#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kzw n PHE 2 N 0.00 -2.06 -3.49 0.00 3.01 -1.26 -4.91 117.46 108.74 1kzw n PHE 2 Ca 0.00 0.76 -0.27 0.00 1.01 0.00 0.00 57.45 58.95 1kzw n PHE 2 Cb 0.00 -3.60 -0.09 0.00 -0.01 0.00 0.00 39.48 35.77 1kzw n PHE 2 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1kzw n ASP 3 N -2.19 1.47 -3.67 4.37 2.03 -1.26 -4.27 116.55 113.04 1kzw n ASP 3 Ca -0.03 -2.89 -0.02 0.00 0.52 0.00 0.00 54.79 52.38 1kzw n ASP 3 Cb 0.54 -0.65 -0.01 0.00 -0.72 0.00 0.00 41.12 40.28 1kzw n ASP 3 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1kzw s SER 4 N -1.14 -0.13 0.16 1.67 1.04 -0.53 -4.99 113.70 109.78 1kzw s SER 4 Ca 0.33 -0.23 -0.30 0.00 0.48 0.00 0.00 55.95 56.22 1kzw s SER 4 Cb 0.07 0.32 -0.07 0.00 0.10 0.00 0.00 66.02 66.43 1kzw s SER 4 CO -0.13 -0.57 1.04 -0.89 0.98 0.00 0.00 173.24 173.67 1kzw s THR 5 N -2.84 4.07 -0.29 2.02 2.01 -1.26 -1.65 115.64 117.70 1kzw s THR 5 Ca 0.12 1.79 -0.01 0.00 0.31 0.00 0.00 61.69 63.90 1kzw s THR 5 Cb 0.01 -4.14 0.09 0.00 0.01 0.00 0.00 72.50 68.47 1kzw s THR 5 CO -0.02 0.31 0.09 0.26 -0.69 0.00 0.00 174.62 174.57 1kzw s TRP 6 N -0.26 1.46 -0.09 4.92 0.52 -0.71 -0.42 118.94 124.35 1kzw s TRP 6 Ca 0.48 -1.50 -0.11 0.00 0.02 0.00 0.00 56.10 54.99 1kzw s TRP 6 Cb -0.27 -1.51 -0.05 0.00 -1.15 0.00 0.00 33.47 30.49 1kzw s TRP 6 CO 0.33 -0.83 0.25 0.21 0.02 0.00 0.00 176.95 176.93 1kzw s LYS 7 N 1.71 3.76 -0.12 4.98 2.47 -0.86 -0.69 119.74 130.99 1kzw s LYS 7 Ca 0.08 0.07 -0.29 0.00 -1.56 0.00 0.00 55.97 54.26 1kzw s LYS 7 Cb -0.17 -3.25 -0.06 0.00 -1.46 0.00 0.00 37.83 32.89 1kzw s LYS 7 CO -0.24 0.64 1.94 0.54 0.16 0.00 0.00 175.35 178.39 1kzw s VAL 8 N -0.73 3.22 -0.14 4.02 0.11 -0.69 -0.70 120.40 125.50 1kzw s VAL 8 Ca 0.18 0.25 -0.22 0.00 -2.93 0.00 0.00 61.98 59.26 1kzw s VAL 8 Cb -0.14 -3.22 -0.25 0.00 -1.53 0.00 0.00 36.38 31.24 1kzw s VAL 8 CO 0.07 -0.08 0.57 -0.78 -3.33 0.00 0.00 175.10 171.54 1kzw h ASP 9 N 11.99 0.17 -5.05 3.54 3.58 -1.38 -3.46 116.42 125.81 1kzw h ASP 9 Ca -0.42 -0.82 -0.05 0.00 0.42 0.00 0.00 57.03 56.16 1kzw h ASP 9 Cb 1.21 -0.06 -0.13 0.00 1.72 0.00 0.00 39.33 42.07 1kzw h ASP 9 CO 0.96 1.37 -0.01 0.00 -2.88 0.00 0.00 179.24 178.69 1kzw s ARG 10 N -2.36 1.09 -0.20 0.28 1.70 -0.95 -5.04 118.95 113.48 1kzw s ARG 10 Ca -0.21 -0.58 -0.04 0.00 -0.47 0.00 0.00 55.73 54.43 1kzw s ARG 10 Cb 0.02 0.49 0.10 0.00 -0.57 0.00 0.00 34.95 34.99 1kzw s ARG 10 CO 0.70 -0.43 0.29 -1.12 -1.08 0.00 0.00 175.30 173.66 1kzw s SER 11 N -2.64 0.71 0.00 -2.89 0.01 -1.26 -0.66 113.70 106.98 1kzw s SER 11 Ca 0.01 0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.44 1kzw s SER 11 Cb 0.01 0.72 0.00 0.00 0.21 0.00 0.00 66.02 66.96 1kzw s SER 11 CO -0.10 -0.29 0.00 -0.62 0.41 0.00 0.00 173.24 172.63 1kzw n GLU 12 N 5.34 0.00 -1.34 12.44 1.02 -0.48 -4.57 120.64 133.05 1kzw n GLU 12 Ca -0.05 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.84 1kzw n GLU 12 Cb 0.50 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.83 1kzw n GLU 12 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1kzw n ASN 13 N 0.00 6.49 -0.05 1.62 5.15 -1.26 -4.66 115.26 122.55 1kzw n ASN 13 Ca 0.00 -2.83 -0.18 0.00 -0.60 0.00 0.00 54.58 50.97 1kzw n ASN 13 Cb 0.00 -1.36 -0.13 0.00 -0.53 0.00 0.00 39.78 37.76 1kzw n ASN 13 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1kzw h TYR 14 N 3.46 0.13 -0.19 1.20 3.20 -1.84 -2.86 116.97 120.07 1kzw h TYR 14 Ca 0.42 -0.10 0.05 0.00 3.14 0.00 0.00 58.73 62.24 1kzw h TYR 14 Cb 0.92 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 1kzw h TYR 14 CO 1.67 1.22 0.14 -0.44 -1.64 0.00 0.00 178.16 179.11 1kzw h ASP 15 N -0.83 0.00 -0.02 -2.11 3.32 -1.91 -1.02 116.42 113.86 1kzw h ASP 15 Ca -0.13 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.83 1kzw h ASP 15 Cb 1.25 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.81 1kzw h ASP 15 CO -0.02 0.00 -0.34 0.50 -1.72 0.00 0.00 179.24 177.66 1kzw h LYS 16 N 0.00 0.26 -0.57 3.56 1.63 -1.94 -2.52 116.57 117.00 1kzw h LYS 16 Ca 0.09 -0.26 0.11 0.00 -0.85 0.00 0.00 60.65 59.74 1kzw h LYS 16 Cb 0.37 0.07 -0.11 0.00 -0.60 0.00 0.00 32.23 31.95 1kzw h LYS 16 CO -0.00 0.95 -0.20 0.35 -3.45 0.00 0.00 179.45 177.10 1kzw h PHE 17 N -0.33 -0.49 -0.14 1.91 3.57 -1.42 -2.01 116.94 118.03 1kzw h PHE 17 Ca -0.04 0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.54 1kzw h PHE 17 Cb 1.06 0.30 -0.01 0.00 2.79 0.00 0.00 35.95 40.09 1kzw h PHE 17 CO 0.16 -0.30 0.10 0.52 -2.23 0.00 0.00 178.31 176.56 1kzw h MET 18 N -0.06 0.10 -0.36 1.11 2.86 -1.28 -0.96 114.93 116.34 1kzw h MET 18 Ca 0.27 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.85 1kzw h MET 18 Cb 0.48 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1kzw h MET 18 CO -0.62 0.06 0.03 1.49 1.06 0.00 0.00 176.91 178.93 1kzw h GLU 19 N 0.10 0.62 -0.79 1.72 4.81 -0.98 -1.22 114.58 118.83 1kzw h GLU 19 Ca 0.06 -0.18 0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1kzw h GLU 19 Cb 0.12 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.39 1kzw h GLU 19 CO -0.01 0.71 0.52 -0.22 -0.73 0.00 0.00 179.01 179.28 1kzw h LYS 20 N 0.45 0.93 -0.59 1.92 1.63 -1.06 -2.98 116.57 116.87 1kzw h LYS 20 Ca 0.11 -0.06 -0.06 0.00 -0.85 0.00 0.00 60.65 59.79 1kzw h LYS 20 Cb 0.41 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 31.81 1kzw h LYS 20 CO 0.01 0.61 0.12 0.52 -3.45 0.00 0.00 179.45 177.27 1kzw h MET 21 N 0.96 0.96 0.00 1.90 2.86 -1.17 -3.49 114.93 116.95 1kzw h MET 21 Ca 0.32 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1kzw h MET 21 Cb 0.07 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1kzw h MET 21 CO -0.10 0.90 0.00 0.41 1.06 0.00 0.00 176.91 179.18 1kzw n GLY 22 N -0.60 0.78 3.49 8.32 0.00 -0.49 -5.10 105.19 111.59 1kzw n GLY 22 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1kzw n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kzw s VAL 23 N -0.77 3.24 0.68 1.61 0.11 -1.01 -5.05 120.40 119.21 1kzw s VAL 23 Ca 0.00 -0.65 -0.16 0.00 -2.93 0.00 0.00 61.98 58.24 1kzw s VAL 23 Cb 0.00 -2.29 0.01 0.00 -1.53 0.00 0.00 36.38 32.57 1kzw s VAL 23 CO 0.00 0.59 1.22 0.54 -3.33 0.00 0.00 175.10 174.12 1kzw s ASN 24 N -0.63 4.51 0.32 3.54 2.20 -1.26 -4.62 114.94 118.99 1kzw s ASN 24 Ca 0.09 2.41 0.10 0.00 -0.94 0.00 0.00 52.86 54.52 1kzw s ASN 24 Cb -0.11 -2.60 0.90 0.00 -2.00 0.00 0.00 41.25 37.44 1kzw s ASN 24 CO 0.01 -2.06 1.72 -0.29 -2.94 0.00 0.00 177.10 173.55 1kzw h ILE 25 N 0.14 0.51 0.55 0.54 2.10 -2.00 0.12 117.51 119.47 1kzw h ILE 25 Ca -0.49 -0.19 -0.03 0.00 1.08 0.00 0.00 64.86 65.24 1kzw h ILE 25 Cb 1.30 -0.09 0.01 0.00 -1.09 0.00 0.00 36.82 36.95 1kzw h ILE 25 CO 0.52 0.10 -0.26 0.58 -1.08 0.00 0.00 178.15 178.00 1kzw h VAL 26 N 0.55 0.00 0.00 2.19 2.07 -1.99 -1.48 116.25 117.59 1kzw h VAL 26 Ca 0.65 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.93 1kzw h VAL 26 Cb 1.26 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1kzw h VAL 26 CO -0.49 0.00 -0.00 0.11 0.02 0.00 0.00 177.57 177.21 1kzw h LYS 27 N -0.97 0.00 0.00 1.57 1.79 -1.90 -0.54 116.57 116.53 1kzw h LYS 27 Ca -0.08 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1kzw h LYS 27 Cb 0.56 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1kzw h LYS 27 CO 0.12 0.00 -0.06 -0.09 -1.08 0.00 0.00 179.45 178.34 1kzw h ARG 28 N 0.00 0.04 -0.67 3.15 2.43 -0.82 -2.39 114.38 116.12 1kzw h ARG 28 Ca -0.00 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1kzw h ARG 28 Cb 0.13 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 1kzw h ARG 28 CO 0.00 0.85 0.25 0.87 -1.51 0.00 0.00 179.97 180.43 1kzw h LYS 29 N -0.75 1.01 -0.95 0.20 1.79 -1.12 -1.28 116.57 115.47 1kzw h LYS 29 Ca -0.01 -0.19 0.02 0.00 -2.18 0.00 0.00 60.65 58.29 1kzw h LYS 29 Cb 0.87 -0.16 -0.05 0.00 -1.58 0.00 0.00 32.23 31.31 1kzw h LYS 29 CO 0.01 0.85 0.62 -0.07 -1.08 0.00 0.00 179.45 179.79 1kzw h LEU 30 N 0.95 1.06 -1.24 2.94 -0.00 -1.27 -2.70 115.31 115.06 1kzw h LEU 30 Ca 0.22 -0.02 -0.07 0.00 -0.00 0.00 0.00 57.88 58.01 1kzw h LEU 30 Cb 0.23 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 40.63 1kzw h LEU 30 CO -0.01 0.74 -0.30 0.00 -0.00 0.00 0.00 178.44 178.87 1kzw h ALA 31 N 1.37 1.37 -0.75 1.53 0.00 -1.30 -2.26 119.26 119.23 1kzw h ALA 31 Ca 0.36 -0.31 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1kzw h ALA 31 Cb -0.07 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.57 1kzw h ALA 31 CO -0.10 0.45 0.37 0.00 0.00 0.00 0.00 179.25 179.97 1kzw h ALA 32 N 1.58 1.05 -0.08 0.00 0.00 -1.15 -2.86 119.26 117.80 1kzw h ALA 32 Ca 0.02 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1kzw h ALA 32 Cb 0.60 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1kzw h ALA 32 CO 0.04 -0.06 0.00 0.72 0.00 0.00 0.00 179.25 179.95 1kzw n HIS 33 N -4.87 0.19 -2.47 0.00 -0.00 -1.02 -4.79 