#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 -2.11 0.00 3.72 -1.26 -4.93 117.46 112.88 1kzw n PHE 2 Ca 0.00 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.07 1kzw n PHE 2 Cb 0.00 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.50 1kzw n PHE 2 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1kzw s ASP 3 N 0.00 5.35 -0.10 4.37 1.11 -1.26 -4.64 116.67 121.49 1kzw s ASP 3 Ca 0.00 -0.39 -0.33 0.00 0.18 0.00 0.00 52.55 52.01 1kzw s ASP 3 Cb 0.00 -2.55 0.13 0.00 1.07 0.00 0.00 42.92 41.57 1kzw s ASP 3 CO 0.00 -2.47 1.31 -0.44 1.18 0.00 0.00 175.17 174.75 1kzw s SER 4 N 7.59 -0.06 -0.23 0.27 0.01 -1.01 -4.99 113.70 115.27 1kzw s SER 4 Ca 0.65 -0.06 -0.15 0.00 1.31 0.00 0.00 55.95 57.70 1kzw s SER 4 Cb -0.08 0.11 -0.04 0.00 0.21 0.00 0.00 66.02 66.22 1kzw s SER 4 CO 0.06 -0.20 0.39 -0.89 0.41 0.00 0.00 173.24 173.02 1kzw s THR 5 N -2.30 5.18 -0.21 1.44 2.01 -1.26 -1.41 115.64 119.10 1kzw s THR 5 Ca 0.13 0.65 0.00 0.00 0.31 0.00 0.00 61.69 62.78 1kzw s THR 5 Cb 0.03 -3.72 0.05 0.00 0.01 0.00 0.00 72.50 68.88 1kzw s THR 5 CO -0.04 0.20 -0.05 0.26 -0.69 0.00 0.00 174.62 174.30 1kzw s TRP 6 N 1.68 2.11 -0.15 4.92 0.52 -0.34 -0.76 118.94 126.92 1kzw s TRP 6 Ca 0.17 -1.49 -0.05 0.00 0.02 0.00 0.00 56.10 54.74 1kzw s TRP 6 Cb -0.15 -1.47 -0.04 0.00 -1.15 0.00 0.00 33.47 30.66 1kzw s TRP 6 CO 0.09 -0.72 0.03 0.21 0.02 0.00 0.00 176.95 176.58 1kzw s LYS 7 N 1.49 3.63 -0.10 4.98 2.47 -0.06 -0.22 119.74 131.93 1kzw s LYS 7 Ca -0.03 -0.38 -0.29 0.00 -1.56 0.00 0.00 55.97 53.71 1kzw s LYS 7 Cb -0.18 -3.05 -0.06 0.00 -1.46 0.00 0.00 37.83 33.09 1kzw s LYS 7 CO -0.07 0.41 1.96 0.54 0.16 0.00 0.00 175.35 178.35 1kzw s VAL 8 N -0.05 3.19 -0.22 4.02 0.11 -0.52 -0.81 120.40 126.12 1kzw s VAL 8 Ca 0.05 0.22 -0.16 0.00 -2.93 0.00 0.00 61.98 59.16 1kzw s VAL 8 Cb -0.12 -3.19 -0.10 0.00 -1.53 0.00 0.00 36.38 31.45 1kzw s VAL 8 CO 0.01 -0.07 -0.30 -0.67 -3.33 0.00 0.00 175.10 170.75 1kzw n ASP 9 N 9.03 1.93 -3.73 3.54 2.03 0.67 -4.85 116.55 125.17 1kzw n ASP 9 Ca 0.23 0.36 -0.28 0.00 0.52 0.00 0.00 54.79 55.62 1kzw n ASP 9 Cb 0.43 -0.80 -0.16 0.00 -0.72 0.00 0.00 41.12 39.87 1kzw n ASP 9 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1kzw s ARG 10 N -2.64 0.69 -0.66 -0.67 0.52 -1.06 -5.00 118.95 110.14 1kzw s ARG 10 Ca -0.32 -0.62 -0.19 0.00 -0.52 0.00 0.00 55.73 54.08 1kzw s ARG 10 Cb 0.09 -2.05 0.12 0.00 0.52 0.00 0.00 34.95 33.63 1kzw s ARG 10 CO 0.45 -0.75 0.78 -1.54 0.02 0.00 0.00 175.30 174.26 1kzw s SER 11 N 1.79 6.30 -0.20 0.23 1.04 -1.26 -1.06 113.70 120.54 1kzw s SER 11 Ca 0.02 -1.62 -0.07 0.00 