#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 1.73 -0.45 0.52 -7.23 0.48 -4.89 120.40 110.56 1zkh s VAL 2 Ca 0.00 -1.93 -0.21 0.00 -1.81 0.00 0.00 61.98 58.03 1zkh s VAL 2 Cb 0.00 -1.82 0.03 0.00 0.56 0.00 0.00 36.38 35.14 1zkh s VAL 2 CO 0.00 -0.37 0.69 -0.94 -0.31 0.00 0.00 175.10 174.17 1zkh s SER 3 N -2.72 6.35 0.06 4.85 1.04 -1.26 -1.72 113.70 120.30 1zkh s SER 3 Ca 0.16 -0.28 0.05 0.00 0.48 0.00 0.00 55.95 56.35 1zkh s SER 3 Cb -0.05 -2.34 -0.04 0.00 0.10 0.00 0.00 66.02 63.69 1zkh s SER 3 CO 0.06 -0.83 -0.07 0.27 0.98 0.00 0.00 173.24 173.65 1zkh s ILE 4 N 2.98 3.61 0.08 -1.02 -4.36 0.38 -0.36 121.20 122.51 1zkh s ILE 4 Ca 0.25 -1.01 0.05 0.00 -0.26 0.00 0.00 60.65 59.68 1zkh s ILE 4 Cb -0.14 -2.65 -0.03 0.00 1.25 0.00 0.00 42.46 40.90 1zkh s ILE 4 CO 0.20 0.23 -0.14 -0.54 0.24 0.00 0.00 174.94 174.93 1zkh s LYS 5 N -1.90 0.84 -0.27 0.37 1.02 0.90 -0.44 119.74 120.26 1zkh s LYS 5 Ca 0.20 -0.99 0.01 0.00 0.02 0.00 0.00 55.97 55.22 1zkh s LYS 5 Cb -0.11 -0.84 0.08 0.00 -0.52 0.00 0.00 37.83 36.43 1zkh s LYS 5 CO 0.12 0.18 0.02 0.08 -0.92 0.00 0.00 175.35 174.83 1zkh s VAL 6 N -1.36 1.41 -0.40 3.17 1.01 0.33 -0.32 120.40 124.24 1zkh s VAL 6 Ca -0.01 -1.43 -0.28 0.00 0.00 0.00 0.00 61.98 60.26 1zkh s VAL 6 Cb -0.09 -1.86 -0.01 0.00 0.00 0.00 0.00 36.38 34.41 1zkh s VAL 6 CO 0.02 -0.36 1.65 -1.58 0.00 0.00 0.00 175.10 174.84 1zkh s GLN 7 N 1.40 3.34 -0.03 2.72 -0.44 0.19 -0.16 119.66 126.69 1zkh s GLN 7 Ca 0.02 1.13 -0.29 0.00 -2.50 0.00 0.00 55.36 53.71 1zkh s GLN 7 Cb -0.18 -4.16 -0.03 0.00 -1.64 0.00 0.00 33.01 27.01 1zkh s GLN 7 CO -0.12 -1.85 0.97 0.08 0.50 0.00 0.00 175.29 174.86 1zkh s VAL 8 N 6.58 4.86 0.60 1.34 1.01 0.67 -0.01 120.40 135.45 1zkh s VAL 8 Ca 0.71 2.01 -0.18 0.00 0.00 0.00 0.00 61.98 64.52 1zkh s VAL 8 Cb -0.18 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 31.87 1zkh s VAL 8 CO 0.32 0.13 1.20 -2.16 0.00 0.00 0.00 175.10 174.58 1zkh s PRO 9 N 1.21 2.95 -0.94 2.72 0.04 -1.25 -3.40 135.00 136.34 1zkh s PRO 9 Ca 0.50 1.78 -0.24 0.00 0.04 0.00 0.00 61.00 63.08 1zkh s PRO 9 Cb -0.20 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1zkh s PRO 9 CO 0.25 -1.21 1.58 -0.80 0.04 0.00 0.00 177.00 176.86 1zkh s ASN 10 N -1.69 6.04 -0.41 6.66 -0.87 -1.26 -1.94 114.94 121.48 1zkh s ASN 10 Ca 0.76 -1.04 0.06 0.00 -1.57 0.00 0.00 52.86 51.07 1zkh s ASN 10 Cb -0.29 -2.56 0.21 0.00 -0.02 0.00 0.00 41.25 38.59 1zkh s ASN 10 CO 0.34 -1.92 0.48 0.23 -2.57 0.00 0.00 177.10 173.65 1zkh n MET 11 N 8.95 0.49 0.04 -0.60 2.81 -1.17 -4.82 117.12 122.82 1zkh n MET 11 Ca 0.31 -3.07 -0.20 0.00 -1.81 0.00 0.00 57.70 52.93 1zkh n MET 11 Cb 0.50 -1.42 -0.14 0.00 -0.71 0.00 0.00 33.22 31.44 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 4.70 0.28 0.00 0.03 7.50 -1.79 -3.36 115.11 122.47 1zkh h GLN 12 Ca 0.14 -0.48 0.00 0.00 0.50 0.00 0.00 58.65 58.81 1zkh h GLN 12 Cb 0.91 0.18 0.00 0.00 0.05 0.00 0.00 27.48 28.62 1zkh h GLN 12 CO 0.40 1.23 -0.82 -3.47 -1.50 0.00 0.00 178.83 174.67 1zkh n ASP 13 N -4.11 0.99 0.24 1.46 -0.08 -1.26 -4.51 116.55 109.28 1zkh n ASP 13 Ca -0.16 -0.57 0.14 0.00 -1.51 0.00 0.00 54.79 52.69 1zkh n ASP 13 Cb 0.82 1.15 0.41 0.00 2.34 0.00 0.00 41.12 45.83 1zkh n ASP 13 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1zkh h LYS 14 N 0.00 0.00 0.00 -0.67 1.79 -1.92 -3.46 116.57 112.31 1zkh h LYS 14 Ca 0.00 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.38 1zkh h LYS 14 Cb 0.35 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.98 1zkh h LYS 14 CO 0.00 0.03 -0.01 -2.37 -1.08 0.00 0.00 179.45 176.02 1zkh n THR 15 N -3.11 0.00 0.85 -0.16 5.66 -1.26 -5.06 114.28 111.20 1zkh n THR 15 Ca 0.02 -0.71 0.10 0.00 -3.05 0.00 0.00 64.05 60.41 1zkh n THR 15 Cb 0.43 0.49 0.05 0.00 -1.55 0.00 0.00 70.33 69.75 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 -0.26 1.67 -2.22 1.09 0.28 -1.26 -4.85 120.64 115.09 1zkh n GLU 16 Ca -0.01 -1.36 -0.26 0.00 -0.16 0.00 0.00 57.16 55.36 1zkh n GLU 16 Cb 0.27 -1.38 0.11 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 -1.90 2.21 -0.20 -1.84 0.51 -1.26 -4.96 118.94 111.49 1zkh s TRP 17 Ca 0.20 0.23 0.02 0.00 -2.12 0.00 0.00 56.10 54.43 1zkh s TRP 17 Cb 0.16 -3.41 0.29 0.00 -0.81 0.00 0.00 33.47 29.70 1zkh s TRP 17 CO 0.35 -1.84 1.43 0.36 -0.51 0.00 0.00 176.95 176.74 1zkh n LYS 18 N -3.15 1.56 -2.93 4.98 2.85 -1.26 -4.89 118.16 115.32 1zkh n LYS 18 Ca 0.12 -1.33 -0.41 0.00 -1.05 0.00 0.00 58.31 55.63 1zkh n LYS 18 Cb 0.60 -1.52 -0.04 0.00 -0.65 0.00 0.00 35.03 33.42 1zkh n LYS 18 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1zkh s LEU 19 N -1.47 4.19 -0.02 -5.58 1.43 -1.26 -4.88 118.68 111.09 1zkh s LEU 19 Ca 0.25 1.15 0.03 0.00 -1.03 0.00 0.00 54.13 54.53 1zkh s LEU 19 Cb 0.21 -3.19 0.04 0.00 0.03 0.00 0.00 46.19 43.28 1zkh s LEU 19 CO 0.05 -0.35 0.93 0.59 0.23 0.00 0.00 176.35 177.80 1zkh n ASN 20 N 5.01 0.43 0.00 2.29 3.02 -1.22 -2.37 115.26 122.42 1zkh n ASN 20 Ca 0.03 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1zkh n ASN 20 Cb 0.49 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 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 -0.23 0.54 3.86 7.41 0.00 -0.82 -4.75 105.19 111.21 1zkh n GLY 21 Ca 0.02 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 1zkh n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zkh n GLN 22 N -2.89 -1.07 -4.69 1.61 0.00 -1.23 -4.78 117.38 104.33 1zkh n GLN 22 Ca 0.00 -2.18 -0.25 0.00 0.00 0.00 0.00 57.00 54.57 1zkh n GLN 22 Cb 0.00 -1.23 -0.16 0.00 0.00 0.00 0.00 30.24 28.85 1zkh n GLN 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1zkh