#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 1.99 -0.35 0.52 -7.23 0.29 -4.89 120.40 110.73 1zkh s VAL 2 Ca 0.00 -1.81 -0.22 0.00 -1.81 0.00 0.00 61.98 58.14 1zkh s VAL 2 Cb 0.00 -1.85 0.00 0.00 0.56 0.00 0.00 36.38 35.09 1zkh s VAL 2 CO 0.00 -0.13 0.72 -0.94 -0.31 0.00 0.00 175.10 174.44 1zkh s SER 3 N -2.36 6.52 -0.07 4.85 1.04 -1.26 -1.41 113.70 121.00 1zkh s SER 3 Ca 0.14 0.32 0.03 0.00 0.48 0.00 0.00 55.95 56.92 1zkh s SER 3 Cb -0.08 -2.37 -0.02 0.00 0.10 0.00 0.00 66.02 63.65 1zkh s SER 3 CO 0.07 -0.65 -0.15 0.27 0.98 0.00 0.00 173.24 173.75 1zkh s ILE 4 N 2.91 2.94 0.08 -1.02 -4.36 0.84 -0.60 121.20 121.99 1zkh s ILE 4 Ca 0.29 -0.75 0.09 0.00 -0.26 0.00 0.00 60.65 60.02 1zkh s ILE 4 Cb -0.14 -2.17 -0.04 0.00 1.25 0.00 0.00 42.46 41.37 1zkh s ILE 4 CO 0.15 0.57 -0.24 -0.54 0.24 0.00 0.00 174.94 175.13 1zkh s LYS 5 N -0.34 1.72 -0.28 0.37 1.02 0.86 -0.12 119.74 122.96 1zkh s LYS 5 Ca 0.03 -1.18 0.01 0.00 0.02 0.00 0.00 55.97 54.85 1zkh s LYS 5 Cb -0.13 -2.02 0.08 0.00 -0.52 0.00 0.00 37.83 35.25 1zkh s LYS 5 CO 0.02 0.49 0.00 0.08 -0.92 0.00 0.00 175.35 175.03 1zkh s VAL 6 N -0.97 1.60 -0.51 3.17 1.01 0.12 0.10 120.40 124.92 1zkh s VAL 6 Ca 0.14 -1.56 -0.27 0.00 0.00 0.00 0.00 61.98 60.29 1zkh s VAL 6 Cb -0.10 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 1zkh s VAL 6 CO 0.05 -0.35 1.72 -1.58 0.00 0.00 0.00 175.10 174.95 1zkh s GLN 7 N 1.31 3.03 -0.03 2.72 -0.44 0.17 -0.38 119.66 126.04 1zkh s GLN 7 Ca 0.02 0.84 -0.30 0.00 -2.50 0.00 0.00 55.36 53.41 1zkh s GLN 7 Cb -0.19 -4.26 -0.03 0.00 -1.64 0.00 0.00 33.01 26.89 1zkh s GLN 7 CO -0.11 -2.24 1.14 0.08 0.50 0.00 0.00 175.29 174.66 1zkh s VAL 8 N 7.60 4.38 0.54 1.34 1.01 0.24 -0.16 120.40 135.36 1zkh s VAL 8 Ca 0.67 1.70 -0.21 0.00 0.00 0.00 0.00 61.98 64.14 1zkh s VAL 8 Cb -0.15 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1zkh s VAL 8 CO 0.26 0.04 1.27 -2.16 0.00 0.00 0.00 175.10 174.52 1zkh s PRO 9 N 1.79 3.24 -0.99 2.72 0.04 -1.25 -3.35 135.00 137.20 1zkh s PRO 9 Ca 0.55 2.02 -0.23 0.00 0.04 0.00 0.00 61.00 63.38 1zkh s PRO 9 Cb -0.24 -2.21 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 1zkh s PRO 9 CO 0.24 -1.04 1.76 -0.80 0.04 0.00 0.00 177.00 177.20 1zkh s ASN 10 N -1.21 5.69 -0.42 6.66 -0.87 -1.26 -1.98 114.94 121.56 1zkh s ASN 10 Ca 0.71 -1.14 0.06 0.00 -1.57 0.00 0.00 52.86 50.92 1zkh s ASN 10 Cb -0.35 -2.57 0.21 0.00 -0.02 0.00 0.00 41.25 38.52 1zkh s ASN 10 CO 0.41 -2.26 0.44 0.23 -2.57 0.00 0.00 177.10 173.35 1zkh n MET 11 N 8.79 0.56 0.04 -0.60 2.81 -1.25 -4.78 117.12 122.68 1zkh n MET 11 Ca 0.39 -3.30 -0.19 0.00 -1.81 0.00 0.00 57.70 52.79 1zkh n MET 11 Cb 0.48 -1.51 -0.14 0.00 -0.71 0.00 0.00 33.22 31.34 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 4.85 0.29 -0.03 0.03 7.50 -1.82 -3.36 115.11 122.57 1zkh h GLN 12 Ca 0.18 -0.47 0.00 0.00 0.50 0.00 0.00 58.65 58.85 1zkh h GLN 12 Cb 0.88 0.17 0.00 0.00 0.05 0.00 0.00 27.48 28.58 1zkh h GLN 12 CO 0.44 1.21 0.00 -0.25 -1.50 0.00 0.00 178.83 178.73 1zkh n ASP 13 N -4.17 1.57 -0.27 1.46 9.92 -1.26 -4.59 116.55 119.21 1zkh n ASP 13 Ca -0.13 -1.35 0.13 0.00 -0.53 0.00 0.00 54.79 52.90 1zkh n ASP 13 Cb 0.78 -0.02 0.36 0.00 -0.64 0.00 0.00 41.12 41.60 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 0.17 0.88 -2.32 -1.24 4.76 -1.26 -4.95 118.16 114.19 1zkh n LYS 14 Ca 0.03 -0.54 -0.03 0.00 -2.87 0.00 0.00 58.31 54.91 1zkh n LYS 14 Cb 0.15 -1.49 0.01 0.00 -1.84 0.00 0.00 35.03 31.86 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 -0.59 0.00 1.03 -0.18 5.66 -1.26 -5.04 114.28 113.89 1zkh n THR 15 Ca 0.12 -0.33 0.11 0.00 -3.05 0.00 0.00 64.05 60.90 1zkh n THR 15 Cb 0.36 0.38 0.06 0.00 -1.55 0.00 0.00 70.33 69.57 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 -0.27 1.44 -2.22 1.09 0.28 -1.26 -4.92 120.64 114.78 1zkh n GLU 16 Ca -0.02 -1.16 -0.26 0.00 -0.16 0.00 0.00 57.16 55.56 1zkh n GLU 16 Cb 0.25 -1.48 0.07 0.00 1.43 0.00 0.00 31.44 31.71 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 -2.37 2.91 -0.72 -1.84 0.51 -1.26 -4.94 118.94 111.23 1zkh s TRP 17 Ca 0.21 0.42 0.01 0.00 -2.12 0.00 0.00 56.10 54.62 1zkh s TRP 17 Cb 0.19 -3.17 0.08 0.00 -0.81 0.00 0.00 33.47 29.75 1zkh s TRP 17 CO 0.50 -1.38 0.74 0.36 -0.51 0.00 0.00 176.95 176.66 1zkh n LYS 18 N -2.89 1.35 -2.60 4.98 -0.00 -1.26 -4.87 118.16 112.87 1zkh n LYS 18 Ca 0.08 -0.33 -0.41 0.00 -0.00 0.00 0.00 58.31 57.65 1zkh n LYS 18 Cb 0.60 -1.48 -0.04 0.00 -0.00 0.00 0.00 35.03 34.12 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 -0.30 4.45 0.00 -5.58 1.43 -1.26 -4.87 118.68 112.54 1zkh s LEU 19 Ca 0.06 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 1zkh s LEU 19 Cb 0.05 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.68 1zkh s LEU 19 CO 0.02 -0.22 0.33 0.59 0.23 0.00 0.00 176.35 177.29 1zkh n ASN 20 N 3.06 0.00 0.00 2.29 3.02 -1.20 -2.71 115.26 119.73 1zkh n ASN 20 Ca 0.04 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 1zkh n ASN 20 Cb 0.48 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 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 0.00 0.61 3.96 7.41 0.00 -0.84 -4.64 105.19 111.70 1zkh n GLY 21 Ca 0.00 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.96 1.60 -0.11 1.61 0.00 -1.23 -4.81 119.66 115.77 1zkh s GLN 22 Ca 0.00 -0.76 0.03 0.00 -0.00 0.00 0.00 55.36 54.63 1zkh s GLN 22 Cb 0.00 -2.20 0.01 0.00 0.00 0.00 0.00 33.01 30.82 1zkh s GLN 22 CO 0.00 -1.58 -0.21 0.08 0.00 0.00 0.00 175.29 173.58 1zkh s VAL 23 N -3.31 1.89 0.13 3.63 1.01 -1.26 -0.59 120.40 121.91 1zkh s VAL 23 Ca 0.66 