#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 -2.45 0.00 3.72 -1.26 -4.83 117.46 112.65 1kzw n PHE 2 Ca 0.00 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.01 1kzw n PHE 2 Cb 0.00 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.52 1kzw n PHE 2 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1kzw s ASP 3 N 0.00 6.38 0.29 4.37 -1.08 -1.26 -4.54 116.67 120.82 1kzw s ASP 3 Ca 0.00 -2.24 -0.19 0.00 -0.52 0.00 0.00 52.55 49.60 1kzw s ASP 3 Cb 0.00 -2.58 0.06 0.00 -1.46 0.00 0.00 42.92 38.94 1kzw s ASP 3 CO 0.00 -1.66 0.90 -0.55 0.52 0.00 0.00 175.17 174.38 1kzw s SER 4 N 4.81 -0.01 -0.23 -0.34 0.15 -1.06 -4.97 113.70 112.04 1kzw s SER 4 Ca 0.58 -0.90 -0.18 0.00 0.70 0.00 0.00 55.95 56.15 1kzw s SER 4 Cb 0.03 0.68 -0.03 0.00 -1.71 0.00 0.00 66.02 64.99 1kzw s SER 4 CO 0.09 -1.35 0.51 -0.89 1.20 0.00 0.00 173.24 172.80 1kzw s THR 5 N -2.35 5.10 -0.25 6.45 2.01 -1.26 -1.30 115.64 124.04 1kzw s THR 5 Ca 0.18 0.90 0.02 0.00 0.31 0.00 0.00 61.69 63.10 1kzw s THR 5 Cb -0.04 -3.83 0.07 0.00 0.01 0.00 0.00 72.50 68.71 1kzw s THR 5 CO 0.08 0.14 -0.06 0.26 -0.69 0.00 0.00 174.62 174.36 1kzw s TRP 6 N 1.91 2.76 -0.07 4.92 0.52 -0.19 -0.51 118.94 128.28 1kzw s TRP 6 Ca 0.22 -2.05 -0.10 0.00 0.02 0.00 0.00 56.10 54.19 1kzw s TRP 6 Cb -0.15 -1.81 -0.05 0.00 -1.15 0.00 0.00 33.47 30.31 1kzw s TRP 6 CO 0.09 -0.83 0.25 0.21 0.02 0.00 0.00 176.95 176.70 1kzw s LYS 7 N 1.27 3.66 0.03 4.98 2.47 -0.29 -0.71 119.74 131.15 1kzw s LYS 7 Ca -0.05 0.09 -0.30 0.00 -1.56 0.00 0.00 55.97 54.15 1kzw s LYS 7 Cb -0.19 -3.21 -0.09 0.00 -1.46 0.00 0.00 37.83 32.88 1kzw s LYS 7 CO -0.07 0.72 1.97 0.54 0.16 0.00 0.00 175.35 178.68 1kzw s VAL 8 N -0.99 3.03 -0.14 4.02 0.11 -0.79 -0.56 120.40 125.09 1kzw s VAL 8 Ca 0.18 0.04 -0.08 0.00 -2.93 0.00 0.00 61.98 59.19 1kzw s VAL 8 Cb -0.14 -3.02 -0.06 0.00 -1.53 0.00 0.00 36.38 31.63 1kzw s VAL 8 CO 0.08 -0.00 -0.19 -0.67 -3.33 0.00 0.00 175.10 170.98 1kzw n ASP 9 N 7.66 1.12 -3.41 3.54 2.03 -0.17 -4.87 116.55 122.44 1kzw n ASP 9 Ca 0.20 0.19 -0.13 0.00 0.52 0.00 0.00 54.79 55.57 1kzw n ASP 9 Cb 0.41 -0.46 -0.10 0.00 -0.72 0.00 0.00 41.12 40.26 1kzw n ASP 9 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1kzw s ARG 10 N -2.30 0.28 -0.29 -0.67 1.70 -1.05 -5.03 118.95 111.59 1kzw s ARG 10 Ca -0.20 0.37 -0.06 0.00 -0.47 0.00 0.00 55.73 55.36 1kzw s ARG 10 Cb 0.07 -0.80 0.01 0.00 -0.57 0.00 0.00 34.95 33.67 1kzw s ARG 10 CO 0.26 -0.67 0.06 -1.54 -1.08 0.00 0.00 175.30 172.34 1kzw s SER 11 N 2.45 5.02 -0.25 -2.89 1.04 -1.26 -2.08 113.70 115.73 1kzw s SER 11 Ca 0.10 -0.72 -0.12 0.00 0.48 0.00 0.00 55.95 55.70 1kzw s SER 11 Cb -0.15 -1.85 -0.05 0.00 0.10 0.00 0.00 66.02 64.07 1kzw s SER 11 CO -0.15 -0.18 0.23 -1.61 0.98 0.00 0.00 173.24 172.51 1kzw s GLU 12 N 1.48 4.05 -1.17 4.02 0.41 0.01 -4.49 118.70 123.01 1kzw s GLU 12 Ca 0.02 -0.18 0.00 0.00 -0.41 0.00 0.00 54.97 54.40 1kzw s GLU 12 Cb -0.17 -3.59 0.00 0.00 -1.78 0.00 0.00 34.13 28.59 1kzw s GLU 12 CO 0.02 -0.06 0.00 -1.71 -0.49 0.00 0.00 175.26 173.02 1kzw n ASN 13 N 4.65 -4.58 -0.09 -0.19 5.15 -1.26 -2.15 115.26 116.79 1kzw n ASN 13 Ca -0.13 0.27 -0.13 0.00 -0.60 0.00 0.00 54.58 53.99 1kzw n ASN 13 Cb 0.52 -3.05 -0.05 0.00 -0.53 0.00 0.00 39.78 36.67 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 0.00 0.79 -0.38 1.20 3.20 -1.88 -2.07 116.97 117.84 1kzw h TYR 14 Ca -0.23 -0.23 -0.02 0.00 3.14 0.00 0.00 58.73 61.39 1kzw h TYR 14 Cb 0.80 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 1kzw h TYR 14 CO 0.36 0.96 0.14 0.38 -1.64 0.00 0.00 178.16 178.37 1kzw h ASP 15 N 0.39 0.48 -0.09 -2.11 2.03 -1.93 -0.97 116.42 114.21 1kzw h ASP 15 Ca 0.04 -0.05 -0.05 0.00 -0.73 0.00 0.00 57.03 56.25 1kzw h ASP 15 Cb 0.83 -0.12 -0.00 0.00 -0.83 0.00 0.00 39.33 39.20 1kzw h ASP 15 CO 0.07 0.44 -0.14 0.11 -1.03 0.00 0.00 179.24 178.69 1kzw h LYS 16 N 0.53 0.25 -0.79 4.15 1.57 -1.97 -1.72 116.57 118.60 1kzw h LYS 16 Ca 0.13 -0.15 0.14 0.00 -1.87 0.00 0.00 60.65 58.90 1kzw h LYS 16 Cb 0.12 0.01 -0.14 0.00 0.08 0.00 0.00 32.23 32.30 1kzw h LYS 16 CO -0.01 0.72 -0.33 0.35 -0.57 0.00 0.00 179.45 179.61 1kzw h PHE 17 N -0.19 -0.89 0.00 -1.35 3.57 -1.39 -2.72 116.94 113.97 1kzw h PHE 17 Ca 0.01 0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 1kzw h PHE 17 Cb 0.70 0.51 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 