115.22 102.24 1kzw n HIS 33 Ca 0.13 -0.07 -0.39 0.00 -0.00 0.00 0.00 57.72 57.38 1kzw n HIS 33 Cb 0.32 -0.07 -0.03 0.00 -0.00 0.00 0.00 29.99 30.20 1kzw n HIS 33 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 1kzw s ASP 34 N -0.55 6.20 -1.05 0.41 1.47 -0.88 -4.85 116.67 117.42 1kzw s ASP 34 Ca 0.06 -1.03 -0.24 0.00 1.18 0.00 0.00 52.55 52.53 1kzw s ASP 34 Cb 0.04 -2.56 -0.08 0.00 -0.34 0.00 0.00 42.92 39.97 1kzw s ASP 34 CO 0.03 -1.77 1.97 0.20 0.68 0.00 0.00 175.17 176.28 1kzw s ASN 35 N 5.16 4.93 -0.16 2.11 0.01 -1.26 -4.85 114.94 120.88 1kzw s ASN 35 Ca 0.47 -1.14 -0.23 0.00 -0.71 0.00 0.00 52.86 51.25 1kzw s ASN 35 Cb -0.03 -2.58 -0.02 0.00 0.41 0.00 0.00 41.25 39.03 1kzw s ASN 35 CO -0.01 -3.08 0.72 -0.22 -1.51 0.00 0.00 177.10 173.00 1kzw s LEU 36 N 11.17 4.19 -0.35 0.60 2.96 -1.26 -4.37 118.68 131.61 1kzw s LEU 36 Ca 0.71 1.03 -0.13 0.00 -0.22 0.00 0.00 54.13 55.51 1kzw s LEU 36 Cb -0.04 -3.05 -0.01 0.00 0.50 0.00 0.00 46.19 43.58 1kzw s LEU 36 CO 0.08 -0.29 0.27 -0.75 -1.32 0.00 0.00 176.35 174.33 1kzw s LYS 37 N 1.79 3.46 -0.70 1.98 2.20 0.26 -1.70 119.74 127.02 1kzw s LYS 37 Ca 0.34 -0.64 -0.17 0.00 -0.36 0.00 0.00 55.97 55.14 1kzw s LYS 37 Cb -0.16 -3.82 0.15 0.00 -1.51 0.00 0.00 37.83 32.48 1kzw s LYS 37 CO 0.12 -0.49 0.73 -0.51 -0.36 0.00 0.00 175.35 174.85 1kzw s LEU 38 N 1.77 5.97 -0.71 5.43 1.43 0.13 -2.22 118.68 130.49 1kzw s LEU 38 Ca 0.07 -2.00 -0.22 0.00 -1.03 0.00 0.00 54.13 50.95 1kzw s LEU 38 Cb -0.17 -2.26 0.08 0.00 0.03 0.00 0.00 46.19 43.86 1kzw s LEU 38 CO 0.11 -0.88 0.99 -0.89 0.23 0.00 0.00 176.35 175.91 1kzw s THR 39 N 1.63 4.39 -0.27 5.49 2.01 -1.12 -1.74 115.64 126.03 1kzw s THR 39 Ca 0.14 -0.58 -0.20 0.00 0.31 0.00 0.00 61.69 61.36 1kzw s THR 39 Cb -0.19 -4.70 -0.02 0.00 0.01 0.00 0.00 72.50 67.61 1kzw s THR 39 CO -0.01 -1.47 0.63 -0.63 -0.69 0.00 0.00 174.62 172.45 1kzw s ILE 40 N 3.83 4.96 -0.15 1.82 1.01 -0.66 -1.53 121.20 130.48 1kzw s ILE 40 Ca 0.24 1.05 0.01 0.00 0.00 0.00 0.00 60.65 61.95 1kzw s ILE 40 Cb -0.15 -3.96 0.02 0.00 0.01 0.00 0.00 42.46 38.38 1kzw s ILE 40 CO 0.06 -0.03 -0.19 0.42 0.00 0.00 0.00 174.94 175.20 1kzw s THR 41 N 2.55 1.89 -0.17 2.92 -4.23 -0.33 -1.45 115.64 116.82 1kzw s THR 41 Ca 0.26 -0.85 -0.12 0.00 -1.18 0.00 0.00 61.69 59.79 1kzw s THR 41 Cb -0.15 -1.71 -0.05 0.00 1.34 0.00 0.00 72.50 71.93 1kzw s THR 41 CO 0.10 0.51 0.24 -1.58 -0.54 0.00 0.00 174.62 173.35 1kzw s GLN 42 N 1.15 4.20 -0.73 3.99 0.74 -1.26 -0.92 119.66 126.83 1kzw s GLN 42 Ca 0.00 0.00 0.04 0.00 0.05 0.00 0.00 55.36 55.45 1kzw s GLN 42 Cb -0.14 -3.41 0.20 0.00 1.10 0.00 0.00 33.01 30.76 1kzw s GLN 42 CO -0.08 0.28 0.64 -1.91 -0.55 0.00 0.00 175.29 173.67 1kzw n GLU 43 N 3.47 2.22 0.00 1.67 0.00 0.41 -4.99 120.64 123.41 1kzw n GLU 43 Ca -0.13 -4.54 0.00 0.00 0.00 0.00 0.00 57.16 52.48 1kzw n GLU 43 Cb 0.52 -2.31 0.00 0.00 0.00 0.00 0.00 31.44 29.65 1kzw n GLU 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1kzw n GLY 44 N 1.69 0.97 0.10 8.31 0.00 -1.26 -1.37 105.19 113.64 1kzw n GLY 44 Ca 0.23 0.47 0.12 0.00 0.00 0.00 0.00 46.02 46.85 1kzw n GLY 44 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1kzw h ASN 45 N 0.00 0.00 -3.48 1.61 -1.24 -1.98 -3.47 115.58 107.02 1kzw h ASN 45 Ca 0.00 -0.10 -0.51 0.00 0.71 0.00 0.00 56.30 56.41 1kzw h ASN 45 Cb 0.00 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 1kzw h ASN 45 CO 0.00 0.05 -0.01 -0.54 -1.29 0.00 0.00 177.43 175.64 1kzw s LYS 46 N -3.17 3.74 -0.05 6.67 1.02 -0.47 -1.65 119.74 125.83 1kzw s LYS 46 Ca 0.07 0.29 -0.04 0.00 0.02 0.00 0.00 55.97 56.31 1kzw s LYS 46 Cb 0.12 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.93 1kzw s LYS 46 CO 0.68 0.12 0.13 -0.06 -0.92 0.00 0.00 175.35 175.30 1kzw s PHE 47 N -2.16 -0.15 -0.32 3.18 0.40 0.24 -0.44 117.98 118.73 1kzw s PHE 47 Ca 0.48 0.39 -0.06 0.00 -0.60 0.00 0.00 56.93 57.14 1kzw s PHE 47 Cb -0.11 0.00 0.03 0.00 0.51 0.00 0.00 43.02 43.46 1kzw s PHE 47 CO 0.28 -0.10 0.08 0.99 0.70 0.00 0.00 175.22 177.18 1kzw s THR 48 N 0.45 3.74 -0.26 0.64 2.01 -0.10 -0.47 115.64 121.65 1kzw s THR 48 Ca -0.03 -1.03 -0.15 0.00 0.31 0.00 0.00 61.69 60.79 1kzw s THR 48 Cb -0.05 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.37 1kzw s THR 48 CO -0.02 -0.09 0.37 0.54 -0.69 0.00 0.00 174.62 174.73 1kzw s VAL 49 N 1.41 5.18 -0.37 3.82 0.11 -0.51 -1.19 120.40 128.86 1kzw s VAL 49 Ca -0.01 0.57 -0.27 0.00 -2.93 0.00 0.00 61.98 59.34 1kzw s VAL 49 Cb -0.19 -3.70 0.02 0.00 -1.53 0.00 0.00 36.38 30.98 1kzw s VAL 49 CO 0.02 0.17 0.99 -0.54 -3.33 0.00 0.00 175.10 172.41 1kzw s LYS 50 N 2.00 3.89 -0.86 1.54 1.02 -0.58 -0.83 119.74 125.91 1kzw s LYS 50 Ca 0.15 0.72 -0.17 0.00 0.02 0.00 0.00 55.97 56.69 1kzw s LYS 50 Cb -0.16 -3.80 0.15 0.00 -0.52 0.00 0.00 37.83 33.51 1kzw s LYS 50 CO 0.10 -0.99 0.98 -1.21 -0.92 0.00 0.00 175.35 173.31 1kzw s GLU 51 N 3.64 3.54 -0.36 1.68 2.02 0.16 -2.78 118.70 126.60 1kzw s GLU 51 Ca 0.41 -1.90 -0.04 0.00 0.02 0.00 0.00 54.97 53.46 1kzw s GLU 51 Cb -0.11 -4.69 0.08 0.00 0.10 0.00 0.00 34.13 29.50 1kzw s GLU 51 CO 0.19 -1.61 0.13 0.45 0.02 0.00 0.00 175.26 174.44 1kzw s SER 52 N 3.20 5.19 0.32 -0.19 0.15 -0.94 -2.17 113.70 119.25 1kzw s SER 52 Ca 0.26 -1.58 0.03 0.00 0.70 0.00 0.00 55.95 55.36 1kzw s SER 52 Cb -0.09 -1.81 -0.01 0.00 -1.71 0.00 0.00 66.02 62.40 1kzw s SER 52 CO -0.07 -0.42 0.36 -1.54 1.20 0.00 0.00 173.24 172.77 1kzw n SER 53 N 4.67 -0.96 0.12 5.45 3.41 0.65 -0.58 113.62 126.40 1kzw n SER 53 Ca -0.08 -2.95 0.19 0.00 -0.26 0.00 0.00 58.87 55.77 1kzw n SER 53 Cb 0.43 1.96 0.77 0.00 -0.26 0.00 0.00 64.21 67.11 1kzw n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kzw h ALA 54 N 2.01 2.03 0.00 7.33 0.00 -1.89 -3.10 119.26 125.63 1kzw h ALA 54 Ca -0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1kzw h ALA 54 Cb 1.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1kzw h ALA 54 CO 0.34 -0.55 -1.51 1.19 0.00 0.00 0.00 179.25 178.72 1kzw n PHE 55 N -3.75 0.25 -3.78 0.00 3.01 -1.26 -5.05 117.46 106.89 1kzw n PHE 55 Ca 0.06 0.07 -0.13 0.00 1.01 0.00 0.00 57.45 58.46 1kzw n PHE 55 Cb 0.53 -0.54 -0.10 0.00 -0.01 0.00 0.00 39.48 39.37 1kzw n PHE 55 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1kzw s ARG 56 N -3.38 0.54 -0.48 -1.08 1.81 -1.17 -4.99 118.95 110.20 1kzw s ARG 56 Ca -0.03 0.00 0.05 0.00 -1.72 0.00 0.00 55.73 54.03 1kzw s ARG 56 Cb 0.13 0.24 0.19 0.00 -0.45 0.00 0.00 34.95 35.06 1kzw s ARG 56 CO 0.86 -0.13 0.42 0.09 -0.68 0.00 0.00 175.30 175.87 1kzw n ASN 57 N 1.88 0.51 -4.16 0.23 4.13 -1.22 -0.25 115.26 116.38 1kzw n ASN 57 Ca -0.19 -2.64 -0.24 0.00 1.68 0.00 0.00 54.58 53.19 1kzw n ASN 57 Cb 0.57 -0.61 -0.15 0.00 -1.54 0.00 0.00 39.78 38.04 1kzw n ASN 57 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 1kzw s ILE 58 N -0.57 1.34 -0.52 2.41 -4.36 -0.92 -4.97 121.20 113.60 1kzw s ILE 58 Ca 0.32 -0.73 -0.20 0.00 -0.26 0.00 0.00 60.65 59.78 1kzw s ILE 58 Cb 0.05 -1.12 0.05 0.00 1.25 0.00 0.00 42.46 42.70 1kzw s ILE 58 CO -0.17 0.38 0.71 -1.61 0.24 0.00 0.00 174.94 174.49 1kzw s GLU 59 N -0.39 3.17 -0.70 0.37 8.01 -1.26 -0.66 118.70 127.25 1kzw s GLU 59 Ca 0.06 -0.74 -0.21 0.00 0.01 0.00 0.00 54.97 54.10 1kzw s GLU 59 Cb -0.07 -4.09 0.09 0.00 -4.31 0.00 0.00 34.13 25.75 1kzw s GLU 59 CO -0.01 -1.30 0.94 0.08 0.01 0.00 0.00 175.26 174.99 1kzw s VAL 60 N 2.98 4.50 -0.51 2.63 1.01 -0.01 -4.95 120.40 126.04 1kzw s VAL 60 Ca 0.19 -0.73 -0.22 0.00 0.00 0.00 0.00 61.98 61.23 1kzw s VAL 60 Cb -0.18 -4.67 0.04 0.00 0.00 0.00 0.00 36.38 31.58 1kzw s VAL 60 CO 0.14 -1.40 0.77 -0.69 0.00 0.00 0.00 175.10 173.92 1kzw s VAL 61 N 3.52 4.65 0.31 2.92 1.01 -1.26 -1.42 120.40 130.12 1kzw s VAL 61 Ca 0.22 0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.31 1kzw s VAL 61 Cb -0.16 -4.38 -0.06 0.00 0.00 0.00 0.00 36.38 31.78 1kzw s VAL 61 CO 0.06 -0.89 -0.10 0.72 0.00 0.00 0.00 175.10 174.89 1kzw s PHE 62 N 3.27 2.25 0.05 5.22 -0.12 0.38 -5.00 117.98 124.03 1kzw s PHE 62 Ca 0.24 -0.53 0.07 0.00 -0.05 0.00 0.00 56.93 56.66 1kzw s PHE 62 Cb -0.15 -1.24 -0.02 0.00 -0.63 0.00 0.00 43.02 40.98 1kzw s PHE 62 CO 0.17 0.52 -0.18 -2.00 -0.05 0.00 0.00 175.22 173.68 1kzw s GLU 63 N -3.63 1.21 -0.31 1.99 2.12 -1.26 -0.59 118.70 118.23 1kzw s GLU 63 Ca 0.31 -0.90 -0.28 0.00 0.36 0.00 0.00 54.97 54.46 1kzw s GLU 63 Cb 0.02 -1.30 -0.04 0.00 0.26 0.00 0.00 34.13 33.07 1kzw s GLU 63 CO 0.15 0.33 2.05 -0.51 -0.54 0.00 0.00 175.26 176.74 1kzw s LEU 64 N -1.24 3.45 0.00 2.70 1.43 -0.66 -1.88 118.68 122.48 1kzw s LEU 64 Ca 0.05 1.50 0.00 0.00 -1.03 0.00 0.00 54.13 54.65 1kzw s LEU 64 Cb -0.09 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.76 1kzw s LEU 64 CO 0.02 -1.97 0.00 0.61 0.23 0.00 0.00 176.35 175.24 1kzw n GLY 65 N 5.65 2.71 3.74 -3.19 0.00 -0.85 -5.00 105.19 108.26 1kzw n GLY 65 