s VAL 23 N -3.75 1.23 0.13 -0.39 0.11 -1.26 -0.24 120.40 116.22 1zkh s VAL 23 Ca 0.74 -0.59 -0.16 0.00 -2.93 0.00 0.00 61.98 59.04 1zkh s VAL 23 Cb -0.02 -1.08 -0.07 0.00 -1.53 0.00 0.00 36.38 33.68 1zkh s VAL 23 CO 0.51 0.36 0.56 -0.76 -3.33 0.00 0.00 175.10 172.44 1zkh s LEU 24 N 0.22 4.39 -0.21 2.54 1.43 0.78 -4.90 118.68 122.92 1zkh s LEU 24 Ca -0.06 1.14 -0.00 0.00 -1.03 0.00 0.00 54.13 54.18 1zkh s LEU 24 Cb -0.12 -3.16 0.06 0.00 0.03 0.00 0.00 46.19 43.00 1zkh s LEU 24 CO 0.02 0.15 -0.04 -0.69 0.23 0.00 0.00 176.35 176.03 1zkh s VAL 25 N -1.36 1.26 0.25 -1.59 1.01 -1.26 -0.52 120.40 118.19 1zkh s VAL 25 Ca 0.35 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.43 1zkh s VAL 25 Cb -0.16 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.62 1zkh s VAL 25 CO 0.19 -0.07 -0.10 -0.36 0.00 0.00 0.00 175.10 174.76 1zkh s PHE 26 N 1.53 1.85 -0.18 5.22 0.08 0.41 -5.00 117.98 121.89 1zkh s PHE 26 Ca -0.03 -0.64 0.00 0.00 0.12 0.00 0.00 56.93 56.38 1zkh s PHE 26 Cb -0.18 -0.97 0.04 0.00 -0.57 0.00 0.00 43.02 41.34 1zkh s PHE 26 CO -0.07 0.32 -0.09 0.99 -0.10 0.00 0.00 175.22 176.27 1zkh s THR 27 N -2.99 1.45 0.05 0.64 2.01 -1.26 -0.47 115.64 115.07 1zkh s THR 27 Ca 0.27 -0.82 0.03 0.00 0.31 0.00 0.00 61.69 61.47 1zkh s THR 27 Cb 0.02 -1.53 -0.03 0.00 0.01 0.00 0.00 72.50 70.97 1zkh s THR 27 CO 0.10 0.20 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.38 1zkh s LEU 28 N 1.49 2.28 0.63 4.42 1.43 -0.70 -4.87 118.68 123.37 1zkh s LEU 28 Ca 0.00 -0.61 -0.17 0.00 -1.03 0.00 0.00 54.13 52.33 1zkh s LEU 28 Cb -0.15 -0.24 -0.01 0.00 0.03 0.00 0.00 46.19 45.81 1zkh s LEU 28 CO -0.08 -0.20 1.17 -2.16 0.23 0.00 0.00 176.35 175.31 1zkh s PRO 29 N -1.81 2.80 0.00 1.29 0.04 -1.26 -0.39 135.00 135.67 1zkh s PRO 29 Ca -0.06 1.66 0.06 0.00 0.04 0.00 0.00 61.00 62.70 1zkh s PRO 29 Cb -0.09 -1.93 0.26 0.00 0.04 0.00 0.00 34.50 32.79 1zkh s PRO 29 CO 0.00 -1.30 1.15 -0.11 0.04 0.00 0.00 177.00 176.79 1zkh n LEU 30 N -2.01 0.00 0.19 -3.56 7.94 -1.26 -1.78 117.00 116.52 1zkh n LEU 30 Ca 0.12 0.45 0.09 0.00 -1.11 0.00 0.00 56.01 55.57 1zkh n LEU 30 Cb 0.51 -0.45 0.12 0.00 0.53 0.00 0.00 43.42 44.12 1zkh n LEU 30 CO 0.46 -0.36 0.66 0.71 -1.11 0.00 0.00 177.39 177.75 1zkh h THR 31 N 0.00 0.24 -2.65 1.96 1.35 -1.96 -1.71 112.91 110.13 1zkh h THR 31 Ca 0.00 -1.34 -0.20 0.00 -0.55 0.00 0.00 66.41 64.32 1zkh h THR 31 Cb 0.09 2.09 0.09 0.00 -1.73 0.00 0.00 68.15 68.69 1zkh h THR 31 CO 0.00 0.13 0.13 0.47 -0.25 0.00 0.00 175.52 176.00 1zkh n ASP 32 N -3.11 -0.76 -3.55 5.36 8.00 -0.74 -4.87 116.55 116.89 1zkh n ASP 32 Ca 0.03 -1.03 -0.14 0.00 0.71 0.00 0.00 54.79 54.36 1zkh n ASP 32 Cb 0.59 -0.49 -0.06 0.00 -0.02 0.00 0.00 41.12 41.14 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 -4.32 1.70 0.56 -1.24 0.00 -1.26 -1.76 119.66 113.35 1zkh s GLN 33 Ca 0.36 -1.70 0.25 0.00 -0.00 0.00 0.00 55.36 54.26 1zkh s GLN 33 Cb -0.02 0.40 1.62 0.00 0.00 0.00 0.00 33.01 35.00 1zkh s GLN 33 CO 0.26 -0.67 2.21 0.28 0.00 0.00 0.00 175.29 177.37 1zkh h VAL 34 N 2.23 0.69 -0.73 3.63 2.07 -1.80 -1.21 116.25 121.12 1zkh h VAL 34 Ca -0.29 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.37 1zkh h VAL 34 Cb 1.24 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 31.95 1zkh h VAL 34 CO 0.40 0.00 0.49 0.28 0.02 0.00 0.00 177.57 178.76 1zkh h SER 35 N 0.00 0.39 0.84 0.57 0.02 -1.79 0.19 113.55 113.77 1zkh h SER 35 Ca 0.01 0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.85 1zkh h SER 35 Cb 0.04 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1zkh h SER 35 CO -0.00 0.21 -0.62 0.58 -1.14 0.00 0.00 176.83 175.86 1zkh h VAL 36 N 0.42 1.29 0.10 2.27 2.07 -1.63 -2.86 116.25 117.91 1zkh h VAL 36 Ca 0.36 -2.23 -0.00 0.00 0.82 0.00 0.00 66.70 65.64 1zkh h VAL 36 Cb 0.80 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 1zkh h VAL 36 CO -0.11 0.61 -0.05 0.40 0.02 0.00 0.00 177.57 178.44 1zkh h ILE 37 N 0.00 1.11 -0.73 4.57 1.08 -0.76 -2.48 117.51 120.31 1zkh h ILE 37 Ca -0.01 -1.28 0.05 0.00 -0.39 0.00 0.00 64.86 63.23 1zkh h ILE 37 Cb 1.21 1.87 -0.05 0.00 -3.07 0.00 0.00 36.82 36.78 1zkh h ILE 37 CO 0.08 0.29 0.44 0.07 -0.69 0.00 0.00 178.15 178.34 1zkh h LYS 38 N -0.77 0.81 -0.25 2.37 2.10 -1.20 -1.61 116.57 118.02 1zkh h LYS 38 Ca -0.01 -0.05 -0.17 0.00 -2.00 0.00 0.00 60.65 58.42 1zkh h LYS 38 Cb 0.57 -0.18 -0.00 0.00 -0.90 0.00 0.00 32.23 31.72 1zkh h LYS 38 CO 0.02 0.54 -0.52 -0.24 -2.00 0.00 0.00 179.45 177.25 1zkh h VAL 39 N 0.84 1.30 -0.29 0.07 3.04 -1.60 -2.07 116.25 117.53 1zkh h VAL 39 Ca 0.31 -1.73 -0.10 0.00 -1.01 0.00 0.00 66.70 64.16 1zkh h VAL 39 Cb 0.10 1.66 -0.01 0.00 -2.01 0.00 0.00 31.29 31.02 1zkh h VAL 39 CO -0.14 0.55 -0.26 0.07 -1.01 0.00 0.00 177.57 176.78 1zkh h LYS 40 N 0.55 0.57 -0.24 4.17 2.10 -0.98 -1.67 116.57 121.07 1zkh h LYS 40 Ca 0.02 -0.23 -0.14 0.00 -2.00 0.00 0.00 60.65 58.31 1zkh h LYS 40 Cb 1.09 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.39 1zkh h LYS 40 CO 0.11 0.78 -0.38 0.82 -2.00 0.00 0.00 179.45 178.78 1zkh h ILE 41 N 0.50 1.31 -0.46 0.07 2.04 -1.26 -0.43 117.51 119.28 1zkh h ILE 41 Ca 0.07 -1.58 0.07 0.00 1.00 0.00 0.00 64.86 64.42 1zkh h ILE 41 Cb 0.71 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.50 1zkh h ILE 41 CO 0.05 0.50 0.31 -0.74 0.00 0.00 0.00 178.15 178.27 1zkh h HIS 42 N 0.40 0.35 0.00 1.37 2.76 -1.09 0.35 115.15 119.29 1zkh h HIS 42 Ca 0.02 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.18 1zkh h HIS 42 Cb 0.97 -0.11 -0.00 0.00 1.55 0.00 0.00 27.41 29.81 1zkh h HIS 42 CO 0.08 0.18 -0.99 0.93 -1.30 0.00 0.00 177.93 176.83 1zkh h GLU 43 N 0.34 0.00 0.09 5.26 4.39 -1.14 -2.06 114.58 121.45 1zkh h GLU 43 Ca 0.20 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.56 1zkh h GLU 43 Cb 0.37 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 1zkh h GLU 43 CO -0.05 0.04 -1.96 0.00 -1.16 0.00 0.00 179.01 175.89 1zkh n ALA 44 N -2.20 1.08 -0.08 3.43 0.00 -0.18 -4.66 120.51 117.89 1zkh n ALA 44 Ca -0.01 -0.67 -0.14 0.00 0.00 0.00 0.00 53.44 52.61 1zkh n ALA 44 Cb 0.59 -0.69 -0.06 0.00 0.00 0.00 0.00 19.45 19.29 1zkh n ALA 44 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1zkh n THR 45 N -3.34 0.87 0.00 0.00 -2.24 0.12 -4.76 114.28 104.91 1zkh n THR 45 Ca -0.29 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1zkh n THR 45 Cb 1.05 -1.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 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 2.31 1.54 3.64 3.38 0.00 -0.78 -4.13 105.19 111.15 1zkh n GLY 46 Ca -0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 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 4.10 0.80 1.61 0.23 -1.25 -4.87 119.30 119.92 1zkh s MET 47 Ca 0.00 1.07 -0.11 0.00 -1.03 0.00 0.00 55.69 55.62 1zkh s MET 47 Cb 0.00 -3.71 0.08 0.00 -1.53 0.00 0.00 34.83 29.67 1zkh s MET 47 CO 0.00 -0.79 1.11 -1.25 -2.03 0.00 0.00 175.02 172.06 1zkh s PRO 48 N 3.42 1.95 0.00 3.16 0.04 -1.26 -3.22 135.00 139.09 1zkh s PRO 48 Ca 0.43 1.28 0.10 0.00 0.04 0.00 0.00 61.00 62.85 1zkh s PRO 48 Cb -0.13 -1.85 0.49 0.00 0.04 0.00 0.00 34.50 33.05 1zkh s PRO 48 CO 0.12 -1.89 1.24 0.00 0.04 0.00 0.00 177.00 176.51 1zkh n ALA 49 N -3.66 1.60 0.27 8.56 0.00 -1.26 -2.37 120.51 123.65 1zkh n ALA 49 Ca 0.10 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.61 1zkh n ALA 49 Cb 0.53 -1.16 0.76 0.00 0.00 0.00 0.00 19.45 19.57 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 1.69 0.00 0.00 0.00 0.00 -1.98 -3.21 103.07 99.57 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 -4.05 0.58 -3.49 4.80 4.01 -1.04 -4.99 118.16 113.97 1zkh n LYS 51 Ca -0.03 -0.11 -0.40 0.00 -0.51 0.00 0.00 58.31 57.27 1zkh n LYS 51 Cb 0.13 -0.49 -0.10 0.00 -0.51 0.00 0.00 35.03 34.07 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 -0.11 3.69 -0.07 1.97 -0.44 -1.00 0.17 119.66 123.86 1zkh s GLN 52 Ca 0.00 -0.41 -0.03 0.00 -2.50 0.00 0.00 55.36 52.42 1zkh s GLN 52 Cb 0.00 -3.75 -0.04 0.00 -1.64 0.00 0.00 33.01 27.58 1zkh s GLN 52 CO 0.00 -0.39 0.05 0.15 0.50 0.00 0.00 175.29 175.61 1zkh s LYS 53 N 1.87 3.11 -0.19 1.67 -0.14 0.12 -4.67 119.74 121.51 1zkh s LYS 53 Ca 0.09 -0.36 -0.02 0.00 -1.36 0.00 0.00 55.97 54.32 1zkh s LYS 53 Cb -0.17 -2.90 -0.00 0.00 -1.68 0.00 0.00 37.83 33.08 1zkh s LYS 53 CO 0.11 0.71 -0.10 -0.51 -0.76 0.00 0.00 175.35 174.80 1zkh s LEU 54 N -1.13 2.69 -0.24 