#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 2.66 -0.31 0.52 -7.23 0.53 -4.90 120.40 111.67 1zkh s VAL 2 Ca 0.00 -1.98 -0.22 0.00 -1.81 0.00 0.00 61.98 57.97 1zkh s VAL 2 Cb 0.00 -2.31 -0.00 0.00 0.56 0.00 0.00 36.38 34.62 1zkh s VAL 2 CO 0.00 -0.17 0.73 -0.94 -0.31 0.00 0.00 175.10 174.42 1zkh s SER 3 N -2.89 6.60 0.02 4.85 1.04 -1.26 -1.68 113.70 120.38 1zkh s SER 3 Ca 0.24 0.56 0.07 0.00 0.48 0.00 0.00 55.95 57.30 1zkh s SER 3 Cb -0.08 -2.38 -0.02 0.00 0.10 0.00 0.00 66.02 63.64 1zkh s SER 3 CO 0.13 -0.58 -0.21 0.27 0.98 0.00 0.00 173.24 173.83 1zkh s ILE 4 N 2.85 1.69 0.07 -1.02 -4.36 0.51 -0.12 121.20 120.82 1zkh s ILE 4 Ca 0.30 -1.08 0.08 0.00 -0.26 0.00 0.00 60.65 59.69 1zkh s ILE 4 Cb -0.14 -1.44 -0.03 0.00 1.25 0.00 0.00 42.46 42.10 1zkh s ILE 4 CO 0.13 0.33 -0.22 -0.54 0.24 0.00 0.00 174.94 174.88 1zkh s LYS 5 N -0.88 1.34 -0.29 0.37 1.02 0.14 -0.05 119.74 121.38 1zkh s LYS 5 Ca 0.08 -1.06 0.03 0.00 0.02 0.00 0.00 55.97 55.04 1zkh s LYS 5 Cb -0.09 -1.54 0.08 0.00 -0.52 0.00 0.00 37.83 35.76 1zkh s LYS 5 CO 0.01 0.38 -0.02 0.08 -0.92 0.00 0.00 175.35 174.87 1zkh s VAL 6 N -0.93 2.06 -0.54 3.17 1.01 0.11 0.27 120.40 125.56 1zkh s VAL 6 Ca 0.08 -1.87 -0.27 0.00 0.00 0.00 0.00 61.98 59.92 1zkh s VAL 6 Cb -0.09 -2.36 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 1zkh s VAL 6 CO 0.03 -0.31 1.64 -1.58 0.00 0.00 0.00 175.10 174.88 1zkh s GLN 7 N 1.08 3.07 -0.03 2.72 -0.44 0.19 -0.79 119.66 125.47 1zkh s GLN 7 Ca 0.01 0.69 -0.30 0.00 -2.50 0.00 0.00 55.36 53.26 1zkh s GLN 7 Cb -0.19 -4.23 -0.04 0.00 -1.64 0.00 0.00 33.01 26.91 1zkh s GLN 7 CO -0.08 -2.20 1.17 0.08 0.50 0.00 0.00 175.29 174.76 1zkh s VAL 8 N 7.27 4.30 0.53 1.34 1.01 0.07 -0.27 120.40 134.65 1zkh s VAL 8 Ca 0.63 1.63 -0.21 0.00 0.00 0.00 0.00 61.98 64.02 1zkh s VAL 8 Cb -0.14 -4.05 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 1zkh s VAL 8 CO 0.25 0.04 1.23 -2.16 0.00 0.00 0.00 175.10 174.46 1zkh s PRO 9 N 1.84 3.34 -0.91 2.72 0.04 -1.25 -3.20 135.00 137.58 1zkh s PRO 9 Ca 0.56 1.92 -0.24 0.00 0.04 0.00 0.00 61.00 63.28 1zkh s PRO 9 Cb -0.25 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 1zkh s PRO 9 CO 0.24 -0.93 1.80 -0.80 0.04 0.00 0.00 177.00 177.34 1zkh s ASN 10 N -1.31 5.52 -0.41 6.66 -0.87 -1.26 -1.90 114.94 121.37 1zkh s ASN 10 Ca 0.70 -0.81 0.05 0.00 -1.57 0.00 0.00 52.86 51.23 1zkh s ASN 10 Cb -0.32 -2.56 0.20 0.00 -0.02 0.00 0.00 41.25 38.54 1zkh s ASN 10 CO 0.38 -2.39 0.43 0.23 -2.57 0.00 0.00 177.10 173.18 1zkh n MET 11 N 8.89 0.38 0.02 -0.60 2.81 -1.22 -4.81 117.12 122.59 1zkh n MET 11 Ca 0.36 -3.10 -0.18 0.00 -1.81 0.00 0.00 57.70 52.97 1zkh n MET 11 Cb 0.48 -1.51 -0.14 0.00 -0.71 0.00 0.00 33.22 31.35 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 5.04 0.26 0.00 