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 61.54 1zkh s VAL 23 Cb -0.06 -1.67 -0.07 0.00 0.00 0.00 0.00 36.38 34.58 1zkh s VAL 23 CO 0.46 0.52 0.63 -0.76 0.00 0.00 0.00 175.10 175.95 1zkh s LEU 24 N 0.62 4.47 -0.23 3.92 1.43 0.49 -4.91 118.68 124.47 1zkh s LEU 24 Ca -0.13 1.32 -0.02 0.00 -1.03 0.00 0.00 54.13 54.28 1zkh s LEU 24 Cb -0.17 -3.16 0.07 0.00 0.03 0.00 0.00 46.19 42.97 1zkh s LEU 24 CO 0.03 0.19 0.04 -0.69 0.23 0.00 0.00 176.35 176.15 1zkh s VAL 25 N -1.26 0.78 0.33 -1.59 1.01 -1.26 0.10 120.40 118.52 1zkh s VAL 25 Ca 0.34 -0.89 0.09 0.00 0.00 0.00 0.00 61.98 61.52 1zkh s VAL 25 Cb -0.19 -1.33 -0.06 0.00 0.00 0.00 0.00 36.38 34.80 1zkh s VAL 25 CO 0.21 -0.31 -0.09 -0.36 0.00 0.00 0.00 175.10 174.54 1zkh s PHE 26 N 1.72 2.32 -0.12 5.22 0.08 0.82 -4.98 117.98 123.04 1zkh s PHE 26 Ca 0.01 -0.53 0.01 0.00 0.12 0.00 0.00 56.93 56.53 1zkh s PHE 26 Cb -0.17 -1.33 0.02 0.00 -0.57 0.00 0.00 43.02 40.97 1zkh s PHE 26 CO -0.12 0.53 -0.12 0.99 -0.10 0.00 0.00 175.22 176.40 1zkh s THR 27 N -2.68 1.37 0.03 0.64 2.01 -1.26 -0.11 115.64 115.64 1zkh s THR 27 Ca 0.32 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 61.81 1zkh s THR 27 Cb 0.03 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.22 1zkh s THR 27 CO 0.16 0.42 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.69 1zkh s LEU 28 N 1.35 2.25 0.63 4.42 1.43 -0.50 -4.89 118.68 123.37 1zkh s LEU 28 Ca 0.00 -0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 52.41 1zkh s LEU 28 Cb -0.14 -0.07 -0.01 0.00 0.03 0.00 0.00 46.19 46.00 1zkh s LEU 28 CO -0.06 -0.23 1.17 -2.16 0.23 0.00 0.00 176.35 175.30 1zkh s PRO 29 N -1.51 2.78 0.00 1.29 0.04 -1.26 -0.55 135.00 135.80 1zkh s PRO 29 Ca -0.12 1.68 0.04 0.00 0.04 0.00 0.00 61.00 62.64 1zkh s PRO 29 Cb -0.10 -1.92 0.19 0.00 0.04 0.00 0.00 34.50 32.71 1zkh s PRO 29 CO -0.00 -1.32 1.06 -0.11 0.04 0.00 0.00 177.00 176.67 1zkh n LEU 30 N -2.02 0.00 0.21 -3.56 7.94 -1.26 -1.38 117.00 116.93 1zkh n LEU 30 Ca 0.13 0.40 0.11 0.00 -1.11 0.00 0.00 56.01 55.54 1zkh n LEU 30 Cb 0.50 -0.40 0.15 0.00 0.53 0.00 0.00 43.42 44.20 1zkh n LEU 30 CO 0.46 -0.35 0.75 0.71 -1.11 0.00 0.00 177.39 177.85 1zkh h THR 31 N 0.00 0.12 -2.92 1.96 1.35 -1.97 -2.49 112.91 108.96 1zkh h THR 31 Ca 0.00 -1.17 -0.26 0.00 -0.55 0.00 0.00 66.41 64.43 1zkh h THR 31 Cb 0.06 2.05 0.12 0.00 -1.73 0.00 0.00 68.15 68.65 1zkh h THR 31 CO 0.00 0.07 0.17 0.47 -0.25 0.00 0.00 175.52 175.98 1zkh n ASP 32 N -3.11 -0.83 -3.67 5.36 9.92 -0.48 -4.88 116.55 118.85 1zkh n ASP 32 Ca 0.04 -1.11 -0.14 0.00 -0.53 0.00 0.00 54.79 53.05 1zkh n ASP 32 Cb 0.56 -0.64 -0.07 0.00 -0.64 0.00 0.00 41.12 40.33 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 -4.70 1.62 0.50 -1.24 0.00 -1.26 -1.86 119.66 112.71 1zkh s GLN 33 Ca 0.46 -1.68 0.15 