#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 2.23 -0.33 -1.45 -7.23 0.46 -4.90 120.40 109.18 1zkh s VAL 2 Ca 0.00 -1.97 -0.21 0.00 -1.81 0.00 0.00 61.98 57.99 1zkh s VAL 2 Cb 0.00 -2.04 -0.00 0.00 0.56 0.00 0.00 36.38 34.89 1zkh s VAL 2 CO 0.00 -0.13 0.66 -0.44 -0.31 0.00 0.00 175.10 174.88 1zkh s SER 3 N -2.59 6.49 -0.04 4.85 0.01 -1.26 -1.61 113.70 119.54 1zkh s SER 3 Ca 0.19 0.34 0.06 0.00 1.31 0.00 0.00 55.95 57.85 1zkh s SER 3 Cb -0.08 -2.34 -0.02 0.00 0.21 0.00 0.00 66.02 63.79 1zkh s SER 3 CO 0.09 -0.55 -0.22 0.27 0.41 0.00 0.00 173.24 173.23 1zkh s ILE 4 N 2.71 2.35 0.08 1.44 -4.36 0.77 0.04 121.20 124.23 1zkh s ILE 4 Ca 0.26 -0.98 0.09 0.00 -0.26 0.00 0.00 60.65 59.76 1zkh s ILE 4 Cb -0.15 -1.86 -0.03 0.00 1.25 0.00 0.00 42.46 41.67 1zkh s ILE 4 CO 0.13 0.58 -0.24 -0.54 0.24 0.00 0.00 174.94 175.11 1zkh s LYS 5 N -0.50 1.74 -0.28 0.37 1.02 0.36 0.30 119.74 122.74 1zkh s LYS 5 Ca 0.06 -1.16 0.02 0.00 0.02 0.00 0.00 55.97 54.91 1zkh s LYS 5 Cb -0.11 -2.02 0.08 0.00 -0.52 0.00 0.00 37.83 35.26 1zkh s LYS 5 CO 0.01 0.50 -0.02 0.08 -0.92 0.00 0.00 175.35 174.99 1zkh s VAL 6 N -0.95 1.84 -0.47 3.17 1.01 0.13 -0.11 120.40 125.01 1zkh s VAL 6 Ca 0.14 -1.69 -0.28 0.00 0.00 0.00 0.00 61.98 60.15 1zkh s VAL 6 Cb -0.10 -2.17 -0.00 0.00 0.00 0.00 0.00 36.38 34.11 1zkh s VAL 6 CO 0.05 -0.30 1.61 -1.58 0.00 0.00 0.00 175.10 174.88 1zkh s GLN 7 N 1.20 3.25 0.03 2.72 -0.44 0.19 -0.23 119.66 126.38 1zkh s GLN 7 Ca 0.00 0.88 -0.30 0.00 -2.50 0.00 0.00 55.36 53.44 1zkh s GLN 7 Cb -0.19 -4.17 -0.04 0.00 -1.64 0.00 0.00 33.01 26.97 1zkh s GLN 7 CO -0.09 -1.98 1.04 0.08 0.50 0.00 0.00 175.29 174.85 1zkh s VAL 8 N 6.72 4.56 0.58 1.34 1.01 0.73 0.10 120.40 135.45 1zkh s VAL 8 Ca 0.65 1.87 -0.19 0.00 0.00 0.00 0.00 61.98 64.32 1zkh s VAL 8 Cb -0.15 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 1zkh s VAL 8 CO 0.29 0.16 1.19 -2.16 0.00 0.00 0.00 175.10 174.58 1zkh s PRO 9 N 0.88 3.05 -1.02 2.72 0.04 -1.25 -3.10 135.00 136.32 1zkh s PRO 9 Ca 0.53 1.79 -0.23 0.00 0.04 0.00 0.00 61.00 63.13 1zkh s PRO 9 Cb -0.24 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.37 1zkh s PRO 9 CO 0.29 -1.14 1.65 -0.80 0.04 0.00 0.00 177.00 177.04 1zkh s ASN 10 N -1.62 6.07 -0.41 6.66 -0.87 -1.26 -1.68 114.94 121.83 1zkh s ASN 10 Ca 0.77 -1.33 0.06 0.00 -1.57 0.00 0.00 52.86 50.78 1zkh s ASN 10 Cb -0.29 -2.57 0.20 0.00 -0.02 0.00 0.00 41.25 38.57 1zkh s ASN 10 CO 0.32 -1.91 0.42 0.23 -2.57 0.00 0.00 177.10 173.59 1zkh n MET 11 N 8.80 0.45 0.04 -0.60 2.81 -1.21 -4.81 117.12 122.60 1zkh n MET 11 Ca 0.37 -3.23 -0.19 0.00 -1.81 0.00 0.00 57.70 52.84 1zkh n MET 11 Cb 0.49 -1.49 -0.14 0.00 -0.71 0.00 0.00 33.22 31.36 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 4.93 0.27 -0.01 0.03 7.50 -1.78 -3.37 115.11 122.69 