3.17 2.01 -1.26 -1.00 118.68 122.91 1zkh s LEU 54 Ca 0.16 -0.44 -0.04 0.00 0.01 0.00 0.00 54.13 53.83 1zkh s LEU 54 Cb -0.12 -1.65 0.00 0.00 0.01 0.00 0.00 46.19 44.43 1zkh s LEU 54 CO 0.06 0.02 -0.02 -1.58 1.01 0.00 0.00 176.35 175.83 1zkh s GLN 55 N 1.20 3.19 -0.34 1.70 0.74 0.42 -0.25 119.66 126.32 1zkh s GLN 55 Ca 0.02 -0.76 -0.08 0.00 0.05 0.00 0.00 55.36 54.59 1zkh s GLN 55 Cb -0.14 -3.07 0.02 0.00 1.10 0.00 0.00 33.01 30.92 1zkh s GLN 55 CO -0.04 -0.29 0.14 -0.47 -0.55 0.00 0.00 175.29 174.08 1zkh s TYR 56 N 1.44 3.21 -1.59 1.67 5.04 0.16 0.56 117.35 127.85 1zkh s TYR 56 Ca 0.04 -1.04 0.00 0.00 -2.44 0.00 0.00 57.07 53.63 1zkh s TYR 56 Cb -0.15 -2.34 0.00 0.00 0.35 0.00 0.00 41.96 39.82 1zkh s TYR 56 CO -0.03 -0.63 0.00 0.39 -1.34 0.00 0.00 175.55 173.95 1zkh n GLU 57 N 4.91 -1.83 -0.23 4.97 -0.58 -1.25 -0.98 120.64 125.65 1zkh n GLU 57 Ca -0.13 0.90 0.00 0.00 -0.42 0.00 0.00 57.16 57.51 1zkh n GLU 57 Cb 0.47 -5.54 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 -0.94 0.88 3.17 0.62 0.00 -1.26 -5.06 105.19 102.60 1zkh n GLY 58 Ca -0.22 -0.01 -0.34 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 -2.00 2.58 -0.89 -0.61 1.01 -0.15 -5.04 121.20 116.09 1zkh s ILE 59 Ca 0.00 -1.02 -0.25 0.00 0.00 0.00 0.00 60.65 59.38 1zkh s ILE 59 Cb 0.00 -2.25 0.02 0.00 0.01 0.00 0.00 42.46 40.24 1zkh s ILE 59 CO 0.00 0.30 1.55 -0.36 0.00 0.00 0.00 174.94 176.44 1zkh s PHE 60 N 1.30 2.23 0.77 3.97 0.40 -1.26 0.37 117.98 125.77 1zkh s PHE 60 Ca 0.01 -0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.04 1zkh s PHE 60 Cb -0.16 -4.49 0.05 0.00 0.51 0.00 0.00 43.02 38.94 1zkh s PHE 60 CO -0.07 -1.97 1.10 0.96 0.70 0.00 0.00 175.22 175.94 1zkh s ILE 61 N 6.62 3.10 0.24 0.64 -4.36 0.65 -4.95 121.20 123.14 1zkh s ILE 61 Ca 0.51 0.36 0.01 0.00 -0.26 0.00 0.00 60.65 61.26 1zkh s ILE 61 Cb -0.05 -3.21 -0.04 0.00 1.25 0.00 0.00 42.46 40.41 1zkh s ILE 61 CO 0.01 -0.46 0.15 -1.59 0.24 0.00 0.00 174.94 173.29 1zkh s LYS 62 N -5.27 1.35 0.00 0.37 0.00 -1.26 -4.34 119.74 110.59 1zkh s LYS 62 Ca 0.60 -1.73 0.19 0.00 0.00 0.00 0.00 55.97 55.03 1zkh s LYS 62 Cb -0.13 0.20 0.96 0.00 0.00 0.00 0.00 37.83 38.85 1zkh s LYS 62 CO 0.53 -0.43 1.57 -0.40 0.00 0.00 0.00 175.35 176.62 1zkh n ASP 63 N -0.56 0.00 -0.04 0.03 5.75 -1.26 -1.57 116.55 118.90 1zkh n ASP 63 Ca 0.03 -0.01 0.15 0.00 -0.01 0.00 0.00 54.79 54.95 1zkh n ASP 63 Cb 0.65 -0.27 0.76 0.00 -1.03 0.00 0.00 41.12 41.23 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 -1.27 0.15 -4.78 -1.12 3.41 -1.26 -4.49 113.62 104.26 1zkh n SER 64 Ca 0.09 -0.47 -0.26 0.00 -0.26 0.00 0.00 58.87 57.98 1zkh n SER 64 Cb 0.15 -0.16 -0.06 0.00 -0.26 0.00 0.00 64.21 63.87 1zkh n SER 64 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1zkh s ASN 65 N -2.41 