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.88 1kzw n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kzw s VAL 66 N -2.54 3.07 -0.54 1.61 0.11 -0.79 -4.87 120.40 116.46 1kzw s VAL 66 Ca 0.00 0.90 -0.25 0.00 -2.93 0.00 0.00 61.98 59.70 1kzw s VAL 66 Cb 0.00 -3.57 0.04 0.00 -1.53 0.00 0.00 36.38 31.31 1kzw s VAL 66 CO 0.00 0.14 0.97 -0.89 -3.33 0.00 0.00 175.10 171.99 1kzw s THR 67 N -0.00 4.36 0.17 5.04 2.01 -1.26 -4.12 115.64 121.83 1kzw s THR 67 Ca 0.57 0.42 0.07 0.00 0.31 0.00 0.00 61.69 63.06 1kzw s THR 67 Cb -0.38 -4.55 -0.04 0.00 0.01 0.00 0.00 72.50 67.54 1kzw s THR 67 CO 0.40 -1.10 -0.14 0.72 -0.69 0.00 0.00 174.62 173.80 1kzw s PHE 68 N 4.04 1.61 -0.52 4.92 -0.71 -0.36 -4.81 117.98 122.15 1kzw s PHE 68 Ca 0.33 -0.57 -0.25 0.00 -1.04 0.00 0.00 56.93 55.40 1kzw s PHE 68 Cb -0.12 -0.78 0.04 0.00 -1.21 0.00 0.00 43.02 40.95 1kzw s PHE 68 CO 0.21 0.27 0.94 1.21 -1.34 0.00 0.00 175.22 176.51 1kzw s ASN 69 N -3.00 6.40 -0.18 1.98 3.84 -1.26 -1.45 114.94 121.26 1kzw s ASN 69 Ca 0.18 -0.16 -0.06 0.00 0.21 0.00 0.00 52.86 53.03 1kzw s ASN 69 Cb -0.02 -2.44 -0.04 0.00 -0.55 0.00 0.00 41.25 38.20 1kzw s ASN 69 CO 0.05 -1.16 0.03 -0.47 -2.79 0.00 0.00 177.10 172.76 1kzw s TYR 70 N 3.89 3.17 -0.20 0.43 5.04 0.31 -4.86 117.35 125.13 1kzw s TYR 70 Ca 0.33 -0.08 -0.06 0.00 -2.44 0.00 0.00 57.07 54.82 1kzw s TYR 70 Cb -0.11 -2.06 -0.03 0.00 0.35 0.00 0.00 41.96 40.11 1kzw s TYR 70 CO 0.22 0.05 0.02 0.54 -1.34 0.00 0.00 175.55 175.04 1kzw s ASN 71 N 0.48 5.04 -1.19 4.32 2.20 -1.26 -1.23 114.94 123.30 1kzw s ASN 71 Ca 0.01 -0.14 -0.12 0.00 -0.94 0.00 0.00 52.86 51.68 1kzw s ASN 71 Cb -0.13 -1.87 0.20 0.00 -2.00 0.00 0.00 41.25 37.46 1kzw s ASN 71 CO 0.01 0.08 1.42 0.18 -2.94 0.00 0.00 177.10 175.85 1kzw n LEU 72 N 4.14 5.53 0.00 3.54 4.77 -1.22 -4.93 117.00 128.83 1kzw n LEU 72 Ca -0.17 -4.66 0.00 0.00 -0.03 0.00 0.00 56.01 51.15 1kzw n LEU 72 Cb 0.52 -1.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 1kzw n LEU 72 CO 0.32 1.00 0.00 0.00 -1.33 0.00 0.00 177.39 177.38 1kzw n ALA 73 N 4.50 0.00 -1.00 -1.18 0.00 -1.26 -4.27 120.51 117.30 1kzw n ALA 73 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1kzw n ALA 73 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 1kzw n ALA 73 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1kzw n ASP 74 N 0.56 0.00 0.00 0.00 9.92 -1.26 -4.80 116.55 120.97 1kzw n ASP 74 Ca 0.00 0.12 0.00 0.00 -0.53 0.00 0.00 54.79 54.38 1kzw n ASP 74 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1kzw n ASP 74 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1kzw n GLY 75 N 1.71 -2.12 2.76 0.44 0.00 -1.26 -5.14 105.19 101.58 1kzw n GLY 75 Ca 0.00 1.05 -0.17 0.00 0.00 0.00 0.00 46.02 46.90 1kzw n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kzw s THR 76 N 0.00 -0.35 -0.21 2.61 2.01 -1.26 -5.02 115.64 113.42 1kzw s THR 76 Ca 0.00 -0.12 -0.25 0.00 0.31 0.00 0.00 61.69 61.63 1kzw s THR 76 Cb 0.00 -0.70 -0.01 0.00 0.01 0.00 0.00 72.50 71.81 1kzw s THR 76 CO 0.00 -0.20 0.84 -1.61 -0.69 0.00 0.00 174.62 172.95 1kzw s GLU 77 N 2.35 4.24 -0.11 4.92 2.02 -1.26 -3.41 118.70 127.45 1kzw s GLU 77 Ca 0.07 0.99 -0.00 0.00 0.02 0.00 0.00 54.97 56.05 1kzw s GLU 77 Cb -0.16 -3.61 0.02 0.00 0.10 0.00 0.00 34.13 30.49 1kzw s GLU 77 CO -0.13 -0.42 -0.08 -0.51 0.02 0.00 0.00 175.26 174.14 1kzw s LEU 78 N 2.50 1.18 -0.28 1.80 1.43 -0.36 -2.25 118.68 122.70 1kzw s LEU 78 Ca 0.37 -0.30 -0.17 0.00 -1.03 0.00 0.00 54.13 53.00 1kzw s LEU 78 Cb -0.16 -0.83 -0.02 0.00 0.03 0.00 0.00 46.19 45.21 1kzw s LEU 78 CO 0.10 -0.12 0.49 0.00 0.23 0.00 0.00 176.35 177.05 1kzw s ARG 79 N 1.69 3.97 0.00 1.70 1.70 0.26 -0.53 118.95 127.74 1kzw s ARG 79 Ca 0.05 0.19 0.00 0.00 -0.47 0.00 0.00 55.73 55.49 1kzw s ARG 79 Cb -0.13 -3.68 0.00 0.00 -0.57 0.00 0.00 34.95 30.57 1kzw s ARG 79 CO -0.08 -0.40 0.00 0.41 -1.08 0.00 0.00 175.30 174.15 1kzw n GLY 80 N 4.52 -1.24 2.99 3.88 0.00 -0.53 -1.30 105.19 113.51 1kzw n GLY 80 Ca -0.05 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 1kzw n GLY 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kzw s THR 81 N -2.95 1.38 -0.14 2.61 -4.23 -1.22 -1.23 115.64 109.87 1kzw s THR 81 Ca 0.00 -0.53 -0.29 0.00 -1.18 0.00 0.00 61.69 59.69 1kzw s THR 81 Cb 0.00 -1.32 -0.01 0.00 1.34 0.00 0.00 72.50 72.51 1kzw s THR 81 CO 0.00 0.43 1.10 0.26 -0.54 0.00 0.00 174.62 175.86 1kzw s TRP 82 N 1.44 3.29 -0.03 3.99 