1kzw h PHE 17 CO 0.10 -0.39 -0.21 0.52 -2.23 0.00 0.00 178.31 176.10 1kzw h MET 18 N -0.07 0.00 -0.65 1.11 2.86 -1.19 -2.34 114.93 114.64 1kzw h MET 18 Ca 0.31 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.95 1kzw h MET 18 Cb 0.58 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.21 1kzw h MET 18 CO -0.83 0.21 0.40 1.49 1.06 0.00 0.00 176.91 179.24 1kzw h GLU 19 N 0.00 0.88 -0.52 1.72 4.81 -1.01 -2.67 114.58 117.79 1kzw h GLU 19 Ca -0.00 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1kzw h GLU 19 Cb 0.53 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 1kzw h GLU 19 CO 0.03 0.62 0.34 -0.22 -0.73 0.00 0.00 179.01 179.05 1kzw h LYS 20 N 0.89 0.59 -0.03 1.92 1.63 -1.29 -3.17 116.57 117.11 1kzw h LYS 20 Ca 0.24 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.97 1kzw h LYS 20 Cb -0.04 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.45 1kzw h LYS 20 CO -0.05 0.39 -0.12 0.52 -3.45 0.00 0.00 179.45 176.74 1kzw h MET 21 N 0.60 0.04 -0.00 1.90 2.86 -1.09 -3.48 114.93 115.77 1kzw h MET 21 Ca 0.21 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1kzw h MET 21 Cb 0.08 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1kzw h MET 21 CO -0.05 0.16 0.00 0.41 1.06 0.00 0.00 176.91 178.49 1kzw n GLY 22 N -1.15 0.66 3.00 8.32 0.00 -1.11 -5.11 105.19 109.80 1kzw n GLY 22 Ca -0.02 -0.33 -0.16 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.40 0.51 1.05 1.61 -7.23 -1.22 -5.09 120.40 108.65 1kzw s VAL 23 Ca 0.00 -0.48 -0.14 0.00 -1.81 0.00 0.00 61.98 59.55 1kzw s VAL 23 Cb 0.00 -0.47 0.22 0.00 0.56 0.00 0.00 36.38 36.68 1kzw s VAL 23 CO 0.00 0.01 1.10 0.54 -0.31 0.00 0.00 175.10 176.44 1kzw s ASN 24 N -0.51 2.16 0.23 4.85 2.20 -1.26 -4.70 114.94 117.92 1kzw s ASN 24 Ca -0.01 1.00 -0.08 0.00 -0.94 0.00 0.00 52.86 52.84 1kzw s ASN 24 Cb -0.04 -1.54 0.21 0.00 -2.00 0.00 0.00 41.25 37.88 1kzw s ASN 24 CO -0.00 -3.40 1.89 -0.29 -2.94 0.00 0.00 177.10 172.36 1kzw h ILE 25 N -2.08 1.24 0.20 0.54 2.10 -2.01 -0.74 117.51 116.77 1kzw h ILE 25 Ca -0.52 -0.50 -0.01 0.00 1.08 0.00 0.00 64.86 64.91 1kzw h ILE 25 Cb 1.32 -0.05 0.00 0.00 -1.09 0.00 0.00 36.82 37.01 1kzw h ILE 25 CO 0.52 0.25 -0.10 0.58 -1.08 0.00 0.00 178.15 178.32 1kzw h VAL 26 N 1.24 0.83 -0.71 2.19 2.07 -1.99 -0.14 116.25 119.73 1kzw h VAL 26 Ca 0.33 -0.17 0.08 0.00 0.82 0.00 0.00 66.70 67.76 1kzw h VAL 26 Cb -0.08 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 30.55 1kzw h VAL 26 CO -0.06 0.04 0.37 0.11 0.02 0.00 0.00 177.57 178.05 1kzw h LYS 27 N -0.35 0.63 -0.57 1.57 6.56 -1.94 -1.84 116.57 120.64 1kzw h LYS 27 Ca -0.03 -0.04 -0.05 0.00 -1.06 0.00 0.00 60.65 59.47 1kzw h LYS 27 Cb 0.27 -0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 31.77 1kzw h LYS 27 CO 0.05 0.42 0.15 0.00 -2.06 0.00 0.00 179.45 178.00 1kzw h ARG 28 N 0.65 0.90 -0.42 3.15 3.08 -1.06 0.15 114.38 120.83 1kzw h ARG 28 Ca 0.34 -0.21 0.03 0.00 0.07 0.00 0.00 59.98 60.21 1kzw h ARG 28 Cb 0.32 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 1kzw h ARG 28 CO -0.24 0.83 0.23 0.87 -1.07 0.00 0.00 179.97 180.59 1kzw h LYS 29 N 0.80 0.45 -0.89 0.04 1.79 -0.97 -0.64 116.57 117.16 1kzw h LYS 29 Ca 0.18 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 1kzw h LYS 29 Cb 0.33 -0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 30.84 1kzw h LYS 29 CO 0.00 0.29 0.56 -0.07 -1.08 0.00 0.00 179.45 179.16 1kzw h LEU 30 N 0.46 1.04 -0.48 2.94 3.38 -1.32 -0.89 115.31 120.45 1kzw h LEU 30 Ca 0.17 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1kzw h LEU 30 Cb 0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1kzw h LEU 30 CO -0.10 0.78 0.15 0.00 0.09 0.00 0.00 178.44 179.36 1kzw h ALA 31 N 1.31 0.63 0.68 1.53 0.00 -0.56 -2.27 119.26 120.58 1kzw h ALA 31 Ca 0.32 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1kzw h ALA 31 Cb -0.09 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.52 1kzw h ALA 31 CO -0.06 0.28 -0.33 0.00 0.00 0.00 0.00 179.25 179.14 1kzw h ALA 32 N 1.01 -0.92 -0.23 0.00 0.00 -1.17 -3.32 119.26 114.63 1kzw h ALA 32 Ca 0.15 -0.21 -0.43 0.00 0.00 0.00 0.00 54.91 54.42 1kzw h ALA 32 Cb 0.27 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 18.32 1kzw h ALA 32 CO -0.01 -0.97 0.93 0.72 0.00 0.00 0.00 179.25 179.93 1kzw n HIS 33 N -5.45 1.20 0.02 0.00 8.25 -0.34 -4.65 115.22 