#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zkh s VAL 2 N 0.00 1.53 -0.21 0.52 -7.23 0.40 -4.91 120.40 110.49 1zkh s VAL 2 Ca 0.00 -1.65 -0.21 0.00 -1.81 0.00 0.00 61.98 58.31 1zkh s VAL 2 Cb 0.00 -1.54 -0.02 0.00 0.56 0.00 0.00 36.38 35.38 1zkh s VAL 2 CO 0.00 -0.26 0.66 -0.44 -0.31 0.00 0.00 175.10 174.75 1zkh s SER 3 N -2.23 6.69 0.04 4.85 0.01 -1.26 -1.50 113.70 120.30 1zkh s SER 3 Ca 0.08 0.85 0.07 0.00 1.31 0.00 0.00 55.95 58.25 1zkh s SER 3 Cb -0.07 -2.36 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 1zkh s SER 3 CO 0.04 -0.32 -0.19 0.27 0.41 0.00 0.00 173.24 173.46 1zkh s ILE 4 N 2.11 1.49 0.07 1.44 -4.36 0.73 0.19 121.20 122.87 1zkh s ILE 4 Ca 0.29 -1.14 0.07 0.00 -0.26 0.00 0.00 60.65 59.61 1zkh s ILE 4 Cb -0.16 -1.31 -0.03 0.00 1.25 0.00 0.00 42.46 42.22 1zkh s ILE 4 CO 0.10 0.14 -0.18 -0.54 0.24 0.00 0.00 174.94 174.69 1zkh s LYS 5 N -1.17 1.09 -0.28 0.37 1.02 0.52 -0.21 119.74 121.08 1zkh s LYS 5 Ca 0.06 -0.98 0.02 0.00 0.02 0.00 0.00 55.97 55.08 1zkh s LYS 5 Cb -0.08 -1.22 0.08 0.00 -0.52 0.00 0.00 37.83 36.08 1zkh s LYS 5 CO 0.02 0.29 -0.01 0.08 -0.92 0.00 0.00 175.35 174.81 1zkh s VAL 6 N -1.02 1.81 -0.50 3.17 1.01 0.78 0.02 120.40 125.68 1zkh s VAL 6 Ca 0.04 -1.68 -0.28 0.00 0.00 0.00 0.00 61.98 60.07 1zkh s VAL 6 Cb -0.09 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 1zkh s VAL 6 CO 0.03 -0.31 1.71 -1.58 0.00 0.00 0.00 175.10 174.94 1zkh s GLN 7 N 1.21 3.07 0.06 2.72 -0.44 0.18 -0.66 119.66 125.79 1zkh s GLN 7 Ca 0.01 0.85 -0.30 0.00 -2.50 0.00 0.00 55.36 53.42 1zkh s GLN 7 Cb -0.19 -4.24 -0.05 0.00 -1.64 0.00 0.00 33.01 26.89 1zkh s GLN 7 CO -0.09 -2.19 1.12 0.08 0.50 0.00 0.00 175.29 174.71 1zkh s VAL 8 N 7.45 4.28 0.59 1.34 1.01 0.40 0.18 120.40 135.64 1zkh s VAL 8 Ca 0.67 1.67 -0.17 0.00 0.00 0.00 0.00 61.98 64.15 1zkh s VAL 8 Cb -0.15 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1zkh s VAL 8 CO 0.27 0.15 1.12 -2.16 0.00 0.00 0.00 175.10 174.47 1zkh s PRO 9 N 0.88 3.14 -1.15 2.72 0.04 -1.25 -3.22 135.00 136.17 1zkh s PRO 9 Ca 0.56 1.50 -0.21 0.00 0.04 0.00 0.00 61.00 62.88 1zkh s PRO 9 Cb -0.27 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.29 1zkh s PRO 9 CO 0.29 -1.00 1.76 -0.80 0.04 0.00 0.00 177.00 177.29 1zkh s ASN 10 N -2.15 6.04 -0.48 6.66 -0.87 -1.26 -1.42 114.94 121.46 1zkh s ASN 10 Ca 0.70 -1.77 0.06 0.00 -1.57 0.00 0.00 52.86 50.28 1zkh s ASN 10 Cb -0.22 -2.58 0.22 0.00 -0.02 0.00 0.00 41.25 38.66 1zkh s ASN 10 CO 0.33 -1.98 0.52 0.23 -2.57 0.00 0.00 177.10 173.64 1zkh n MET 11 N 8.54 1.08 0.03 -0.60 2.81 -1.21 -4.81 117.12 122.96 1zkh n MET 11 Ca 0.43 -3.64 -0.20 0.00 -1.81 0.00 0.00 57.70 52.48 1zkh n MET 11 Cb 0.47 -1.64 -0.14 0.00 -0.71 0.00 0.00 33.22 31.20 1zkh n MET 11 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1zkh h GLN 12 N 4.55 0.25 -0.09 0.03 7.50 -1.80 -3.36 115.11 122.20 1zkh h GLN 