1zkh h GLN 12 Ca 0.18 -0.46 0.00 0.00 0.50 0.00 0.00 58.65 58.88 1zkh h GLN 12 Cb 0.89 0.17 0.00 0.00 0.05 0.00 0.00 27.48 28.59 1zkh h GLN 12 CO 0.42 1.21 -0.02 -3.47 -1.50 0.00 0.00 178.83 175.47 1zkh n ASP 13 N -4.18 1.51 -0.51 1.46 2.03 -1.26 -4.52 116.55 111.08 1zkh n ASP 13 Ca -0.13 -1.25 0.13 0.00 0.52 0.00 0.00 54.79 54.06 1zkh n ASP 13 Cb 0.78 0.06 0.38 0.00 -0.72 0.00 0.00 41.12 41.62 1zkh n ASP 13 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1zkh n LYS 14 N 0.30 1.55 -3.25 -0.67 4.76 -1.26 -4.94 118.16 114.66 1zkh n LYS 14 Ca 0.04 -1.02 -0.03 0.00 -2.87 0.00 0.00 58.31 54.43 1zkh n LYS 14 Cb 0.17 -1.48 0.02 0.00 -1.84 0.00 0.00 35.03 31.90 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 0.17 0.00 1.06 -0.18 5.66 -1.26 -5.04 114.28 114.69 1zkh n THR 15 Ca 0.16 -0.50 0.11 0.00 -3.05 0.00 0.00 64.05 60.77 1zkh n THR 15 Cb 0.40 0.62 0.11 0.00 -1.55 0.00 0.00 70.33 69.92 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 -0.52 0.59 -2.31 1.09 0.28 -1.26 -4.87 120.64 113.64 1zkh n GLU 16 Ca -0.03 -0.44 -0.26 0.00 -0.16 0.00 0.00 57.16 56.27 1zkh n GLU 16 Cb 0.44 -1.49 0.05 0.00 1.43 0.00 0.00 31.44 31.87 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 -2.71 3.09 -0.15 -1.84 0.51 -1.26 -4.95 118.94 111.64 1zkh s TRP 17 Ca 0.16 0.54 0.01 0.00 -2.12 0.00 0.00 56.10 54.69 1zkh s TRP 17 Cb 0.18 -2.94 0.11 0.00 -0.81 0.00 0.00 33.47 30.00 1zkh s TRP 17 CO 0.66 -1.09 1.11 0.36 -0.51 0.00 0.00 176.95 177.47 1zkh n LYS 18 N -2.73 1.24 -2.68 4.98 -0.00 -1.26 -4.85 118.16 112.86 1zkh n LYS 18 Ca 0.06 -0.48 -0.42 0.00 -0.00 0.00 0.00 58.31 57.47 1zkh n LYS 18 Cb 0.59 -1.23 -0.03 0.00 -0.00 0.00 0.00 35.03 34.36 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 -0.52 4.39 0.00 -5.58 1.43 -1.26 -4.88 118.68 112.27 1zkh s LEU 19 Ca 0.09 1.72 0.00 0.00 -1.03 0.00 0.00 54.13 54.91 1zkh s LEU 19 Cb 0.08 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.72 1zkh s LEU 19 CO 0.02 -0.26 0.51 0.59 0.23 0.00 0.00 176.35 177.44 1zkh n ASN 20 N 3.73 0.00 0.00 2.29 3.02 -1.17 -2.32 115.26 120.82 1zkh n ASN 20 Ca 0.06 -1.15 0.00 0.00 -0.03 0.00 0.00 54.58 53.46 1zkh n ASN 20 Cb 0.50 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 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 0.76 3.81 7.41 0.00 -0.67 -4.67 105.19 111.83 1zkh n GLY 21 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.44 0.62 -0.14 1.61 0.00 -1.23 -4.66 119.66 115.41 1zkh s GLN 22 Ca 0.00 -0.03 0.02 0.00 -0.00 0.00 0.00 55.36 55.36 1zkh s GLN 22 Cb 0.00 -1.81 0.01 0.00 0.00 0.00 0.00 33.01 31.21 1zkh s GLN 22 CO 0.00 -2.49 -0.21 0.08 0.00 0.00 0.00 175.29 172.67 1zkh s VAL 23 N -3.46 2.02 0.24 3.63 1.01 -1.26 -0.19 120.40 122.38 1zkh s VAL 23 Ca 0.68 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 61.57 