114.25 1kzw n HIS 33 Ca -0.13 -2.07 -0.07 0.00 -0.26 0.00 0.00 57.72 55.19 1kzw n HIS 33 Cb 0.38 -1.72 -0.12 0.00 1.12 0.00 0.00 29.99 29.64 1kzw n HIS 33 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 1kzw h ASP 34 N 3.55 0.00 -5.27 0.41 1.82 -1.51 -3.45 116.42 111.97 1kzw h ASP 34 Ca 0.43 0.00 -0.29 0.00 -0.39 0.00 0.00 57.03 56.78 1kzw h ASP 34 Cb 0.92 0.00 0.15 0.00 0.68 0.00 0.00 39.33 41.09 1kzw h ASP 34 CO 0.84 0.95 -0.69 0.59 -1.61 0.00 0.00 179.24 179.32 1kzw n ASN 35 N -3.16 -2.13 -4.66 2.28 3.02 -1.26 -0.95 115.26 108.40 1kzw n ASN 35 Ca -0.09 -0.56 -0.42 0.00 -0.03 0.00 0.00 54.58 53.48 1kzw n ASN 35 Cb 0.98 -4.66 -0.04 0.00 -0.61 0.00 0.00 39.78 35.46 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 -5.90 4.13 -0.25 3.41 2.96 -1.26 -4.17 118.68 117.60 1kzw s LEU 36 Ca 0.01 1.15 -0.04 0.00 -0.22 0.00 0.00 54.13 55.02 1kzw s LEU 36 Cb -0.00 -3.26 0.00 0.00 0.50 0.00 0.00 46.19 43.44 1kzw s LEU 36 CO 0.66 -0.48 -0.00 -0.75 -1.32 0.00 0.00 176.35 174.45 1kzw s LYS 37 N 2.56 3.18 -0.49 1.98 2.20 -0.10 -1.88 119.74 127.18 1kzw s LYS 37 Ca 0.38 -0.77 -0.14 0.00 -0.36 0.00 0.00 55.97 55.07 1kzw s LYS 37 Cb -0.16 -3.13 0.10 0.00 -1.51 0.00 0.00 37.83 33.13 1kzw s LYS 37 CO 0.10 -0.32 0.42 -0.51 -0.36 0.00 0.00 175.35 174.67 1kzw s LEU 38 N 1.45 5.80 -0.51 5.43 1.43 0.12 -2.09 118.68 130.31 1kzw s LEU 38 Ca 0.03 -1.59 -0.19 0.00 -1.03 0.00 0.00 54.13 51.36 1kzw s LEU 38 Cb -0.16 -2.15 0.06 0.00 0.03 0.00 0.00 46.19 43.97 1kzw s LEU 38 CO -0.01 -0.72 0.62 -0.89 0.23 0.00 0.00 176.35 175.58 1kzw s THR 39 N 1.57 4.88 -0.13 5.49 2.01 -0.83 -1.02 115.64 127.62 1kzw s THR 39 Ca 0.04 -0.55 -0.15 0.00 0.31 0.00 0.00 61.69 61.34 1kzw s THR 39 Cb -0.27 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 67.89 1kzw s THR 39 CO 0.04 -0.82 0.35 -0.63 -0.69 0.00 0.00 174.62 172.87 1kzw s ILE 40 N 2.60 5.25 -0.09 1.82 1.01 -0.42 -0.85 121.20 130.52 1kzw s ILE 40 Ca 0.14 0.68 -0.04 0.00 0.00 0.00 0.00 60.65 61.43 1kzw s ILE 40 Cb -0.20 -3.68 0.05 0.00 0.01 0.00 0.00 42.46 38.63 1kzw s ILE 40 CO 0.11 0.40 0.21 -0.89 0.00 0.00 0.00 174.94 174.77 1kzw s THR 41 N 0.32 -0.09 -0.07 2.92 2.01 -0.61 -2.57 115.64 117.55 1kzw s THR 41 Ca 0.20 0.18 0.01 0.00 0.31 0.00 0.00 61.69 62.39 1kzw s THR 41 Cb -0.14 -0.34 -0.03 0.00 0.01 0.00 0.00 72.50 72.01 1kzw s THR 41 CO 0.06 0.08 -0.08 0.00 -0.69 0.00 0.00 174.62 173.99 1kzw s GLN 42 N 1.41 2.71 -0.37 4.92 -2.07 -1.26 -0.74 119.66 124.26 1kzw s GLN 42 Ca -0.08 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 52.90 1kzw s GLN 42 Cb -0.11 -2.56 0.14 0.00 -1.09 0.00 0.00 33.01 29.39 1kzw s GLN 42 CO -0.08 0.65 0.21 -2.00 -1.32 0.00 0.00 175.29 172.76 1kzw s GLU 43 N -0.79 0.67 -0.80 9.60 2.56 -0.34 -4.99 118.70 124.62 1kzw s GLU 43 Ca 0.12 -1.44 -0.01 0.00 0.00 0.00 0.00 54.97 53.64 1kzw s GLU 43 Cb -0.11 -1.47 -0.01 0.00 2.00 0.00 0.00 34.13 34.54 1kzw s GLU 43 CO 0.01 -1.20 0.74 0.41 -0.56 0.00 0.00 175.26 174.66 1kzw n GLY 44 N 3.96 -1.23 4.62 -1.50 0.00 -1.26 -2.91 105.19 106.87 1kzw n GLY 44 Ca 0.11 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.63 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 -2.06 0.00 -4.52 1.61 4.13 -1.26 -4.97 115.26 108.20 1kzw n ASN 45 Ca -0.02 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.82 1kzw n ASN 45 Cb 0.53 -0.19 -0.03 0.00 -1.54 0.00 0.00 39.78 38.54 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 0.00 3.19 -0.30 3.52 1.02 -1.15 -1.96 119.74 124.07 1kzw s LYS 46 Ca 0.00 -0.41 -0.18 0.00 0.02 0.00 0.00 55.97 55.40 1kzw s LYS 46 Cb 0.00 -4.18 -0.02 0.00 -0.52 0.00 0.00 37.83 33.12 1kzw s LYS 46 CO 0.00 -1.96 0.50 -0.06 -0.92 0.00 0.00 175.35 172.91 1kzw s PHE 47 N 5.00 3.22 -0.54 3.18 0.40 0.28 -1.20 117.98 128.32 1kzw s PHE 47 Ca 0.31 0.40 -0.20 0.00 -0.60 0.00 0.00 56.93 56.83 1kzw s PHE 47 Cb -0.11 -2.80 0.06 0.00 0.51 0.00 0.00 43.02 40.68 1kzw s PHE 47 CO 0.14 -0.40 0.71 0.99 0.70 0.00 0.00 175.22 177.36 1kzw s THR 48 N 2.33 4.76 -0.43 0.64 2.01 0.08 -1.00 115.64 124.02 1kzw s THR 48 Ca 0.19 -0.46 -0.19 0.00 0.31 0.00 0.00 61.69 61.54 1kzw s THR 48 Cb -0.16 -4.40 0.02 0.00 0.01 0.00 0.00 72.50 67.98 1kzw s THR 48 CO 0.11 -0.95 0.53 0.54 -0.69 0.00 0.00 174.62 174.15 1kzw s VAL 49 N 2.93 4.98 -0.42 3.82 0.11 -0.28 -1.58 120.40 129.96 1kzw s VAL 49 Ca 0.17 -0.17 -0.23 