12 Ca 0.15 -0.44 0.00 0.00 0.50 0.00 0.00 58.65 58.87 1zkh h GLN 12 Cb 0.83 0.16 0.00 0.00 0.05 0.00 0.00 27.48 28.52 1zkh h GLN 12 CO 0.54 1.21 0.00 -0.25 -1.50 0.00 0.00 178.83 178.83 1zkh n ASP 13 N -4.16 1.98 -0.17 1.46 9.92 -1.26 -4.49 116.55 119.84 1zkh n ASP 13 Ca -0.15 -1.56 0.12 0.00 -0.53 0.00 0.00 54.79 52.67 1zkh n ASP 13 Cb 0.79 -0.06 0.29 0.00 -0.64 0.00 0.00 41.12 41.51 1zkh n ASP 13 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1zkh n LYS 14 N 0.32 0.54 -2.88 -1.24 4.76 -1.26 -4.96 118.16 113.45 1zkh n LYS 14 Ca 0.06 -0.34 -0.02 0.00 -2.87 0.00 0.00 58.31 55.14 1zkh n LYS 14 Cb 0.25 -1.49 0.01 0.00 -1.84 0.00 0.00 35.03 31.96 1zkh n LYS 14 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 1zkh n THR 15 N -0.94 0.00 -0.01 -0.18 5.66 -1.26 -5.04 114.28 112.51 1zkh n THR 15 Ca 0.09 -0.39 0.07 0.00 -3.05 0.00 0.00 64.05 60.78 1zkh n THR 15 Cb 0.35 0.50 0.17 0.00 -1.55 0.00 0.00 70.33 69.79 1zkh n THR 15 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1zkh n GLU 16 N -0.42 2.36 -2.28 1.09 0.28 -1.26 -4.85 120.64 115.55 1zkh n GLU 16 Ca -0.02 -2.01 -0.27 0.00 -0.16 0.00 0.00 57.16 54.70 1zkh n GLU 16 Cb 0.36 -1.34 0.04 0.00 1.43 0.00 0.00 31.44 31.93 1zkh n GLU 16 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1zkh s TRP 17 N -1.06 3.19 -0.23 -1.84 0.51 -1.26 -4.95 118.94 113.30 1zkh s TRP 17 Ca 0.27 0.65 0.00 0.00 -2.12 0.00 0.00 56.10 54.90 1zkh s TRP 17 Cb 0.15 -2.89 0.01 0.00 -0.81 0.00 0.00 33.47 29.94 1zkh s TRP 17 CO 0.20 -1.01 0.91 0.36 -0.51 0.00 0.00 176.95 176.90 1zkh n LYS 18 N -2.72 1.04 -2.76 4.98 -0.00 -1.26 -4.86 118.16 112.58 1zkh n LYS 18 Ca 0.06 -0.06 -0.42 0.00 -0.00 0.00 0.00 58.31 57.88 1zkh n LYS 18 Cb 0.58 -1.14 -0.03 0.00 -0.00 0.00 0.00 35.03 34.45 1zkh n LYS 18 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1zkh s LEU 19 N -0.06 4.19 -0.01 -5.58 1.43 -1.26 -4.87 118.68 112.51 1zkh s LEU 19 Ca 0.01 1.36 0.01 0.00 -1.03 0.00 0.00 54.13 54.48 1zkh s LEU 19 Cb 0.01 -3.43 0.02 0.00 0.03 0.00 0.00 46.19 42.82 1zkh s LEU 19 CO 0.00 -0.47 0.80 0.59 0.23 0.00 0.00 176.35 177.50 1zkh n ASN 20 N 5.36 0.23 -0.02 2.29 3.02 -1.19 -2.53 115.26 122.43 1zkh n ASN 20 Ca 0.08 -1.64 -0.00 0.00 -0.03 0.00 0.00 54.58 52.99 1zkh n ASN 20 Cb 0.48 -0.12 -0.00 0.00 -0.61 0.00 0.00 39.78 39.53 1zkh n ASN 20 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zkh n GLY 21 N -0.10 0.46 3.96 7.41 0.00 -0.51 -4.71 105.19 111.70 1zkh n GLY 21 Ca 0.01 -0.43 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 1zkh n GLY 21 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1zkh s GLN 22 N -0.85 1.45 -0.13 1.61 0.00 -1.22 -4.80 119.66 115.71 1zkh s GLN 22 Ca 0.00 -0.76 0.02 0.00 -0.00 0.00 0.00 55.36 54.63 1zkh s GLN 22 Cb 0.00 -2.16 0.01 0.00 0.00 0.00 0.00 33.01 30.86 1zkh s GLN 22 CO 0.00 -1.70 -0.21 0.08 0.00 0.00 0.00 175.29 173.46 1zkh