1zkh s VAL 23 Cb -0.10 -1.79 -0.08 0.00 0.00 0.00 0.00 36.38 34.41 1zkh s VAL 23 CO 0.53 0.54 0.65 -0.76 0.00 0.00 0.00 175.10 176.06 1zkh s LEU 24 N 0.89 4.22 -0.21 3.92 1.43 0.68 -4.89 118.68 124.71 1zkh s LEU 24 Ca -0.05 1.18 -0.02 0.00 -1.03 0.00 0.00 54.13 54.21 1zkh s LEU 24 Cb -0.15 -3.68 0.06 0.00 0.03 0.00 0.00 46.19 42.45 1zkh s LEU 24 CO -0.03 -0.05 0.03 -0.69 0.23 0.00 0.00 176.35 175.84 1zkh s VAL 25 N -1.72 0.68 0.26 -1.59 1.01 -1.26 0.17 120.40 117.96 1zkh s VAL 25 Ca 0.46 -0.72 0.10 0.00 0.00 0.00 0.00 61.98 61.83 1zkh s VAL 25 Cb -0.13 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 1zkh s VAL 25 CO 0.19 -0.24 -0.09 -0.36 0.00 0.00 0.00 175.10 174.61 1zkh s PHE 26 N 1.78 2.53 -0.20 5.22 0.40 0.15 -4.98 117.98 122.87 1zkh s PHE 26 Ca -0.01 -0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.06 1zkh s PHE 26 Cb -0.17 -1.12 0.05 0.00 0.51 0.00 0.00 43.02 42.28 1zkh s PHE 26 CO -0.09 0.65 -0.06 0.99 0.70 0.00 0.00 175.22 177.40 1zkh s THR 27 N -2.34 1.38 0.05 0.64 2.01 -1.26 -0.16 115.64 115.97 1zkh s THR 27 Ca 0.30 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 61.39 1zkh s THR 27 Cb -0.06 -1.58 -0.03 0.00 0.01 0.00 0.00 72.50 70.85 1zkh s THR 27 CO 0.17 0.04 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.28 1zkh s LEU 28 N 1.49 2.26 0.64 4.42 1.43 -0.64 -4.86 118.68 123.43 1zkh s LEU 28 Ca -0.02 -0.57 -0.17 0.00 -1.03 0.00 0.00 54.13 52.34 1zkh s LEU 28 Cb -0.17 -0.33 -0.01 0.00 0.03 0.00 0.00 46.19 45.71 1zkh s LEU 28 CO -0.07 -0.14 1.22 -2.16 0.23 0.00 0.00 176.35 175.43 1zkh s PRO 29 N -1.61 2.65 0.15 1.29 0.04 -1.26 -0.41 135.00 135.86 1zkh s PRO 29 Ca -0.06 1.84 0.14 0.00 0.04 0.00 0.00 61.00 62.95 1zkh s PRO 29 Cb -0.10 -1.89 0.66 0.00 0.04 0.00 0.00 34.50 33.21 1zkh s PRO 29 CO 0.01 -1.46 1.42 -0.11 0.04 0.00 0.00 177.00 176.90 1zkh n LEU 30 N -2.00 0.30 0.18 -3.56 7.94 -1.26 -1.61 117.00 116.99 1zkh n LEU 30 Ca 0.14 0.62 0.12 0.00 -1.11 0.00 0.00 56.01 55.78 1zkh n LEU 30 Cb 0.50 -0.63 0.23 0.00 0.53 0.00 0.00 43.42 44.05 1zkh n LEU 30 CO 0.46 -0.63 0.78 0.71 -1.11 0.00 0.00 177.39 177.60 1zkh h THR 31 N 0.00 0.00 -2.39 1.96 1.35 -1.96 -1.25 112.91 110.62 1zkh h THR 31 Ca 0.00 -0.84 -0.14 0.00 -0.55 0.00 0.00 66.41 64.88 1zkh h THR 31 Cb 0.10 1.80 0.06 0.00 -1.73 0.00 0.00 68.15 68.38 1zkh h THR 31 CO 0.00 0.00 0.09 0.47 -0.25 0.00 0.00 175.52 175.83 1zkh n ASP 32 N -2.82 -0.61 -3.55 5.36 9.92 -0.63 -4.85 116.55 119.36 1zkh n ASP 32 Ca 0.04 -0.96 -0.15 0.00 -0.53 0.00 0.00 54.79 53.20 1zkh n ASP 32 Cb 0.50 -0.34 -0.06 0.00 -0.64 0.00 0.00 41.12 40.58 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 -3.91 1.69 0.49 -1.24 0.00 -1.26 -1.45 119.66 113.98 1zkh s GLN 33 Ca 0.24 -1.74 0.23 0.00 -0.00 0.00 0.00 55.36 54.09 1zkh s GLN 33 Cb -0.01 0.38 1.26 