#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 0.00 -2.04 0.00 3.72 -1.26 -4.89 117.46 112.99 1kzw n PHE 2 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 1kzw n PHE 2 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 1kzw n PHE 2 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1kzw n ASP 3 N 2.23 3.79 -2.74 4.37 -0.08 -1.26 -4.60 116.55 118.26 1kzw n ASP 3 Ca 0.00 -2.80 -0.06 0.00 -1.51 0.00 0.00 54.79 50.42 1kzw n ASP 3 Cb 0.00 -1.63 0.02 0.00 2.34 0.00 0.00 41.12 41.86 1kzw n ASP 3 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1kzw n SER 4 N 9.64 -1.90 -4.71 1.67 2.88 -1.10 -4.95 113.62 115.15 1kzw n SER 4 Ca 0.48 -2.23 -0.40 0.00 -1.33 0.00 0.00 58.87 55.40 1kzw n SER 4 Cb 0.44 3.15 -0.05 0.00 -0.75 0.00 0.00 64.21 67.00 1kzw n SER 4 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1kzw s THR 5 N -2.17 5.06 -0.21 2.46 2.01 -1.26 -0.93 115.64 120.61 1kzw s THR 5 Ca 0.16 1.35 -0.00 0.00 0.31 0.00 0.00 61.69 63.51 1kzw s THR 5 Cb -0.04 -4.00 0.05 0.00 0.01 0.00 0.00 72.50 68.53 1kzw s THR 5 CO 0.09 0.24 -0.04 0.26 -0.69 0.00 0.00 174.62 174.48 1kzw s TRP 6 N 0.94 1.98 -0.10 4.92 0.52 -0.12 -0.45 118.94 126.63 1kzw s TRP 6 Ca 0.35 -1.41 -0.10 0.00 0.02 0.00 0.00 56.10 54.95 1kzw s TRP 6 Cb -0.17 -1.42 -0.05 0.00 -1.15 0.00 0.00 33.47 30.69 1kzw s TRP 6 CO 0.16 -0.70 0.24 0.21 0.02 0.00 0.00 176.95 176.87 1kzw s LYS 7 N 1.54 3.77 -0.07 4.98 2.47 -0.15 -0.85 119.74 131.42 1kzw s LYS 7 Ca -0.03 0.05 -0.29 0.00 -1.56 0.00 0.00 55.97 54.14 1kzw s LYS 7 Cb -0.17 -3.26 -0.06 0.00 -1.46 0.00 0.00 37.83 32.88 1kzw s LYS 7 CO -0.07 0.63 1.82 0.54 0.16 0.00 0.00 175.35 178.42 1kzw s VAL 8 N -0.68 3.35 -0.10 4.02 0.11 -0.65 -0.59 120.40 125.85 1kzw s VAL 8 Ca 0.17 0.41 -0.13 0.00 -2.93 0.00 0.00 61.98 59.50 1kzw s VAL 8 Cb -0.13 -3.30 -0.04 0.00 -1.53 0.00 0.00 36.38 31.38 1kzw s VAL 8 CO 0.06 -0.07 -0.25 -0.67 -3.33 0.00 0.00 175.10 170.84 1kzw n ASP 9 N 7.97 1.70 -4.28 3.54 -0.08 -0.52 -4.88 116.55 120.00 1kzw n ASP 9 Ca 0.20 0.27 -0.15 0.00 -1.51 0.00 0.00 54.79 53.60 1kzw n ASP 9 Cb 0.43 -0.62 -0.10 0.00 2.34 0.00 0.00 41.12 43.16 1kzw n ASP 9 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1kzw s ARG 10 N -2.64 1.25 -0.18 -0.67 1.70 -0.82 -5.04 118.95 112.54 1kzw s ARG 10 Ca -0.21 -1.64 -0.08 0.00 -0.47 0.00 0.00 55.73 53.34 1kzw s ARG 10 Cb 0.03 -0.31 0.08 0.00 -0.57 0.00 0.00 34.95 34.18 1kzw s ARG 10 CO 0.31 -0.19 0.40 -1.12 -1.08 0.00 0.00 175.30 173.62 1kzw s SER 11 N -3.24 -0.30 0.00 -2.89 0.01 -1.26 -1.01 113.70 105.01 1kzw s SER 11 Ca 0.30 0.92 0.00 0.00 1.31 0.00 0.00 55.95 58.48 1kzw s SER 11 Cb 0.07 1.08 0.00 0.00 0.21 0.00 0.00 66.02 67.38 1kzw s SER 11 CO 0.08 -0.22 0.00 1.21 0.41 0.00 0.00 173.24 174.72 1kzw n GLU 12 N 4.97 0.00 -2.52 12.44 2.13 -0.02 -4.57 120.64 133.07 1kzw n GLU 12 Ca -0.14 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.33 1kzw n GLU 12 Cb 0.52 -0.38 0.01 0.00 0.27 0.00 0.00 31.44 31.86 1kzw n GLU 12 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1kzw n ASN 13 N -0.53 6.25 -3.67 4.31 5.15 -1.26 -4.94 115.26 120.56 1kzw n ASN 13 Ca 0.00 -3.73 -0.41 0.00 -0.60 0.00 0.00 54.58 49.84 1kzw n ASN 13 Cb 0.00 -0.88 -0.00 0.00 -0.53 0.00 0.00 39.78 38.37 1kzw n ASN 13 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1kzw n TYR 14 N -0.29 2.85 0.09 1.20 9.36 -1.26 -3.96 117.16 125.15 1kzw n TYR 14 Ca 0.43 -2.85 0.00 0.00 3.32 0.00 0.00 57.90 58.80 1kzw n TYR 14 Cb 0.35 -2.05 0.00 0.00 -0.63 0.00 0.00 39.34 37.01 1kzw n TYR 14 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1kzw n ASP 15 N 3.52 -1.49 -0.07 2.98 5.75 -1.26 -4.75 116.55 121.23 1kzw n ASP 15 Ca 0.52 0.33 -0.10 0.00 -0.01 0.00 0.00 54.79 55.54 1kzw n ASP 15 Cb 0.32 1.67 -0.02 0.00 -1.03 0.00 0.00 41.12 42.05 1kzw n ASP 15 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 1kzw h LYS 16 N 0.00 0.35 -0.57 0.11 3.11 -2.00 -1.36 116.57 116.22 1kzw h LYS 16 Ca 0.00 -0.03 0.07 0.00 -2.81 0.00 0.00 60.65 57.88 1kzw h LYS 16 Cb 0.00 -0.08 -0.10 0.00 -1.00 0.00 0.00 32.23 31.06 1kzw h LYS 16 CO 0.00 0.27 -0.52 0.35 -2.81 0.00 0.00 179.45 176.74 1kzw h PHE 17 N 0.34 -1.58 -0.69 1.91 3.57 -1.93 -0.35 116.94 118.21 1kzw h PHE 17 Ca 0.09 0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.71 1kzw h PHE 17 Cb 0.00 0.77 -0.04 0.00 2.79 0.00 0.00 35.95 39.47 1kzw h PHE 17 CO -0.05 -0.45 0.44 