s VAL 23 N -3.38 1.97 0.14 3.63 1.01 -1.26 -0.45 120.40 122.06 1zkh s VAL 23 Ca 0.68 -0.92 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 1zkh s VAL 23 Cb -0.06 -1.75 -0.07 0.00 0.00 0.00 0.00 36.38 34.50 1zkh s VAL 23 CO 0.47 0.53 0.67 -0.76 0.00 0.00 0.00 175.10 176.01 1zkh s LEU 24 N 0.84 4.48 -0.23 3.92 1.43 0.16 -4.90 118.68 124.39 1zkh s LEU 24 Ca -0.07 1.40 -0.01 0.00 -1.03 0.00 0.00 54.13 54.42 1zkh s LEU 24 Cb -0.15 -3.22 0.07 0.00 0.03 0.00 0.00 46.19 42.91 1zkh s LEU 24 CO -0.02 0.18 0.00 -0.69 0.23 0.00 0.00 176.35 176.05 1zkh s VAL 25 N -1.26 1.04 0.31 -1.59 1.01 -1.26 -0.15 120.40 118.50 1zkh s VAL 25 Ca 0.35 -0.99 0.10 0.00 0.00 0.00 0.00 61.98 61.44 1zkh s VAL 25 Cb -0.19 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 1zkh s VAL 25 CO 0.22 -0.23 -0.04 -0.36 0.00 0.00 0.00 175.10 174.69 1zkh s PHE 26 N 1.61 2.51 -0.14 5.22 0.40 0.71 -4.98 117.98 123.31 1zkh s PHE 26 Ca -0.02 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 55.93 1zkh s PHE 26 Cb -0.18 -1.32 0.03 0.00 0.51 0.00 0.00 43.02 42.05 1zkh s PHE 26 CO -0.09 0.56 -0.11 0.99 0.70 0.00 0.00 175.22 177.27 1zkh s THR 27 N -2.49 1.35 0.06 0.64 2.01 -1.26 -0.19 115.64 115.75 1zkh s THR 27 Ca 0.33 -0.54 0.03 0.00 0.31 0.00 0.00 61.69 61.82 1zkh s THR 27 Cb -0.02 -1.33 -0.03 0.00 0.01 0.00 0.00 72.50 71.13 1zkh s THR 27 CO 0.18 0.38 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.64 1zkh s LEU 28 N 1.57 2.30 0.70 4.42 1.43 -0.56 -4.89 118.68 123.64 1zkh s LEU 28 Ca 0.04 -0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 52.37 1zkh s LEU 28 Cb -0.13 -0.22 0.02 0.00 0.03 0.00 0.00 46.19 45.89 1zkh s LEU 28 CO -0.09 -0.21 1.15 -2.16 0.23 0.00 0.00 176.35 175.27 1zkh s PRO 29 N -1.93 2.46 0.00 1.29 0.04 -1.26 -0.46 135.00 135.15 1zkh s PRO 29 Ca -0.05 1.56 0.08 0.00 0.04 0.00 0.00 61.00 62.63 1zkh s PRO 29 Cb -0.08 -1.89 0.41 0.00 0.04 0.00 0.00 34.50 32.98 1zkh s PRO 29 CO 0.00 -1.55 1.18 -0.11 0.04 0.00 0.00 177.00 176.56 1zkh n LEU 30 N -2.59 0.00 0.14 -3.56 7.94 -1.26 -1.91 117.00 115.76 1zkh n LEU 30 Ca 0.12 0.34 0.12 0.00 -1.11 0.00 0.00 56.01 55.48 1zkh n LEU 30 Cb 0.51 -0.34 0.23 0.00 0.53 0.00 0.00 43.42 44.35 1zkh n LEU 30 CO 0.48 -0.24 0.65 0.71 -1.11 0.00 0.00 177.39 177.87 1zkh h THR 31 N 0.00 0.00 -2.81 1.96 1.35 -1.97 -2.48 112.91 108.96 1zkh h THR 31 Ca 0.00 -0.73 -0.23 0.00 -0.55 0.00 0.00 66.41 64.90 1zkh h THR 31 Cb 0.10 1.59 0.10 0.00 -1.73 0.00 0.00 68.15 68.21 1zkh h THR 31 CO 0.00 0.00 0.16 0.47 -0.25 0.00 0.00 175.52 175.90 1zkh n ASP 32 N -2.58 -0.65 -4.01 5.36 9.92 -0.80 -4.90 116.55 118.88 1zkh n ASP 32 Ca 0.04 -1.10 -0.12 0.00 -0.53 0.00 0.00 54.79 53.08 1zkh n ASP 32 Cb 0.48 -0.56 -0.08 0.00 -0.64 0.00 0.00 41.12 40.32 1zkh n ASP 32 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1zkh s GLN 33 N -4.51 1.39 0.49 -1.24 0.00 -1.26 -2.03 119.66 112.49 1zkh