0.48 0.00 0.00 55.95 54.76 1kzw s SER 11 Cb -0.17 -2.31 -0.03 0.00 0.10 0.00 0.00 66.02 63.60 1kzw s SER 11 CO -0.14 -1.07 0.05 -1.61 0.98 0.00 0.00 173.24 171.45 1kzw s GLU 12 N 2.49 3.83 -1.17 4.02 2.02 -0.56 -4.21 118.70 125.11 1kzw s GLU 12 Ca 0.15 -0.42 -0.07 0.00 0.02 0.00 0.00 54.97 54.65 1kzw s GLU 12 Cb -0.20 -3.19 0.01 0.00 0.10 0.00 0.00 34.13 30.85 1kzw s GLU 12 CO 0.03 0.13 1.02 -1.71 0.02 0.00 0.00 175.26 174.75 1kzw n ASN 13 N 3.94 -5.63 -0.06 -0.19 5.15 -1.26 -1.32 115.26 115.90 1kzw n ASN 13 Ca -0.17 -0.47 -0.14 0.00 -0.60 0.00 0.00 54.58 53.21 1kzw n ASN 13 Cb 0.52 -4.42 -0.12 0.00 -0.53 0.00 0.00 39.78 35.23 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 -2.31 0.02 -0.94 1.20 5.03 -1.92 -3.09 116.97 114.96 1kzw h TYR 14 Ca -0.49 -0.01 0.07 0.00 2.58 0.00 0.00 58.73 60.87 1kzw h TYR 14 Cb 1.32 -0.00 -0.07 0.00 1.55 0.00 0.00 36.73 39.53 1kzw h TYR 14 CO 0.43 0.91 0.60 -0.44 -1.32 0.00 0.00 178.16 178.34 1kzw h ASP 15 N -0.88 0.94 -0.20 -2.11 5.19 -1.95 -1.50 116.42 115.92 1kzw h ASP 15 Ca -0.00 0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 1kzw h ASP 15 Cb 0.92 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 1kzw h ASP 15 CO 0.00 0.59 0.09 0.11 -3.12 0.00 0.00 179.24 176.92 1kzw h LYS 16 N 1.07 0.29 -0.11 3.56 1.79 -2.00 -0.26 116.57 120.91 1kzw h LYS 16 Ca 0.41 -0.05 0.04 0.00 -2.18 0.00 0.00 60.65 58.88 1kzw h LYS 16 Cb 0.19 -0.05 -0.05 0.00 -1.58 0.00 0.00 32.23 30.74 1kzw h LYS 16 CO -0.18 0.33 -0.21 0.35 -1.08 0.00 0.00 179.45 178.66 1kzw h PHE 17 N 0.18 -0.57 -0.78 -1.35 3.57 -1.50 -0.81 116.94 115.69 1kzw h PHE 17 Ca 0.07 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 1kzw h PHE 17 Cb 0.14 0.27 -0.04 0.00 2.79 0.00 0.00 35.95 39.11 1kzw h PHE 17 CO -0.02 -0.30 0.47 0.52 -2.23 0.00 0.00 178.31 176.76 1kzw h MET 18 N -0.28 1.05 -0.75 1.11 2.86 -1.28 -1.30 114.93 116.34 1kzw h MET 18 Ca 0.10 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1kzw h MET 18 Cb 0.42 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 1kzw h MET 18 CO -0.28 0.74 0.50 1.49 1.06 0.00 0.00 176.91 180.42 1kzw h GLU 19 N 1.06 0.99 -0.95 1.72 4.22 -1.05 -0.53 114.58 120.04 1kzw h GLU 19 Ca 0.28 -0.06 0.09 0.00 0.08 0.00 0.00 59.36 59.75 1kzw h GLU 19 Cb -0.04 -0.22 -0.07 0.00 0.50 0.00 0.00 28.75 28.91 1kzw h GLU 19 CO -0.05 0.66 0.60 -0.22 -2.18 0.00 0.00 179.01 177.81 1kzw h LYS 20 N 1.02 0.99 0.44 1.92 1.63 -0.89 -2.97 116.57 118.72 1kzw h LYS 20 Ca 0.28 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 60.00 1kzw h LYS 20 Cb -0.12 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.29 