0.03 7.50 -1.82 -3.35 115.11 122.77 1zkh h GLN 12 Ca 0.19 -0.40 0.00 0.00 0.50 0.00 0.00 58.65 58.94 1zkh h GLN 12 Cb 0.91 0.14 0.00 0.00 0.05 0.00 0.00 27.48 28.58 1zkh h GLN 12 CO 0.38 1.16 0.00 -3.47 -1.50 0.00 0.00 178.83 175.40 1zkh n ASP 13 N -4.24 1.73 -0.82 1.46 2.03 -1.26 -4.59 116.55 110.86 1zkh n ASP 13 Ca -0.12 -1.76 0.12 0.00 0.52 0.00 0.00 54.79 53.54 1zkh n ASP 13 Cb 0.72 0.00 0.29 0.00 -0.72 0.00 0.00 41.12 41.41 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 -0.38 2.09 -2.52 -0.67 4.76 -1.26 -4.96 118.16 115.22 1zkh n LYS 14 Ca 0.00 -1.63 -0.01 0.00 -2.87 0.00 0.00 58.31 53.80 1zkh n LYS 14 Cb 0.20 -1.46 0.01 0.00 -1.84 0.00 0.00 35.03 31.94 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 0.88 0.00 0.34 -0.18 5.66 -1.26 -5.04 114.28 114.68 1zkh n THR 15 Ca 0.17 -0.26 0.08 0.00 -3.05 0.00 0.00 64.05 60.99 1zkh n THR 15 Cb 0.47 0.35 0.13 0.00 -1.55 0.00 0.00 70.33 69.73 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 -0.32 1.84 -3.20 1.09 0.28 -1.26 -4.90 120.64 114.17 1zkh n GLU 16 Ca -0.01 -1.79 -0.18 0.00 -0.16 0.00 0.00 57.16 55.02 1zkh n GLU 16 Cb 0.26 -1.35 0.00 0.00 1.43 0.00 0.00 31.44 31.79 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 -1.24 2.68 -0.32 -1.84 0.51 -1.26 -4.97 118.94 112.50 1zkh s TRP 17 Ca 0.25 -0.45 0.00 0.00 -2.12 0.00 0.00 56.10 53.77 1zkh s TRP 17 Cb 0.15 -2.30 0.00 0.00 -0.81 0.00 0.00 33.47 30.51 1zkh s TRP 17 CO 0.22 -0.37 0.79 0.36 -0.51 0.00 0.00 176.95 177.44 1zkh n LYS 18 N -1.78 0.94 -2.62 4.98 -0.00 -1.26 -4.85 118.16 113.57 1zkh n LYS 18 Ca 0.07 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.96 1zkh n LYS 18 Cb 0.60 -1.17 -0.03 0.00 -0.00 0.00 0.00 35.03 34.43 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 0.00 4.28 0.00 -5.58 1.43 -1.26 -4.87 118.68 112.69 1zkh s LEU 19 Ca 0.00 1.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.75 1zkh s LEU 19 Cb 0.00 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.66 1zkh s LEU 19 CO 0.00 -0.45 0.76 0.59 0.23 0.00 0.00 176.35 177.48 1zkh n ASN 20 N 4.80 0.00 0.00 2.29 3.02 -1.20 -2.65 115.26 121.52 1zkh n ASN 20 Ca 0.09 -1.55 0.00 0.00 -0.03 0.00 0.00 54.58 53.09 1zkh n ASN 20 Cb 0.48 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 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 0.86 3.80 7.41 0.00 -0.80 -4.73 105.19 111.73 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 -0.23 0.60 -0.13 1.61 0.00 -1.23 -4.71 119.66 115.58 1zkh s GLN 22 Ca 0.00 0.02 0.02 0.00 -0.00 0.00 0.00 55.36 55.40 1zkh s GLN 22 Cb 0.00 -1.80 0.01 0.00 0.00 0.00 0.00 33.01 31.22 1zkh s GLN 22 CO 0.00 -2.51 -0.18 0.08 0.00 0.00 0.00 175.29 172.68 1zkh s VAL 23 N -3.41 1.73 0.00 3.63 1.01 -1.26 -0.75 120.40 121.35 1zkh s VAL 23 Ca 0.68 -0.78 -0.22 0.00 0.00 