0.23 -1.26 -3.47 118.94 123.14 1kzw s TRP 82 Ca 0.02 1.39 0.05 0.00 -2.03 0.00 0.00 56.10 55.53 1kzw s TRP 82 Cb -0.13 -3.31 -0.01 0.00 0.03 0.00 0.00 33.47 30.05 1kzw s TRP 82 CO -0.08 -0.76 -0.19 -1.12 0.96 0.00 0.00 176.95 175.77 1kzw s SER 83 N 1.34 2.25 -0.54 2.95 0.01 -0.19 -2.01 113.70 117.52 1kzw s SER 83 Ca 0.50 -0.36 -0.21 0.00 1.31 0.00 0.00 55.95 57.19 1kzw s SER 83 Cb -0.19 -0.46 0.06 0.00 0.21 0.00 0.00 66.02 65.63 1kzw s SER 83 CO 0.15 0.20 0.76 -0.22 0.41 0.00 0.00 173.24 174.54 1kzw s LEU 84 N -0.19 4.68 -1.12 2.44 2.96 -1.26 -0.82 118.68 125.37 1kzw s LEU 84 Ca 0.01 -0.80 -0.14 0.00 -0.22 0.00 0.00 54.13 52.98 1kzw s LEU 84 Cb -0.10 -2.55 0.18 0.00 0.50 0.00 0.00 46.19 44.23 1kzw s LEU 84 CO 0.01 -1.07 1.30 -0.70 -1.32 0.00 0.00 176.35 174.57 1kzw s GLU 85 N 3.18 3.98 2.95 1.98 -6.30 0.32 -4.89 118.70 119.93 1kzw s GLU 85 Ca 0.20 -2.50 0.00 0.00 -2.50 0.00 0.00 54.97 50.18 1kzw s GLU 85 Cb -0.17 -4.94 0.00 0.00 0.00 0.00 0.00 34.13 29.02 1kzw s GLU 85 CO 0.13 -1.68 0.00 0.41 0.02 0.00 0.00 175.26 174.15 1kzw n GLY 86 N 4.20 1.45 2.74 -1.50 0.00 -1.26 -2.18 105.19 108.63 1kzw n GLY 86 Ca 0.31 0.21 -0.25 0.00 0.00 0.00 0.00 46.02 46.30 1kzw n GLY 86 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1kzw n ASN 87 N 6.06 3.55 -3.60 1.61 5.15 -1.26 -4.95 115.26 121.82 1kzw n ASN 87 Ca 0.00 -3.51 -0.24 0.00 -0.60 0.00 0.00 54.58 50.23 1kzw n ASN 87 Cb 0.00 -0.57 -0.17 0.00 -0.53 0.00 0.00 39.78 38.51 1kzw n ASN 87 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1kzw s LYS 88 N -3.21 0.06 -0.68 1.20 1.02 -0.93 -4.41 119.74 112.79 1kzw s LYS 88 Ca 0.46 0.03 -0.25 0.00 0.02 0.00 0.00 55.97 56.24 1kzw s LYS 88 Cb 0.30 -1.55 0.05 0.00 -0.52 0.00 0.00 37.83 36.12 1kzw s LYS 88 CO -0.12 -0.62 1.10 -0.51 -0.92 0.00 0.00 175.35 174.28 1kzw s LEU 89 N 2.17 3.84 -0.19 3.17 1.43 -0.26 -0.52 118.68 128.32 1kzw s LEU 89 Ca 0.03 -0.70 -0.12 0.00 -1.03 0.00 0.00 54.13 52.31 1kzw s LEU 89 Cb -0.15 -2.52 -0.05 0.00 0.03 0.00 0.00 46.19 43.50 1kzw s LEU 89 CO -0.09 -1.59 0.23 -0.51 0.23 0.00 0.00 176.35 174.62 1kzw s ILE 90 N 4.77 5.34 -0.30 -0.59 2.07 0.00 -1.07 121.20 131.42 1kzw s ILE 90 Ca 0.28 0.40 0.01 0.00 -1.41 0.00 0.00 60.65 59.93 1kzw s ILE 90 Cb -0.13 -3.57 0.09 0.00 0.13 0.00 0.00 42.46 38.98 1kzw s ILE 90 CO 0.13 0.39 0.04 -0.83 -1.91 0.00 0.00 174.94 172.76 1kzw s GLY 91 N 0.57 1.39 -0.68 1.50 0.00 0.31 -1.02 107.32 109.39 1kzw s GLY 91 Ca 0.13 -1.84 -0.21 0.00 0.00 0.00 0.00 44.72 42.79 1kzw s GLY 91 CO 0.02 1.22 0.91 0.54 0.00 0.00 0.00 173.10 175.80 1kzw s LYS 92 N 1.34 3.16 -0.37 2.90 3.01 -1.23 -0.44 119.74 128.12 1kzw s LYS 92 Ca 0.06 -1.12 -0.06 0.00 -1.01 0.00 0.00 55.97 53.85 1kzw s LYS 92 Cb -0.18 -4.33 0.07 0.00 -1.01 0.00 0.00 37.83 32.37 1kzw s LYS 92 CO -0.15 -1.73 0.15 -0.06 0.51 0.00 0.00 175.35 174.07 1kzw s PHE 93 N 3.44 3.35 -0.17 3.18 0.08 -0.17 -3.38 117.98 124.31 1kzw s PHE 93 Ca 0.20 -1.75 -0.19 0.00 0.12 0.00 0.00 56.93 55.32 1kzw s PHE 93 Cb -0.17 -2.63 -0.03 0.00 -0.57 0.00 0.00 43.02 39.62 1kzw s PHE 93 CO 0.06 -0.83 0.54 0.21 -0.10 0.00 0.00 175.22 175.10 1kzw s LYS 94 N 1.32 4.25 -0.05 0.44 2.20 -0.42 -0.43 119.74 127.05 1kzw s LYS 94 Ca 0.01 0.49 -0.30 0.00 -0.36 0.00 0.00 55.97 55.81 1kzw s LYS 94 Cb -0.21 -3.53 -0.06 0.00 -1.51 0.00 0.00 37.83 32.52 1kzw s LYS 94 CO 0.00 -0.07 1.70 0.50 -0.36 0.00 0.00 175.35 177.12 1kzw s ARG 95 N 1.38 4.15 0.38 4.03 3.52 -0.62 -0.58 118.95 131.21 1kzw s ARG 95 Ca 0.26 2.21 0.05 0.00 -0.13 0.00 0.00 55.73 58.13 1kzw s ARG 95 Cb -0.16 -4.01 0.76 0.00 -1.56 0.00 0.00 34.95 29.98 1kzw s ARG 95 CO 0.10 -0.89 2.04 0.00 -0.81 0.00 0.00 175.30 175.74 1kzw h THR 96 N 5.63 1.12 -1.16 4.11 1.03 -1.82 -0.56 112.91 121.25 1kzw h THR 96 Ca -0.40 -0.24 -0.65 0.00 -0.01 0.00 0.00 66.41 65.11 1kzw h THR 96 Cb 1.18 0.37 -0.26 0.00 -1.07 0.00 0.00 68.15 68.37 1kzw h THR 96 CO 0.95 0.13 0.85 0.47 -0.01 0.00 0.00 175.52 177.91 1kzw n ASP 97 N -4.46 7.48 0.02 0.00 8.00 -1.26 -4.64 116.55 121.70 1kzw n ASP 97 Ca 0.05 -3.69 0.00 0.00 0.71 0.00 0.00 54.79 51.86 1kzw n ASP 97 Cb 0.06 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.14 1kzw n ASP 97 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1kzw n ASN 98 N -0.61 -0.37 0.00 -2.24 4.13 -0.73 -5.05 115.26 110.39 1kzw n ASN 98 Ca 0.57 0.09 0.00 0.00 1.68 0.00 0.00 54.58 56.91 1kzw n ASN 98 Cb 0.55 0.72 0.00 0.00 -1.54 0.00 