1kzw h LYS 20 CO -0.06 0.66 -0.21 0.52 -3.45 0.00 0.00 179.45 176.91 1kzw h MET 21 N 1.02 -0.57 0.00 1.90 2.86 -1.13 -3.49 114.93 115.52 1kzw h MET 21 Ca 0.44 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 58.12 1kzw h MET 21 Cb 0.30 0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1kzw h MET 21 CO -0.22 -0.33 0.00 0.41 1.06 0.00 0.00 176.91 177.83 1kzw n GLY 22 N -1.09 0.14 3.26 8.32 0.00 -0.23 -5.12 105.19 110.48 1kzw n GLY 22 Ca -0.11 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 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 0.00 1.55 0.83 1.61 -7.23 -1.04 -5.01 120.40 111.11 1kzw s VAL 23 Ca 0.00 -1.56 -0.11 0.00 -1.81 0.00 0.00 61.98 58.50 1kzw s VAL 23 Cb 0.00 -1.48 0.09 0.00 0.56 0.00 0.00 36.38 35.54 1kzw s VAL 23 CO 0.00 -0.17 1.09 0.54 -0.31 0.00 0.00 175.10 176.26 1kzw s ASN 24 N -2.03 4.14 0.36 4.85 2.20 -1.26 -4.52 114.94 118.68 1kzw s ASN 24 Ca 0.06 1.41 0.08 0.00 -0.94 0.00 0.00 52.86 53.47 1kzw s ASN 24 Cb -0.09 -2.13 0.78 0.00 -2.00 0.00 0.00 41.25 37.82 1kzw s ASN 24 CO 0.04 -2.21 1.90 -0.29 -2.94 0.00 0.00 177.10 173.61 1kzw h ILE 25 N -1.25 0.91 0.12 0.54 2.10 -2.01 -1.62 117.51 116.30 1kzw h ILE 25 Ca -0.48 -0.25 -0.01 0.00 1.08 0.00 0.00 64.86 65.21 1kzw h ILE 25 Cb 1.27 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 37.12 1kzw h ILE 25 CO 0.57 0.13 -0.06 0.58 -1.08 0.00 0.00 178.15 178.30 1kzw h VAL 26 N 0.72 1.02 -0.57 2.19 2.07 -1.99 0.07 116.25 119.76 1kzw h VAL 26 Ca 0.40 -0.55 0.11 0.00 0.82 0.00 0.00 66.70 67.47 1kzw h VAL 26 Cb 0.54 1.37 -0.08 0.00 -1.52 0.00 0.00 31.29 31.60 1kzw h VAL 26 CO -0.16 0.13 0.11 0.11 0.02 0.00 0.00 177.57 177.78 1kzw h LYS 27 N -0.42 0.24 -0.24 1.57 1.79 -1.92 -0.46 116.57 117.12 1kzw h LYS 27 Ca -0.02 -0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.47 1kzw h LYS 27 Cb 0.34 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.91 1kzw h LYS 27 CO 0.03 0.16 0.08 0.00 -1.08 0.00 0.00 179.45 178.63 1kzw h ARG 28 N 0.24 0.18 -0.36 3.15 3.08 -1.29 -0.96 114.38 118.41 1kzw h ARG 28 Ca 0.30 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.33 1kzw h ARG 28 Cb 0.43 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1kzw h ARG 28 CO -0.39 0.12 0.21 0.87 -1.07 0.00 0.00 179.97 179.71 1kzw h LYS 29 N 0.18 0.49 -0.18 0.04 1.57 -0.84 -0.65 116.57 117.18 1kzw h LYS 29 Ca 0.11 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1kzw h LYS 29 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1kzw h LYS 29 CO -0.12 0.37 0.11 -0.07 -0.57 0.00 0.00 179.45 179.17 1kzw h LEU 30 N 0.46 0.21 -1.26 2.94 