z5f s ARG 70 N 2.12 4.40 0.00 4.34 3.00 0.98 -0.42 118.95 133.36 1z5f s ARG 70 Ca 0.05 1.04 0.00 0.00 -1.00 0.00 0.00 55.73 55.82 1z5f s ARG 70 Cb -0.12 -3.50 0.00 0.00 0.00 0.00 0.00 34.95 31.32 1z5f s ARG 70 CO -0.04 -0.13 0.00 -0.89 0.00 0.00 0.00 175.30 174.25 1z5f n ILE 71 N 4.21 0.00 -4.09 4.11 5.41 -1.25 -4.98 119.36 122.77 1z5f n ILE 71 Ca 0.03 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.67 1z5f n ILE 71 Cb 0.50 -0.07 -0.09 0.00 -0.71 0.00 0.00 39.64 39.28 1z5f n ILE 71 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1z5f s LYS 72 N -1.32 1.13 0.39 0.38 2.20 -1.26 -5.11 119.74 116.14 1z5f s LYS 72 Ca 0.00 -1.38 0.00 0.00 -0.36 0.00 0.00 55.97 54.23 1z5f s LYS 72 Cb 0.00 0.31 0.00 0.00 -1.51 0.00 0.00 37.83 36.63 1z5f s LYS 72 CO 0.00 -0.38 0.00 1.28 -0.36 0.00 0.00 175.35 175.89 1z5f n LEU 73 N -0.20 -0.74 0.06 5.43 4.77 -1.26 -4.17 117.00 120.89 1z5f n LEU 73 Ca -0.04 1.67 0.11 0.00 -0.03 0.00 0.00 56.01 57.72 1z5f n LEU 73 Cb 0.64 -4.29 -0.06 0.00 -2.33 0.00 0.00 43.42 37.38 1z5f n LEU 73 CO 0.28 -3.17 -0.25 -0.81 -1.33 0.00 0.00 177.39 172.11 1z5f n PRO 74 N -4.05 0.60 -3.16 3.23 -0.04 -1.26 -4.58 135.00 125.75 1z5f n PRO 74 Ca -0.02 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.26 1z5f n PRO 74 Cb 0.66 -1.71 -0.03 0.00 -0.04 0.00 0.00 33.50 32.39 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 -2.06 -0.23 0.30 0.00 5.04 -1.26 -5.04 115.29 112.04 1z5f s HIS 76 Ca 0.38 0.63 0.10 0.00 -1.54 0.00 0.00 55.06 54.62 1z5f s HIS 76 Cb 0.32 -0.24 -0.05 0.00 0.04 0.00 0.00 32.58 32.66 1z5f s HIS 76 CO -0.08 -0.33 -0.01 0.71 -2.34 0.00 0.00 174.74 172.69 1z5f s TYR 77 N 2.32 2.59 0.09 3.88 1.51 -1.26 -3.91 117.35 122.57 1z5f s TYR 77 Ca 0.03 -0.32 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 1z5f s TYR 77 Cb -0.12 -1.30 -0.04 0.00 -0.11 0.00 0.00 41.96 40.38 1z5f s TYR 77 CO -0.07 0.56 0.05 0.15 -1.11 0.00 0.00 175.55 175.13 1z5f s LYS 78 N -3.68 2.74 -0.21 -0.62 -0.14 0.43 -4.77 119.74 113.49 1z5f s LYS 78 Ca 0.33 -0.76 -0.20 0.00 -1.36 0.00 0.00 55.97 53.97 1z5f s LYS 78 Cb -0.04 -2.64 -0.03 0.00 -1.68 0.00 0.00 37.83 33.44 1z5f s LYS 78 CO 0.19 0.55 0.60 -1.17 -0.76 0.00 0.00 175.35 174.76 1z5f s LEU 79 N -2.39 4.13 -0.10 3.17 0.20 -1.26 -2.26 118.68 120.17 1z5f s LEU 79 Ca 0.28 0.77 -0.04 0.00 0.69 0.00 0.00 54.13 55.83 1z5f s LEU 79 Cb -0.12 -2.84 0.05 0.00 -0.43 0.00 0.00 46.19 42.86 1z5f s LEU 79 CO 0.20 -0.26 0.20 -0.55 -0.29 0.00 0.00 176.35 175.66 1z5f s SER 80 N 1.23 0.38 0.14 3.68 0.15 -0.48 -4.98 113.70 113.83 1z5f s SER 80 Ca 0.27 0.44 0.04 0.00 0.70 0.00 0.00 55.95 57.40 1z5f s SER 80 Cb -0.16 0.43 -0.04 0.00 -1.71 0.00 0.00 66.02 64.54 1z5f s SER 80 CO 0.10 -0.22 -0.08 -0.94 1.20 0.00 0.00 