0.00 -0.00 0.00 0.00 55.36 54.30 1zkh s GLN 33 Cb -0.03 0.38 1.19 0.00 0.00 0.00 0.00 33.01 34.55 1zkh s GLN 33 CO 0.34 -0.62 2.11 0.28 0.00 0.00 0.00 175.29 177.40 1zkh h VAL 34 N 2.28 1.03 -0.94 3.63 2.07 -1.67 -1.43 116.25 121.23 1zkh h VAL 34 Ca -0.29 -0.13 0.20 0.00 0.82 0.00 0.00 66.70 67.30 1zkh h VAL 34 Cb 1.24 1.02 -0.08 0.00 -1.52 0.00 0.00 31.29 31.96 1zkh h VAL 34 CO 0.42 0.04 0.61 0.28 0.02 0.00 0.00 177.57 178.94 1zkh h SER 35 N 0.04 0.49 0.40 0.57 0.02 -1.76 0.20 113.55 113.52 1zkh h SER 35 Ca 0.01 0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 60.87 1zkh h SER 35 Cb 0.06 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1zkh h SER 35 CO 0.00 0.19 -0.61 0.58 -1.14 0.00 0.00 176.83 175.85 1zkh h VAL 36 N 0.49 1.39 0.04 2.27 2.07 -1.64 -2.26 116.25 118.62 1zkh h VAL 36 Ca 0.50 -2.01 -0.00 0.00 0.82 0.00 0.00 66.70 66.01 1zkh h VAL 36 Cb 1.13 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 1zkh h VAL 36 CO -0.23 0.59 -0.02 0.40 0.02 0.00 0.00 177.57 178.33 1zkh h ILE 37 N 0.15 1.33 -0.76 4.57 1.08 -0.73 -2.17 117.51 120.98 1zkh h ILE 37 Ca -0.01 -1.37 0.02 0.00 -0.39 0.00 0.00 64.86 63.11 1zkh h ILE 37 Cb 1.11 2.21 -0.04 0.00 -3.07 0.00 0.00 36.82 37.03 1zkh h ILE 37 CO 0.09 0.34 0.49 0.07 -0.69 0.00 0.00 178.15 178.45 1zkh h LYS 38 N -0.68 0.95 -0.29 2.37 2.10 -1.16 -1.58 116.57 118.28 1zkh h LYS 38 Ca -0.01 -0.06 -0.15 0.00 -2.00 0.00 0.00 60.65 58.44 1zkh h LYS 38 Cb 0.60 -0.21 -0.01 0.00 -0.90 0.00 0.00 32.23 31.71 1zkh h LYS 38 CO 0.01 0.63 -0.42 -0.24 -2.00 0.00 0.00 179.45 177.43 1zkh h VAL 39 N 0.98 1.29 -0.28 0.07 3.04 -1.47 -1.17 116.25 118.71 1zkh h VAL 39 Ca 0.29 -1.60 -0.13 0.00 -1.01 0.00 0.00 66.70 64.25 1zkh h VAL 39 Cb -0.04 1.52 -0.01 0.00 -2.01 0.00 0.00 31.29 30.75 1zkh h VAL 39 CO -0.09 0.51 -0.38 0.07 -1.01 0.00 0.00 177.57 176.67 1zkh h LYS 40 N 0.57 0.65 -0.38 4.17 2.10 -1.05 -1.39 116.57 121.24 1zkh h LYS 40 Ca 0.04 -0.32 -0.13 0.00 -2.00 0.00 0.00 60.65 58.25 1zkh h LYS 40 Cb 0.96 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.28 1zkh h LYS 40 CO 0.09 0.92 -0.26 0.82 -2.00 0.00 0.00 179.45 179.01 1zkh h ILE 41 N 0.54 1.28 -0.37 0.07 2.04 -1.22 -0.39 117.51 119.45 1zkh h ILE 41 Ca 0.05 -1.42 0.04 0.00 1.00 0.00 0.00 64.86 64.53 1zkh h ILE 41 Cb 0.89 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 1zkh h ILE 41 CO 0.08 0.47 0.25 -0.74 0.00 0.00 0.00 178.15 178.21 1zkh h HIS 42 N 0.65 0.35 0.02 1.37 2.76 -0.94 0.35 115.15 119.70 1zkh h HIS 42 Ca 0.07 0.01 -0.26 0.00 -2.20 0.00 0.00 60.37 57.99 1zkh h HIS 42 Cb 0.84 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 29.64 1zkh h HIS 42 CO 0.06 0.20 -1.41 0.93 -1.30 0.00 0.00 177.93 176.41 1zkh h GLU 43 N 0.36 0.04 0.08 5.26 4.39 -1.03 -2.28 114.58 121.40 1zkh h GLU 43 Ca 