3.38 -1.11 -2.01 115.31 117.93 1kzw h LEU 30 Ca 0.13 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1kzw h LEU 30 Cb 0.01 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1kzw h LEU 30 CO -0.02 0.18 -0.06 0.00 0.09 0.00 0.00 178.44 178.63 1kzw h ALA 31 N 1.04 1.01 0.00 1.53 0.00 -1.21 -3.12 119.26 118.51 1kzw h ALA 31 Ca 0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1kzw h ALA 31 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1kzw h ALA 31 CO -0.01 0.08 -0.08 0.00 0.00 0.00 0.00 179.25 179.24 1kzw h ALA 32 N 1.94 0.00 0.00 0.00 0.00 -1.08 -3.36 119.26 116.75 1kzw h ALA 32 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1kzw h ALA 32 Cb 0.61 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1kzw h ALA 32 CO 0.01 -0.02 0.00 0.72 0.00 0.00 0.00 179.25 179.95 1kzw n HIS 33 N -4.62 0.00 0.35 0.00 8.25 -0.76 -4.51 115.22 113.93 1kzw n HIS 33 Ca -0.10 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.50 1kzw n HIS 33 Cb 0.45 -0.07 0.44 0.00 1.12 0.00 0.00 29.99 31.93 1kzw n HIS 33 CO 0.00 0.00 0.00 0.38 0.64 0.00 0.00 176.34 177.36 1kzw h ASP 34 N 0.08 0.00 -5.25 0.41 3.04 -1.70 -3.47 116.42 109.53 1kzw h ASP 34 Ca 0.00 0.00 -0.18 0.00 -3.24 0.00 0.00 57.03 53.61 1kzw h ASP 34 Cb 0.34 0.00 0.14 0.00 -1.04 0.00 0.00 39.33 38.78 1kzw h ASP 34 CO 0.00 0.00 -0.62 0.59 -2.04 0.00 0.00 179.24 177.17 1kzw n ASN 35 N -2.76 -6.54 -4.61 4.15 3.02 -1.26 -0.59 115.26 106.67 1kzw n ASN 35 Ca 0.03 -0.53 -0.41 0.00 -0.03 0.00 0.00 54.58 53.64 1kzw n ASN 35 Cb 0.38 -4.89 -0.06 0.00 -0.61 0.00 0.00 39.78 34.61 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 -4.91 4.11 -0.21 3.41 0.20 -1.26 -4.44 118.68 115.59 1kzw s LEU 36 Ca 0.33 0.56 -0.09 0.00 0.69 0.00 0.00 54.13 55.62 1kzw s LEU 36 Cb -0.04 -2.94 -0.05 0.00 -0.43 0.00 0.00 46.19 42.73 1kzw s LEU 36 CO 0.69 -0.53 0.12 -0.75 -0.29 0.00 0.00 176.35 175.58 1kzw s LYS 37 N 2.76 4.07 -0.52 1.98 2.20 -0.50 -1.43 119.74 128.30 1kzw s LYS 37 Ca 0.29 -0.28 -0.17 0.00 -0.36 0.00 0.00 55.97 55.45 1kzw s LYS 37 Cb -0.15 -3.40 0.10 0.00 -1.51 0.00 0.00 37.83 32.87 1kzw s LYS 37 CO 0.12 0.19 0.51 -0.51 -0.36 0.00 0.00 175.35 175.30 1kzw s LEU 38 N 0.66 5.73 -0.47 5.43 1.43 0.69 -1.38 118.68 130.77 1kzw s LEU 38 Ca 0.06 -1.47 -0.19 0.00 -1.03 0.00 0.00 54.13 51.50 1kzw s LEU 38 Cb -0.12 -2.24 0.04 0.00 0.03 0.00 0.00 46.19 43.90 1kzw s LEU 38 CO 0.01 -0.83 0.57 -0.89 0.23 0.00 0.00 176.35 175.44 1kzw s THR 39 N 1.91 4.93 -0.19 5.49 2.01 -0.73 -1.19 115.64 127.87 1kzw s THR 39 Ca 0.06 -0.36 -0.07 0.00 0.31 0.00 0.00 61.69 61.63 1kzw s THR 39 Cb -0.26 -4.21 -0.04 0.00 0.01 0.00 0.00 72.50 68.01 1kzw s THR 39 CO 0.06 -0.66 0.06 -0.63 -0.69 0.00 0.00 174.62 172.76 1kzw s ILE 40 N 2.50 4.72 -0.06 1.82 1.01 -0.50 -1.22 121.20 129.47 1kzw s ILE 40 Ca 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 60.65 60.74 1kzw s ILE 40 Cb -0.18 -3.13 0.03 0.00 0.01 0.00 0.00 42.46 39.19 1kzw s ILE 40 CO 0.14 0.45 -0.01 -0.89 0.00 0.00 0.00 174.94 174.62 1kzw s THR 41 N 0.49 0.39 -0.16 2.92 2.01 -0.31 -2.41 115.64 118.56 1kzw s THR 41 Ca 0.03 0.06 -0.10 0.00 0.31 0.00 0.00 61.69 61.98 1kzw s THR 41 Cb -0.13 -0.51 -0.05 0.00 0.01 0.00 0.00 72.50 71.83 1kzw s THR 41 CO 0.01 0.24 0.19 -1.58 -0.69 0.00 0.00 174.62 172.78 1kzw s GLN 42 N 1.60 4.01 -0.49 4.92 -0.44 -1.26 -0.57 119.66 127.43 1kzw s GLN 42 Ca -0.01 -0.09 0.03 0.00 -2.50 0.00 0.00 55.36 52.79 1kzw s GLN 42 Cb -0.13 -3.36 0.14 0.00 -1.64 0.00 0.00 33.01 28.03 1kzw s GLN 42 CO -0.03 0.42 0.29 -2.00 0.50 0.00 0.00 175.29 174.46 1kzw s GLU 43 N -0.02 1.53 1.90 1.67 2.56 0.48 -5.01 118.70 121.81 1kzw s GLU 43 Ca 0.13 -2.31 0.00 0.00 0.00 0.00 0.00 54.97 52.79 1kzw s GLU 43 Cb -0.12 -2.57 0.00 0.00 2.00 0.00 0.00 34.13 33.44 1kzw s GLU 43 CO 0.02 -1.19 0.00 0.41 -0.56 0.00 0.00 175.26 173.93 1kzw n GLY 44 N 3.18 1.94 0.41 -1.50 0.00 -1.26 -2.37 105.19 105.59 1kzw n GLY 44 Ca 0.12 0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.28 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 5.46 1.74 -4.65 1.61 4.13 -1.26 -5.05 115.26 117.24 1kzw n ASN 45 Ca 0.00 -1.37 -0.33 0.00 1.68 0.00 0.00 54.58 54.56 1kzw n ASN 45 Cb 0.00 0.25 -0.09 0.00 -1.54 0.00 0.00 39.78 38.39 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 -1.38 2.71 -0.23 3.52 1.02 -1.00 -1.87 119.74 122.51 1kzw s LYS 46 Ca 0.13 -0.64 -0.05 0.00 0.02 0.00 0.00 55.97 55.43 1kzw s LYS 46 Cb 0.11 -2.61 -0.01 0.00 -0.52 0.00 0.00 37.83 34.79 1kzw s LYS 46 CO 0.25 0.62 -0.01 -0.06 -0.92 0.00 0.00 175.35 175.23 1kzw s PHE 47 N -1.03 3.00 -0.62 3.18 0.08 0.01 -0.39 117.98 122.21 1kzw s PHE 47 Ca 0.18 -0.76 -0.24 0.00 0.12 0.00 0.00 56.93 56.23 1kzw s PHE 47 Cb -0.11 -2.14 0.05 0.00 -0.57 0.00 0.00 43.02 40.25 1kzw s PHE 47 CO 0.09 -0.47 0.99 0.99 -0.10 0.00 0.00 175.22 176.71 1kzw s THR 48 N 1.47 4.29 -0.48 0.64 2.01 0.27 -1.70 115.64 122.15 1kzw s THR 48 Ca 0.05 0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.96 1kzw s THR 48 Cb -0.14 -4.64 0.11 0.00 0.01 0.00 0.00 72.50 67.83 1kzw s THR 48 CO -0.01 -1.34 0.37 -0.69 -0.69 0.00 0.00 174.62 172.26 1kzw s VAL 49 N 4.19 4.54 -0.53 3.82 1.01 -0.23 -1.16 120.40 132.04 1kzw s VAL 49 Ca 0.27 -1.57 -0.26 