0.52 -2.23 0.00 0.00 178.31 176.54 1kzw h MET 18 N -0.27 0.85 -0.78 1.11 2.86 -1.83 0.04 114.93 116.90 1kzw h MET 18 Ca 0.13 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 1kzw h MET 18 Cb 0.56 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 1kzw h MET 18 CO -0.69 0.56 0.46 1.49 1.06 0.00 0.00 176.91 179.79 1kzw h GLU 19 N 0.87 1.06 -0.61 1.72 4.81 -1.19 -2.29 114.58 118.94 1kzw h GLU 19 Ca 0.27 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1kzw h GLU 19 Cb -0.02 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.11 1kzw h GLU 19 CO -0.09 0.76 0.27 -0.22 -0.73 0.00 0.00 179.01 179.00 1kzw h LYS 20 N 1.07 0.88 0.00 1.92 3.64 -0.71 -2.40 116.57 120.96 1kzw h LYS 20 Ca 0.28 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1kzw h LYS 20 Cb -0.02 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1kzw h LYS 20 CO -0.05 0.70 -0.00 0.52 -2.27 0.00 0.00 179.45 178.35 1kzw h MET 21 N 0.87 0.00 -0.51 1.90 2.86 -0.94 -3.48 114.93 115.63 1kzw h MET 21 Ca 0.21 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1kzw h MET 21 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1kzw h MET 21 CO -0.02 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.36 1kzw n GLY 22 N -0.52 0.60 3.26 8.32 0.00 -0.90 -5.07 105.19 110.88 1kzw n GLY 22 Ca -0.01 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 1kzw n GLY 22 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1kzw s VAL 23 N -1.74 1.78 0.90 1.61 -7.23 -0.96 -5.03 120.40 109.71 1kzw s VAL 23 Ca 0.00 -1.11 -0.12 0.00 -1.81 0.00 0.00 61.98 58.94 1kzw s VAL 23 Cb 0.00 -1.51 0.13 0.00 0.56 0.00 0.00 36.38 35.56 1kzw s VAL 23 CO 0.00 0.37 1.14 0.54 -0.31 0.00 0.00 175.10 176.83 1kzw s ASN 24 N -0.88 3.63 0.26 4.85 2.20 -1.26 -4.39 114.94 119.35 1kzw s ASN 24 Ca 0.09 0.98 -0.01 0.00 -0.94 0.00 0.00 52.86 52.97 1kzw s ASN 24 Cb -0.09 -1.56 0.52 0.00 -2.00 0.00 0.00 41.25 38.12 1kzw s ASN 24 CO 0.01 -2.48 1.78 -0.29 -2.94 0.00 0.00 177.10 173.17 1kzw h ILE 25 N -1.45 0.78 -0.19 0.54 -0.00 -2.01 0.09 117.51 115.27 1kzw h ILE 25 Ca -0.50 -0.24 0.02 0.00 -0.00 0.00 0.00 64.86 64.14 1kzw h ILE 25 Cb 1.33 0.03 -0.02 0.00 -0.00 0.00 0.00 36.82 38.15 1kzw h ILE 25 CO 0.62 0.13 0.06 0.58 -0.00 0.00 0.00 178.15 179.53 1kzw h VAL 26 N 0.69 0.94 -0.87 2.19 2.07 -1.99 -1.05 116.25 118.23 1kzw h VAL 26 Ca 0.46 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.91 1kzw h VAL 26 Cb 0.60 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 1kzw h VAL 26 CO -0.33 0.03 0.46 0.11 0.02 0.00 0.00 177.57 177.85 1kzw h LYS 27 N 0.14 1.22 -0.62 1.57 6.56 -1.84 0.27 116.57 123.87 1kzw h LYS 27 Ca 0.08 -0.15 0.08 0.00 -1.06 0.00 0.00 60.65 59.60 1kzw h LYS 27 Cb 0.06 -0.23 -0.04 0.00 -0.57 0.00 0.00 32.23 31.45 1kzw h LYS 27 CO -0.09 0.90 0.41 0.00 -2.06 0.00 0.00 179.45 178.61 1kzw h ARG 28 N 1.22 0.52 0.29 3.15 -0.00 -0.84 0.63 114.38 119.35 1kzw h ARG 28 Ca 0.30 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.98 59.74 1kzw h ARG 28 Cb 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 29.97 29.91 1kzw h ARG 28 CO -0.05 0.35 -0.14 -0.22 0.00 0.00 0.00 179.97 179.91 1kzw h LYS 29 N 0.54 -0.37 0.18 0.04 3.11 -1.00 -3.22 116.57 115.86 1kzw h LYS 29 Ca 0.27 0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 58.13 1kzw h LYS 29 Cb 0.38 0.08 0.00 0.00 -1.00 0.00 0.00 32.23 31.69 1kzw h LYS 29 CO -0.08 -0.03 -0.09 -0.07 -2.81 0.00 0.00 179.45 176.37 1kzw h LEU 30 N -0.90 -0.21 0.00 5.20 3.38 -0.87 -1.23 115.31 120.68 1kzw h LEU 30 Ca -0.04 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1kzw h LEU 30 Cb 0.51 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1kzw h LEU 30 CO 0.06 0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.71 1kzw n ALA 31 N -2.37 2.13 -0.01 1.53 0.00 0.20 -2.40 120.51 119.59 1kzw n ALA 31 Ca -0.09 -0.11 -0.04 0.00 0.00 0.00 0.00 53.44 53.20 1kzw n ALA 31 Cb 0.22 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 1kzw n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kzw h ALA 32 N 3.05 -0.09 -0.56 0.00 0.00 -1.56 -3.42 119.26 116.68 1kzw h ALA 32 Ca 0.00 -0.11 -0.57 0.00 0.00 0.00 0.00 54.91 54.23 1kzw h ALA 32 Cb 0.16 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 17.83 1kzw h ALA 32 CO 0.00 -0.09 0.97 0.72 0.00 0.00 0.00 179.25 180.85 1kzw n HIS 33 N -4.81 1.87 1.15 0.00 8.25 -0.47 -4.72 115.22 116.49 1kzw n HIS 33 Ca -0.03 -2.19 0.12 0.00 -0.26 0.00 0.00 57.72 55.36 1kzw n HIS 33 Cb 0.13 -1.51 0.36 0.00 1.12 0.00 0.00 29.99 30.08 1kzw n HIS 33 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1kzw n ASP 34 N 1.13 2.09 -3.48 0.41 5.75 -1.01 -4.89 116.55 116.56 1kzw n ASP 34 Ca 0.53 -1.73 -0.22 0.00 -0.01 0.00 0.00 54.79 53.35 1kzw n ASP 34 Cb 0.47 -0.07 0.06 0.00 -1.03 0.00 0.00 41.12 40.54 1kzw n ASP 34 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1kzw n ASN 35 N 0.61 -5.32 -4.58 -1.12 3.02 -1.26 -0.89 115.26 105.72 1kzw n ASN 35 Ca 0.17 -0.84 -0.41 0.00 -0.03 0.00 0.00 54.58 53.47 1kzw n ASN 35 Cb 0.42 -4.34 -0.07 0.00 -0.61 0.00 0.00 39.78 35.18 1kzw n ASN 35 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1kzw s LEU 36 N -6.01 4.22 -0.27 3.41 2.96 -1.26 -4.23 118.68 117.50 1kzw s LEU 36 Ca 0.40 0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 54.52 1kzw s LEU 36 Cb -0.09 -2.69 0.04 0.00 0.50 0.00 0.00 46.19 43.94 1kzw s LEU 36 CO 0.80 -0.46 -0.04 -0.75 -1.32 0.00 0.00 176.35 174.58 1kzw s LYS 37 N 2.49 2.57 -0.55 1.98 2.20 -0.30 -1.64 119.74 126.50 1kzw s LYS 37 Ca 0.22 -1.16 -0.16 0.00 -0.36 0.00 0.00 55.97 54.50 1kzw s LYS 37 Cb -0.15 -3.07 0.12 0.00 -1.51 0.00 0.00 37.83 33.23 1kzw s LYS 37 CO 0.12 -0.52 0.53 -0.51 -0.36 0.00 0.00 175.35 174.61 1kzw s LEU 38 N 1.26 6.04 -0.45 5.43 1.43 -0.03 -1.36 118.68 131.00 1kzw s LEU 38 Ca -0.03 -1.72 -0.20 0.00 -1.03 0.00 0.00 54.13 51.15 1kzw s LEU 38 Cb -0.18 -2.23 0.03 0.00 0.03 0.00 0.00 46.19 43.84 1kzw s LEU 38 CO -0.03 -0.90 0.63 -0.89 0.23 0.00 0.00 176.35 175.39 1kzw s THR 39 N 1.79 4.85 -0.10 5.49 2.01 -0.47 -0.94 115.64 128.26 1kzw s THR 39 Ca 0.04 -0.05 -0.02 0.00 0.31 0.00 0.00 61.69 61.97 1kzw s THR 39 Cb -0.29 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 67.97 1kzw s THR 39 CO 0.04 -0.64 -0.02 -0.63 -0.69 0.00 0.00 174.62 172.68 1kzw s ILE 40 N 2.75 4.12 -0.14 1.82 1.01 -0.10 -0.72 121.20 129.94 1kzw s ILE 40 Ca 0.20 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.49 1kzw s ILE 40 Cb -0.15 -2.74 0.06 0.00 0.01 0.00 0.00 42.46 39.64 1kzw s ILE 40 CO 0.17 0.58 0.29 -0.89 0.00 0.00 0.00 174.94 175.08 1kzw s THR 41 N -0.57 -0.35 -0.48 2.92 2.01 -0.14 -2.70 115.64 116.33 1kzw s THR 41 Ca 0.09 0.23 -0.24 0.00 0.31 0.00 0.00 61.69 62.08 1kzw s THR 41 Cb -0.12 -0.47 0.03 0.00 0.01 0.00 0.00 72.50 71.95 1kzw s THR 41 CO 0.02 0.10 0.86 -1.58 -0.69 0.00 0.00 174.62 173.33 1kzw s GLN 42 N 2.16 3.42 -1.21 4.92 0.74 -1.26 -0.51 119.66 127.92 1kzw s GLN 42 Ca -0.02 -0.07 -0.11 0.00 0.05 0.00 0.00 55.36 55.21 1kzw s GLN 42 Cb -0.11 -3.96 0.20 0.00 1.10 0.00 0.00 33.01 30.23 1kzw s GLN 42 CO -0.09 -1.24 1.54 -1.91 -0.55 0.00 0.00 175.29 173.04 1kzw n GLU 43 N 7.02 3.57 0.00 1.67 2.13 0.09 -4.94 120.64 130.18 1kzw n GLU 43 Ca 0.03 -3.88 0.00 0.00 0.66 0.00 0.00 57.16 53.97 1kzw n GLU 43 Cb 0.48 -2.90 0.00 0.00 0.27 0.00 0.00 31.44 29.29 1kzw n GLU 43 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1kzw n GLY 44 N 3.28 1.08 0.01 8.31 0.00 -1.26 -1.63 105.19 114.98 1kzw n GLY 44 Ca 0.35 0.33 0.11 0.00 0.00 0.00 0.00 46.02 46.81 1kzw n GLY 44 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1kzw n ASN 45 N 7.10 0.72 -4.39 1.61 4.13 -1.26 -4.92 115.26 118.25 1kzw n ASN 45 Ca 0.00 -0.55 -0.45 0.00 1.68 0.00 0.00 54.58 55.26 1kzw n ASN 45 Cb 0.00 0.78 -0.05 0.00 -1.54 0.00 0.00 39.78 38.97 1kzw n ASN 45 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1kzw s LYS 46 N -3.07 3.05 -0.43 3.52 1.02 -0.64 -1.47 119.74 121.71 1kzw s LYS 46 Ca 0.07 -1.26 -0.27 0.00 0.02 0.00 0.00 55.97 54.53 1kzw s LYS 46 Cb 0.16 -4.21 0.02 0.00 -0.52 0.00 0.00 37.83 33.28 1kzw s LYS 46 CO 0.81 -1.38 1.02 -0.06 -0.92 0.00 0.00 175.35 174.81 1kzw s PHE 47 N 2.44 2.94 -0.56 3.18 0.08 0.03 -0.74 117.98 125.35 1kzw s PHE 47 Ca 0.11 0.67 -0.24 0.00 0.12 0.00 0.00 56.93 57.58 1kzw s PHE 47 Cb -0.24 -4.05 0.04 0.00 -0.57 0.00 0.00 43.02 38.20 1kzw s PHE 47 CO 0.07 -1.08 0.95 0.99 -0.10 0.00 0.00 175.22 176.06 1kzw s THR 48 N 3.95 4.37 -0.38 0.64 2.01 0.34 -1.54 115.64 125.02 1kzw s THR 48 Ca 0.42 0.24 -0.04 0.00 0.31 0.00 0.00 61.69 62.63 1kzw s THR 48 Cb -0.10 -4.56 0.09 0.00 0.01 0.00 0.00 72.50 67.94 1kzw s THR 48 CO 0.26 -1.16 0.16 -0.69 -0.69 0.00 0.00 174.62 172.50 1kzw s VAL 49 N 4.01 3.36 -0.52 3.82 1.01 -0.03 -0.96 120.40 131.08 1kzw s VAL 49 Ca 0.30 -1.79 -0.25 0.00 0.00 0.00 