0.00 0.00 61.98 61.66 1zkh s VAL 23 Cb -0.11 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 1zkh s VAL 23 CO 0.53 0.49 0.65 -0.76 0.00 0.00 0.00 175.10 176.01 1zkh s LEU 24 N 0.97 4.41 -0.28 3.92 1.43 0.03 -4.91 118.68 124.26 1zkh s LEU 24 Ca -0.06 1.24 0.03 0.00 -1.03 0.00 0.00 54.13 54.31 1zkh s LEU 24 Cb -0.15 -3.02 0.07 0.00 0.03 0.00 0.00 46.19 43.12 1zkh s LEU 24 CO -0.03 0.06 -0.06 -0.69 0.23 0.00 0.00 176.35 175.86 1zkh s VAL 25 N -0.06 2.04 0.29 -1.59 1.01 -1.26 0.07 120.40 120.89 1zkh s VAL 25 Ca 0.34 -1.72 0.10 0.00 0.00 0.00 0.00 61.98 60.69 1zkh s VAL 25 Cb -0.19 -2.27 -0.06 0.00 0.00 0.00 0.00 36.38 33.87 1zkh s VAL 25 CO 0.19 -0.20 -0.14 -0.36 0.00 0.00 0.00 175.10 174.59 1zkh s PHE 26 N 1.12 2.17 -0.17 5.22 0.08 0.92 -4.99 117.98 122.34 1zkh s PHE 26 Ca -0.03 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.54 1zkh s PHE 26 Cb -0.19 -1.09 0.03 0.00 -0.57 0.00 0.00 43.02 41.20 1zkh s PHE 26 CO -0.07 0.55 -0.10 0.99 -0.10 0.00 0.00 175.22 176.49 1zkh s THR 27 N -2.70 1.46 0.06 0.64 2.01 -1.26 -0.36 115.64 115.49 1zkh s THR 27 Ca 0.29 -0.76 0.03 0.00 0.31 0.00 0.00 61.69 61.57 1zkh s THR 27 Cb -0.01 -1.50 -0.03 0.00 0.01 0.00 0.00 72.50 70.97 1zkh s THR 27 CO 0.14 0.26 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.47 1zkh s LEU 28 N 1.50 2.30 0.52 4.42 1.43 -0.67 -4.86 118.68 123.31 1zkh s LEU 28 Ca 0.02 -0.64 -0.21 0.00 -1.03 0.00 0.00 54.13 52.27 1zkh s LEU 28 Cb -0.15 -0.30 -0.06 0.00 0.03 0.00 0.00 46.19 45.71 1zkh s LEU 28 CO -0.09 -0.18 1.20 -2.16 0.23 0.00 0.00 176.35 175.35 1zkh s PRO 29 N -1.93 3.38 0.04 1.29 0.04 -1.26 -0.35 135.00 136.21 1zkh s PRO 29 Ca -0.04 1.84 0.06 0.00 0.04 0.00 0.00 61.00 62.90 1zkh s PRO 29 Cb -0.08 -2.19 0.27 0.00 0.04 0.00 0.00 34.50 32.54 1zkh s PRO 29 CO 0.01 -0.88 1.17 -0.11 0.04 0.00 0.00 177.00 177.23 1zkh n LEU 30 N -1.01 0.08 0.10 -3.56 7.94 -1.26 -1.34 117.00 117.95 1zkh n LEU 30 Ca 0.10 0.53 0.13 0.00 -1.11 0.00 0.00 56.01 55.66 1zkh n LEU 30 Cb 0.48 -0.54 0.34 0.00 0.53 0.00 0.00 43.42 44.24 1zkh n LEU 30 CO 0.47 -0.51 0.76 0.35 -1.11 0.00 0.00 177.39 177.35 1zkh n THR 31 N -1.60 0.56 -1.45 1.96 -2.24 -1.26 -1.86 114.28 108.39 1zkh n THR 31 Ca 0.01 -0.29 -0.10 0.00 -2.27 0.00 0.00 64.05 61.39 1zkh n THR 31 Cb 0.04 -0.48 0.07 0.00 -2.10 0.00 0.00 70.33 67.86 1zkh n THR 31 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1zkh n ASP 32 N -2.26 0.09 -3.78 3.42 8.00 -0.45 -4.92 116.55 116.65 1zkh n ASP 32 Ca 0.05 -1.19 -0.13 0.00 0.71 0.00 0.00 54.79 54.22 1zkh n ASP 32 Cb 0.44 -0.34 -0.07 0.00 -0.02 0.00 0.00 41.12 41.13 1zkh n ASP 32 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1zkh s GLN 33 N -3.92 1.54 0.53 -1.24 0.00 -1.26 -1.90 119.66 113.41 1zkh s GLN 33 Ca 0.26 -1.64 0.21 0.00 -0.00 0.00 