0.00 -2.93 0.00 0.00 61.98 58.82 1kzw s VAL 49 Cb -0.19 -4.12 0.02 0.00 -1.53 0.00 0.00 36.38 30.56 1kzw s VAL 49 CO 0.12 -0.51 0.76 -0.54 -3.33 0.00 0.00 175.10 171.60 1kzw s LYS 50 N 2.43 3.52 -0.74 1.54 1.02 -0.03 -1.05 119.74 126.42 1kzw s LYS 50 Ca 0.16 0.01 -0.13 0.00 0.02 0.00 0.00 55.97 56.04 1kzw s LYS 50 Cb -0.16 -3.89 0.19 0.00 -0.52 0.00 0.00 37.83 33.45 1kzw s LYS 50 CO 0.16 -1.00 0.67 -1.21 -0.92 0.00 0.00 175.35 173.04 1kzw s GLU 51 N 3.16 3.33 -0.30 1.68 2.02 0.24 -1.96 118.70 126.87 1kzw s GLU 51 Ca 0.29 -2.33 -0.10 0.00 0.02 0.00 0.00 54.97 52.86 1kzw s GLU 51 Cb -0.13 -4.30 -0.02 0.00 0.10 0.00 0.00 34.13 29.79 1kzw s GLU 51 CO 0.20 -1.28 0.16 -1.12 0.02 0.00 0.00 175.26 173.24 1kzw s SER 52 N 2.21 5.62 0.27 -0.19 0.01 -0.89 -2.72 113.70 118.00 1kzw s SER 52 Ca 0.15 -0.37 -0.01 0.00 1.31 0.00 0.00 55.95 57.03 1kzw s SER 52 Cb -0.15 -2.03 0.00 0.00 0.21 0.00 0.00 66.02 64.06 1kzw s SER 52 CO -0.06 -0.15 0.36 -1.54 0.41 0.00 0.00 173.24 172.26 1kzw n SER 53 N 5.00 -0.99 -1.77 2.44 3.41 -0.77 -0.92 113.62 120.03 1kzw n SER 53 Ca -0.14 -2.46 -0.00 0.00 -0.26 0.00 0.00 58.87 56.00 1kzw n SER 53 Cb 0.50 1.87 -0.01 0.00 -0.26 0.00 0.00 64.21 66.31 1kzw n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kzw n ALA 54 N -1.25 2.93 0.13 7.33 0.00 -0.13 -3.67 120.51 125.85 1kzw n ALA 54 Ca -0.10 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1kzw n ALA 54 Cb 0.45 -1.52 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1kzw n ALA 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1kzw n PHE 55 N 1.80 -2.45 -3.90 0.00 3.01 -1.26 -5.06 117.46 109.59 1kzw n PHE 55 Ca 0.02 0.54 -0.09 0.00 1.01 0.00 0.00 57.45 58.93 1kzw n PHE 55 Cb 0.29 1.14 -0.05 0.00 -0.01 0.00 0.00 39.48 40.85 1kzw n PHE 55 CO 0.00 0.00 0.00 -0.98 1.01 0.00 0.00 176.76 176.79 1kzw s ARG 56 N -1.74 1.44 -0.31 -1.08 3.03 -1.24 -5.14 118.95 113.90 1kzw s ARG 56 Ca 0.00 -1.10 0.03 0.00 2.03 0.00 0.00 55.73 56.69 1kzw s ARG 56 Cb 0.00 0.48 0.09 0.00 -1.03 0.00 0.00 34.95 34.48 1kzw s ARG 56 CO 0.00 -0.59 0.01 0.54 -1.13 0.00 0.00 175.30 174.13 1kzw s ASN 57 N -2.96 4.60 0.02 -2.89 2.20 -1.26 -1.84 114.94 112.81 1kzw s ASN 57 Ca 0.17 -1.90 0.02 0.00 -0.94 0.00 0.00 52.86 50.21 1kzw s ASN 57 Cb -0.00 -1.54 -0.01 0.00 -2.00 0.00 0.00 41.25 37.70 1kzw s ASN 57 CO 0.04 -0.33 -0.07 0.27 -2.94 0.00 0.00 177.10 174.06 1kzw s ILE 58 N 1.02 0.54 -0.27 0.54 -5.25 -1.10 -4.96 121.20 111.70 1kzw s ILE 58 Ca 0.05 -0.62 -0.16 0.00 -0.99 0.00 0.00 60.65 58.94 1kzw s ILE 58 Cb -0.19 -0.52 -0.03 0.00 2.95 0.00 0.00 42.46 44.67 1kzw s ILE 58 CO -0.08 -0.07 0.41 -1.83 -1.79 0.00 0.00 174.94 171.57 1kzw s GLU 59 N -0.76 4.00 -0.50 0.37 -1.05 -1.26 -0.59 118.70 118.91 1kzw s GLU 59 Ca -0.02 0.08 -0.16 0.00 -0.15 0.00 0.00 54.97 54.72 1kzw s GLU 59 Cb -0.06 -3.67 0.08 0.00 -0.44 0.00 0.00 34.13 30.05 1kzw s GLU 59 CO 0.00 -0.32 0.46 0.08 0.95 0.00 0.00 175.26 176.44 1kzw s VAL 60 N 2.14 5.16 -0.56 1.83 1.01 -0.22 -4.95 120.40 124.80 1kzw s VAL 60 Ca 0.16 -1.06 -0.21 0.00 0.00 0.00 0.00 61.98 60.88 1kzw s VAL 60 Cb -0.16 -4.21 0.07 0.00 0.00 0.00 0.00 36.38 32.08 1kzw s VAL 60 CO 0.10 -0.69 0.76 -0.69 0.00 0.00 0.00 175.10 174.58 1kzw s VAL 61 N 1.82 4.68 -0.18 2.92 1.01 -1.26 -1.13 120.40 128.26 1kzw s VAL 61 Ca 0.06 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 1kzw s VAL 61 Cb -0.25 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 31.67 1kzw s VAL 61 CO 0.07 -1.06 -0.09 0.72 0.00 0.00 0.00 175.10 174.74 1kzw s PHE 62 N 3.13 2.89 0.23 5.22 -0.71 -0.17 -4.92 117.98 123.65 1kzw s PHE 62 Ca 0.18 -0.91 -0.30 0.00 -1.04 0.00 0.00 56.93 54.86 1kzw s PHE 62 Cb -0.19 -1.99 -0.09 0.00 -1.21 0.00 0.00 43.02 39.54 1kzw s PHE 62 CO 0.11 -0.46 1.19 -2.00 -1.34 0.00 0.00 175.22 172.73 1kzw s GLU 63 N 1.06 4.51 -0.14 1.99 -6.30 -1.26 -0.55 118.70 118.00 1kzw s GLU 63 Ca 0.00 1.91 -0.29 0.00 -2.50 0.00 0.00 54.97 54.09 1kzw s GLU 63 Cb -0.15 -3.20 -0.07 0.00 0.00 0.00 0.00 34.13 30.72 1kzw s GLU 63 CO -0.01 -0.02 2.14 1.28 0.02 0.00 0.00 175.26 178.67 1kzw n LEU 64 N 1.91 3.51 -1.36 2.70 4.77 -0.83 -3.06 117.00 124.65 1kzw n LEU 64 Ca 0.02 0.43 -0.01 0.00 -0.03 0.00 0.00 56.01 56.43 1kzw n LEU 64 Cb 0.44 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.00 1kzw n LEU 64 CO 0.56 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 