0.00 61.98 60.25 1kzw s VAL 49 Cb -0.13 -3.17 0.04 0.00 0.00 0.00 0.00 36.38 33.11 1kzw s VAL 49 CO 0.19 -0.52 0.94 -0.75 0.00 0.00 0.00 175.10 174.96 1kzw s LYS 50 N 1.21 3.41 -0.92 2.72 2.20 0.10 -0.97 119.74 127.49 1kzw s LYS 50 Ca 0.04 -0.10 -0.13 0.00 -0.36 0.00 0.00 55.97 55.42 1kzw s LYS 50 Cb -0.22 -4.00 0.22 0.00 -1.51 0.00 0.00 37.83 32.32 1kzw s LYS 50 CO -0.02 -1.39 0.91 -1.21 -0.36 0.00 0.00 175.35 173.28 1kzw s GLU 51 N 3.89 3.76 -0.30 4.03 2.02 -0.07 -1.37 118.70 130.65 1kzw s GLU 51 Ca 0.33 -2.57 -0.22 0.00 0.02 0.00 0.00 54.97 52.54 1kzw s GLU 51 Cb -0.11 -4.53 -0.00 0.00 0.10 0.00 0.00 34.13 29.58 1kzw s GLU 51 CO 0.22 -1.35 0.71 0.45 0.02 0.00 0.00 175.26 175.31 1kzw s SER 52 N 2.15 6.59 0.16 -0.19 0.15 -0.46 -2.58 113.70 119.52 1kzw s SER 52 Ca 0.23 0.57 -0.08 0.00 0.70 0.00 0.00 55.95 57.37 1kzw s SER 52 Cb -0.09 -2.37 -0.01 0.00 -1.71 0.00 0.00 66.02 61.84 1kzw s SER 52 CO -0.08 -0.54 0.26 -0.94 1.20 0.00 0.00 173.24 173.13 1kzw s SER 53 N 1.61 0.07 0.57 5.45 1.04 -0.77 -1.15 113.70 120.52 1kzw s SER 53 Ca 0.29 -0.90 0.26 0.00 0.48 0.00 0.00 55.95 56.08 1kzw s SER 53 Cb -0.15 0.42 1.56 0.00 0.10 0.00 0.00 66.02 67.95 1kzw s SER 53 CO 0.12 -0.87 2.12 0.00 0.98 0.00 0.00 173.24 175.59 1kzw h ALA 54 N 2.59 1.91 0.04 5.32 0.00 -1.23 -3.08 119.26 124.81 1kzw h ALA 54 Ca -0.32 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1kzw h ALA 54 Cb 1.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1kzw h ALA 54 CO 0.50 -0.24 -0.02 0.74 0.00 0.00 0.00 179.25 180.23 1kzw h PHE 55 N 0.00 -0.05 -2.01 0.00 -1.00 -1.87 -3.50 116.94 108.51 1kzw h PHE 55 Ca 0.08 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.84 1kzw h PHE 55 Cb 0.38 0.02 -0.19 0.00 3.61 0.00 0.00 35.95 39.77 1kzw h PHE 55 CO 0.00 0.59 0.29 -0.98 -1.61 0.00 0.00 178.31 176.60 1kzw s ARG 56 N -3.02 0.96 -0.58 1.51 1.70 -1.16 -5.10 118.95 113.26 1kzw s ARG 56 Ca -0.15 0.14 -0.02 0.00 -0.47 0.00 0.00 55.73 55.23 1kzw s ARG 56 Cb -0.01 0.45 0.15 0.00 -0.57 0.00 0.00 34.95 34.98 1kzw s ARG 56 CO 0.58 -0.32 0.38 0.54 -1.08 0.00 0.00 175.30 175.40 1kzw s ASN 57 N -1.38 5.09 -0.17 -2.89 4.22 -1.26 -1.85 114.94 116.70 1kzw s ASN 57 Ca -0.07 -2.78 -0.01 0.00 -2.14 0.00 0.00 52.86 47.87 1kzw s ASN 57 Cb -0.00 -1.81 -0.01 0.00 1.28 0.00 0.00 41.25 40.71 1kzw s ASN 57 CO 0.05 -0.37 -0.12 0.27 -2.04 0.00 0.00 177.10 174.89 1kzw s ILE 58 N 0.05 2.90 -0.65 0.54 -4.36 -1.06 -4.92 121.20 113.70 1kzw s ILE 58 Ca 0.16 -0.68 -0.24 0.00 -0.26 0.00 0.00 60.65 59.63 1kzw s ILE 58 Cb -0.21 -2.25 0.06 0.00 1.25 0.00 0.00 42.46 41.30 1kzw s ILE 58 CO -0.03 0.50 1.02 -0.70 0.24 0.00 0.00 174.94 175.96 1kzw s GLU 59 N 0.88 3.17 -0.49 0.37 2.12 -1.26 -0.89 118.70 122.59 1kzw s GLU 59 Ca -0.03 -0.61 -0.18 0.00 0.36 0.00 0.00 54.97 54.51 1kzw s GLU 59 Cb -0.15 -4.18 0.06 0.00 0.26 0.00 0.00 34.13 30.12 1kzw s GLU 59 CO -0.00 -1.81 0.53 0.08 -0.54 0.00 0.00 175.26 173.51 1kzw s VAL 60 N 4.34 5.03 -0.68 3.70 1.01 -0.14 -4.89 120.40 128.77 1kzw s VAL 60 Ca 0.26 -0.73 -0.18 0.00 0.00 0.00 0.00 61.98 61.33 1kzw s VAL 60 Cb -0.14 -4.22 0.12 0.00 0.00 0.00 0.00 36.38 32.14 1kzw s VAL 60 CO 0.13 -0.70 0.79 -0.69 0.00 0.00 0.00 175.10 174.62 1kzw s VAL 61 N 2.21 4.91 -0.19 2.92 1.01 -1.26 -0.85 120.40 129.15 1kzw s VAL 61 Ca 0.10 -1.30 -0.06 0.00 0.00 0.00 0.00 61.98 60.72 1kzw s VAL 61 Cb -0.21 -4.54 -0.03 0.00 0.00 0.00 0.00 36.38 31.60 1kzw s VAL 61 CO 0.10 -1.18 0.03 0.72 0.00 0.00 0.00 175.10 174.77 1kzw s PHE 62 N 2.33 3.14 -0.07 5.22 -0.12 -0.59 -4.91 117.98 122.99 1kzw s PHE 62 Ca 0.16 -0.15 -0.25 0.00 -0.05 0.00 0.00 56.93 56.65 1kzw s PHE 62 Cb -0.19 -2.07 -0.03 0.00 -0.63 0.00 0.00 43.02 40.10 1kzw s PHE 62 CO 0.01 -0.01 0.76 -2.00 -0.05 0.00 0.00 175.22 173.94 1kzw s GLU 63 N 0.60 4.44 0.14 1.99 2.12 -1.26 -0.79 118.70 125.94 1kzw s GLU 63 Ca 0.01 0.98 -0.31 0.00 0.36 0.00 0.00 54.97 56.02 1kzw s GLU 63 Cb -0.13 -3.47 -0.11 0.00 0.26 0.00 0.00 34.13 30.68 1kzw s GLU 63 CO 0.02 -0.01 1.83 -0.51 -0.54 0.00 0.00 175.26 176.05 1kzw s LEU 64 N 1.02 4.40 0.00 2.70 1.43 -0.54 -1.74 118.68 125.95 1kzw s LEU 64 Ca 0.40 2.80 0.00 0.00 -1.03 0.00 0.00 54.13 56.30 1kzw s LEU 64 Cb -0.18 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.47 1kzw s LEU 64 CO 0.19 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.37 1kzw n GLY 65 N 4.22 2.78 3.72 -3.19 0.00 -0.28 -5.00 105.19 