0.00 0.00 0.00 0.00 33.01 34.64 1zkh s GLN 33 CO 0.18 -0.66 2.02 0.28 0.00 0.00 0.00 175.29 177.11 1zkh h VAL 34 N 2.23 0.77 -0.87 3.63 2.07 -1.60 -1.66 116.25 120.83 1zkh h VAL 34 Ca -0.29 -0.64 0.20 0.00 0.82 0.00 0.00 66.70 66.80 1zkh h VAL 34 Cb 1.24 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 32.34 1zkh h VAL 34 CO 0.40 0.16 0.58 0.28 0.02 0.00 0.00 177.57 179.02 1zkh h SER 35 N 0.00 0.32 0.37 0.57 0.02 -1.76 0.17 113.55 113.24 1zkh h SER 35 Ca -0.00 0.03 -0.17 0.00 -0.84 0.00 0.00 61.79 60.81 1zkh h SER 35 Cb 0.37 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1zkh h SER 35 CO 0.02 0.13 -0.72 0.58 -1.14 0.00 0.00 176.83 175.70 1zkh h VAL 36 N 0.32 1.41 -0.05 2.27 2.07 -1.66 -2.80 116.25 117.81 1zkh h VAL 36 Ca 0.44 -2.20 -0.02 0.00 0.82 0.00 0.00 66.70 65.74 1zkh h VAL 36 Cb 1.21 2.16 -0.00 0.00 -1.52 0.00 0.00 31.29 33.14 1zkh h VAL 36 CO -0.14 0.65 -0.06 0.40 0.02 0.00 0.00 177.57 178.44 1zkh h ILE 37 N 0.20 1.39 -0.89 4.57 1.08 -0.82 -2.03 117.51 121.01 1zkh h ILE 37 Ca -0.03 -1.26 -0.01 0.00 -0.39 0.00 0.00 64.86 63.18 1zkh h ILE 37 Cb 1.28 2.12 -0.04 0.00 -3.07 0.00 0.00 36.82 37.11 1zkh h ILE 37 CO 0.12 0.34 0.53 0.07 -0.69 0.00 0.00 178.15 178.52 1zkh h LYS 38 N -0.33 1.21 -0.09 2.37 2.10 -1.12 -1.86 116.57 118.84 1zkh h LYS 38 Ca 0.01 -0.11 -0.22 0.00 -2.00 0.00 0.00 60.65 58.32 1zkh h LYS 38 Cb 0.59 -0.25 0.01 0.00 -0.90 0.00 0.00 32.23 31.67 1zkh h LYS 38 CO 0.01 0.85 -0.83 -0.24 -2.00 0.00 0.00 179.45 177.25 1zkh h VAL 39 N 1.23 1.32 -0.33 0.07 3.04 -1.52 -2.13 116.25 117.92 1zkh h VAL 39 Ca 0.32 -2.12 -0.11 0.00 -1.01 0.00 0.00 66.70 63.78 1zkh h VAL 39 Cb -0.04 2.13 -0.01 0.00 -2.01 0.00 0.00 31.29 31.36 1zkh h VAL 39 CO -0.06 0.65 -0.23 0.07 -1.01 0.00 0.00 177.57 177.00 1zkh h LYS 40 N 0.41 0.65 -0.25 4.17 2.10 -1.11 -1.64 116.57 120.90 1zkh h LYS 40 Ca -0.06 -0.25 -0.13 0.00 -2.00 0.00 0.00 60.65 58.21 1zkh h LYS 40 Cb 1.45 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.74 1zkh h LYS 40 CO 0.16 0.82 -0.34 0.82 -2.00 0.00 0.00 179.45 178.92 1zkh h ILE 41 N 0.57 1.31 -0.40 0.07 2.04 -1.35 0.12 117.51 119.86 1zkh h ILE 41 Ca 0.08 -1.53 0.06 0.00 1.00 0.00 0.00 64.86 64.47 1zkh h ILE 41 Cb 0.70 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 1zkh h ILE 41 CO 0.05 0.48 0.27 -0.74 0.00 0.00 0.00 178.15 178.22 1zkh h HIS 42 N 0.39 0.29 0.00 1.37 2.76 -1.15 0.35 115.15 119.17 1zkh h HIS 42 Ca 0.03 0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.06 1zkh h HIS 42 Cb 0.92 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.76 1zkh h HIS 42 CO 0.08 0.16 -1.23 0.93 -1.30 0.00 0.00 177.93 176.57 1zkh h GLU 43 N 0.29 0.00 0.05 5.26 4.39 -1.12 -2.15 114.58 121.30 1zkh h GLU 43 Ca 0.18 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.74 1zkh h GLU 43 Cb 