1kzw n GLY 65 N 5.40 0.67 2.92 -0.72 0.00 -0.40 -4.98 105.19 108.07 1kzw n GLY 65 Ca 0.27 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.01 0.35 -0.46 1.61 0.11 -1.17 -5.05 120.40 112.77 1kzw s VAL 66 Ca 0.01 -0.14 -0.24 0.00 -2.93 0.00 0.00 61.98 58.69 1kzw s VAL 66 Cb -0.00 -0.33 0.03 0.00 -1.53 0.00 0.00 36.38 34.55 1kzw s VAL 66 CO 0.03 0.12 0.83 -0.89 -3.33 0.00 0.00 175.10 171.86 1kzw s THR 67 N 0.22 4.59 0.05 5.04 2.01 -1.26 -4.08 115.64 122.21 1kzw s THR 67 Ca -0.02 0.51 0.00 0.00 0.31 0.00 0.00 61.69 62.49 1kzw s THR 67 Cb -0.06 -4.37 -0.03 0.00 0.01 0.00 0.00 72.50 68.06 1kzw s THR 67 CO -0.00 -0.77 -0.04 0.72 -0.69 0.00 0.00 174.62 173.83 1kzw s PHE 68 N 3.45 0.56 -0.72 4.92 -0.71 -0.52 -4.81 117.98 120.15 1kzw s PHE 68 Ca 0.32 -0.83 -0.24 0.00 -1.04 0.00 0.00 56.93 55.14 1kzw s PHE 68 Cb -0.12 -0.37 0.06 0.00 -1.21 0.00 0.00 43.02 41.38 1kzw s PHE 68 CO 0.24 -0.24 1.13 -0.80 -1.34 0.00 0.00 175.22 174.20 1kzw s ASN 69 N -2.41 6.20 -0.26 1.98 -0.87 -1.26 -1.50 114.94 116.83 1kzw s ASN 69 Ca 0.00 -0.84 -0.23 0.00 -1.57 0.00 0.00 52.86 50.22 1kzw s ASN 69 Cb 0.01 -2.48 -0.01 0.00 -0.02 0.00 0.00 41.25 38.74 1kzw s ASN 69 CO -0.05 -1.59 0.77 -0.47 -2.57 0.00 0.00 177.10 173.18 1kzw s TYR 70 N 4.75 3.27 -0.10 2.20 5.04 0.47 -4.75 117.35 128.24 1kzw s TYR 70 Ca 0.29 0.97 -0.26 0.00 -2.44 0.00 0.00 57.07 55.63 1kzw s TYR 70 Cb -0.12 -3.04 -0.02 0.00 0.35 0.00 0.00 41.96 39.13 1kzw s TYR 70 CO 0.10 -0.42 0.86 0.54 -1.34 0.00 0.00 175.55 175.29 1kzw s ASN 71 N 1.45 7.09 0.47 4.32 2.20 -1.26 -0.51 114.94 128.69 1kzw s ASN 71 Ca 0.32 1.33 -0.18 0.00 -0.94 0.00 0.00 52.86 53.39 1kzw s ASN 71 Cb -0.15 -2.48 -0.09 0.00 -2.00 0.00 0.00 41.25 36.53 1kzw s ASN 71 CO 0.09 -0.31 0.95 -0.76 -2.94 0.00 0.00 177.10 174.13 1kzw s LEU 72 N 1.58 3.77 -1.31 3.54 1.43 -0.62 -4.99 118.68 122.08 1kzw s LEU 72 Ca 0.42 1.57 -0.12 0.00 -1.03 0.00 0.00 54.13 54.97 1kzw s LEU 72 Cb -0.18 -4.47 -0.05 0.00 0.03 0.00 0.00 46.19 41.52 1kzw s LEU 72 CO 0.18 -0.48 2.41 0.00 0.23 0.00 0.00 176.35 178.69 1kzw n ALA 73 N -1.17 5.75 0.03 4.21 0.00 -1.26 -3.86 120.51 124.21 1kzw n ALA 73 Ca 0.06 -3.32 0.00 0.00 0.00 0.00 0.00 53.44 50.18 1kzw n ALA 73 Cb 0.54 -3.40 0.00 0.00 0.00 0.00 0.00 19.45 16.59 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 5.10 -0.49 0.00 0.00 9.92 -1.26 -4.79 116.55 125.03 1kzw n ASP 74 Ca 0.59 0.24 0.00 0.00 -0.53 0.00 0.00 54.79 55.10 1kzw n ASP 74 Cb 0.29 0.68 0.00 0.00 -0.64 0.00 0.00 41.12 41.45 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 -1.36 -1.82 3.61 0.44 0.00 -1.25 -5.16 105.19 99.65 1kzw n GLY 75 Ca 0.00 0.78 -0.03 0.00 0.00 0.00 0.00 46.02 46.77 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 -0.11 -0.21 2.61 2.01 -1.26 -5.04 115.64 113.65 1kzw s THR 76 Ca 0.00 0.00 -0.13 0.00 0.31 0.00 0.00 61.69 61.87 1kzw s THR 76 Cb 0.00 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.46 1kzw s THR 76 CO 0.00 0.00 0.26 -1.61 -0.69 0.00 0.00 174.62 172.58 1kzw s GLU 77 N 1.60 4.16 -0.37 4.92 2.02 -1.26 -1.59 118.70 128.19 1kzw s GLU 77 Ca -0.08 -0.03 -0.07 0.00 0.02 0.00 0.00 54.97 54.80 1kzw s GLU 77 Cb -0.05 -3.50 0.06 0.00 0.10 0.00 0.00 34.13 30.74 1kzw s GLU 77 CO -0.16 0.09 0.16 -0.51 0.02 0.00 0.00 175.26 174.86 1kzw s LEU 78 N 0.94 4.64 -0.22 1.80 1.43 0.34 -2.24 118.68 125.38 1kzw s LEU 78 Ca 0.13 -1.31 -0.29 0.00 -1.03 0.00 0.00 54.13 51.63 1kzw s LEU 78 Cb -0.13 -1.90 -0.00 0.00 0.03 0.00 0.00 46.19 44.18 1kzw s LEU 78 CO 0.05 -0.41 1.17 0.00 0.23 0.00 0.00 176.35 177.39 1kzw s ARG 79 N 1.39 4.19 0.00 1.70 3.03 -0.04 -0.39 118.95 128.83 1kzw s ARG 79 Ca 0.01 1.45 0.00 0.00 2.03 0.00 0.00 55.73 59.22 1kzw s ARG 79 Cb -0.21 -3.73 0.00 0.00 -1.03 0.00 0.00 34.95 29.98 1kzw s ARG 79 CO 0.02 -0.74 0.00 0.41 -1.13 0.00 0.00 175.30 173.86 1kzw n GLY 80 N 3.60 -0.84 3.00 3.88 0.00 -0.56 -1.08 105.19 113.20 1kzw n GLY 80 Ca 0.13 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.84 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 -3.00 1.46 -0.21 2.61 -4.23 -0.48 -1.43 115.64 110.37 1kzw s THR 81 Ca 0.00 -0.57 -0.25 0.00 -1.18 0.00 0.00 61.69 59.70 1kzw s THR 81 Cb 0.00 -1.39 -0.01 0.00 1.34 0.00 0.00 72.50 72.44 1kzw s THR 81 CO 0.00 0.44 0.83 0.26 -0.54 0.00 0.00 174.62 175.61 1kzw s TRP 82 N 1.50 3.36 -0.02 3.99 0.52 -1.26 -1.35 118.94 125.68 1kzw s TRP 82 Ca 0.04 1.18 0.05 0.00 0.02 0.00 0.00 56.10 57.40 1kzw s TRP 82 Cb -0.13 -3.03 -0.01 0.00 -1.15 0.00 0.00 33.47 29.15 1kzw s TRP 82 CO -0.10 -0.33 -0.17 -1.12 0.02 0.00 0.00 176.95 175.26 1kzw s SER 83 N 1.26 2.00 -0.36 2.95 0.01 -0.36 -1.27 113.70 117.93 1kzw s SER 83 Ca 0.36 -0.31 -0.23 0.00 1.31 0.00 0.00 55.95 57.08 1kzw s SER 83 Cb -0.16 -0.27 0.01 0.00 0.21 0.00 0.00 66.02 65.81 1kzw s SER 83 CO 0.09 0.20 0.77 -0.22 0.41 0.00 0.00 173.24 174.49 1kzw s LEU 84 N -0.33 4.14 0.08 2.44 2.96 -1.26 -0.55 118.68 126.16 1kzw s LEU 84 Ca 0.05 0.36 -0.09 0.00 -0.22 0.00 0.00 54.13 54.23 1kzw s LEU 84 Cb -0.07 -3.00 -0.24 0.00 0.50 0.00 0.00 46.19 43.38 1kzw s LEU 84 CO -0.00 -0.71 1.16 -0.33 -1.32 0.00 0.00 176.35 175.16 1kzw h GLU 85 N 8.44 0.45 0.00 1.98 5.08 -1.34 -3.49 114.58 125.70 1kzw h GLU 85 Ca -0.25 -0.62 0.00 0.00 -1.00 0.00 0.00 59.36 57.49 1kzw h GLU 85 Cb 1.10 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1kzw h GLU 85 CO 0.90 1.26 0.00 0.41 -1.00 0.00 0.00 179.01 180.58 1kzw n GLY 86 N 1.33 -1.91 2.15 -3.84 0.00 -1.26 -4.89 105.19 96.77 1kzw n GLY 86 Ca -0.10 0.65 -0.29 0.00 0.00 0.00 0.00 46.02 46.28 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 0.00 6.26 -3.69 1.61 5.15 -1.26 -4.98 115.26 118.35 1kzw n ASN 87 Ca 0.00 -3.77 -0.13 0.00 -0.60 0.00 0.00 54.58 50.08 1kzw n ASN 87 Cb 0.00 -0.73 -0.13 0.00 -0.53 0.00 0.00 39.78 38.39 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 -3.69 0.15 -0.43 1.20 1.02 -1.26 -3.38 119.74 113.35 1kzw s LYS 88 Ca 0.58 0.63 -0.21 0.00 0.02 0.00 0.00 55.97 56.99 1kzw s LYS 88 Cb 0.47 -0.10 0.02 0.00 -0.52 0.00 0.00 37.83 37.70 1kzw s LYS 88 CO 0.01 -0.24 0.66 -0.51 -0.92 0.00 0.00 175.35 174.35 1kzw s LEU 89 N 1.90 4.45 -0.31 3.17 1.43 0.14 -0.76 118.68 128.71 1kzw s LEU 89 Ca -0.03 -0.27 -0.14 0.00 -1.03 0.00 0.00 54.13 52.66 1kzw s LEU 89 Cb -0.11 -2.76 -0.03 0.00 0.03 0.00 0.00 46.19 43.32 1kzw s LEU 89 CO -0.08 -0.77 0.32 -0.51 0.23 0.00 0.00 176.35 175.54 1kzw s ILE 90 N 2.86 5.21 -0.69 -0.59 2.07 0.29 -0.81 121.20 129.53 1kzw s ILE 90 Ca 0.23 0.20 -0.17 0.00 -1.41 0.00 0.00 60.65 59.51 1kzw s ILE 90 Cb -0.14 -3.72 0.15 0.00 0.13 0.00 0.00 42.46 38.88 1kzw s ILE 90 CO 0.19 0.05 0.73 -0.83 -1.91 0.00 0.00 174.94 173.17 1kzw s GLY 91 N 1.71 2.15 -0.61 1.50 0.00 -0.02 -1.22 107.32 110.83 1kzw s GLY 91 Ca 0.11 -2.71 -0.25 0.00 0.00 0.00 0.00 44.72 41.87 1kzw s GLY 91 CO 0.11 1.44 1.06 0.54 0.00 0.00 0.00 173.10 176.24 1kzw s LYS 92 N 1.63 3.30 0.09 2.90 3.01 -0.46 -0.83 119.74 129.40 1kzw s LYS 92 Ca 0.14 -0.26 0.09 0.00 -1.01 0.00 0.00 55.97 54.93 1kzw s LYS 92 Cb -0.19 -4.10 -0.03 0.00 -1.01 0.00 0.00 37.83 32.50 1kzw s LYS 92 CO -0.01 -1.70 -0.23 -0.06 0.51 0.00 0.00 175.35 173.86 1kzw s PHE 93 N 4.49 1.98 0.00 3.18 0.08 -0.76 -1.38 117.98 125.58 1kzw s PHE 93 Ca 0.32 -0.40 0.08 0.00 0.12 0.00 0.00 56.93 57.05 1kzw s PHE 93 Cb -0.11 -1.11 -0.02 0.00 -0.57 0.00 0.00 43.02 41.20 1kzw s PHE 93 CO 0.18 0.21 -0.25 0.15 -0.10 0.00 0.00 175.22 175.41 1kzw s LYS 94 N -1.74 1.90 0.26 0.44 1.02 -0.24 -0.36 119.74 121.03 1kzw s LYS 94 Ca 0.09 -0.95 -0.29 0.00 0.02 0.00 0.00 55.97 54.83 1kzw s LYS 94 Cb -0.10 -1.92 -0.09 0.00 -0.52 0.00 0.00 37.83 35.20 1kzw s LYS 94 CO 0.04 0.52 1.23 1.03 -0.92 0.00 0.00 175.35 177.24 1kzw s ARG 95 N -0.81 4.47 -0.03 1.68 0.52 -0.16 -0.86 118.95 123.76 1kzw s ARG 95 Ca 0.10 2.00 -0.25 0.00 -0.52 0.00 0.00 55.73 57.06 1kzw s ARG 95 Cb -0.10 -3.16 -0.19 0.00 0.52 0.00 0.00 34.95 32.02 1kzw s ARG 95 CO 0.00 -0.06 1.16 0.00 0.02 0.00 0.00 175.30 176.42 1kzw h THR 96 N 3.34 1.16 0.00 0.02 1.03 -1.80 -2.54 112.91 114.11 1kzw h THR 96 Ca -0.47 -1.07 -0.14 0.00 -0.01 0.00 0.00 66.41 64.73 1kzw h THR 96 Cb 1.22 1.83 0.01 0.00 -1.07 0.00 0.00 68.15 70.13 1kzw h THR 96 CO 0.70 0.26 -0.53 0.44 -0.01 0.00 0.00 175.52 176.38 1kzw h ASP 97 N -0.63 0.46 1.37 0.00 3.32 -1.95 -3.37 116.42 115.62 1kzw h ASP 97 Ca -0.01 -0.77 -0.13 0.00 0.02 0.00 0.00 57.03 56.14 1kzw h ASP 97 Cb 0.51 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1kzw h ASP 97 CO 0.02 1.17 -0.64 0.78 -1.72 0.00 0.00 179.24 178.85 1kzw h ASN 98 N -0.19 0.00 0.00 6.45 4.21 -1.98 -3.49 115.58 120.58 1kzw h ASN 98 Ca -0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.44 1kzw h ASN 98 Cb 1.25 