0.00 55.36 54.19 1zkh s GLN 33 Cb -0.01 0.37 1.41 0.00 0.00 0.00 0.00 33.01 34.78 1zkh s GLN 33 CO 0.18 -0.59 2.14 0.28 0.00 0.00 0.00 175.29 177.30 1zkh h VAL 34 N 2.33 0.82 -0.79 3.63 2.07 -1.77 -1.49 116.25 121.05 1zkh h VAL 34 Ca -0.30 -0.21 0.18 0.00 0.82 0.00 0.00 66.70 67.20 1zkh h VAL 34 Cb 1.24 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 32.08 1zkh h VAL 34 CO 0.43 0.05 0.54 0.28 0.02 0.00 0.00 177.57 178.89 1zkh h SER 35 N 0.00 0.29 0.35 0.57 0.02 -1.78 0.20 113.55 113.20 1zkh h SER 35 Ca -0.00 0.02 -0.18 0.00 -0.84 0.00 0.00 61.79 60.79 1zkh h SER 35 Cb 0.11 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1zkh h SER 35 CO 0.01 0.13 -0.73 0.58 -1.14 0.00 0.00 176.83 175.68 1zkh h VAL 36 N 0.29 1.40 0.10 2.27 2.07 -1.66 -2.82 116.25 117.90 1zkh h VAL 36 Ca 0.40 -2.20 -0.00 0.00 0.82 0.00 0.00 66.70 65.71 1zkh h VAL 36 Cb 1.10 2.16 0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1zkh h VAL 36 CO -0.11 0.65 -0.05 0.40 0.02 0.00 0.00 177.57 178.49 1zkh h ILE 37 N 0.22 1.13 -0.76 4.57 1.08 -0.74 -1.93 117.51 121.07 1zkh h ILE 37 Ca -0.03 -1.09 0.04 0.00 -0.39 0.00 0.00 64.86 63.40 1zkh h ILE 37 Cb 1.30 1.79 -0.05 0.00 -3.07 0.00 0.00 36.82 36.79 1zkh h ILE 37 CO 0.12 0.25 0.47 0.07 -0.69 0.00 0.00 178.15 178.38 1zkh h LYS 38 N -0.66 0.88 -0.26 2.37 2.10 -1.21 -1.75 116.57 118.04 1zkh h LYS 38 Ca -0.01 -0.05 -0.18 0.00 -2.00 0.00 0.00 60.65 58.40 1zkh h LYS 38 Cb 0.52 -0.20 -0.00 0.00 -0.90 0.00 0.00 32.23 31.65 1zkh h LYS 38 CO 0.02 0.58 -0.55 -0.24 -2.00 0.00 0.00 179.45 177.26 1zkh h VAL 39 N 0.91 1.29 -0.33 0.07 3.04 -1.55 -0.67 116.25 119.01 1zkh h VAL 39 Ca 0.31 -1.75 -0.08 0.00 -1.01 0.00 0.00 66.70 64.17 1zkh h VAL 39 Cb 0.06 1.67 -0.02 0.00 -2.01 0.00 0.00 31.29 30.99 1zkh h VAL 39 CO -0.13 0.57 -0.14 0.07 -1.01 0.00 0.00 177.57 176.93 1zkh h LYS 40 N 0.61 0.57 -0.18 4.17 2.10 -1.01 -1.24 116.57 121.60 1zkh h LYS 40 Ca 0.01 -0.18 -0.19 0.00 -2.00 0.00 0.00 60.65 58.29 1zkh h LYS 40 Cb 1.15 -0.05 0.01 0.00 -0.90 0.00 0.00 32.23 32.43 1zkh h LYS 40 CO 0.12 0.70 -0.62 0.82 -2.00 0.00 0.00 179.45 178.46 1zkh h ILE 41 N 0.53 1.30 -0.39 0.07 2.04 -1.23 -1.40 117.51 118.42 1zkh h ILE 41 Ca 0.09 -1.84 0.06 0.00 1.00 0.00 0.00 64.86 64.17 1zkh h ILE 41 Cb 0.54 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 1zkh h ILE 41 CO 0.03 0.58 0.26 -0.74 0.00 0.00 0.00 178.15 178.29 1zkh h HIS 42 N 0.46 0.29 0.08 1.37 2.76 -0.63 0.40 115.15 119.88 1zkh h HIS 42 Ca -0.03 0.01 -0.30 0.00 -2.20 0.00 0.00 60.37 57.85 1zkh h HIS 42 Cb 1.25 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 30.09 1zkh h HIS 42 CO 0.09 0.16 -1.58 0.93 -1.30 0.00 0.00 177.93 176.23 1zkh h GLU 43 N 0.30 0.17 0.03 5.26 4.39 -1.18 -2.47 114.58 121.07 1zkh h GLU 43 Ca 0.17 -0.30 -0.10 0.00 