107.45 1kzw n GLY 65 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1kzw n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kzw s VAL 66 N -2.00 5.00 -0.12 1.61 1.01 -0.71 -4.93 120.40 120.26 1kzw s VAL 66 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 61.98 63.16 1kzw s VAL 66 Cb 0.00 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1kzw s VAL 66 CO 0.00 0.27 1.25 0.28 0.00 0.00 0.00 175.10 176.90 1kzw s THR 67 N 0.65 4.26 0.09 3.92 -1.32 -1.26 -4.51 115.64 117.47 1kzw s THR 67 Ca 0.38 1.55 -0.04 0.00 -1.21 0.00 0.00 61.69 62.37 1kzw s THR 67 Cb -0.18 -4.00 -0.03 0.00 -1.51 0.00 0.00 72.50 66.78 1kzw s THR 67 CO 0.19 -0.09 0.08 0.72 -2.21 0.00 0.00 174.62 173.31 1kzw s PHE 68 N 3.04 0.48 -0.55 9.09 -0.71 -0.22 -4.85 117.98 124.27 1kzw s PHE 68 Ca 0.55 -0.94 -0.21 0.00 -1.04 0.00 0.00 56.93 55.30 1kzw s PHE 68 Cb -0.23 -0.28 0.06 0.00 -1.21 0.00 0.00 43.02 41.36 1kzw s PHE 68 CO 0.17 -0.49 0.75 -0.80 -1.34 0.00 0.00 175.22 173.52 1kzw s ASN 69 N -2.94 6.24 -0.08 1.98 -0.87 -1.26 -1.45 114.94 116.57 1kzw s ASN 69 Ca 0.11 -0.85 -0.05 0.00 -1.57 0.00 0.00 52.86 50.50 1kzw s ASN 69 Cb 0.07 -2.34 -0.04 0.00 -0.02 0.00 0.00 41.25 38.91 1kzw s ASN 69 CO -0.07 -1.07 0.14 -0.47 -2.57 0.00 0.00 177.10 173.06 1kzw s TYR 70 N 3.13 3.53 -0.29 2.20 5.04 0.68 -4.91 117.35 126.73 1kzw s TYR 70 Ca 0.19 0.44 -0.02 0.00 -2.44 0.00 0.00 57.07 55.24 1kzw s TYR 70 Cb -0.18 -1.88 0.10 0.00 0.35 0.00 0.00 41.96 40.34 1kzw s TYR 70 CO 0.13 0.68 0.10 -0.80 -1.34 0.00 0.00 175.55 174.32 1kzw s ASN 71 N -1.31 3.77 -0.88 4.32 0.01 -1.26 -0.64 114.94 118.94 1kzw s ASN 71 Ca 0.19 -1.45 -0.25 0.00 -0.71 0.00 0.00 52.86 50.64 1kzw s ASN 71 Cb -0.12 -0.67 0.01 0.00 0.41 0.00 0.00 41.25 40.88 1kzw s ASN 71 CO 0.08 -0.41 1.58 -0.76 -1.51 0.00 0.00 177.10 176.08 1kzw s LEU 72 N 1.80 3.32 0.00 0.60 1.43 -1.12 -4.81 118.68 119.91 1kzw s LEU 72 Ca 0.09 -0.84 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 1kzw s LEU 72 Cb -0.17 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.49 1kzw s LEU 72 CO -0.27 -1.98 0.00 0.00 0.23 0.00 0.00 176.35 174.33 1kzw n ALA 73 N 10.66 0.00 -1.06 4.21 0.00 -1.26 -3.52 120.51 129.55 1kzw n ALA 73 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1kzw n ALA 73 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1kzw n ALA 73 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1kzw n ASP 74 N 0.00 0.00 -2.68 0.00 2.03 -1.26 -4.66 116.55 109.97 1kzw n ASP 74 Ca 0.00 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.26 1kzw n ASP 74 Cb 0.00 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.47 1kzw n ASP 74 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1kzw n GLY 75 N 2.69 -0.19 3.46 0.27 0.00 -1.23 -5.08 105.19 105.11 1kzw n GLY 75 Ca 0.00 0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 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 0.12 4.35 -0.40 2.61 2.01 -1.26 -4.92 115.64 118.16 1kzw s THR 76 Ca 0.16 -0.26 -0.23 0.00 0.31 0.00 0.00 61.69 61.67 1kzw s THR 76 Cb 0.25 -4.65 0.02 0.00 0.01 0.00 0.00 72.50 68.13 1kzw s THR 76 CO -0.09 -1.38 0.75 -1.61 -0.69 0.00 0.00 174.62 171.60 1kzw s GLU 77 N 4.00 3.57 -0.20 4.92 2.02 -1.26 -2.79 118.70 128.96 1kzw s GLU 77 Ca 0.23 0.06 0.00 0.00 0.02 0.00 0.00 54.97 55.28 1kzw s GLU 77 Cb -0.16 -3.87 0.05 0.00 0.10 0.00 0.00 34.13 30.25 1kzw s GLU 77 CO 0.12 -0.95 -0.05 -0.51 0.02 0.00 0.00 175.26 173.88 1kzw s LEU 78 N 3.10 2.09 -0.29 1.80 1.43 0.18 -1.26 118.68 125.74 1kzw s LEU 78 Ca 0.29 -0.94 -0.20 0.00 -1.03 0.00 0.00 54.13 52.25 1kzw s LEU 78 Cb -0.13 -1.05 -0.01 0.00 0.03 0.00 0.00 46.19 45.03 1kzw s LEU 78 CO 0.19 -0.21 0.59 0.00 0.23 0.00 0.00 176.35 177.15 1kzw s ARG 79 N 1.51 3.95 0.00 1.70 1.70 0.05 -0.23 118.95 127.63 1kzw s ARG 79 Ca -0.03 0.31 0.00 0.00 -0.47 0.00 0.00 55.73 55.54 1kzw s ARG 79 Cb -0.17 -3.70 0.00 0.00 -0.57 0.00 0.00 34.95 30.50 1kzw s ARG 79 CO -0.07 -0.50 0.00 0.41 -1.08 0.00 0.00 175.30 174.06 1kzw n GLY 80 N 4.41 -0.52 2.99 3.88 0.00 -0.53 -1.45 105.19 113.98 1kzw n GLY 80 Ca -0.02 -0.92 -0.23 0.00 0.00 0.00 0.00 46.02 44.85 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 -3.11 0.98 -0.09 2.61 -4.23 -0.42 -1.05 115.64 110.33 1kzw s THR 81 Ca 0.00 -0.39 -0.17 0.00 -1.18 0.00 0.00 61.69 59.95 1kzw s THR 81 Cb 0.00 -0.92 -0.05 0.00 1.34 0.00 0.00 72.50 72.88 1kzw s THR 81 CO 0.00 0.32 0.45 0.26 -0.54 0.00 0.00 174.62 175.11 1kzw s TRP 82 N 0.73 3.56 -0.07 3.99 0.52 -1.26 -0.76 118.94 125.65 1kzw s TRP 82 Ca -0.14 0.89 0.01 0.00 0.02 0.00 0.00 56.10 56.89 1kzw s TRP 82 Cb -0.15 -2.48 0.02 0.00 -1.15 0.00 0.00 33.47 29.71 1kzw s TRP 82 CO 0.03 0.28 -0.10 -1.12 0.02 0.00 0.00 176.95 176.06 1kzw s SER 83 N 0.22 1.73 -0.12 2.95 0.01 -0.36 -1.12 113.70 117.01 1kzw s SER 83 Ca 0.25 -0.27 -0.28 0.00 1.31 0.00 0.00 55.95 56.96 1kzw s SER 83 Cb -0.15 -0.76 -0.01 0.00 0.21 0.00 0.00 66.02 65.30 1kzw s SER 83 CO 0.10 -0.02 0.93 -0.22 0.41 0.00 0.00 173.24 174.44 1kzw s LEU 84 N 0.98 4.23 -0.54 2.44 2.96 -1.26 -1.07 118.68 126.41 1kzw s LEU 84 Ca -0.09 1.39 0.05 0.00 -0.22 0.00 0.00 54.13 55.26 1kzw s LEU 84 Cb -0.15 -3.42 0.17 0.00 0.50 0.00 0.00 46.19 43.30 1kzw s LEU 84 CO 0.00 -0.40 0.42 -0.62 -1.32 0.00 0.00 176.35 174.43 1kzw n GLU 85 N 4.97 0.96 0.00 1.98 -0.58 0.29 -5.00 120.64 123.26 1kzw n GLU 85 Ca 0.07 -3.78 0.00 0.00 -0.42 0.00 0.00 57.16 53.03 1kzw n GLU 85 Cb 0.49 -1.94 0.00 0.00 -0.57 0.00 0.00 31.44 29.42 1kzw n GLU 85 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1kzw n GLY 86 N 2.38 1.64 2.38 0.62 0.00 -1.26 -3.44 105.19 107.51 1kzw n GLY 86 Ca 0.25 -0.32 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 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 9.13 6.10 -3.57 1.61 5.15 -1.26 -4.97 115.26 127.44 1kzw n ASN 87 Ca 0.00 -3.77 -0.18 0.00 -0.60 0.00 0.00 54.58 50.03 1kzw n ASN 87 Cb 0.00 -0.67 -0.14 0.00 -0.53 0.00 0.00 39.78 38.44 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 -3.74 0.13 -0.50 1.20 1.02 -1.22 -3.91 119.74 112.73 1kzw s LYS 88 Ca 0.54 0.35 -0.22 0.00 0.02 0.00 0.00 55.97 56.66 1kzw s LYS 88 Cb 0.44 -0.85 0.04 0.00 -0.52 0.00 0.00 37.83 36.94 1kzw s LYS 88 CO -0.11 -0.51 0.78 -0.51 -0.92 0.00 0.00 175.35 174.08 1kzw s LEU 89 N 2.31 4.40 -0.28 3.17 1.43 0.23 -0.55 118.68 129.39 1kzw s LEU 89 Ca 0.05 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.60 1kzw s LEU 89 Cb -0.14 -2.77 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 1kzw s LEU 89 CO -0.10 -1.00 0.33 -0.51 0.23 0.00 0.00 176.35 175.30 1kzw s ILE 90 N 3.30 5.21 -0.55 -0.59 2.07 -0.24 -0.54 121.20 129.86 1kzw s ILE 90 Ca 0.26 0.42 -0.14 0.00 -1.41 0.00 0.00 60.65 59.77 1kzw s ILE 90 Cb -0.14 -3.67 0.14 0.00 0.13 0.00 0.00 42.46 38.91 1kzw s ILE 90 CO 0.18 0.15 0.49 -0.83 -1.91 0.00 0.00 174.94 173.02 1kzw s GLY 91 N 1.68 2.14 -0.63 1.50 0.00 0.83 -1.23 107.32 111.61 1kzw s GLY 91 Ca 0.13 -2.63 -0.23 0.00 0.00 0.00 0.00 44.72 41.99 1kzw s GLY 91 CO 0.10 1.18 0.94 0.54 0.00 0.00 0.00 173.10 175.86 1kzw s LYS 92 N 1.37 3.16 0.02 2.90 3.01 0.06 -1.19 119.74 129.07 1kzw s LYS 92 Ca 0.05 -0.72 0.08 0.00 -1.01 0.00 0.00 55.97 54.37 1kzw s LYS 92 Cb -0.27 -4.18 -0.02 0.00 -1.01 0.00 0.00 37.83 32.34 1kzw s LYS 92 CO 0.01 -1.71 -0.24 -0.06 0.51 0.00 0.00 175.35 173.86 1kzw s PHE 93 N 3.94 2.11 -0.08 3.18 0.08 -0.48 -1.30 117.98 125.43 1kzw s PHE 93 Ca 0.23 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.89 1kzw s PHE 93 Cb -0.16 -1.29 -0.03 0.00 -0.57 0.00 0.00 43.02 40.97 1kzw s PHE 93 CO 0.12 0.07 -0.07 0.15 -0.10 0.00 0.00 175.22 175.38 1kzw s LYS 94 N -1.00 2.84 -0.21 0.44 1.02 -0.53 -0.14 119.74 122.15 1kzw s LYS 94 Ca 0.10 -0.56 -0.28 0.00 0.02 0.00 0.00 55.97 55.24 1kzw s LYS 94 Cb -0.09 -2.60 -0.05 0.00 -0.52 0.00 0.00 37.83 34.56 1kzw s LYS 94 CO 0.01 0.61 2.09 1.03 -0.92 0.00 0.00 175.35 178.17 1kzw s ARG 95 N -0.66 3.30 0.27 1.68 1.81 -0.21 -0.77 118.95 124.37 1kzw s ARG 95 Ca 0.10 1.97 0.23 0.00 -1.72 0.00 0.00 55.73 56.31 1kzw s ARG 95 Cb -0.11 -4.30 1.01 0.00 -0.45 0.00 0.00 34.95 31.09 1kzw s ARG 95 CO 0.02 -1.90 1.71 -2.37 -0.68 0.00 0.00 175.30 172.07 1kzw n THR 96 N 7.40 0.85 0.25 0.02 5.66 -0.39 -0.29 114.28 127.79 1kzw n THR 96 Ca 0.27 0.29 0.15 0.00 -3.05 0.00 0.00 64.05 61.71 1kzw n THR 96 Cb 0.45 -1.24 0.48 0.00 -1.55 0.00 0.00 70.33 68.47 1kzw n THR 96 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 175.07 172.46 1kzw h ASP 97 N 0.00 0.00 0.00 1.09 3.32 -1.92 -3.44 116.42 115.47 1kzw h ASP 97 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1kzw h ASP 97 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1kzw h ASP 97 CO 0.00 0.03 -0.30 0.59 -1.72 0.00 0.00 179.24 177.84 1kzw n ASN 98 N -3.12 1.04 0.00 6.45 4.13 -0.60 -5.05 115.26 118.11 1kzw n ASN 98 Ca 0.02 