0.33 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1zkh h GLU 43 CO -0.04 0.30 -0.69 0.00 -1.16 0.00 0.00 179.01 177.42 1zkh h ALA 44 N 1.48 0.08 0.01 3.43 0.00 -0.12 -3.41 119.26 120.72 1zkh h ALA 44 Ca -0.12 -0.80 -0.41 0.00 0.00 0.00 0.00 54.91 53.57 1zkh h ALA 44 Cb 1.50 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 19.50 1zkh h ALA 44 CO 0.05 0.38 -2.41 0.25 0.00 0.00 0.00 179.25 177.51 1zkh n THR 45 N -4.36 1.53 0.00 0.00 -2.24 0.12 -4.77 114.28 104.56 1zkh n THR 45 Ca -0.18 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1zkh n THR 45 Cb 0.66 -1.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.21 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 1.74 1.67 3.66 3.38 0.00 -0.81 -4.14 105.19 110.68 1zkh n GLY 46 Ca -0.48 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 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 4.24 0.79 1.61 0.23 -1.25 -4.85 119.30 120.07 1zkh s MET 47 Ca 0.00 1.48 -0.11 0.00 -1.03 0.00 0.00 55.69 56.03 1zkh s MET 47 Cb 0.00 -3.70 0.07 0.00 -1.53 0.00 0.00 34.83 29.68 1zkh s MET 47 CO 0.00 -0.67 1.11 -1.25 -2.03 0.00 0.00 175.02 172.18 1zkh s PRO 48 N 3.34 2.00 0.08 3.16 0.04 -1.26 -3.24 135.00 139.13 1zkh s PRO 48 Ca 0.49 1.31 0.13 0.00 0.04 0.00 0.00 61.00 62.96 1zkh s PRO 48 Cb -0.18 -1.86 0.59 0.00 0.04 0.00 0.00 34.50 33.09 1zkh s PRO 48 CO 0.10 -1.85 1.42 0.00 0.04 0.00 0.00 177.00 176.70 1zkh n ALA 49 N -3.56 1.43 0.12 8.56 0.00 -1.26 -2.28 120.51 123.52 1zkh n ALA 49 Ca 0.10 0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.69 1zkh n ALA 49 Cb 0.53 -1.21 0.65 0.00 0.00 0.00 0.00 19.45 19.41 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 1.57 0.05 0.00 0.00 0.00 -1.98 -3.10 103.07 99.62 1zkh h GLY 50 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1zkh h GLY 50 CO 0.00 0.01 0.00 0.28 0.00 0.00 0.00 176.54 176.83 1zkh n LYS 51 N -4.46 -0.09 -3.69 4.80 4.01 -1.06 -4.98 118.16 112.68 1zkh n LYS 51 Ca 0.03 -0.20 -0.36 0.00 -0.51 0.00 0.00 58.31 57.27 1zkh n LYS 51 Cb 0.33 -0.67 -0.10 0.00 -0.51 0.00 0.00 35.03 34.08 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 -0.04 4.05 0.00 1.97 -0.44 -0.97 0.74 119.66 124.97 1zkh s GLN 52 Ca 0.00 -0.28 0.06 0.00 -2.50 0.00 0.00 55.36 52.64 1zkh s GLN 52 Cb 0.00 -3.50 -0.03 0.00 -1.64 0.00 0.00 33.01 27.84 1zkh s GLN 52 CO 0.00 0.07 -0.18 0.15 0.50 0.00 0.00 175.29 175.83 1zkh s LYS 53 N 1.02 2.20 -0.24 1.67 -0.14 0.89 -4.67 119.74 120.47 1zkh s LYS 53 Ca 0.07 -0.89 -0.04 0.00 -1.36 0.00 0.00 55.97 53.76 1zkh s LYS 53 Cb -0.13 -2.22 0.01 0.00 -1.68 0.00 0.00 37.83 33.80 1zkh s LYS 53 CO 0.04 0.57 -0.03 -0.51 -0.76 0.00 0.00 175.35 174.66 1zkh s LEU 54 N -1.10 3.14 -0.31 3.17 2.01 -1.26 -1.12 118.68 123.20 1zkh s LEU 54 Ca 0.13 -0.60 -0.08 0.00 0.01 0.00 0.00 54.13 53.59 