0.15 -0.06 -0.16 0.00 0.34 0.00 0.00 59.36 59.63 1zkh h GLU 43 Cb 0.17 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1zkh h GLU 43 CO -0.03 0.78 -0.80 0.00 -1.16 0.00 0.00 179.01 177.80 1zkh h ALA 44 N 0.92 0.05 0.03 3.43 0.00 -0.42 -3.40 119.26 119.87 1zkh h ALA 44 Ca -0.17 -0.81 -0.39 0.00 0.00 0.00 0.00 54.91 53.54 1zkh h ALA 44 Cb 1.92 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 19.91 1zkh h ALA 44 CO 0.11 0.43 -2.35 0.25 0.00 0.00 0.00 179.25 177.69 1zkh n THR 45 N -4.25 1.56 0.00 0.00 -2.24 0.12 -4.69 114.28 104.78 1zkh n THR 45 Ca -0.18 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1zkh n THR 45 Cb 0.73 -1.52 0.00 0.00 -2.10 0.00 0.00 70.33 67.43 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 2.14 1.92 3.63 3.38 0.00 -0.86 -4.02 105.19 111.39 1zkh n GLY 46 Ca -0.43 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 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 4.05 0.79 1.61 0.23 -1.25 -4.88 119.30 119.85 1zkh s MET 47 Ca 0.00 0.94 -0.11 0.00 -1.03 0.00 0.00 55.69 55.49 1zkh s MET 47 Cb 0.00 -3.72 0.07 0.00 -1.53 0.00 0.00 34.83 29.64 1zkh s MET 47 CO 0.00 -0.80 1.11 -1.25 -2.03 0.00 0.00 175.02 172.05 1zkh s PRO 48 N 3.38 2.04 0.22 3.16 0.04 -1.26 -3.28 135.00 139.30 1zkh s PRO 48 Ca 0.41 1.32 0.19 0.00 0.04 0.00 0.00 61.00 62.96 1zkh s PRO 48 Cb -0.13 -1.86 0.89 0.00 0.04 0.00 0.00 34.50 33.44 1zkh s PRO 48 CO 0.13 -1.83 1.58 0.00 0.04 0.00 0.00 177.00 176.93 1zkh n ALA 49 N -3.49 1.37 0.08 8.56 0.00 -1.26 -2.09 120.51 123.68 1zkh n ALA 49 Ca 0.10 0.10 0.18 0.00 0.00 0.00 0.00 53.44 53.81 1zkh n ALA 49 Cb 0.52 -1.30 0.70 0.00 0.00 0.00 0.00 19.45 19.38 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 1.25 0.00 0.00 0.00 0.00 -1.98 -3.08 103.07 99.26 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 -4.31 0.42 -3.34 4.80 4.01 -0.99 -4.97 118.16 113.78 1zkh n LYS 51 Ca 0.06 -0.14 -0.40 0.00 -0.51 0.00 0.00 58.31 57.32 1zkh n LYS 51 Cb 0.47 -0.56 -0.09 0.00 -0.51 0.00 0.00 35.03 34.35 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 3.82 -0.10 1.97 -0.44 -0.89 0.40 119.66 124.32 1zkh s GLN 52 Ca 0.00 -0.09 -0.04 0.00 -2.50 0.00 0.00 55.36 52.73 1zkh s GLN 52 Cb 0.00 -3.73 -0.04 0.00 -1.64 0.00 0.00 33.01 27.61 1zkh s GLN 52 CO 0.00 -0.43 0.05 0.15 0.50 0.00 0.00 175.29 175.56 1zkh s LYS 53 N 2.16 3.16 -0.19 1.67 -0.14 0.93 -4.69 119.74 122.64 1zkh s LYS 53 Ca 0.16 -0.30 0.01 0.00 -1.36 0.00 0.00 55.97 54.48 1zkh s LYS 53 Cb -0.16 -2.95 0.02 0.00 -1.68 0.00 0.00 37.83 33.07 1zkh s LYS 53 CO 0.11 0.73 -0.19 -0.51 -0.76 0.00 0.00 175.35 174.73 1zkh s LEU 54 N -0.93 2.27 -0.24 3.17 1.43 -1.26 -1.12 118.68 122.00 1zkh s LEU 54 Ca 0.14 -0.73 -0.03 0.00 -1.03 0.00 0.00 54.13 52.47 1zkh s LEU 54 Cb -0.12 -1.49 0.01 0.00 0.03 0.00 