s GLN 33 Ca 0.41 -1.58 0.20 0.00 -0.00 0.00 0.00 55.36 54.39 1zkh s GLN 33 Cb -0.02 0.34 1.25 0.00 0.00 0.00 0.00 33.01 34.57 1zkh s GLN 33 CO 0.30 -0.50 2.05 0.28 0.00 0.00 0.00 175.29 177.42 1zkh h VAL 34 N 2.45 0.88 -0.69 3.63 2.07 -1.72 -0.88 116.25 121.99 1zkh h VAL 34 Ca -0.32 -0.50 0.18 0.00 0.82 0.00 0.00 66.70 66.88 1zkh h VAL 34 Cb 1.25 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.27 1zkh h VAL 34 CO 0.46 0.13 0.48 0.28 0.02 0.00 0.00 177.57 178.95 1zkh h SER 35 N 0.00 0.13 1.09 0.57 0.02 -1.73 0.14 113.55 113.77 1zkh h SER 35 Ca -0.00 0.01 -0.16 0.00 -0.84 0.00 0.00 61.79 60.80 1zkh h SER 35 Cb 0.27 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 1zkh h SER 35 CO 0.02 0.06 -0.77 0.58 -1.14 0.00 0.00 176.83 175.58 1zkh h VAL 36 N 0.13 1.38 -0.06 2.27 2.07 -1.52 -2.92 116.25 117.61 1zkh h VAL 36 Ca 0.33 -2.79 -0.08 0.00 0.82 0.00 0.00 66.70 64.98 1zkh h VAL 36 Cb 1.13 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 33.49 1zkh h VAL 36 CO -0.05 0.75 -0.28 0.40 0.02 0.00 0.00 177.57 178.42 1zkh h ILE 37 N 0.00 1.44 -0.79 4.57 1.08 -0.80 -2.40 117.51 120.61 1zkh h ILE 37 Ca -0.01 -1.72 0.00 0.00 -0.39 0.00 0.00 64.86 62.75 1zkh h ILE 37 Cb 1.52 2.39 -0.04 0.00 -3.07 0.00 0.00 36.82 37.62 1zkh h ILE 37 CO 0.10 0.49 0.50 0.07 -0.69 0.00 0.00 178.15 178.62 1zkh h LYS 38 N -0.24 1.05 -0.36 2.37 2.10 -1.25 -1.92 116.57 118.31 1zkh h LYS 38 Ca -0.02 -0.08 -0.15 0.00 -2.00 0.00 0.00 60.65 58.40 1zkh h LYS 38 Cb 0.93 -0.23 -0.01 0.00 -0.90 0.00 0.00 32.23 32.03 1zkh h LYS 38 CO 0.06 0.72 -0.37 -0.24 -2.00 0.00 0.00 179.45 177.62 1zkh h VAL 39 N 1.07 1.28 -0.60 0.07 3.04 -1.57 -0.30 116.25 119.25 1zkh h VAL 39 Ca 0.29 -1.54 -0.07 0.00 -1.01 0.00 0.00 66.70 64.36 1zkh h VAL 39 Cb -0.09 1.43 -0.02 0.00 -2.01 0.00 0.00 31.29 30.60 1zkh h VAL 39 CO -0.06 0.51 0.09 0.07 -1.01 0.00 0.00 177.57 177.17 1zkh h LYS 40 N 0.70 0.97 -0.24 4.17 2.10 -1.24 -1.46 116.57 121.57 1zkh h LYS 40 Ca 0.06 -0.25 -0.10 0.00 -2.00 0.00 0.00 60.65 58.36 1zkh h LYS 40 Cb 0.96 -0.12 -0.00 0.00 -0.90 0.00 0.00 32.23 32.17 1zkh h LYS 40 CO 0.09 0.91 -0.25 0.82 -2.00 0.00 0.00 179.45 179.02 1zkh h ILE 41 N 0.92 1.32 -0.54 0.07 2.04 -1.26 -0.21 117.51 119.84 1zkh h ILE 41 Ca 0.18 -1.41 0.07 0.00 1.00 0.00 0.00 64.86 64.70 1zkh h ILE 41 Cb 0.42 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 1zkh h ILE 41 CO 0.01 0.44 0.36 -0.74 0.00 0.00 0.00 178.15 178.22 1zkh h HIS 42 N 0.29 0.46 0.00 1.37 2.76 -0.76 0.37 115.15 119.65 1zkh h HIS 42 Ca 0.04 0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.06 1zkh h HIS 42 Cb 0.80 -0.15 -0.03 0.00 1.55 0.00 0.00 27.41 29.58 1zkh h HIS 42 CO 0.08 0.24 -1.42 0.39 -1.30 0.00 0.00 177.93 175.92 1zkh n GLU 43 N -4.47 0.62 0.13 5.26 1.02 -0.58 -1.45 120.64 121.17 1zkh n GLU 43 Ca 0.08 0.21 -0.24 0.00 -0.02 0.00 0.00 57.16 57.18 1zkh n GLU 43 Cb 0.27 -1.80 -0.16 0.00 -0.02 0.00 0.00 31.44 29.74 1zkh n GLU 43 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1zkh h ALA 44 N 1.46 -0.06 0.00 0.62 0.00 -0.17 -3.40 119.26 117.70 1zkh h ALA 44 Ca -0.16 -0.94 -0.36 0.00 0.00 0.00 0.00 54.91 53.45 1zkh h ALA 44 Cb 1.56 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 19.53 1zkh h ALA 44 CO 0.04 0.80 -2.22 0.25 0.00 0.00 0.00 179.25 178.12 1zkh n THR 45 N -3.67 1.21 0.00 0.00 -2.24 0.12 -4.69 114.28 105.01 1zkh n THR 45 Ca -0.18 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 1zkh n THR 45 Cb 1.09 -1.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 1zkh n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zkh n GLY 46 N 1.81 1.21 3.63 3.38 0.00 -0.53 -4.14 105.19 110.55 1zkh n GLY 46 Ca -0.42 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 1zkh n GLY 46 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1zkh s MET 47 N 0.00 4.13 0.76 1.61 0.23 -1.24 -4.91 119.30 119.88 1zkh s MET 47 Ca 0.00 0.75 -0.12 0.00 -1.03 0.00 0.00 55.69 55.30 1zkh s MET 47 Cb 0.00 -3.65 0.05 0.00 -1.53 0.00 0.00 34.83 29.70 1zkh s MET 47 CO 0.00 -0.49 1.10 -1.25 -2.03 0.00 0.00 175.02 172.35 1zkh s PRO 48 N 2.72 2.27 0.00 3.16 0.04 -1.26 -3.42 135.00 138.51 1zkh s PRO 48 Ca 0.31 1.26 0.09 0.00 0.04 0.00 0.00 61.00 62.70 1zkh s PRO 48 Cb -0.15 -1.89 0.39 0.00 0.04 0.00 0.00 34.50 32.88 1zkh s PRO 48 CO 0.08 -1.64 1.27 0.00 0.04 0.00 0.00 177.00 176.75 1zkh n ALA 49 N -3.32 1.43 0.28 8.56 0.00 -1.26 -2.30 120.51 123.90 1zkh n ALA 49 Ca 0.10 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.62 1zkh n ALA 49 Cb 0.53 -1.14 0.77 0.00 0.00 0.00 0.00 19.45 19.61 1zkh n ALA 49 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1zkh h GLY 50 N 1.51 0.00 0.00 0.00 0.00 -1.99 -3.15 103.07 99.44 1zkh h GLY 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1zkh h GLY 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 1zkh n LYS 51 N -4.12 0.42 -3.42 4.80 4.01 -1.03 -4.96 118.16 113.87 1zkh n LYS 51 Ca -0.03 -0.15 -0.41 0.00 -0.51 0.00 0.00 58.31 57.21 1zkh n LYS 51 Cb 0.11 -0.58 -0.09 0.00 -0.51 0.00 0.00 35.03 33.95 1zkh n LYS 51 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 1zkh s GLN 52 N -0.10 3.47 -0.04 1.97 -0.44 -0.97 0.72 119.66 124.26 1zkh s GLN 52 Ca 0.00 -0.52 -0.01 0.00 -2.50 0.00 0.00 55.36 52.33 1zkh s GLN 52 Cb 0.00 -3.83 -0.04 0.00 -1.64 0.00 0.00 33.01 27.50 1zkh s GLN 52 CO 0.00 -0.56 0.02 0.15 0.50 0.00 0.00 175.29 175.40 1zkh s LYS 53 N 1.97 2.94 -0.17 1.67 -0.14 0.74 -4.69 119.74 122.07 1zkh s LYS 53 Ca 0.11 -0.49 0.01 0.00 -1.36 0.00 0.00 55.97 54.24 1zkh s LYS 53 Cb -0.17 -2.77 0.02 0.00 -1.68 0.00 0.00 37.83 33.22 1zkh s LYS 53 CO 0.12 0.67 -0.20 -0.51 -0.76 0.00 0.00 175.35 174.66 1zkh s LEU 54 N -1.29 2.10 -0.25 3.17 1.43 -1.26 -1.07 118.68 121.52 1zkh s LEU 54 Ca 0.17 -0.63 