1zkh s LEU 54 Cb -0.10 -1.74 0.01 0.00 0.01 0.00 0.00 46.19 44.37 1zkh s LEU 54 CO 0.03 -0.08 0.12 -1.58 1.01 0.00 0.00 176.35 175.84 1zkh s GLN 55 N 1.43 3.07 -0.39 1.70 0.74 0.59 -0.53 119.66 126.27 1zkh s GLN 55 Ca 0.03 -0.89 -0.12 0.00 0.05 0.00 0.00 55.36 54.44 1zkh s GLN 55 Cb -0.15 -3.47 0.03 0.00 1.10 0.00 0.00 33.01 30.52 1zkh s GLN 55 CO -0.03 -0.49 0.24 -0.47 -0.55 0.00 0.00 175.29 173.99 1zkh s TYR 56 N 1.52 3.25 -1.62 1.67 5.04 0.11 0.72 117.35 128.03 1zkh s TYR 56 Ca 0.03 -0.94 -0.00 0.00 -2.44 0.00 0.00 57.07 53.72 1zkh s TYR 56 Cb -0.18 -2.53 0.00 0.00 0.35 0.00 0.00 41.96 39.61 1zkh s TYR 56 CO 0.04 -0.66 0.02 0.39 -1.34 0.00 0.00 175.55 174.00 1zkh n GLU 57 N 5.03 -1.89 -0.20 4.97 -0.58 -1.23 -1.42 120.64 125.32 1zkh n GLU 57 Ca -0.12 0.92 0.00 0.00 -0.42 0.00 0.00 57.16 57.54 1zkh n GLU 57 Cb 0.46 -5.58 0.00 0.00 -0.57 0.00 0.00 31.44 25.75 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 -0.98 0.89 3.18 0.62 0.00 -1.26 -5.07 105.19 102.56 1zkh n GLY 58 Ca -0.22 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 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 2.52 -0.95 -0.61 1.01 -0.51 -5.05 121.20 115.62 1zkh s ILE 59 Ca 0.00 -0.89 -0.24 0.00 0.00 0.00 0.00 60.65 59.53 1zkh s ILE 59 Cb 0.00 -2.15 0.00 0.00 0.01 0.00 0.00 42.46 40.32 1zkh s ILE 59 CO 0.00 0.42 1.69 -0.36 0.00 0.00 0.00 174.94 176.69 1zkh s PHE 60 N 1.33 2.17 0.41 3.97 0.08 -1.26 0.05 117.98 124.73 1zkh s PHE 60 Ca 0.04 -0.11 -0.22 0.00 0.12 0.00 0.00 56.93 56.75 1zkh s PHE 60 Cb -0.14 -4.38 -0.10 0.00 -0.57 0.00 0.00 43.02 37.82 1zkh s PHE 60 CO -0.09 -1.86 0.96 0.96 -0.10 0.00 0.00 175.22 175.10 1zkh s ILE 61 N 7.45 4.25 0.30 0.64 -4.36 0.31 -4.98 121.20 124.81 1zkh s ILE 61 Ca 0.57 1.52 0.07 0.00 -0.26 0.00 0.00 60.65 62.56 1zkh s ILE 61 Cb -0.03 -3.68 -0.03 0.00 1.25 0.00 0.00 42.46 39.96 1zkh s ILE 61 CO -0.05 -0.19 0.26 -1.59 0.24 0.00 0.00 174.94 173.61 1zkh s LYS 62 N -2.89 2.85 0.58 0.37 0.00 -1.26 -4.27 119.74 115.12 1zkh s LYS 62 Ca 0.60 -1.16 0.35 0.00 0.00 0.00 0.00 55.97 55.75 1zkh s LYS 62 Cb -0.13 -2.54 1.74 0.00 0.00 0.00 0.00 37.83 36.91 1zkh s LYS 62 CO 0.17 0.24 2.14 0.38 0.00 0.00 0.00 175.35 178.28 1zkh h ASP 63 N 1.34 0.00 0.00 0.03 2.03 -1.98 -1.88 116.42 115.96 1zkh h ASP 63 Ca -0.47 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.83 1zkh h ASP 63 Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 1zkh h ASP 63 CO 0.59 0.04 0.00 -1.20 -1.03 0.00 0.00 179.24 177.65 1zkh n SER 64 N -3.29 0.00 -4.76 4.15 7.64 -1.26 -3.46 113.62 112.64 1zkh n SER 64 Ca -0.01 -1.12 -0.23 0.00 1.01 0.00 0.00 58.87 58.52 1zkh n SER 64 Cb 0.21 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.35 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 -1.59 4.72 0.28 6.43 0.01 -0.71 -5.06 