0.00 39.78 39.51 1kzw n ASN 98 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1kzw n GLY 99 N -0.99 0.79 3.63 7.41 0.00 -0.30 -5.02 105.19 110.71 1kzw n GLY 99 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1kzw n GLY 99 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1kzw s ASN 100 N -2.13 6.60 -0.08 1.61 0.02 -1.26 -4.79 114.94 114.91 1kzw s ASN 100 Ca 0.00 0.73 -0.30 0.00 -1.02 0.00 0.00 52.86 52.27 1kzw s ASN 100 Cb 0.00 -2.35 -0.03 0.00 0.02 0.00 0.00 41.25 38.89 1kzw s ASN 100 CO 0.00 -0.40 1.33 -1.83 0.02 0.00 0.00 177.10 176.22 1kzw s GLU 101 N 2.56 4.27 -0.44 -0.60 -1.05 -1.26 -1.59 118.70 120.60 1kzw s GLU 101 Ca 0.27 1.81 -0.17 0.00 -0.15 0.00 0.00 54.97 56.73 1kzw s GLU 101 Cb -0.15 -3.68 0.03 0.00 -0.44 0.00 0.00 34.13 29.88 1kzw s GLU 101 CO 0.09 -0.62 0.44 -1.17 0.95 0.00 0.00 175.26 174.95 1kzw s LEU 102 N 2.92 4.99 -0.61 1.83 0.20 0.42 -3.30 118.68 125.12 1kzw s LEU 102 Ca 0.60 -0.80 -0.18 0.00 0.69 0.00 0.00 54.13 54.44 1kzw s LEU 102 Cb -0.26 -2.35 0.12 0.00 -0.43 0.00 0.00 46.19 43.27 1kzw s LEU 102 CO 0.22 -0.61 0.68 0.20 -0.29 0.00 0.00 176.35 176.54 1kzw s ASN 103 N 1.98 6.25 -0.39 3.68 0.01 0.06 -1.00 114.94 125.53 1kzw s ASN 103 Ca 0.11 -1.65 -0.11 0.00 -0.71 0.00 0.00 52.86 50.50 1kzw s ASN 103 Cb -0.18 -2.28 0.05 0.00 0.41 0.00 0.00 41.25 39.25 1kzw s ASN 103 CO 0.12 -1.01 0.23 -0.89 -1.51 0.00 0.00 177.10 174.05 1kzw s THR 104 N 2.23 4.50 -0.47 1.60 2.01 0.42 -1.19 115.64 124.74 1kzw s THR 104 Ca 0.11 -1.04 -0.16 0.00 0.31 0.00 0.00 61.69 60.91 1kzw s THR 104 Cb -0.24 -3.60 0.06 0.00 0.01 0.00 0.00 72.50 68.74 1kzw s THR 104 CO 0.04 -0.34 0.43 -0.69 -0.69 0.00 0.00 174.62 173.37 1kzw s VAL 105 N 1.52 5.16 -0.54 3.82 1.01 -0.28 -0.53 120.40 130.56 1kzw s VAL 105 Ca 0.02 -0.88 -0.23 0.00 0.00 0.00 0.00 61.98 60.88 1kzw s VAL 105 Cb -0.21 -4.14 0.04 0.00 0.00 0.00 0.00 36.38 32.08 1kzw s VAL 105 CO 0.05 -0.59 0.89 -0.13 0.00 0.00 0.00 175.10 175.32 1kzw s ARG 106 N 1.86 3.30 0.23 2.72 0.52 -0.24 -0.90 118.95 126.44 1kzw s ARG 106 Ca 0.07 -0.36 0.06 0.00 -0.52 0.00 0.00 55.73 54.98 1kzw s ARG 106 Cb -0.22 -4.06 -0.05 0.00 0.52 0.00 0.00 34.95 31.14 1kzw s ARG 106 CO 0.08 -1.44 -0.08 -1.83 0.02 0.00 0.00 175.30 172.05 1kzw s GLU 107 N 3.73 1.36 -0.04 3.54 4.04 -0.75 -1.11 118.70 129.48 1kzw s GLU 107 Ca 0.28 -1.65 0.04 0.00 0.04 0.00 0.00 54.97 53.68 1kzw s GLU 107 Cb -0.14 -0.95 -0.00 0.00 0.02 0.00 0.00 34.13 33.06 1kzw s GLU 107 CO 0.18 0.06 -0.15 0.42 -1.84 0.00 0.00 175.26 173.93 1kzw s ILE 108 N -3.13 1.25 0.00 1.83 1.01 -1.26 -0.04 121.20 120.85 1kzw s ILE 108 Ca 0.25 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 60.28 1kzw s ILE 108 Cb 0.03 -1.08 0.00 0.00 0.01 0.00 0.00 42.46 41.42 1kzw s ILE 108 CO 0.08 0.36 0.00 -0.38 0.00 0.00 0.00 174.94 175.00 1kzw n ILE 109 N 3.17 0.00 0.00 2.92 2.08 -1.21 -5.03 119.36 121.29 1kzw n ILE 109 Ca -0.18 0.17 0.00 0.00 0.56 0.00 0.00 62.75 63.30 1kzw n ILE 109 Cb 0.53 -1.11 0.00 0.00 -0.75 0.00 0.00 39.64 38.31 1kzw n ILE 109 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1kzw n GLY 110 N 2.17 0.84 2.43 7.39 0.00 -1.26 -4.94 105.19 111.82 1kzw n GLY 110 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1kzw n GLY 110 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1kzw n ASP 111 N 0.00 6.77 -3.64 1.61 8.00 -1.26 -4.88 116.55 123.15 1kzw n ASP 111 Ca 0.00 -3.34 -0.14 0.00 0.71 0.00 0.00 54.79 52.02 1kzw n ASP 111 Cb 0.00 -1.15 -0.13 0.00 -0.02 0.00 0.00 41.12 39.82 1kzw n ASP 111 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1kzw s GLU 112 N -2.34 0.16 -0.34 -1.24 2.02 -1.26 -1.75 118.70 113.96 1kzw s GLU 112 Ca 0.53 0.70 -0.27 0.00 0.02 0.00 0.00 54.97 55.94 1kzw s GLU 112 Cb 0.38 -0.15 0.02 0.00 0.10 0.00 0.00 34.13 34.48 1kzw s GLU 112 CO -0.19 -0.33 1.00 -1.17 0.02 0.00 0.00 175.26 174.59 1kzw s LEU 113 N 2.42 3.95 -0.49 1.80 2.96 0.57 -3.35 118.68 126.54 1kzw s LEU 113 Ca 0.02 0.83 -0.15 0.00 -0.22 0.00 0.00 54.13 54.62 1kzw s LEU 113 Cb -0.12 -3.41 0.09 0.00 0.50 0.00 0.00 46.19 43.25 1kzw s LEU 113 CO -0.09 -0.87 0.42 -0.69 -1.32 0.00 0.00 176.35 173.80 1kzw s VAL 114 N 3.58 5.13 -0.52 1.68 1.01 0.94 -0.66 120.40 131.56 1kzw s VAL 114 Ca 0.42 -1.23 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 1kzw s VAL 114 Cb -0.12 -4.14 0.08 0.00 0.00 0.00 0.00 36.38 32.20 1kzw s VAL 114 CO 0.17 -0.66 0.56 -1.58 0.00 0.00 