173.24 173.30 1z5f s SER 81 N 2.07 1.64 0.15 5.45 1.04 -1.26 -0.35 113.70 122.44 1z5f s SER 81 Ca -0.01 -1.03 -0.24 0.00 0.48 0.00 0.00 55.95 55.15 1z5f s SER 81 Cb -0.12 0.02 0.06 0.00 0.10 0.00 0.00 66.02 66.08 1z5f s SER 81 CO -0.07 -0.38 0.79 -0.44 0.98 0.00 0.00 173.24 174.12 1z5f s SER 82 N -3.15 -0.34 -0.27 7.02 0.01 -1.19 -4.96 113.70 110.82 1z5f s SER 82 Ca 0.17 -0.26 -0.09 0.00 1.31 0.00 0.00 55.95 57.08 1z5f s SER 82 Cb 0.03 0.55 -0.03 0.00 0.21 0.00 0.00 66.02 66.79 1z5f s SER 82 CO 0.00 -0.97 0.12 0.42 0.41 0.00 0.00 173.24 173.22 1z5f s THR 83 N -3.53 4.65 0.07 1.44 -4.23 -1.26 -2.41 115.64 110.38 1z5f s THR 83 Ca 0.07 -0.12 -0.27 0.00 -1.18 0.00 0.00 61.69 60.20 1z5f s THR 83 Cb -0.02 -3.22 0.07 0.00 1.34 0.00 0.00 72.50 70.66 1z5f s THR 83 CO -0.03 0.27 0.64 0.54 -0.54 0.00 0.00 174.62 175.50 1z5f s ASN 84 N 1.66 -0.61 0.67 3.99 4.22 -1.04 -4.62 114.94 119.20 1z5f s ASN 84 Ca 0.06 0.31 -0.16 0.00 -2.14 0.00 0.00 52.86 50.93 1z5f s ASN 84 Cb -0.16 0.57 0.00 0.00 1.28 0.00 0.00 41.25 42.95 1z5f s ASN 84 CO 0.06 -0.81 1.19 -0.89 -2.04 0.00 0.00 177.10 174.61 1z5f s THR 85 N -2.62 2.61 0.06 0.54 2.01 -1.05 -1.64 115.64 115.55 1z5f s THR 85 Ca -0.04 0.32 0.04 0.00 0.31 0.00 0.00 61.69 62.32 1z5f s THR 85 Cb -0.01 -2.96 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 1z5f s THR 85 CO -0.03 -0.14 -0.11 0.27 -0.69 0.00 0.00 174.62 173.92 1z5f s ILE 86 N -1.91 0.87 -0.15 1.82 -4.36 -1.26 -0.48 121.20 115.73 1z5f s ILE 86 Ca 0.74 -1.24 -0.06 0.00 -0.26 0.00 0.00 60.65 59.83 1z5f s ILE 86 Cb -0.28 -0.91 -0.04 0.00 1.25 0.00 0.00 42.46 42.49 1z5f s ILE 86 CO 0.40 -0.31 0.06 0.00 0.24 0.00 0.00 174.94 175.33 1z5f s ILE 88 N -0.15 0.13 -0.13 0.00 2.07 -1.04 -0.54 121.20 121.54 1z5f s ILE 88 Ca 0.07 -1.13 -0.01 0.00 -1.41 0.00 0.00 60.65 58.17 1z5f s ILE 88 Cb -0.12 -1.36 -0.02 0.00 0.13 0.00 0.00 42.46 41.09 1z5f s ILE 88 CO 0.01 -0.59 -0.11 -0.89 -1.91 0.00 0.00 174.94 171.46 1z5f s THR 89 N -3.86 3.28 0.16 4.00 2.01 0.05 -0.48 115.64 120.79 1z5f s THR 89 Ca 0.06 -0.58 0.08 0.00 0.31 0.00 0.00 61.69 61.55 1z5f s THR 89 Cb 0.04 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1z5f s THR 89 CO -0.10 0.53 -0.18 0.00 -0.69 0.00 0.00 174.62 174.18 1z5f n VAL 91 N 0.34 0.00 -0.30 0.00 0.24 -0.98 -2.20 118.33 115.42 1z5f n VAL 91 Ca -0.14 0.00 0.14 0.00 -2.04 0.00 0.00 64.34 62.30 1z5f n VAL 91 Cb 0.57 0.00 0.30 0.00 -1.47 0.00 0.00 33.84 33.24 1z5f n VAL 91 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 1z5f h ASN 92 N 0.00 0.00 0.00 -1.34 2.35 -1.65 -3.35 115.58 111.59 1z5f h ASN 92 Ca 0.00 0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.88 1z5f h ASN 92 Cb 0.00 0.27 -0.07 0.00 0.05 0.00 0.00 38.32 38.57 1z5f h ASN 92 CO 0.00 -0.17 -0.01 0.00 -1.65 0.00 0.00 177.43 175.60 1z5f n GLN 93 N -5.23 0.40 -3.57 0.81 10.64 -1.26 -3.96 117.38 115.20 1z5f n GLN 93 Ca 0.22 -0.59 -0.13 0.00 -1.83 0.00 0.00 57.00 54.68 1z5f n GLN 93 Cb 0.71 0.07 -0.12 0.00 -0.86 0.00 0.00 30.24 30.05 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 -1.71 -0.38 0.03 2.61 1.02 -1.26 -4.77 118.68 114.21 1z5f s LEU 94 Ca 0.04 0.44 -0.30 0.00 0.02 0.00 0.00 54.13 54.33 1z5f s LEU 94 Cb 0.13 0.82 -0.04 0.00 0.02 0.00 0.00 46.19 47.11 1z5f s LEU 94 CO -0.03 -0.27 1.12 -2.16 0.02 0.00 0.00 176.35 175.03 1z5f s PRO 95 N 2.46 4.47 0.00 1.29 0.04 -1.26 -2.33 135.00 139.66 1z5f s PRO 95 Ca 0.04 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1z5f s PRO 95 Cb -0.13 -3.41 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1z5f s PRO 95 CO -0.11 -0.21 0.00 0.44 0.04 0.00 0.00 177.00 177.16 1z5f n ILE 96 N 3.99 0.00 -4.55 0.56 -6.64 -1.18 -3.81 119.36 107.73 1z5f n ILE 96 Ca 0.08 0.00 -0.27 0.00 -1.77 0.00 0.00 62.75 60.79 1z5f n ILE 96 Cb 0.48 1.08 -0.17 0.00 -1.44 0.00 0.00 39.64 39.59 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 1.78 -0.43 4.28 3.76 -1.08 -4.43 115.29 119.17 1z5f s HIS 97 Ca 0.00 -0.76 -0.16 0.00 -0.15 0.00 0.00 55.06 53.99 1z5f s HIS 97 Cb 0.00 -1.29 0.03 0.00 1.11 0.00 0.00 32.58 32.43 1z5f s HIS 97 CO 0.00 -0.39 0.40 0.12 -0.85 0.00 0.00 174.74 174.03 1z5f s PHE 98 N 0.84 3.19 0.00 1.40 5.36 -1.26 -0.77 117.98 126.74 1z5f s PHE 98 Ca -0.10 -0.53 0.00 0.00 -0.96 0.00 0.00 56.93 55.34 1z5f s PHE 98 Cb -0.15 -2.89 0.00 0.00 -0.34 0.00 0.00 43.02 39.64 1z5f s PHE 98 CO 0.01 -0.71 0.46 0.00 -1.46 0.00 0.00 175.22 173.53 1z5f n ALA 99 N 5.46 -0.05 -3.00 11.12 0.00 0.30 -4.96 120.51 129.38 1z5f n ALA 99 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1z5f n ALA 99 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.05 1.74 3.91 0.00 0.00 -1.11 -5.00 105.19 104.68 1z5f n GLY 100 Ca 0.00 -0.81 -0.28 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.60 4.97 0.53 1.61 0.11 -1.26 -3.10 120.40 120.66 1z5f s VAL 101 Ca 0.00 0.10 0.00 0.00 -2.93 0.00 0.00 61.98 59.15 1z5f s VAL 101 Cb 0.00 -3.79 0.00 0.00 -1.53 0.00 0.00 36.38 31.06 1z5f s VAL 101 CO 0.00 -0.52 0.00 0.61 -3.33 0.00 0.00 175.10 171.86 1z5f n GLY 102 N -1.44 -2.80 3.64 6.54 0.00 0.37 -4.60 105.19 106.89 1z5f n GLY 102 Ca -0.01 -0.92 -0.46 0.00 0.00 0.00 0.00 46.02 44.63 1z5f n GLY 102 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1z5f n SER 103 N -4.26 2.41 -4.81 1.61 7.64 -1.24 -3.79 113.62 111.17 1z5f n SER 103 Ca -0.07 1.13 -0.33 0.00 1.01 0.00 0.00 58.87 60.61 1z5f n SER 103 Cb 0.63 -1.37 -0.03 0.00 -1.01 0.00 0.00 64.21 62.44 1z5f n SER 103 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03