114.94 119.02 1zkh s ASN 65 Ca 0.15 -0.81 0.06 0.00 -0.71 0.00 0.00 52.86 51.55 1zkh s ASN 65 Cb 0.07 -0.67 -0.06 0.00 0.41 0.00 0.00 41.25 41.00 1zkh s ASN 65 CO 0.11 -0.40 -0.04 -0.94 -1.51 0.00 0.00 177.10 174.32 1zkh s SER 66 N -3.91 2.69 0.13 -1.22 1.04 -1.26 -2.06 113.70 109.10 1zkh s SER 66 Ca 0.40 -1.21 -0.16 0.00 0.48 0.00 0.00 55.95 55.46 1zkh s SER 66 Cb -0.01 -0.15 -0.02 0.00 0.10 0.00 0.00 66.02 65.94 1zkh s SER 66 CO 0.24 -0.38 1.65 -0.07 0.98 0.00 0.00 173.24 175.66 1zkh h LEU 67 N 2.27 0.55 -1.52 2.42 3.38 -1.42 -2.03 115.31 118.96 1zkh h LEU 67 Ca -0.40 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.36 1zkh h LEU 67 Cb 1.23 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1zkh h LEU 67 CO 0.67 0.60 0.15 0.00 0.09 0.00 0.00 178.44 179.96 1zkh h ALA 68 N 0.97 1.63 -0.79 1.53 0.00 -1.40 0.18 119.26 121.37 1zkh h ALA 68 Ca 0.12 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1zkh h ALA 68 Cb 0.24 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1zkh h ALA 68 CO -0.01 0.30 0.49 -0.92 0.00 0.00 0.00 179.25 179.11 1zkh h TYR 69 N 0.47 0.90 -0.58 0.00 3.20 -1.67 -0.80 116.97 118.50 1zkh h TYR 69 Ca 0.12 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1zkh h TYR 69 Cb 0.07 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.05 1zkh h TYR 69 CO 0.00 0.47 0.00 0.66 -1.64 0.00 0.00 178.16 177.65 1zkh n TYR 70 N -4.65 0.77 -3.52 -3.82 4.01 -1.02 -4.96 117.16 103.97 1zkh n TYR 70 Ca 0.11 -0.39 -0.22 0.00 -0.16 0.00 0.00 57.90 57.24 1zkh n TYR 70 Cb 0.15 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.26 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 1.50 -5.99 -4.56 7.72 5.03 -0.26 -4.85 115.26 113.85 1zkh n ASN 71 Ca 0.22 -0.50 -0.19 0.00 0.87 0.00 0.00 54.58 54.98 1zkh n ASN 71 Cb 0.59 -4.71 -0.06 0.00 -1.02 0.00 0.00 39.78 34.58 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 -6.20 1.96 1.07 3.52 -1.94 0.46 -4.93 119.30 113.23 1zkh s MET 72 Ca 0.53 0.22 -0.18 0.00 -1.71 0.00 0.00 55.69 54.56 1zkh s MET 72 Cb -0.23 -4.88 0.24 0.00 2.01 0.00 0.00 34.83 31.97 1zkh s MET 72 CO 0.68 -4.03 1.24 0.00 -0.01 0.00 0.00 175.02 172.89 1zkh s ALA 73 N 13.02 1.52 -0.12 3.03 0.00 -1.26 -4.85 121.76 133.10 1zkh s ALA 73 Ca 0.84 -1.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.37 1zkh s ALA 73 Cb -0.11 -2.81 -0.08 0.00 0.00 0.00 0.00 23.12 20.12 1zkh s ALA 73 CO 0.05 -2.97 2.08 0.09 0.00 0.00 0.00 175.76 175.01 1zkh n ASN 74 N -4.22 3.53 0.00 0.00 4.13 -1.26 -2.30 115.26 115.14 1zkh n ASN 74 Ca 0.15 0.60 0.00 0.00 1.68 0.00 0.00 54.58 57.01 1zkh n ASN 74 Cb 0.59 -1.49 0.00 0.00 -1.54 0.00 0.00 39.78 37.35 1zkh n ASN 74 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1zkh n GLY 75 N 5.17 1.97 3.63 7.41 0.00 0.11 -4.83 105.19 118.64 