0.00 46.19 44.63 1zkh s LEU 54 CO 0.03 -0.02 -0.04 -1.58 0.23 0.00 0.00 176.35 174.97 1zkh s GLN 55 N 1.27 3.11 -0.41 1.70 0.74 0.10 -0.66 119.66 125.50 1zkh s GLN 55 Ca 0.03 -0.81 -0.13 0.00 0.05 0.00 0.00 55.36 54.51 1zkh s GLN 55 Cb -0.14 -3.04 0.05 0.00 1.10 0.00 0.00 33.01 30.98 1zkh s GLN 55 CO -0.12 -0.32 0.28 -0.47 -0.55 0.00 0.00 175.29 174.12 1zkh s TYR 56 N 1.41 3.26 -1.54 1.67 5.04 0.13 0.71 117.35 128.03 1zkh s TYR 56 Ca 0.03 -0.97 -0.01 0.00 -2.44 0.00 0.00 57.07 53.69 1zkh s TYR 56 Cb -0.16 -2.74 0.00 0.00 0.35 0.00 0.00 41.96 39.42 1zkh s TYR 56 CO -0.03 -0.71 0.06 0.39 -1.34 0.00 0.00 175.55 173.92 1zkh n GLU 57 N 5.07 -2.16 -0.51 4.97 -0.58 -1.18 -1.43 120.64 124.82 1zkh n GLU 57 Ca -0.11 0.87 0.00 0.00 -0.42 0.00 0.00 57.16 57.49 1zkh n GLU 57 Cb 0.45 -5.53 0.00 0.00 -0.57 0.00 0.00 31.44 25.79 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 -1.00 1.00 2.96 0.62 0.00 -1.26 -5.07 105.19 102.44 1zkh n GLY 58 Ca -0.20 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.00 1.40 -0.76 -0.61 1.01 -0.51 -5.07 121.20 114.66 1zkh s ILE 59 Ca 0.00 -0.76 -0.26 0.00 0.00 0.00 0.00 60.65 59.64 1zkh s ILE 59 Cb 0.00 -1.47 -0.02 0.00 0.01 0.00 0.00 42.46 40.98 1zkh s ILE 59 CO 0.00 0.22 1.77 -0.36 0.00 0.00 0.00 174.94 176.57 1zkh s PHE 60 N 1.52 1.87 0.43 3.97 0.08 -1.26 0.19 117.98 124.78 1zkh s PHE 60 Ca 0.01 0.47 -0.20 0.00 0.12 0.00 0.00 56.93 57.33 1zkh s PHE 60 Cb -0.15 -4.21 -0.11 0.00 -0.57 0.00 0.00 43.02 37.99 1zkh s PHE 60 CO -0.08 -2.07 0.94 0.96 -0.10 0.00 0.00 175.22 174.87 1zkh s ILE 61 N 8.55 4.42 0.31 0.64 -4.36 0.17 -4.99 121.20 125.94 1zkh s ILE 61 Ca 0.62 1.44 0.10 0.00 -0.26 0.00 0.00 60.65 62.55 1zkh s ILE 61 Cb -0.09 -3.61 -0.06 0.00 1.25 0.00 0.00 42.46 39.95 1zkh s ILE 61 CO 0.10 -0.35 -0.12 -1.59 0.24 0.00 0.00 174.94 173.23 1zkh s LYS 62 N -3.25 1.83 0.56 0.37 0.00 -1.26 -4.40 119.74 113.59 1zkh s LYS 62 Ca 0.61 -1.81 0.28 0.00 0.00 0.00 0.00 55.97 55.05 1zkh s LYS 62 Cb -0.09 -1.79 1.48 0.00 0.00 0.00 0.00 37.83 37.43 1zkh s LYS 62 CO 0.15 0.23 1.98 0.22 0.00 0.00 0.00 175.35 177.93 1zkh h ASP 63 N 2.09 0.00 0.12 0.03 1.82 -1.98 -0.59 116.42 117.91 1zkh h ASP 63 Ca -0.41 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.23 1zkh h ASP 63 Cb 1.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.26 1zkh h ASP 63 CO 0.65 0.00 0.00 -1.20 -1.61 0.00 0.00 179.24 177.08 1zkh n SER 64 N -4.03 0.00 -4.69 2.28 7.64 -1.26 -4.09 113.62 109.47 1zkh n SER 64 Ca 0.08 -0.39 -0.25 0.00 1.01 0.00 0.00 58.87 59.32 1zkh n SER 64 Cb 0.59 -0.10 -0.08 0.00 -1.01 0.00 0.00 64.21 63.61 1zkh n SER 64 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1zkh s ASN 65 N -2.19 4.25 0.39 6.43 0.01 -0.23 -5.07 114.94 118.52 1zkh s ASN 65 Ca 0.25 -1.12 0.04 0.00 -0.71 0.00 