0.34 0.00 0.00 59.36 59.47 1zkh h GLU 43 Cb 0.30 0.11 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1zkh h GLU 43 CO -0.04 0.98 -0.41 0.00 -1.16 0.00 0.00 179.01 178.39 1zkh h ALA 44 N 0.60 0.01 0.02 3.43 0.00 -0.48 -3.39 119.26 119.45 1zkh h ALA 44 Ca -0.25 -0.54 -0.40 0.00 0.00 0.00 0.00 54.91 53.72 1zkh h ALA 44 Cb 2.00 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.76 1zkh h ALA 44 CO 0.13 0.19 -2.34 0.25 0.00 0.00 0.00 179.25 177.49 1zkh n THR 45 N -4.38 1.55 0.00 0.00 -2.24 0.13 -4.73 114.28 104.61 1zkh n THR 45 Ca -0.11 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1zkh n THR 45 Cb 0.60 -1.64 0.00 0.00 -2.10 0.00 0.00 70.33 67.18 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 1.87 1.32 3.62 3.38 0.00 -0.93 -4.10 105.19 110.35 1zkh n GLY 46 Ca -0.45 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 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 4.08 0.74 1.61 0.23 -1.25 -4.93 119.30 119.79 1zkh s MET 47 Ca 0.00 0.52 -0.13 0.00 -1.03 0.00 0.00 55.69 55.05 1zkh s MET 47 Cb 0.00 -3.66 0.04 0.00 -1.53 0.00 0.00 34.83 29.68 1zkh s MET 47 CO 0.00 -0.44 1.12 -1.25 -2.03 0.00 0.00 175.02 172.42 1zkh s PRO 48 N 2.52 2.28 0.12 3.16 0.04 -1.26 -3.40 135.00 138.47 1zkh s PRO 48 Ca 0.26 1.37 0.15 0.00 0.04 0.00 0.00 61.00 62.82 1zkh s PRO 48 Cb -0.15 -1.89 0.67 0.00 0.04 0.00 0.00 34.50 33.17 1zkh s PRO 48 CO 0.09 -1.65 1.46 0.00 0.04 0.00 0.00 177.00 176.94 1zkh n ALA 49 N -3.10 1.41 -0.08 8.56 0.00 -1.26 -1.99 120.51 124.03 1zkh n ALA 49 Ca 0.10 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.70 1zkh n ALA 49 Cb 0.52 -1.24 0.49 0.00 0.00 0.00 0.00 19.45 19.23 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 1.44 0.59 0.00 0.00 0.00 -1.99 -3.12 103.07 99.99 1zkh h GLY 50 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1zkh h GLY 50 CO 0.00 0.11 0.00 0.28 0.00 0.00 0.00 176.54 176.93 1zkh n LYS 51 N -4.47 2.08 -3.50 4.80 4.01 -0.98 -4.96 118.16 115.14 1zkh n LYS 51 Ca 0.10 -0.16 -0.41 0.00 -0.51 0.00 0.00 58.31 57.32 1zkh n LYS 51 Cb 0.36 -0.58 -0.10 0.00 -0.51 0.00 0.00 35.03 34.19 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 -0.34 3.32 -0.12 1.97 -0.44 -0.84 0.33 119.66 123.54 1zkh s GLN 52 Ca 0.00 -0.76 -0.03 0.00 -2.50 0.00 0.00 55.36 52.07 1zkh s GLN 52 Cb 0.00 -3.87 -0.03 0.00 -1.64 0.00 0.00 33.01 27.47 1zkh s GLN 52 CO 0.00 -0.55 -0.01 0.15 0.50 0.00 0.00 175.29 175.37 1zkh s LYS 53 N 1.73 3.32 -0.31 1.67 -0.14 0.04 -4.57 119.74 121.48 1zkh s LYS 53 Ca 0.06 -0.45 -0.10 0.00 -1.36 0.00 0.00 55.97 54.12 1zkh s LYS 53 Cb -0.18 -2.86 -0.01 0.00 -1.68 0.00 0.00 37.83 33.09 1zkh s LYS 53 CO 0.10 0.49 0.16 -0.51 -0.76 0.00 0.00 175.35 174.84 1zkh s LEU 54 N -0.29 4.12 -0.28 3.17 2.01 -1.26 -1.22 118.68 124.93 1zkh s LEU 54 Ca 0.06 -0.44 -0.06 0.00 0.01 0.00 0.00 54.13 53.69 1zkh s LEU 54 Cb -0.12 -2.03 -0.00 0.00 0.01 0.00 0.00 46.19 44.05 1zkh s LEU 54 CO 0.02 -0.18 0.06 -1.58 1.01 0.00 0.00 176.35 175.68 1zkh s GLN 55 N 1.64 3.23 -0.49 1.70 0.74 0.02 -0.62 119.66 125.89 1zkh s GLN 55 Ca 0.05 -0.75 -0.15 0.00 0.05 0.00 0.00 55.36 54.56 1zkh s GLN 55 Cb -0.17 -3.31 0.10 0.00 1.10 0.00 0.00 33.01 30.73 1zkh s GLN 55 CO 0.07 -0.36 0.42 -0.47 -0.55 0.00 0.00 175.29 174.40 1zkh s TYR 56 N 1.52 3.27 -1.55 1.67 5.04 0.14 0.89 117.35 128.31 1zkh s TYR 56 Ca 0.04 -1.18 -0.01 0.00 -2.44 0.00 0.00 57.07 53.47 1zkh s TYR 56 Cb -0.16 -3.42 0.00 0.00 0.35 0.00 0.00 41.96 38.74 1zkh s TYR 56 CO 0.02 -0.90 0.11 0.39 -1.34 0.00 0.00 175.55 173.83 1zkh n GLU 57 N 5.18 -2.38 -0.09 4.97 -0.58 -1.22 -1.87 120.64 124.65 1zkh n GLU 57 Ca -0.13 0.87 0.00 0.00 -0.42 0.00 0.00 57.16 57.49 1zkh n GLU 57 Cb 0.42 -5.56 0.00 0.00 -0.57 0.00 0.00 31.44 25.73 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 -1.05 0.94 3.01 0.62 0.00 -1.26 -5.07 105.19 102.38 1zkh n GLY 58 Ca -0.19 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 1.81 -0.77 -0.61 1.01 -0.78 -5.06 121.20 114.80 1zkh s ILE 59 Ca 0.00 -1.28 -0.25 0.00 0.00 0.00 0.00 60.65 59.12 1zkh s ILE 59 Cb 0.00 -1.94 -0.02 0.00 0.01 0.00 0.00 42.46 40.51 1zkh s ILE 59 CO 0.00 0.05 1.78 -0.36 0.00 0.00 0.00 174.94 176.41 1zkh s PHE 60 N 1.29 1.87 0.66 3.97 0.08 -1.26 0.23 117.98 124.82 1zkh s PHE 60 Ca -0.05 0.47 -0.11 0.00 0.12 0.00 0.00 56.93 57.36 1zkh s PHE 60 Cb -0.18 -4.20 -0.01 0.00 -0.57 0.00 0.00 43.02 38.06 1zkh s PHE 60 CO -0.07 -2.04 1.06 0.96 -0.10 0.00 0.00 175.22 175.02 1zkh s ILE 61 N 8.64 4.14 0.18 0.64 -4.36 0.21 -4.99 121.20 125.66 1zkh s ILE 61 Ca 0.62 0.68 0.01 0.00 -0.26 0.00 0.00 60.65 61.70 1zkh s ILE 61 Cb -0.09 -3.69 -0.05 0.00 1.25 0.00 0.00 42.46 39.89 1zkh s ILE 61 CO 0.09 -0.90 0.02 -1.59 0.24 0.00 0.00 174.94 172.80 1zkh s LYS 62 N -5.25 1.12 0.00 0.37 0.00 -1.26 -4.38 119.74 110.34 1zkh s LYS 62 Ca 0.56 -1.55 0.19 0.00 0.00 0.00 0.00 55.97 55.18 1zkh s LYS 62 Cb -0.11 -0.20 1.01 0.00 0.00 0.00 0.00 37.83 38.53 1zkh s LYS 62 CO 0.53 -0.17 1.60 -0.40 0.00 0.00 0.00 175.35 176.91 1zkh n ASP 63 N -0.25 0.00 0.00 0.03 5.75 -1.26 -0.97 116.55 119.85 1zkh n ASP 63 Ca -0.06 -0.09 0.14 0.00 -0.01 0.00 0.00 54.79 54.78 1zkh n ASP 63 Cb 0.64 -0.24 0.69 0.00 -1.03 0.00 0.00 41.12 41.18 1zkh n ASP 63 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1zkh n SER 64 N -1.24 0.00 -4.84 -1.12 2.88 -1.26 -4.34 113.62 103.69 1zkh n SER 64 Ca 0.10 0.16 -0.30 0.00 -1.33 0.00 0.00 58.87 57.50 1zkh n SER 64 Cb 0.14 -0.39 -0.04 0.00 -0.75 0.00 0.00 64.21 63.18 1zkh n SER 64 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1zkh s ASN 65 N -2.77 4.39 0.28 -3.46 0.01 -0.14 -5.09 114.94 108.16 1zkh s ASN 65 Ca 0.22 -1.46 0.02 0.00 -0.71 0.00 0.00 52.86 50.93 1zkh s ASN 65 Cb 0.20 0.52 -0.04 0.00 0.41 0.00 0.00 41.25 42.33 1zkh s ASN 65 CO 0.49 -1.00 0.16 -0.94 -1.51 0.00 0.00 177.10 174.30 1zkh s SER 66 N -4.09 1.22 0.07 -1.22 1.04 -1.26 -2.86 113.70 106.59 1zkh s SER 66 Ca 0.19 -1.52 -0.18 0.00 0.48 0.00 0.00 55.95 54.92 1zkh s SER 66 Cb -0.01 0.37 -0.11 0.00 0.10 0.00 0.00 66.02 66.37 1zkh s SER 66 CO 0.12 -0.88 1.40 -0.07 0.98 0.00 0.00 173.24 174.79 1zkh h LEU 67 N 2.31 0.50 -1.66 2.42 3.38 -1.56 -2.81 115.31 117.89 1zkh h LEU 67 Ca -0.34 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.19 1zkh h LEU 67 Cb 1.25 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 1zkh h LEU 67 CO 0.52 0.84 0.20 0.00 0.09 0.00 0.00 178.44 180.09 1zkh h ALA 68 N 0.67 1.75 -0.49 1.53 0.00 -1.55 -0.01 119.26 121.17 1zkh h ALA 68 Ca 0.04 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1zkh h ALA 68 Cb 0.68 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1zkh h ALA 68 CO 0.04 0.23 0.22 -0.92 0.00 0.00 0.00 179.25 178.82 1zkh h TYR 69 N 0.44 0.40 -0.06 0.00 5.03 -1.81 -1.75 116.97 119.23 1zkh h TYR 69 Ca 0.12 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.45 1zkh h TYR 69 Cb -0.03 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 38.14 1zkh h TYR 69 CO 0.00 0.18 0.00 0.66 -1.32 0.00 0.00 178.16 177.68 1zkh n TYR 70 N -4.93 0.06 -3.61 -3.82 4.01 -0.87 -4.93 117.16 103.07 1zkh n TYR 70 Ca 0.04 -0.03 -0.23 0.00 -0.16 0.00 0.00 57.90 57.52 1zkh n TYR 70 Cb 0.15 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.25 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 0.29 -5.21 -4.56 7.72 5.03 -0.34 -4.85 115.26 113.34 1zkh n ASN 71 Ca 0.18 -0.59 -0.21 0.00 0.87 0.00 0.00 54.58 54.83 1zkh n ASN 71 Cb 0.37 -4.88 -0.06 0.00 -1.02 0.00 0.00 39.78 34.18 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 -6.16 2.05 0.85 3.52 -1.94 -0.17 -4.93 119.30 112.52 1zkh s MET 72 Ca 0.47 -0.10 -0.14 0.00 -1.71 0.00 0.00 55.69 54.21 1zkh s MET 72 Cb -0.21 -4.97 0.20 0.00 2.01 0.00 0.00 34.83 31.86 1zkh s MET 72 CO 0.74 -4.05 1.06 0.00 -0.01 0.00 0.00 175.02 172.76 1zkh n ALA 73 N 16.36 -1.59 -1.63 3.03 0.00 -1.26 -4.85 120.51 130.58 1zkh n ALA 73 Ca 0.43 -1.41 -0.46 0.00 0.00 0.00 0.00 53.44 52.00 1zkh n ALA 73 Cb 0.45 -0.08 -0.04 0.00 0.00 0.00 0.00 19.45 19.79 1zkh n ALA 73 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1zkh n ASN 74 N -3.88 3.40 0.00 0.00 4.13 -1.26 -2.17 115.26 115.48 1zkh n ASN 74 Ca 0.13 0.69 0.00 0.00 1.68 0.00 0.00 54.58 57.09 1zkh n ASN 74 Cb 0.48 -1.44 0.00 0.00 -1.54 0.00 0.00 39.78 37.28 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 5.06 1.94 3.63 7.41 0.00 0.83 -4.85 105.19 119.21 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 