4.46 0.24 4.04 0.01 -0.61 -5.10 114.94 115.57 1zkh s ASN 65 Ca 0.33 -1.17 0.02 0.00 -0.71 0.00 0.00 52.86 51.33 1zkh s ASN 65 Cb 0.21 -0.17 -0.05 0.00 0.41 0.00 0.00 41.25 41.64 1zkh s ASN 65 CO 0.44 -0.70 0.05 -0.94 -1.51 0.00 0.00 177.10 174.44 1zkh s SER 66 N -3.99 1.50 0.12 -1.22 1.04 -1.26 -3.21 113.70 106.68 1zkh s SER 66 Ca 0.36 -1.30 -0.16 0.00 0.48 0.00 0.00 55.95 55.32 1zkh s SER 66 Cb 0.02 0.08 -0.03 0.00 0.10 0.00 0.00 66.02 66.20 1zkh s SER 66 CO 0.20 -0.63 1.63 -0.07 0.98 0.00 0.00 173.24 175.35 1zkh h LEU 67 N 2.43 0.54 -1.27 2.42 3.38 -1.53 -2.45 115.31 118.82 1zkh h LEU 67 Ca -0.38 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.41 1zkh h LEU 67 Cb 1.23 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 1zkh h LEU 67 CO 0.63 0.61 0.51 0.00 0.09 0.00 0.00 178.44 180.29 1zkh h ALA 68 N 0.94 1.56 -0.62 1.53 0.00 -1.48 0.46 119.26 121.66 1zkh h ALA 68 Ca 0.12 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1zkh h ALA 68 Cb 0.28 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1zkh h ALA 68 CO -0.00 0.36 0.35 -0.92 0.00 0.00 0.00 179.25 179.03 1zkh h TYR 69 N 0.93 0.64 -0.01 0.00 3.20 -1.75 -0.91 116.97 119.07 1zkh h TYR 69 Ca 0.32 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.21 1zkh h TYR 69 Cb 0.08 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.16 1zkh h TYR 69 CO -0.00 0.32 -0.01 0.66 -1.64 0.00 0.00 178.16 177.49 1zkh n TYR 70 N -4.79 0.00 -3.53 -3.82 4.01 -0.94 -4.93 117.16 103.15 1zkh n TYR 70 Ca 0.07 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.59 1zkh n TYR 70 Cb 0.14 -0.01 0.08 0.00 -0.31 0.00 0.00 39.34 39.24 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 0.08 -5.38 -4.57 7.72 5.03 -0.30 -4.86 115.26 112.97 1zkh n ASN 71 Ca 0.19 -0.54 -0.21 0.00 0.87 0.00 0.00 54.58 54.89 1zkh n ASN 71 Cb 0.34 -4.94 -0.07 0.00 -1.02 0.00 0.00 39.78 34.08 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 -6.08 1.96 0.45 3.52 -1.94 -0.00 -4.93 119.30 112.28 1zkh s MET 72 Ca 0.45 -0.33 -0.08 0.00 -1.71 0.00 0.00 55.69 54.02 1zkh s MET 72 Cb -0.20 -5.01 0.11 0.00 2.01 0.00 0.00 34.83 31.73 1zkh s MET 72 CO 0.71 -4.32 0.55 0.00 -0.01 0.00 0.00 175.02 171.95 1zkh n ALA 73 N 16.69 -0.88 -1.63 3.03 0.00 -1.26 -4.83 120.51 131.62 1zkh n ALA 73 Ca 0.43 -0.73 -0.44 0.00 0.00 0.00 0.00 53.44 52.70 1zkh n ALA 73 Cb 0.46 -0.04 -0.03 0.00 0.00 0.00 0.00 19.45 19.83 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 -3.49 3.68 0.00 0.00 3.02 -1.26 -2.45 115.26 114.76 1zkh n ASN 74 Ca 0.07 0.66 0.00 0.00 -0.03 0.00 0.00 54.58 55.28 1zkh n ASN 74 Cb 0.25 -1.50 0.00 0.00 -0.61 0.00 0.00 39.78 37.92 1zkh n ASN 74 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zkh n GLY 75 N 5.03 1.35 3.61 7.41 0.00 0.52 -4.84 105.19 118.27 1zkh n GLY 75 