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 1zkh s LEU 54 Cb -0.12 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.66 1zkh s LEU 54 CO 0.07 0.02 -0.02 -1.58 0.23 0.00 0.00 176.35 175.08 1zkh s GLN 55 N 1.16 3.18 -0.37 1.70 0.74 0.37 -0.50 119.66 125.94 1zkh s GLN 55 Ca 0.02 -0.77 -0.10 0.00 0.05 0.00 0.00 55.36 54.56 1zkh s GLN 55 Cb -0.14 -3.10 0.03 0.00 1.10 0.00 0.00 33.01 30.91 1zkh s GLN 55 CO -0.10 -0.31 0.20 -0.47 -0.55 0.00 0.00 175.29 174.06 1zkh s TYR 56 N 1.45 3.25 -1.51 1.67 5.04 0.96 0.62 117.35 128.82 1zkh s TYR 56 Ca 0.04 -1.07 -0.01 0.00 -2.44 0.00 0.00 57.07 53.59 1zkh s TYR 56 Cb -0.16 -2.45 0.00 0.00 0.35 0.00 0.00 41.96 39.70 1zkh s TYR 56 CO -0.02 -0.68 0.06 0.39 -1.34 0.00 0.00 175.55 173.97 1zkh n GLU 57 N 4.97 -2.18 -0.09 4.97 -0.58 -1.23 -1.13 120.64 125.37 1zkh n GLU 57 Ca -0.12 0.85 0.00 0.00 -0.42 0.00 0.00 57.16 57.48 1zkh n GLU 57 Cb 0.46 -5.52 0.00 0.00 -0.57 0.00 0.00 31.44 25.81 1zkh n GLU 57 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zkh n GLY 58 N -0.99 0.85 3.30 0.62 0.00 -1.26 -5.06 105.19 102.65 1zkh n GLY 58 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 1zkh n GLY 58 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zkh s ILE 59 N -2.05 3.53 -0.92 -0.61 1.01 -0.28 -5.03 121.20 116.85 1zkh s ILE 59 Ca 0.00 -0.71 -0.24 0.00 0.00 0.00 0.00 60.65 59.70 1zkh s ILE 59 Cb 0.00 -2.76 -0.02 0.00 0.01 0.00 0.00 42.46 39.70 1zkh s ILE 59 CO 0.00 0.21 1.80 -0.36 0.00 0.00 0.00 174.94 176.59 1zkh s PHE 60 N 1.45 2.00 0.63 3.97 0.08 -1.26 -0.03 117.98 124.83 1zkh s PHE 60 Ca 0.03 0.23 -0.12 0.00 0.12 0.00 0.00 56.93 57.19 1zkh s PHE 60 Cb -0.16 -4.23 -0.03 0.00 -0.57 0.00 0.00 43.02 38.03 1zkh s PHE 60 CO -0.01 -1.82 1.04 0.96 -0.10 0.00 0.00 175.22 175.29 1zkh s ILE 61 N 8.61 4.26 0.27 0.64 -4.36 0.35 -4.97 121.20 125.99 1zkh s ILE 61 Ca 0.63 0.83 0.11 0.00 -0.26 0.00 0.00 60.65 61.97 1zkh s ILE 61 Cb -0.05 -3.58 -0.05 0.00 1.25 0.00 0.00 42.46 40.03 1zkh s ILE 61 CO -0.02 -0.86 -0.17 -1.59 0.24 0.00 0.00 174.94 172.54 1zkh s LYS 62 N -4.79 1.78 0.00 0.37 -2.85 -1.26 -4.35 119.74 108.64 1zkh s LYS 62 Ca 0.58 -1.68 0.20 0.00 -1.00 0.00 0.00 55.97 54.07 1zkh s LYS 62 Cb -0.13 -1.85 1.10 0.00 -2.06 0.00 0.00 37.83 34.89 1zkh s LYS 62 CO 0.48 0.35 1.60 -0.40 0.10 0.00 0.00 175.35 177.48 1zkh n ASP 63 N -0.57 0.00 -0.50 0.03 5.75 -1.26 -1.87 116.55 118.13 1zkh n ASP 63 Ca -0.06 -0.33 0.14 0.00 -0.01 0.00 0.00 54.79 54.52 1zkh n ASP 63 Cb 0.59 -0.13 0.44 0.00 -1.03 0.00 0.00 41.12 40.99 1zkh n ASP 63 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1zkh n SER 64 N -1.13 1.61 -3.54 -1.12 3.41 -1.26 -3.87 113.62 107.71 1zkh n SER 64 Ca 0.12 -1.47 -0.15 0.00 -0.26 0.00 0.00 58.87 57.11 1zkh n SER 64 Cb 0.11 0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1zkh n SER 64 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1zkh n ASN 65 N 