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.28 1kzw n ASN 98 Cb 0.40 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.64 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 2.09 2.84 3.72 7.41 0.00 0.60 -5.03 105.19 116.82 1kzw n GLY 99 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 0.15 6.67 0.01 1.61 0.01 -1.26 -4.44 114.94 117.69 1kzw s ASN 100 Ca 0.00 2.51 -0.30 0.00 -0.71 0.00 0.00 52.86 54.36 1kzw s ASN 100 Cb 0.00 -2.59 -0.04 0.00 0.41 0.00 0.00 41.25 39.03 1kzw s ASN 100 CO 0.00 -0.76 1.06 -1.83 -1.51 0.00 0.00 177.10 174.05 1kzw s GLU 101 N 1.15 4.51 -0.17 -0.60 4.04 -1.26 -1.05 118.70 125.33 1kzw s GLU 101 Ca 0.68 1.54 0.01 0.00 0.04 0.00 0.00 54.97 57.24 1kzw s GLU 101 Cb -0.41 -3.43 0.02 0.00 0.02 0.00 0.00 34.13 30.33 1kzw s GLU 101 CO 0.31 -0.14 -0.18 -1.17 -1.84 0.00 0.00 175.26 172.24 1kzw s LEU 102 N 1.10 1.96 -0.33 1.83 0.20 0.80 -3.84 118.68 120.40 1kzw s LEU 102 Ca 0.54 -0.59 -0.09 0.00 0.69 0.00 0.00 54.13 54.68 1kzw s LEU 102 Cb -0.24 -1.36 0.01 0.00 -0.43 0.00 0.00 46.19 44.17 1kzw s LEU 102 CO 0.28 -0.02 0.16 0.20 -0.29 0.00 0.00 176.35 176.68 1kzw s ASN 103 N 1.34 5.52 -0.38 3.68 0.01 -0.13 -1.39 114.94 123.60 1kzw s ASN 103 Ca 0.04 -0.77 -0.13 0.00 -0.71 0.00 0.00 52.86 51.30 1kzw s ASN 103 Cb -0.13 -1.98 0.01 0.00 0.41 0.00 0.00 41.25 39.57 1kzw s ASN 103 CO -0.12 -0.27 0.24 -0.89 -1.51 0.00 0.00 177.10 174.56 1kzw s THR 104 N 1.56 4.97 -0.56 1.60 2.01 -0.33 -0.44 115.64 124.43 1kzw s THR 104 Ca 0.03 -0.63 -0.20 0.00 0.31 0.00 0.00 61.69 61.20 1kzw s THR 104 Cb -0.18 -3.71 0.08 0.00 0.01 0.00 0.00 72.50 68.70 1kzw s THR 104 CO 0.05 -0.20 0.71 -0.69 -0.69 0.00 0.00 174.62 173.81 1kzw s VAL 105 N 1.64 4.76 -0.33 3.82 1.01 -0.46 -0.12 120.40 130.72 1kzw s VAL 105 Ca 0.04 -0.66 -0.28 0.00 0.00 0.00 0.00 61.98 61.08 1kzw s VAL 105 Cb -0.19 -4.44 0.02 0.00 0.00 0.00 0.00 36.38 31.77 1kzw s VAL 105 CO 0.09 -1.04 1.05 -0.13 0.00 0.00 0.00 175.10 175.06 1kzw s ARG 106 N 2.89 4.02 -0.04 2.72 0.52 0.30 -1.23 118.95 128.13 1kzw s ARG 106 Ca 0.15 0.97 -0.05 0.00 -0.52 0.00 0.00 55.73 56.28 1kzw s ARG 106 Cb -0.21 -3.75 0.01 0.00 0.52 0.00 0.00 34.95 31.52 1kzw s ARG 106 CO 0.10 -0.91 0.14 -1.83 0.02 0.00 0.00 175.30 172.81 1kzw s GLU 107 N 3.63 0.23 -0.49 3.54 -1.05 -0.54 -0.60 118.70 123.42 1kzw s GLU 107 Ca 0.44 0.06 -0.19 0.00 -0.15 0.00 0.00 54.97 55.13 1kzw s GLU 107 Cb -0.12 0.11 0.05 0.00 -0.44 0.00 0.00 34.13 33.73 1kzw s GLU 107 CO 0.16 -0.04 0.58 0.42 0.95 0.00 0.00 175.26 177.33 1kzw s ILE 108 N -0.26 4.94 -1.27 1.83 -1.09 -1.25 -0.62 121.20 123.48 1kzw s ILE 108 Ca -0.03 -0.52 -0.11 0.00 -2.23 0.00 0.00 60.65 57.75 1kzw s ILE 108 Cb -0.03 -4.24 0.16 0.00 -1.58 0.00 0.00 42.46 36.77 1kzw s ILE 108 CO 0.00 -0.72 1.78 2.30 -1.23 0.00 0.00 174.94 177.07 1kzw n ILE 109 N 5.55 4.27 0.00 2.92 -5.35 -0.55 -4.79 119.36 121.42 1kzw n ILE 109 Ca -0.07 -4.40 0.00 0.00 -0.27 0.00 0.00 62.75 58.01 1kzw n ILE 109 Cb 0.45 -2.40 0.00 0.00 -1.74 0.00 0.00 39.64 35.96 1kzw n ILE 109 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1kzw n GLY 110 N 3.25 1.96 2.49 3.28 0.00 -1.26 -3.98 105.19 110.93 1kzw n GLY 110 Ca 0.40 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 46.10 1kzw n GLY 110 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1kzw n ASP 111 N 5.07 1.30 -3.64 1.61 5.75 -1.26 -4.91 116.55 120.48 1kzw n ASP 111 Ca 0.00 -2.85 -0.16 0.00 -0.01 0.00 0.00 54.79 51.77 1kzw n ASP 111 Cb 0.00 -0.56 -0.14 0.00 -1.03 0.00 0.00 41.12 39.38 1kzw n ASP 111 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1kzw s GLU 112 N -2.88 0.10 -0.46 0.11 2.12 -1.26 -3.52 118.70 112.92 1kzw s GLU 112 Ca 0.32 0.56 -0.29 0.00 0.36 0.00 0.00 54.97 55.92 1kzw s GLU 112 Cb 0.42 -0.37 0.02 0.00 0.26 0.00 0.00 34.13 34.46 1kzw s GLU 112 CO -0.01 -0.36 1.22 -1.17 -0.54 0.00 0.00 175.26 174.39 1kzw s LEU 113 N 2.34 3.63 -0.34 2.70 2.96 0.31 -1.48 118.68 128.80 1kzw s LEU 113 Ca 0.03 0.59 -0.15 0.00 -0.22 0.00 0.00 54.13 54.38 1kzw s LEU 113 Cb -0.13 -3.55 -0.01 0.00 0.50 0.00 0.00 46.19 43.00 1kzw s LEU 113 CO -0.08 -1.30 0.34 -0.69 -1.32 0.00 0.00 176.35 173.30 1kzw s VAL 114 N 4.72 5.19 -0.75 1.68 1.01 0.21 -0.60 120.40 131.87 1kzw s VAL 114 Ca 0.52 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 62.32 1kzw s VAL 114 Cb -0.09 -3.80 0.16 0.00 0.00 0.00 0.00 36.38 32.65 1kzw s VAL 114 CO 0.32 -0.07 0.78 -1.10 0.00 0.00 0.00 175.10 175.02 1kzw s GLN 115 N 1.95 3.38 -0.65 2.72 -0.21 0.28 -1.47 119.66 125.67 1kzw s GLN 115 Ca 0.10 -1.95 -0.25 0.00 0.02 0.00 0.00 55.36 53.28 1kzw s GLN 115 Cb -0.17 -4.46 0.05 0.00 1.00 0.00 0.00 33.01 29.43 1kzw s GLN 115 CO 0.11 -1.45 1.09 0.99 -2.12 0.00 0.00 175.29 173.92 1kzw s THR 116 N 1.44 4.10 -0.43 -0.19 2.01 -0.37 -1.50 115.64 120.70 1kzw s THR 116 Ca 0.17 0.18 -0.24 0.00 0.31 0.00 0.00 61.69 62.11 1kzw s THR 116 Cb -0.15 -4.74 0.02 0.00 0.01 0.00 0.00 72.50 67.64 1kzw s THR 116 CO -0.04 -1.51 0.83 -0.31 -0.69 0.00 0.00 174.62 172.91 1kzw s TYR 117 N 4.71 3.00 -0.48 4.92 2.02 -0.61 -1.35 117.35 129.55 1kzw s TYR 117 Ca 0.31 0.33 -0.13 0.00 -0.37 0.00 0.00 57.07 57.21 1kzw s TYR 117 Cb -0.12 -3.70 0.10 0.00 -0.40 0.00 0.00 41.96 37.84 1kzw s TYR 117 CO 0.16 -0.97 0.39 0.08 -1.57 0.00 0.00 175.55 173.64 1kzw s VAL 118 N 3.40 4.76 -0.22 0.71 1.01 0.41 -1.27 120.40 129.20 1kzw s VAL 118 Ca 0.33 -1.46 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 1kzw s VAL 118 Cb -0.12 -4.00 0.06 0.00 0.00 0.00 0.00 36.38 32.32 1kzw s VAL 118 CO 0.22 -0.71 -0.02 -0.47 0.00 0.00 0.00 175.10 174.12 1kzw s TYR 119 N 1.51 1.91 -1.15 5.22 5.04 -0.66 -0.96 117.35 128.26 1kzw s TYR 119 Ca 0.04 -1.44 -0.12 0.00 -2.44 0.00 0.00 57.07 53.11 1kzw s TYR 119 Cb -0.26 -1.39 -0.02 0.00 0.35 0.00 0.00 41.96 40.63 1kzw s TYR 119 CO 0.03 -0.72 0.80 0.39 -1.34 0.00 0.00 175.55 174.71 1kzw n GLU 120 N 4.81 -2.37 0.00 4.97 1.02 -1.25 -2.06 120.64 125.76 1kzw n GLU 120 Ca -0.11 0.61 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 1kzw n GLU 120 Cb 0.45 -4.85 0.00 0.00 -0.02 0.00 0.00 31.44 27.02 1kzw n GLU 120 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1kzw n GLY 121 N -1.53 2.18 3.64 0.62 0.00 -1.26 -5.03 105.19 103.80 1kzw n GLY 121 Ca -0.14 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.49 5.01 -0.19 1.61 1.01 -0.88 -5.06 120.40 121.41 1kzw s VAL 122 Ca 0.00 1.12 -0.21 0.00 0.00 0.00 0.00 61.98 62.89 1kzw s VAL 122 Cb 0.00 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1kzw s VAL 122 CO 0.00 0.07 0.62 -1.61 0.00 0.00 0.00 175.10 174.17 1kzw s GLU 123 N 2.26 4.22 -0.21 2.72 2.02 -1.26 -1.66 118.70 126.79 1kzw s GLU 123 Ca 0.26 0.60 -0.02 0.00 0.02 0.00 0.00 54.97 55.83 1kzw s GLU 123 Cb -0.16 -3.57 0.07 0.00 0.10 0.00 0.00 34.13 30.57 1kzw s GLU 123 CO 0.09 -0.21 0.04 0.00 0.02 0.00 0.00 175.26 175.20 1kzw s ALA 124 N 1.82 1.11 -0.35 5.21 0.00 -0.40 -4.46 121.76 124.68 1kzw s ALA 124 Ca 0.28 -0.87 -0.22 0.00 0.00 0.00 0.00 51.96 51.16 1kzw s ALA 124 Cb -0.16 -1.26 0.01 0.00 0.00 0.00 0.00 23.12 21.71 1kzw s ALA 124 CO 0.11 -1.25 0.72 0.15 0.00 0.00 0.00 175.76 175.48 1kzw s LYS 125 N 1.81 3.74 -0.23 0.00 1.02 -1.26 -1.57 119.74 123.26 1kzw s LYS 125 Ca 0.00 0.22 -0.20 0.00 0.02 0.00 0.00 55.97 56.01 1kzw s LYS 125 Cb -0.17 -3.80 -0.02 0.00 -0.52 0.00 0.00 37.83 33.32 1kzw s LYS 125 CO -0.11 -0.78 0.62 1.03 -0.92 0.00 0.00 175.35 175.19 1kzw s ARG 126 N 2.90 4.16 -0.17 1.68 0.52 -0.56 -0.84 118.95 126.64 1kzw s ARG 126 Ca 0.28 0.56 0.01 0.00 -0.52 0.00 0.00 55.73 56.07 1kzw s ARG 126 Cb -0.14 -3.61 0.02 0.00 0.52 0.00 0.00 34.95 31.74 1kzw s ARG 126 CO 0.15 -0.32 -0.20 0.42 0.02 0.00 0.00 175.30 175.38 1kzw s ILE 127 N 2.18 2.00 -0.13 1.52 1.01 -0.18 -0.55 121.20 127.05 1kzw s ILE 127 Ca 0.27 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 60.03 1kzw s ILE 127 Cb -0.16 -1.81 0.00 0.00 0.01 0.00 0.00 42.46 40.51 1kzw s ILE 127 CO 0.09 0.53 -0.20 -0.36 0.00 0.00 0.00 174.94 175.00 1kzw s PHE 128 N 1.25 2.68 0.35 3.97 0.40 0.23 -1.44 117.98 125.42 1kzw s PHE 128 Ca 0.03 -1.16 -0.11 0.00 -0.60 0.00 0.00 56.93 55.10 1kzw s PHE 128 Cb -0.13 -1.81 -0.07 0.00 0.51 0.00 0.00 43.02 41.51 1kzw s PHE 128 CO -0.11 -0.51 0.71 0.21 0.70 0.00 0.00 175.22 176.22 1kzw s LYS 129 N 0.68 3.83 -0.22 0.44 2.20 0.24 -0.53 119.74 126.37 1kzw s LYS 129 Ca -0.10 0.45 -0.28 0.00 -0.36 0.00 0.00 55.97 55.69 1kzw s LYS 129 Cb -0.16 -2.46 -0.04 0.00 -1.51 0.00 0.00 37.83 33.66 1kzw s LYS 129 CO 0.02 0.08 2.09 0.21 -0.36 0.00 0.00 175.35 177.39 1kzw s LYS 130 N -3.47 3.27 0.00 4.03 2.47 -1.23 -0.98 119.74 123.83 1kzw s LYS 130 Ca 0.51 1.93 0.00 0.00 -1.56 0.00 0.00 55.97 56.85 1kzw s LYS 130 Cb -0.10 -4.31 0.00 0.00 -1.46 0.00 0.00 37.83 31.96 1kzw s LYS 130 CO 0.26 -1.94 0.00 -3.47 0.16 0.00 0.00 175.35 170.36