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.45 1kzw h ASN 98 CO 0.10 0.62 0.00 0.61 -1.29 0.00 0.00 177.43 177.47 1kzw n GLY 99 N 1.26 1.92 3.77 2.83 0.00 -0.96 -5.01 105.19 109.00 1kzw n GLY 99 Ca 0.01 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 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 0.05 4.96 0.23 1.61 0.01 -1.26 -4.03 114.94 116.51 1kzw s ASN 100 Ca 0.00 2.00 -0.29 0.00 -0.71 0.00 0.00 52.86 53.87 1kzw s ASN 100 Cb 0.00 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 39.02 1kzw s ASN 100 CO 0.00 -1.73 0.90 -1.83 -1.51 0.00 0.00 177.10 172.93 1kzw s GLU 101 N -4.18 4.78 -0.13 -0.60 1.03 -1.26 -0.99 118.70 117.36 1kzw s GLU 101 Ca 0.67 1.41 -0.02 0.00 0.03 0.00 0.00 54.97 57.05 1kzw s GLU 101 Cb -0.21 -3.26 0.04 0.00 -0.80 0.00 0.00 34.13 29.90 1kzw s GLU 101 CO 0.43 0.53 0.02 -1.17 -1.33 0.00 0.00 175.26 173.74 1kzw s LEU 102 N -1.20 0.81 -0.40 1.83 0.20 0.52 -1.82 118.68 118.62 1kzw s LEU 102 Ca 0.40 -0.40 -0.18 0.00 0.69 0.00 0.00 54.13 54.63 1kzw s LEU 102 Cb -0.25 -0.50 0.01 0.00 -0.43 0.00 0.00 46.19 45.02 1kzw s LEU 102 CO 0.30 -0.24 0.51 0.20 -0.29 0.00 0.00 176.35 176.83 1kzw s ASN 103 N 1.93 6.26 -0.67 3.68 0.01 -0.22 -1.83 114.94 124.10 1kzw s ASN 103 Ca 0.03 -0.37 -0.14 0.00 -0.71 0.00 0.00 52.86 51.67 1kzw s ASN 103 Cb -0.14 -2.26 0.17 0.00 0.41 0.00 0.00 41.25 39.43 1kzw s ASN 103 CO -0.07 -0.59 0.60 -0.89 -1.51 0.00 0.00 177.10 174.64 1kzw s THR 104 N 2.40 5.22 -0.53 1.60 2.01 -0.01 -0.55 115.64 125.78 1kzw s THR 104 Ca 0.17 -2.05 -0.15 0.00 0.31 0.00 0.00 61.69 59.97 1kzw s THR 104 Cb -0.16 -4.29 0.13 0.00 0.01 0.00 0.00 72.50 68.19 1kzw s THR 104 CO 0.15 -0.93 0.48 -0.69 -0.69 0.00 0.00 174.62 172.93 1kzw s VAL 105 N 0.83 5.08 -0.56 3.82 1.01 0.04 -0.84 120.40 129.77 1kzw s VAL 105 Ca 0.11 -1.53 -0.19 0.00 0.00 0.00 0.00 61.98 60.37 1kzw s VAL 105 Cb -0.20 -4.26 0.08 0.00 0.00 0.00 0.00 36.38 32.00 1kzw s VAL 105 CO -0.03 -0.85 0.70 -0.60 0.00 0.00 0.00 175.10 174.32 1kzw s ARG 106 N 1.57 3.09 -0.04 2.72 3.52 0.01 -1.28 118.95 128.54 1kzw s ARG 106 Ca 0.03 -1.08 0.02 0.00 -0.13 0.00 0.00 55.73 54.58 1kzw s ARG 106 Cb -0.29 -4.19 0.01 0.00 -1.56 0.00 0.00 34.95 28.91 1kzw s ARG 106 CO 0.03 -1.44 -0.09 -1.83 -0.81 0.00 0.00 175.30 171.15 1kzw s GLU 107 N 2.82 1.15 -0.23 5.12 -1.05 -0.04 -0.68 118.70 125.79 1kzw s GLU 107 Ca 0.14 -0.30 -0.08 0.00 -0.15 0.00 0.00 54.97 54.58 1kzw s GLU 107 Cb -0.21 -1.04 -0.04 0.00 -0.44 0.00 0.00 34.13 32.40 1kzw s GLU 107 CO 0.09 0.06 0.09 0.42 0.95 0.00 0.00 175.26 176.87 1kzw s ILE 108 N 0.45 4.69 -0.13 1.83 1.01 -1.22 -0.83 121.20 127.00 1kzw s ILE 108 Ca -0.08 -0.05 -0.23 0.00 0.00 0.00 0.00 60.65 60.29 1kzw s ILE 108 Cb -0.12 -3.17 -0.26 0.00 0.01 0.00 0.00 42.46 38.92 1kzw s ILE 108 CO 0.01 0.36 0.63 0.40 0.00 0.00 0.00 174.94 176.34 1kzw h ILE 109 N 5.28 1.37 0.00 2.92 1.08 -1.93 -3.50 117.51 122.73 1kzw h ILE 109 Ca -0.37 -2.36 0.00 0.00 -0.39 0.00 0.00 64.86 61.74 1kzw h ILE 109 Cb 1.18 2.94 0.00 0.00 -3.07 0.00 0.00 36.82 37.87 1kzw h ILE 109 CO 0.61 0.59 0.00 0.61 -0.69 0.00 0.00 178.15 179.28 1kzw n GLY 110 N 1.62 -1.28 0.09 5.37 0.00 -1.26 -4.99 105.19 104.74 1kzw n GLY 110 Ca -0.19 0.56 0.10 0.00 0.00 0.00 0.00 46.02 46.49 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 -0.08 0.27 -3.85 1.61 5.68 -1.26 -4.75 116.55 114.17 1kzw n ASP 111 Ca 0.00 -1.43 -0.17 0.00 -0.50 0.00 0.00 54.79 52.69 1kzw n ASP 111 Cb 0.00 -0.02 -0.16 0.00 -1.14 0.00 0.00 41.12 39.81 1kzw n ASP 111 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1kzw s GLU 112 N -1.97 0.41 -0.39 0.11 2.02 -1.26 -2.86 118.70 114.76 1kzw s GLU 112 Ca 0.30 0.00 -0.24 0.00 0.02 0.00 0.00 54.97 55.06 1kzw s GLU 112 Cb 0.14 -0.52 0.02 0.00 0.10 0.00 0.00 34.13 33.87 1kzw s GLU 112 CO 0.24 -0.09 0.85 -1.17 0.02 0.00 0.00 175.26 175.11 1kzw s LEU 113 N 0.82 4.08 -0.48 1.80 2.96 0.40 -3.69 118.68 124.57 1kzw s LEU 113 Ca -0.09 0.32 -0.16 0.00 -0.22 0.00 0.00 54.13 53.98 1kzw s LEU 113 Cb -0.12 -3.12 0.07 0.00 0.50 0.00 0.00 46.19 43.52 1kzw s LEU 113 CO -0.01 -0.85 0.44 -0.69 -1.32 0.00 0.00 176.35 173.92 1kzw s VAL 114 N 3.36 5.17 -0.55 1.68 1.01 -0.01 -0.46 120.40 130.60 1kzw s VAL 114 Ca 0.34 -0.98 -0.18 0.00 0.00 0.00 0.00 61.98 61.16 1kzw s VAL 114 Cb -0.12 -4.16 0.10 0.00 0.00 0.00 0.00 36.38 32.19 1kzw s VAL 114 CO 0.20 -0.63 0.62 -1.58 0.00 0.00 0.00 175.10 173.71 1kzw s GLN 115 N 1.82 3.04 -0.55 2.72 0.74 -0.15 -0.86 119.66 126.42 1kzw s GLN 115 Ca 0.06 -1.30 -0.21 0.00 0.05 0.00 0.00 55.36 53.96 1kzw s GLN 115 Cb -0.24 -4.22 0.06 0.00 1.10 0.00 0.00 33.01 29.71 1kzw s GLN 115 CO 0.07 -1.38 0.76 0.99 -0.55 0.00 0.00 175.29 175.18 1kzw s THR 116 N 2.38 4.68 -0.43 -0.34 2.01 -0.40 -1.35 115.64 122.18 1kzw s THR 116 Ca 0.10 -0.37 -0.22 0.00 0.31 0.00 0.00 61.69 61.50 1kzw s THR 116 Cb -0.24 -4.44 0.02 0.00 0.01 0.00 0.00 72.50 67.85 1kzw s THR 116 CO 0.07 -1.02 0.74 -0.31 -0.69 0.00 0.00 174.62 173.42 1kzw s TYR 117 N 3.14 3.03 -0.54 4.92 1.51 0.25 -0.78 117.35 128.88 1kzw s TYR 117 Ca 0.19 0.16 -0.03 0.00 -1.01 0.00 0.00 57.07 56.38 1kzw s TYR 117 Cb -0.18 -3.54 0.14 0.00 -0.11 0.00 0.00 41.96 38.27 1kzw s TYR 117 CO 0.12 -0.92 0.35 0.08 -1.11 0.00 0.00 175.55 174.08 1kzw s VAL 118 N 3.13 3.54 -0.35 0.71 1.01 0.29 -1.09 120.40 127.64 1kzw s VAL 118 Ca 0.28 -2.64 -0.17 0.00 0.00 0.00 0.00 61.98 59.45 1kzw s VAL 118 Cb -0.13 -3.36 -0.00 0.00 0.00 0.00 0.00 36.38 32.89 1kzw s VAL 118 CO 0.21 -0.81 0.47 -0.47 0.00 0.00 0.00 175.10 174.50 1kzw s TYR 119 N 0.37 3.18 0.00 5.22 5.04 -0.87 -1.06 117.35 129.24 1kzw s TYR 119 Ca 0.14 0.09 0.00 0.00 -2.44 0.00 0.00 57.07 54.86 1kzw s TYR 119 Cb -0.21 -2.87 0.00 0.00 0.35 0.00 0.00 41.96 39.23 1kzw s TYR 119 CO -0.04 -0.53 0.00 -1.91 -1.34 0.00 0.00 175.55 171.74 1kzw n GLU 120 N 5.65 0.00 -2.69 4.97 0.00 -0.76 -1.88 120.64 125.93 1kzw n GLU 120 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 57.16 57.06 1kzw n GLU 120 Cb 0.49 0.00 0.12 0.00 0.00 0.00 0.00 31.44 32.05 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 1.80 2.68 8.31 0.00 -1.26 -5.06 105.19 111.66 1kzw n GLY 121 Ca 0.00 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.25 -0.01 0.08 1.61 1.01 -0.79 -5.16 120.40 116.89 1kzw s VAL 122 Ca 0.15 0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.31 1kzw s VAL 122 Cb 0.43 -0.28 -0.06 0.00 0.00 0.00 0.00 36.38 36.47 1kzw s VAL 122 CO -0.11 0.13 0.42 -1.61 0.00 0.00 0.00 175.10 173.93 1kzw s GLU 123 N 2.13 3.80 -0.10 2.72 8.01 -1.26 -2.06 118.70 131.94 1kzw s GLU 123 Ca 0.05 0.23 -0.04 0.00 0.01 0.00 0.00 54.97 55.22 1kzw s GLU 123 Cb -0.13 -3.02 0.05 0.00 -4.31 0.00 0.00 34.13 26.73 1kzw s GLU 123 CO -0.04 0.57 0.20 0.00 0.01 0.00 0.00 175.26 176.00 1kzw s ALA 124 N -1.37 -0.33 -0.47 5.21 0.00 -0.25 -4.73 121.76 119.82 1kzw s ALA 124 Ca 0.32 0.72 -0.19 0.00 0.00 0.00 0.00 51.96 52.82 1kzw s ALA 124 Cb -0.14 -0.86 0.04 0.00 0.00 0.00 0.00 23.12 22.16 1kzw s ALA 124 CO 0.18 -0.55 0.57 0.15 0.00 0.00 0.00 175.76 176.11 1kzw s LYS 125 N 2.21 3.14 -0.42 0.00 1.02 -0.92 -0.58 119.74 124.20 1kzw s LYS 125 Ca 0.01 -0.77 -0.22 0.00 0.02 0.00 0.00 55.97 55.01 1kzw s LYS 125 Cb -0.12 -4.03 0.02 0.00 -0.52 0.00 0.00 37.83 33.18 1kzw s LYS 125 CO -0.07 -1.07 0.72 1.03 -0.92 0.00 0.00 175.35 175.04 1kzw s ARG 126 N 2.49 3.48 -0.35 1.68 0.52 -0.45 -0.81 118.95 125.50 1kzw s ARG 126 Ca 0.15 -0.09 -0.13 0.00 -0.52 0.00 0.00 55.73 55.15 1kzw s ARG 126 Cb -0.18 -3.90 -0.01 0.00 0.52 0.00 0.00 34.95 31.39 1kzw s ARG 126 CO 0.14 -0.97 0.23 0.42 0.02 0.00 0.00 175.30 175.14 1kzw s ILE 127 N 3.02 5.11 -0.23 1.52 1.01 -0.88 -0.98 121.20 129.77 1kzw s ILE 127 Ca 0.27 -0.38 -0.07 0.00 0.00 0.00 0.00 60.65 60.47 1kzw s ILE 127 Cb -0.13 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 1kzw s ILE 127 CO 0.19 -0.07 0.06 -0.36 0.00 0.00 0.00 174.94 174.77 1kzw s PHE 128 N 1.68 3.11 0.25 3.97 0.40 0.39 -1.00 117.98 126.78 1kzw s PHE 128 Ca 0.05 -0.31 -0.24 0.00 -0.60 0.00 0.00 56.93 55.84 1kzw s PHE 128 Cb -0.18 -2.19 -0.09 0.00 0.51 0.00 0.00 43.02 41.08 1kzw s PHE 128 CO 0.09 -0.23 0.82 0.21 0.70 0.00 0.00 175.22 176.81 1kzw s LYS 129 N 1.28 4.46 -0.07 0.44 2.47 0.28 -0.45 119.74 128.16 1kzw s LYS 129 Ca 0.05 1.12 -0.30 0.00 -1.56 0.00 0.00 55.97 55.28 1kzw s LYS 129 Cb -0.15 -2.95 -0.06 0.00 -1.46 0.00 0.00 37.83 33.21 1kzw s LYS 129 CO 0.03 0.40 1.77 0.21 0.16 0.00 0.00 175.35 177.92 1kzw s LYS 130 N -1.78 4.03 0.00 4.03 2.20 -1.14 -1.14 119.74 125.94 1kzw s LYS 130 Ca 0.44 2.20 0.00 0.00 -0.36 0.00 0.00 55.97 58.25 1kzw s LYS 130 Cb -0.19 -4.07 0.00 0.00 -1.51 0.00 0.00 37.83 32.06 1kzw s LYS 130 CO 0.24 -1.04 0.03 -3.47 -0.36 0.00 0.00 175.35 170.75