0.00 52.86 51.32 1zkh s ASN 65 Cb 0.13 -0.48 -0.05 0.00 0.41 0.00 0.00 41.25 41.26 1zkh s ASN 65 CO 0.24 -0.45 0.06 -0.94 -1.51 0.00 0.00 177.10 174.50 1zkh s SER 66 N -3.82 3.03 0.11 -1.22 1.04 -1.26 -2.09 113.70 109.49 1zkh s SER 66 Ca 0.38 -1.49 -0.14 0.00 0.48 0.00 0.00 55.95 55.18 1zkh s SER 66 Cb 0.04 0.09 -0.05 0.00 0.10 0.00 0.00 66.02 66.20 1zkh s SER 66 CO 0.21 -0.69 1.49 -0.07 0.98 0.00 0.00 173.24 175.16 1zkh h LEU 67 N 1.85 0.74 -1.57 2.42 3.38 -1.56 -2.55 115.31 118.02 1zkh h LEU 67 Ca -0.41 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.17 1zkh h LEU 67 Cb 1.26 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1zkh h LEU 67 CO 0.70 0.97 0.23 0.00 0.09 0.00 0.00 178.44 180.42 1zkh h ALA 68 N 0.79 1.68 -0.54 1.53 0.00 -1.63 0.14 119.26 121.23 1zkh h ALA 68 Ca 0.08 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1zkh h ALA 68 Cb 0.68 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1zkh h ALA 68 CO 0.05 0.28 0.33 -0.92 0.00 0.00 0.00 179.25 178.99 1zkh h TYR 69 N 0.52 0.63 -0.31 0.00 3.20 -1.77 -1.99 116.97 117.25 1zkh h TYR 69 Ca 0.14 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1zkh h TYR 69 Cb -0.01 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.05 1zkh h TYR 69 CO 0.00 0.37 0.00 0.66 -1.64 0.00 0.00 178.16 177.55 1zkh n TYR 70 N -4.76 0.40 -3.51 -3.82 4.01 -1.02 -4.94 117.16 103.52 1zkh n TYR 70 Ca 0.04 -0.20 -0.21 0.00 -0.16 0.00 0.00 57.90 57.36 1zkh n TYR 70 Cb 0.06 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.17 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 0.93 -4.90 -4.57 7.72 5.03 -0.28 -4.86 115.26 114.34 1zkh n ASN 71 Ca 0.18 -0.55 -0.27 0.00 0.87 0.00 0.00 54.58 54.81 1zkh n ASN 71 Cb 0.47 -4.95 -0.06 0.00 -1.02 0.00 0.00 39.78 34.21 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 -5.97 2.45 0.75 3.52 -1.94 0.32 -4.94 119.30 113.50 1zkh s MET 72 Ca 0.39 -0.70 -0.13 0.00 -1.71 0.00 0.00 55.69 53.54 1zkh s MET 72 Cb -0.17 -5.14 0.18 0.00 2.01 0.00 0.00 34.83 31.71 1zkh s MET 72 CO 0.71 -3.78 0.81 0.00 -0.01 0.00 0.00 175.02 172.75 1zkh n ALA 73 N 14.51 -1.72 -1.63 3.03 0.00 -1.26 -4.84 120.51 128.60 1zkh n ALA 73 Ca 0.43 -1.13 -0.44 0.00 0.00 0.00 0.00 53.44 52.30 1zkh n ALA 73 Cb 0.47 -0.07 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 1zkh n ALA 73 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1zkh n ASN 74 N -3.95 3.59 0.00 0.00 2.85 -1.26 -2.53 115.26 113.96 1zkh n ASN 74 Ca 0.11 0.61 0.00 0.00 -0.11 0.00 0.00 54.58 55.18 1zkh n ASN 74 Cb 0.39 -1.50 0.00 0.00 1.24 0.00 0.00 39.78 39.91 1zkh n ASN 74 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1zkh n GLY 75 N 5.14 1.39 3.62 8.20 0.00 0.23 -4.82 105.19 118.95 1zkh n GLY 75 Ca 0.26 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 