0.00 175.10 173.59 1kzw s GLN 115 N 1.61 3.04 -0.50 2.72 0.74 0.08 -1.80 119.66 125.55 1kzw s GLN 115 Ca 0.04 -1.25 -0.16 0.00 0.05 0.00 0.00 55.36 54.04 1kzw s GLN 115 Cb -0.26 -4.18 0.09 0.00 1.10 0.00 0.00 33.01 29.76 1kzw s GLN 115 CO 0.05 -1.26 0.45 0.99 -0.55 0.00 0.00 175.29 174.97 1kzw s THR 116 N 2.22 5.20 -0.22 -0.34 2.01 -0.08 -1.18 115.64 123.25 1kzw s THR 116 Ca 0.09 -1.19 -0.15 0.00 0.31 0.00 0.00 61.69 60.75 1kzw s THR 116 Cb -0.23 -4.22 -0.04 0.00 0.01 0.00 0.00 72.50 68.02 1kzw s THR 116 CO 0.08 -0.70 0.38 -0.31 -0.69 0.00 0.00 174.62 173.37 1kzw s TYR 117 N 1.69 3.33 -0.32 4.92 1.51 0.13 -1.12 117.35 127.49 1kzw s TYR 117 Ca 0.04 0.54 0.03 0.00 -1.01 0.00 0.00 57.07 56.67 1kzw s TYR 117 Cb -0.26 -2.53 0.09 0.00 -0.11 0.00 0.00 41.96 39.15 1kzw s TYR 117 CO 0.06 -0.07 0.03 0.08 -1.11 0.00 0.00 175.55 174.54 1kzw s VAL 118 N 1.51 2.02 -0.61 0.71 1.01 -0.33 -0.84 120.40 123.87 1kzw s VAL 118 Ca 0.17 -2.04 -0.24 0.00 0.00 0.00 0.00 61.98 59.87 1kzw s VAL 118 Cb -0.15 -2.43 0.05 0.00 0.00 0.00 0.00 36.38 33.85 1kzw s VAL 118 CO 0.08 -0.50 0.98 -0.47 0.00 0.00 0.00 175.10 175.19 1kzw s TYR 119 N 1.06 2.70 0.00 5.22 5.04 -1.22 -0.76 117.35 129.40 1kzw s TYR 119 Ca 0.07 -0.23 0.00 0.00 -2.44 0.00 0.00 57.07 54.46 1kzw s TYR 119 Cb -0.19 -4.21 0.00 0.00 0.35 0.00 0.00 41.96 37.91 1kzw s TYR 119 CO -0.10 -1.53 0.00 -1.91 -1.34 0.00 0.00 175.55 170.67 1kzw n GLU 120 N 7.72 0.00 -0.43 4.97 0.00 -1.21 -3.45 120.64 128.25 1kzw n GLU 120 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 57.16 57.14 1kzw n GLU 120 Cb 0.47 -0.39 -0.01 0.00 0.00 0.00 0.00 31.44 31.51 1kzw n GLU 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1kzw n GLY 121 N 0.00 0.04 2.76 8.31 0.00 -1.26 -5.10 105.19 109.94 1kzw n GLY 121 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1kzw n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kzw s VAL 122 N 0.00 0.27 0.01 1.61 1.01 -1.22 -5.16 120.40 116.91 1kzw s VAL 122 Ca 0.00 0.16 -0.15 0.00 0.00 0.00 0.00 61.98 62.00 1kzw s VAL 122 Cb 0.00 -0.43 -0.06 0.00 0.00 0.00 0.00 36.38 35.89 1kzw s VAL 122 CO 0.00 0.23 0.41 -0.70 0.00 0.00 0.00 175.10 175.04 1kzw s GLU 123 N 1.85 3.92 -0.09 2.72 2.12 -1.26 -3.38 118.70 124.58 1kzw s GLU 123 Ca 0.02 0.41 0.01 0.00 0.36 0.00 0.00 54.97 55.77 1kzw s GLU 123 Cb -0.12 -3.21 0.02 0.00 0.26 0.00 0.00 34.13 31.07 1kzw s GLU 123 CO -0.04 0.69 -0.09 0.00 -0.54 0.00 0.00 175.26 175.27 1kzw s ALA 124 N -1.09 1.22 -0.43 6.30 0.00 -0.02 -4.50 121.76 123.24 1kzw s ALA 124 Ca 0.24 -0.43 -0.16 0.00 0.00 0.00 0.00 51.96 51.61 1kzw s ALA 124 Cb -0.17 -0.72 0.03 0.00 0.00 0.00 0.00 23.12 22.27 1kzw s ALA 124 CO 0.14 -0.16 0.35 0.15 0.00 0.00 0.00 175.76 176.24 1kzw s LYS 125 N 1.20 3.00 -0.30 0.00 1.02 -1.26 -0.70 119.74 122.70 1kzw s LYS 125 Ca -0.05 -1.04 -0.15 0.00 0.02 0.00 0.00 55.97 54.75 1kzw s LYS 125 Cb -0.14 -4.01 -0.03 0.00 -0.52 0.00 0.00 37.83 33.13 1kzw s LYS 125 CO -0.02 -0.84 0.38 1.03 -0.92 0.00 0.00 175.35 174.97 1kzw s ARG 126 N 1.78 3.83 -0.23 1.68 0.52 -0.32 -1.39 118.95 124.82 1kzw s ARG 126 Ca 0.06 -0.14 -0.06 0.00 -0.52 0.00 0.00 55.73 55.07 1kzw s ARG 126 Cb -0.20 -3.72 -0.02 0.00 0.52 0.00 0.00 34.95 31.53 1kzw s ARG 126 CO 0.10 -0.39 0.02 0.42 0.02 0.00 0.00 175.30 175.47 1kzw s ILE 127 N 2.07 3.93 -0.17 1.52 1.01 0.17 -0.74 121.20 128.99 1kzw s ILE 127 Ca 0.14 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.48 1kzw s ILE 127 Cb -0.16 -2.81 0.01 0.00 0.01 0.00 0.00 42.46 39.51 1kzw s ILE 127 CO 0.11 0.38 -0.16 -0.36 0.00 0.00 0.00 174.94 174.91 1kzw s PHE 128 N 1.46 2.79 0.42 3.97 0.40 0.17 -0.94 117.98 126.26 1kzw s PHE 128 Ca 0.05 -1.26 -0.22 0.00 -0.60 0.00 0.00 56.93 54.90 1kzw s PHE 128 Cb -0.15 -1.92 -0.10 0.00 0.51 0.00 0.00 43.02 41.36 1kzw s PHE 128 CO 0.01 -0.61 0.99 0.21 0.70 0.00 0.00 175.22 176.52 1kzw s LYS 129 N 1.07 4.17 -0.15 0.44 2.20 0.12 -0.32 119.74 127.28 1kzw s LYS 129 Ca -0.00 1.29 -0.30 0.00 -0.36 0.00 0.00 55.97 56.60 1kzw s LYS 129 Cb -0.14 -2.33 -0.07 0.00 -1.51 0.00 0.00 37.83 33.77 1kzw s LYS 129 CO -0.05 -0.10 2.13 1.17 -0.36 0.00 0.00 175.35 178.14 1kzw n LYS 130 N -0.41 2.17 -0.59 4.03 3.00 -0.71 -2.04 118.16 123.61 1kzw n LYS 130 Ca 0.06 0.68 0.00 0.00 -0.00 0.00 0.00 58.31 59.05 1kzw n LYS 130 Cb 0.52 -3.08 0.00 0.00 0.00 0.00 0.00 35.03 32.48 1kzw n LYS 130 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93