3.39 -0.46 4.61 0.00 -0.56 -4.95 121.76 121.79 1zkh s ALA 76 Ca 0.00 -0.12 -0.15 0.00 0.00 0.00 0.00 51.96 51.69 1zkh s ALA 76 Cb 0.00 -3.75 0.06 0.00 0.00 0.00 0.00 23.12 19.43 1zkh s ALA 76 CO 0.00 -1.72 0.38 0.08 0.00 0.00 0.00 175.76 174.49 1zkh s VAL 77 N 4.00 5.24 0.08 0.00 1.01 -1.26 -0.68 120.40 128.78 1zkh s VAL 77 Ca 0.48 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 61.41 1zkh s VAL 77 Cb -0.12 -4.08 -0.06 0.00 0.00 0.00 0.00 36.38 32.12 1zkh s VAL 77 CO 0.21 -0.52 0.39 -0.63 0.00 0.00 0.00 175.10 174.55 1zkh s ILE 78 N 1.66 5.11 -0.27 2.22 -1.09 0.14 -3.37 121.20 125.61 1zkh s ILE 78 Ca 0.04 0.40 -0.01 0.00 -2.23 0.00 0.00 60.65 58.86 1zkh s ILE 78 Cb -0.23 -3.64 0.04 0.00 -1.58 0.00 0.00 42.46 37.06 1zkh s ILE 78 CO 0.08 0.27 -0.05 -1.00 -1.23 0.00 0.00 174.94 173.01 1zkh s HIS 79 N -1.41 3.20 0.05 3.97 3.76 0.26 0.56 115.29 125.67 1zkh s HIS 79 Ca 0.33 -1.89 -0.29 0.00 -0.15 0.00 0.00 55.06 53.06 1zkh s HIS 79 Cb -0.14 -2.05 -0.04 0.00 1.11 0.00 0.00 32.58 31.46 1zkh s HIS 79 CO 0.18 -0.80 0.95 -1.17 -0.85 0.00 0.00 174.74 173.05 1zkh s LEU 80 N 1.24 4.43 -0.04 0.89 2.96 0.63 -0.80 118.68 127.99 1zkh s LEU 80 Ca -0.04 1.69 -0.07 0.00 -0.22 0.00 0.00 54.13 55.48 1zkh s LEU 80 Cb -0.19 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 42.98 1zkh s LEU 80 CO -0.03 -0.15 0.18 0.00 -1.32 0.00 0.00 176.35 175.03 1zkh s ALA 81 N 0.48 -0.44 0.21 5.97 0.00 -0.36 -3.82 121.76 123.80 1zkh s ALA 81 Ca 0.48 0.28 -0.30 0.00 0.00 0.00 0.00 51.96 52.43 1zkh s ALA 81 Cb -0.22 -0.14 -0.08 0.00 0.00 0.00 0.00 23.12 22.68 1zkh s ALA 81 CO 0.28 -0.14 1.05 -1.17 0.00 0.00 0.00 175.76 175.78 1zkh s LEU 82 N -0.51 4.54 0.25 0.00 2.96 -1.26 -0.78 118.68 123.88 1zkh s LEU 82 Ca -0.06 2.07 -0.05 0.00 -0.22 0.00 0.00 54.13 55.87 1zkh s LEU 82 Cb -0.04 -3.61 0.49 0.00 0.50 0.00 0.00 46.19 43.53 1zkh s LEU 82 CO 0.01 -0.11 1.64 0.50 -1.32 0.00 0.00 176.35 177.07 1zkh h LYS 83 N 4.66 0.12 -1.34 1.98 3.64 -0.49 -3.39 116.57 121.76 1zkh h LYS 83 Ca -0.45 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 58.95 1zkh h LYS 83 Cb 1.21 -0.03 -0.23 0.00 -0.41 0.00 0.00 32.23 32.77 1zkh h LYS 83 CO 0.70 0.08 -0.31 -2.00 -2.27 0.00 0.00 179.45 175.65 1zkh s GLU 84 N -6.08 0.51 -0.21 1.90 2.12 -1.26 -5.02 118.70 110.66 1zkh s GLU 84 Ca -0.13 0.95 0.11 0.00 0.36 0.00 0.00 54.97 56.25 1zkh s GLU 84 Cb 0.23 0.35 -0.22 0.00 0.26 0.00 0.00 34.13 34.75 1zkh s GLU 84 CO 0.76 -0.58 0.01 -2.13 -0.54 0.00 0.00 175.26 172.78 1zkh n ARG 85 N 5.42 0.67 -0.99 4.30 3.00 -1.26 -5.20 116.66 122.60 1zkh n ARG 85 Ca -0.03 0.08 0.00 0.00 -0.00 0.00 0.00 57.85 57.90 1zkh n ARG 85 Cb 0.51 -1.55 0.00 0.00 0.00 0.00 0.00 32.46 31.42 1zkh n ARG 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04