0.18 2.17 -3.73 4.04 3.02 -0.78 -5.06 115.26 115.10 1zkh n ASN 65 Ca 0.17 -2.09 -0.19 0.00 -0.03 0.00 0.00 54.58 52.44 1zkh n ASN 65 Cb 0.38 0.03 -0.09 0.00 -0.61 0.00 0.00 39.78 39.50 1zkh n ASN 65 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1zkh s SER 66 N -2.72 1.55 0.02 6.41 1.04 -1.26 -2.32 113.70 116.42 1zkh s SER 66 Ca 0.13 -1.65 -0.20 0.00 0.48 0.00 0.00 55.95 54.71 1zkh s SER 66 Cb -0.01 0.48 -0.17 0.00 0.10 0.00 0.00 66.02 66.42 1zkh s SER 66 CO 0.08 -0.97 1.25 -0.07 0.98 0.00 0.00 173.24 174.51 1zkh h LEU 67 N 2.18 0.42 -1.70 2.42 3.38 -1.62 -2.87 115.31 117.53 1zkh h LEU 67 Ca -0.30 -0.58 0.04 0.00 0.09 0.00 0.00 57.88 57.13 1zkh h LEU 67 Cb 1.24 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 1zkh h LEU 67 CO 0.45 0.93 0.28 0.00 0.09 0.00 0.00 178.44 180.19 1zkh h ALA 68 N 0.50 1.91 -0.17 1.53 0.00 -1.62 0.30 119.26 121.70 1zkh h ALA 68 Ca -0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1zkh h ALA 68 Cb 0.88 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1zkh h ALA 68 CO 0.06 0.03 0.08 -0.92 0.00 0.00 0.00 179.25 178.49 1zkh h TYR 69 N 0.38 0.15 -0.07 0.00 3.20 -1.82 -2.34 116.97 116.47 1zkh h TYR 69 Ca 0.18 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1zkh h TYR 69 Cb 0.22 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1zkh h TYR 69 CO -0.00 0.09 0.00 0.66 -1.64 0.00 0.00 178.16 177.26 1zkh n TYR 70 N -5.02 0.08 -3.44 -3.82 4.01 -0.93 -4.92 117.16 103.12 1zkh n TYR 70 Ca -0.03 -0.04 -0.19 0.00 -0.16 0.00 0.00 57.90 57.48 1zkh n TYR 70 Cb 0.05 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.16 1zkh n TYR 70 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1zkh n ASN 71 N 0.13 -3.77 -4.57 7.72 5.03 -0.29 -4.87 115.26 114.64 1zkh n ASN 71 Ca 0.18 -0.56 -0.28 0.00 0.87 0.00 0.00 54.58 54.79 1zkh n ASN 71 Cb 0.32 -4.88 -0.05 0.00 -1.02 0.00 0.00 39.78 34.15 1zkh n ASN 71 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1zkh s MET 72 N -5.70 2.62 0.26 3.52 -1.94 -0.06 -4.94 119.30 113.06 1zkh s MET 72 Ca 0.23 -0.73 -0.04 0.00 -1.71 0.00 0.00 55.69 53.44 1zkh s MET 72 Cb -0.10 -5.16 0.06 0.00 2.01 0.00 0.00 34.83 31.64 1zkh s MET 72 CO 0.70 -3.54 0.28 0.00 -0.01 0.00 0.00 175.02 172.45 1zkh n ALA 73 N 13.76 -0.61 -1.74 3.03 0.00 -1.26 -4.84 120.51 128.84 1zkh n ALA 73 Ca 0.42 -0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.04 1zkh n ALA 73 Cb 0.47 -0.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.87 1zkh n ALA 73 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1zkh s ASN 74 N -2.18 6.03 0.00 0.00 2.47 -1.26 -2.77 114.94 117.23 1zkh s ASN 74 Ca 0.17 2.13 0.00 0.00 0.42 0.00 0.00 52.86 55.59 1zkh s ASN 74 Cb -0.01 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.27 1zkh s ASN 74 CO 0.13 -1.46 0.00 0.61 -3.72 0.00 0.00 177.10 172.65 1zkh n GLY 75 N 5.06 1.05 3.62 1.21 0.00 0.13 -4.85 105.19 111.41 