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 3.34 -0.53 4.61 0.00 -0.68 -4.94 121.76 121.56 1zkh s ALA 76 Ca 0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 51.96 51.76 1zkh s ALA 76 Cb 0.00 -3.78 0.07 0.00 0.00 0.00 0.00 23.12 19.41 1zkh s ALA 76 CO 0.00 -1.82 0.62 0.08 0.00 0.00 0.00 175.76 174.64 1zkh s VAL 77 N 4.33 4.90 0.09 0.00 1.01 -1.26 -0.49 120.40 128.98 1zkh s VAL 77 Ca 0.54 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.70 1zkh s VAL 77 Cb -0.14 -4.34 -0.06 0.00 0.00 0.00 0.00 36.38 31.84 1zkh s VAL 77 CO 0.23 -0.88 0.40 -0.63 0.00 0.00 0.00 175.10 174.23 1zkh s ILE 78 N 2.52 5.10 -0.27 2.22 -1.09 0.84 -3.52 121.20 127.01 1zkh s ILE 78 Ca 0.13 0.40 -0.03 0.00 -2.23 0.00 0.00 60.65 58.92 1zkh s ILE 78 Cb -0.21 -3.64 0.02 0.00 -1.58 0.00 0.00 42.46 37.05 1zkh s ILE 78 CO 0.09 0.26 -0.01 -1.00 -1.23 0.00 0.00 174.94 173.05 1zkh s HIS 79 N -1.43 3.11 0.10 3.97 3.76 0.22 0.55 115.29 125.58 1zkh s HIS 79 Ca 0.34 -1.44 -0.30 0.00 -0.15 0.00 0.00 55.06 53.51 1zkh s HIS 79 Cb -0.14 -2.12 -0.06 0.00 1.11 0.00 0.00 32.58 31.38 1zkh s HIS 79 CO 0.19 -0.70 0.94 -1.17 -0.85 0.00 0.00 174.74 173.15 1zkh s LEU 80 N 1.36 4.49 -0.05 0.89 2.96 0.12 -0.30 118.68 128.15 1zkh s LEU 80 Ca 0.00 1.76 -0.11 0.00 -0.22 0.00 0.00 54.13 55.56 1zkh s LEU 80 Cb -0.17 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 42.98 1zkh s LEU 80 CO -0.02 -0.06 0.25 0.00 -1.32 0.00 0.00 176.35 175.19 1zkh s ALA 81 N 0.02 -0.62 0.38 5.97 0.00 -0.28 -3.76 121.76 123.48 1zkh s ALA 81 Ca 0.46 0.40 -0.25 0.00 0.00 0.00 0.00 51.96 52.57 1zkh s ALA 81 Cb -0.23 -0.14 -0.09 0.00 0.00 0.00 0.00 23.12 22.66 1zkh s ALA 81 CO 0.29 -0.19 1.05 -1.17 0.00 0.00 0.00 175.76 175.74 1zkh s LEU 82 N -0.70 4.21 0.01 0.00 2.96 -1.26 -0.07 118.68 123.82 1zkh s LEU 82 Ca -0.08 2.05 -0.02 0.00 -0.22 0.00 0.00 54.13 55.86 1zkh s LEU 82 Cb -0.04 -4.10 -0.01 0.00 0.50 0.00 0.00 46.19 42.54 1zkh s LEU 82 CO 0.02 -0.41 1.04 0.50 -1.32 0.00 0.00 176.35 176.17 1zkh h LYS 83 N 2.72 -0.02 -3.21 1.98 1.63 -0.04 -3.41 116.57 116.21 1zkh h LYS 83 Ca -0.48 0.00 -0.30 0.00 -0.85 0.00 0.00 60.65 59.02 1zkh h LYS 83 Cb 1.21 0.00 -0.36 0.00 -0.60 0.00 0.00 32.23 32.49 1zkh h LYS 83 CO 0.63 -0.01 -0.66 -1.21 -3.45 0.00 0.00 179.45 174.75 1zkh s GLU 84 N -3.17 0.01 0.53 1.90 2.02 -1.26 -5.04 118.70 113.68 1zkh s GLU 84 Ca -0.01 0.45 0.29 0.00 0.02 0.00 0.00 54.97 55.72 1zkh s GLU 84 Cb 0.01 -0.31 1.45 0.00 0.10 0.00 0.00 34.13 35.38 1zkh s GLU 84 CO 0.04 -0.27 2.05 0.07 0.02 0.00 0.00 175.26 177.17 1zkh h ARG 85 N 8.07 0.00 0.00 1.61 0.11 -1.99 -3.54 114.38 118.64 1zkh h ARG 85 Ca -0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.86 1zkh h ARG 85 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 1zkh h ARG 85 CO 0.23 0.11 0.00 0.41 0.10 0.00 0.00 179.97 180.82