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 3.42 -0.48 4.61 0.00 -0.12 -4.96 121.76 122.23 1zkh s ALA 76 Ca 0.00 -0.24 -0.17 0.00 0.00 0.00 0.00 51.96 51.55 1zkh s ALA 76 Cb 0.00 -3.66 0.06 0.00 0.00 0.00 0.00 23.12 19.53 1zkh s ALA 76 CO 0.00 -1.63 0.48 0.08 0.00 0.00 0.00 175.76 174.70 1zkh s VAL 77 N 3.70 5.09 0.12 0.00 1.01 -1.26 -0.10 120.40 128.96 1zkh s VAL 77 Ca 0.43 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 1zkh s VAL 77 Cb -0.11 -4.19 -0.06 0.00 0.00 0.00 0.00 36.38 32.03 1zkh s VAL 77 CO 0.19 -0.66 0.37 -0.63 0.00 0.00 0.00 175.10 174.37 1zkh s ILE 78 N 2.04 5.17 -0.21 2.22 -1.09 0.12 -3.12 121.20 126.32 1zkh s ILE 78 Ca 0.09 0.11 0.00 0.00 -2.23 0.00 0.00 60.65 58.62 1zkh s ILE 78 Cb -0.22 -3.62 0.03 0.00 -1.58 0.00 0.00 42.46 37.07 1zkh s ILE 78 CO 0.09 0.11 -0.14 -1.00 -1.23 0.00 0.00 174.94 172.77 1zkh s HIS 79 N -1.58 2.95 0.04 3.97 3.76 0.22 0.43 115.29 125.08 1zkh s HIS 79 Ca 0.38 -1.70 -0.25 0.00 -0.15 0.00 0.00 55.06 53.34 1zkh s HIS 79 Cb -0.13 -1.97 -0.05 0.00 1.11 0.00 0.00 32.58 31.54 1zkh s HIS 79 CO 0.23 -0.78 0.78 -1.17 -0.85 0.00 0.00 174.74 172.94 1zkh s LEU 80 N 1.28 4.44 0.01 0.89 2.96 0.78 -0.73 118.68 128.31 1zkh s LEU 80 Ca 0.01 1.45 -0.13 0.00 -0.22 0.00 0.00 54.13 55.24 1zkh s LEU 80 Cb -0.15 -3.24 0.02 0.00 0.50 0.00 0.00 46.19 43.31 1zkh s LEU 80 CO -0.09 -0.01 0.27 0.00 -1.32 0.00 0.00 176.35 175.20 1zkh s ALA 81 N 0.07 -0.64 0.27 5.97 0.00 -0.27 -3.84 121.76 123.32 1zkh s ALA 81 Ca 0.39 0.10 -0.25 0.00 0.00 0.00 0.00 51.96 52.21 1zkh s ALA 81 Cb -0.20 0.17 -0.09 0.00 0.00 0.00 0.00 23.12 22.99 1zkh s ALA 81 CO 0.23 -0.30 0.87 -1.17 0.00 0.00 0.00 175.76 175.39 1zkh s LEU 82 N -1.61 4.40 0.17 0.00 2.96 -1.26 -0.05 118.68 123.29 1zkh s LEU 82 Ca -0.11 1.72 -0.12 0.00 -0.22 0.00 0.00 54.13 55.41 1zkh s LEU 82 Cb -0.04 -3.79 0.08 0.00 0.50 0.00 0.00 46.19 42.94 1zkh s LEU 82 CO 0.01 0.01 1.75 0.50 -1.32 0.00 0.00 176.35 177.30 1zkh h LYS 83 N 3.47 0.88 -6.41 1.98 3.64 -0.41 -3.42 116.57 116.30 1zkh h LYS 83 Ca -0.47 -0.14 -0.54 0.00 -1.27 0.00 0.00 60.65 58.22 1zkh h LYS 83 Cb 1.19 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 1zkh h LYS 83 CO 0.65 0.73 0.02 -2.00 -2.27 0.00 0.00 179.45 176.58 1zkh s GLU 84 N -5.63 4.17 -0.29 1.90 2.56 -1.26 -5.06 118.70 115.09 1zkh s GLU 84 Ca -0.13 0.73 0.00 0.00 0.00 0.00 0.00 54.97 55.58 1zkh s GLU 84 Cb 0.13 -3.00 0.14 0.00 2.00 0.00 0.00 34.13 33.40 1zkh s GLU 84 CO 0.79 0.49 0.34 0.50 -0.56 0.00 0.00 175.26 176.82 1zkh s ARG 85 N -1.73 0.36 0.00 4.30 3.52 -1.26 -5.18 118.95 118.96 1zkh s ARG 85 Ca 0.38 0.00 0.00 0.00 -0.13 0.00 0.00 55.73 55.98 1zkh s ARG 85 Cb -0.17 -0.52 0.00 0.00 -1.56 0.00 0.00 34.95 32.70 1zkh s ARG 85 CO 0.20 -1.01 0.00 0.41 -0.81 0.00 0.00 175.30 174.09