Ca 0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.69 -4.97 121.76 121.65 1zkh s ALA 76 Ca 0.00 -0.36 -0.14 0.00 0.00 0.00 0.00 51.96 51.46 1zkh s ALA 76 Cb 0.00 -3.57 0.09 0.00 0.00 0.00 0.00 23.12 19.64 1zkh s ALA 76 CO 0.00 -1.59 0.40 0.08 0.00 0.00 0.00 175.76 174.65 1zkh s VAL 77 N 3.53 5.02 0.18 0.00 1.01 -1.26 -0.07 120.40 128.82 1zkh s VAL 77 Ca 0.40 -1.25 -0.05 0.00 0.00 0.00 0.00 61.98 61.07 1zkh s VAL 77 Cb -0.12 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.13 1zkh s VAL 77 CO 0.18 -0.64 0.44 -0.63 0.00 0.00 0.00 175.10 174.44 1zkh s ILE 78 N 1.58 5.10 -0.20 2.22 -1.09 0.57 -3.85 121.20 125.53 1zkh s ILE 78 Ca 0.04 0.09 -0.01 0.00 -2.23 0.00 0.00 60.65 58.53 1zkh s ILE 78 Cb -0.25 -3.65 0.01 0.00 -1.58 0.00 0.00 42.46 36.99 1zkh s ILE 78 CO 0.05 -0.05 -0.12 -1.00 -1.23 0.00 0.00 174.94 172.59 1zkh s HIS 79 N -1.77 2.89 0.03 3.97 3.76 0.19 0.57 115.29 124.94 1zkh s HIS 79 Ca 0.42 -1.37 -0.24 0.00 -0.15 0.00 0.00 55.06 53.73 1zkh s HIS 79 Cb -0.12 -2.01 -0.05 0.00 1.11 0.00 0.00 32.58 31.51 1zkh s HIS 79 CO 0.25 -0.70 0.74 -1.17 -0.85 0.00 0.00 174.74 173.02 1zkh s LEU 80 N 1.37 4.43 -0.00 0.89 2.96 0.99 -0.44 118.68 128.88 1zkh s LEU 80 Ca 0.05 1.39 -0.07 0.00 -0.22 0.00 0.00 54.13 55.28 1zkh s LEU 80 Cb -0.14 -3.19 0.00 0.00 0.50 0.00 0.00 46.19 43.37 1zkh s LEU 80 CO -0.08 0.01 0.14 0.00 -1.32 0.00 0.00 176.35 175.10 1zkh s ALA 81 N 0.04 -0.34 0.40 5.97 0.00 -0.17 -3.82 121.76 123.84 1zkh s ALA 81 Ca 0.38 -0.08 -0.13 0.00 0.00 0.00 0.00 51.96 52.12 1zkh s ALA 81 Cb -0.20 0.08 -0.08 0.00 0.00 0.00 0.00 23.12 22.93 1zkh s ALA 81 CO 0.22 -0.20 0.81 -1.17 0.00 0.00 0.00 175.76 175.42 1zkh s LEU 82 N -1.28 3.87 0.29 0.00 2.96 -1.26 0.16 118.68 123.42 1zkh s LEU 82 Ca -0.14 1.29 0.03 0.00 -0.22 0.00 0.00 54.13 55.09 1zkh s LEU 82 Cb -0.07 -4.15 0.68 0.00 0.50 0.00 0.00 46.19 43.14 1zkh s LEU 82 CO 0.02 -0.38 1.74 0.50 -1.32 0.00 0.00 176.35 176.91 1zkh h LYS 83 N 1.52 0.58 -5.22 1.98 1.63 -0.66 -3.40 116.57 113.01 1zkh h LYS 83 Ca -0.47 -0.03 -0.51 0.00 -0.85 0.00 0.00 60.65 58.78 1zkh h LYS 83 Cb 1.18 -0.13 -0.30 0.00 -0.60 0.00 0.00 32.23 32.38 1zkh h LYS 83 CO 0.64 0.38 -0.82 -2.00 -3.45 0.00 0.00 179.45 174.20 1zkh s GLU 84 N -5.90 1.37 0.36 1.90 2.12 -1.26 -4.99 118.70 112.30 1zkh s GLU 84 Ca -0.12 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 54.69 1zkh s GLU 84 Cb 0.24 -1.26 0.00 0.00 0.26 0.00 0.00 34.13 33.37 1zkh s GLU 84 CO 0.79 0.26 0.00 -2.13 -0.54 0.00 0.00 175.26 173.63 1zkh n ARG 85 N 2.97 0.00 -0.36 4.30 0.00 -1.26 -5.19 116.66 117.12 1zkh n ARG 85 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.69 1zkh n ARG 85 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.00 1zkh n ARG 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04