1zkh n GLY 75 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1zkh n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zkh s ALA 76 N -2.00 3.40 -0.53 4.61 0.00 -0.75 -4.95 121.76 121.55 1zkh s ALA 76 Ca 0.00 -0.23 -0.18 0.00 0.00 0.00 0.00 51.96 51.55 1zkh s ALA 76 Cb 0.00 -3.69 0.09 0.00 0.00 0.00 0.00 23.12 19.51 1zkh s ALA 76 CO 0.00 -1.68 0.57 0.08 0.00 0.00 0.00 175.76 174.73 1zkh s VAL 77 N 3.79 5.00 0.16 0.00 1.01 -1.26 -0.36 120.40 128.74 1zkh s VAL 77 Ca 0.44 -0.94 -0.06 0.00 0.00 0.00 0.00 61.98 61.43 1zkh s VAL 77 Cb -0.11 -4.32 -0.06 0.00 0.00 0.00 0.00 36.38 31.90 1zkh s VAL 77 CO 0.20 -0.85 0.41 -0.63 0.00 0.00 0.00 175.10 174.23 1zkh s ILE 78 N 2.23 5.11 -0.19 2.22 -1.09 0.10 -3.51 121.20 126.07 1zkh s ILE 78 Ca 0.09 0.15 -0.00 0.00 -2.23 0.00 0.00 60.65 58.66 1zkh s ILE 78 Cb -0.24 -3.62 0.01 0.00 -1.58 0.00 0.00 42.46 37.03 1zkh s ILE 78 CO 0.08 0.03 -0.15 -1.00 -1.23 0.00 0.00 174.94 172.67 1zkh s HIS 79 N -1.67 2.85 -0.01 3.97 3.76 0.20 0.51 115.29 124.90 1zkh s HIS 79 Ca 0.42 -1.47 -0.25 0.00 -0.15 0.00 0.00 55.06 53.60 1zkh s HIS 79 Cb -0.12 -1.97 -0.04 0.00 1.11 0.00 0.00 32.58 31.55 1zkh s HIS 79 CO 0.23 -0.74 0.78 -1.17 -0.85 0.00 0.00 174.74 173.00 1zkh s LEU 80 N 1.34 4.38 -0.07 0.89 2.96 0.13 -0.47 118.68 127.83 1zkh s LEU 80 Ca 0.05 1.39 -0.12 0.00 -0.22 0.00 0.00 54.13 55.23 1zkh s LEU 80 Cb -0.14 -3.24 0.03 0.00 0.50 0.00 0.00 46.19 43.34 1zkh s LEU 80 CO -0.10 -0.09 0.30 0.00 -1.32 0.00 0.00 176.35 175.14 1zkh s ALA 81 N 0.49 -0.75 0.37 5.97 0.00 -0.23 -3.78 121.76 123.84 1zkh s ALA 81 Ca 0.41 0.61 -0.25 0.00 0.00 0.00 0.00 51.96 52.72 1zkh s ALA 81 Cb -0.20 -0.25 -0.09 0.00 0.00 0.00 0.00 23.12 22.58 1zkh s ALA 81 CO 0.22 -0.19 1.05 -1.17 0.00 0.00 0.00 175.76 175.67 1zkh s LEU 82 N -0.49 4.24 0.20 0.00 2.96 -1.26 -0.18 118.68 124.14 1zkh s LEU 82 Ca -0.06 2.08 -0.18 0.00 -0.22 0.00 0.00 54.13 55.74 1zkh s LEU 82 Cb -0.04 -4.06 0.17 0.00 0.50 0.00 0.00 46.19 42.77 1zkh s LEU 82 CO 0.02 -0.40 1.59 0.50 -1.32 0.00 0.00 176.35 176.74 1zkh h LYS 83 N 2.82 -0.11 -1.70 1.98 1.63 -0.07 -3.44 116.57 117.68 1zkh h LYS 83 Ca -0.48 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.36 1zkh h LYS 83 Cb 1.21 0.02 -0.23 0.00 -0.60 0.00 0.00 32.23 32.64 1zkh h LYS 83 CO 0.63 -0.07 0.42 -2.00 -3.45 0.00 0.00 179.45 174.98 1zkh s GLU 84 N -6.06 0.70 -0.68 1.90 2.56 -1.26 -5.08 118.70 110.79 1zkh s GLU 84 Ca -0.14 0.32 -0.27 0.00 0.00 0.00 0.00 54.97 54.87 1zkh s GLU 84 Cb 0.17 0.33 0.02 0.00 2.00 0.00 0.00 34.13 36.66 1zkh s GLU 84 CO 0.71 -0.19 1.39 -0.98 -0.56 0.00 0.00 175.26 175.63 1zkh s ARG 85 N -0.77 3.14 0.00 4.30 1.70 -1.26 -5.16 118.95 120.90 1zkh s ARG 85 Ca -0.03 0.05 0.00 0.00 -0.47 0.00 0.00 55.73 55.28 1zkh s ARG 85 Cb -0.02 -4.19 0.00 0.00 -0.57 0.00 0.00 34.95 30.17 1zkh s ARG 85 CO 0.02 -2.18 0.00 0.41 -1.08 0.00 0.00 175.30 172.47