0.00 0.00 0.00 0.00 61.98 60.42 1kzw s VAL 49 Cb -0.14 -3.90 0.03 0.00 0.00 0.00 0.00 36.38 32.38 1kzw s VAL 49 CO 0.15 -0.72 1.02 -0.54 0.00 0.00 0.00 175.10 175.01 1kzw s LYS 50 N 1.46 3.47 -0.88 2.72 1.02 -0.36 -1.22 119.74 125.95 1kzw s LYS 50 Ca 0.04 0.06 -0.21 0.00 0.02 0.00 0.00 55.97 55.88 1kzw s LYS 50 Cb -0.26 -3.99 0.09 0.00 -0.52 0.00 0.00 37.83 33.15 1kzw s LYS 50 CO 0.01 -1.45 1.17 -1.21 -0.92 0.00 0.00 175.35 172.95 1kzw s GLU 51 N 4.20 3.46 -0.44 1.68 2.02 0.12 -1.78 118.70 127.96 1kzw s GLU 51 Ca 0.37 -1.32 -0.18 0.00 0.02 0.00 0.00 54.97 53.86 1kzw s GLU 51 Cb -0.10 -4.81 0.03 0.00 0.10 0.00 0.00 34.13 29.35 1kzw s GLU 51 CO 0.24 -1.90 0.48 -1.12 0.02 0.00 0.00 175.26 172.98 1kzw s SER 52 N 3.94 6.20 0.06 -0.19 0.01 -0.48 -1.56 113.70 121.68 1kzw s SER 52 Ca 0.33 -0.76 -0.05 0.00 1.31 0.00 0.00 55.95 56.78 1kzw s SER 52 Cb -0.07 -2.24 -0.02 0.00 0.21 0.00 0.00 66.02 63.91 1kzw s SER 52 CO -0.04 -0.66 0.08 -0.94 0.41 0.00 0.00 173.24 172.10 1kzw s SER 53 N 2.06 0.26 0.60 2.44 1.04 -0.69 -1.41 113.70 118.00 1kzw s SER 53 Ca 0.13 -0.72 0.30 0.00 0.48 0.00 0.00 55.95 56.14 1kzw s SER 53 Cb -0.18 0.25 1.84 0.00 0.10 0.00 0.00 66.02 68.03 1kzw s SER 53 CO 0.13 -0.60 2.25 0.00 0.98 0.00 0.00 173.24 175.99 1kzw h ALA 54 N 3.23 1.53 0.20 5.32 0.00 -1.09 -2.92 119.26 125.53 1kzw h ALA 54 Ca -0.33 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1kzw h ALA 54 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1kzw h ALA 54 CO 0.57 -0.03 -0.10 0.35 0.00 0.00 0.00 179.25 180.04 1kzw h PHE 55 N 0.00 -0.25 -2.45 0.00 3.04 -1.86 -3.49 116.94 111.92 1kzw h PHE 55 Ca 0.01 -0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.89 1kzw h PHE 55 Cb 0.06 0.08 -0.17 0.00 2.56 0.00 0.00 35.95 38.48 1kzw h PHE 55 CO 0.00 0.14 0.10 -0.98 -2.02 0.00 0.00 178.31 175.55 1kzw s ARG 56 N -4.06 1.03 -0.53 1.11 3.03 -1.10 -5.12 118.95 113.31 1kzw s ARG 56 Ca -0.14 -0.02 -0.10 0.00 2.03 0.00 0.00 55.73 57.51 1kzw s ARG 56 Cb 0.01 0.48 0.13 0.00 -1.03 0.00 0.00 34.95 34.55 1kzw s ARG 56 CO 0.53 -0.35 0.41 1.21 -1.13 0.00 0.00 175.30 175.97 1kzw s ASN 57 N -1.61 5.81 -0.07 -2.89 2.47 -1.26 -1.70 114.94 115.69 1kzw s ASN 57 Ca -0.08 -2.07 0.04 0.00 0.42 0.00 0.00 52.86 51.17 1kzw s ASN 57 Cb -0.01 -2.03 -0.00 0.00 -1.45 0.00 0.00 41.25 37.76 1kzw s ASN 57 CO 0.03 -0.67 -0.21 0.27 -3.72 0.00 0.00 177.10 172.81 1kzw s ILE 58 N 1.13 1.75 -0.64 -5.21 -4.36 -0.60 -4.98 121.20 108.29 1kzw s ILE 58 Ca 0.08 -0.87 -0.18 0.00 -0.26 0.00 0.00 60.65 59.41 1kzw s ILE 58 Cb -0.24 -1.51 0.12 0.00 1.25 0.00 0.00 42.46 42.07 1kzw s ILE 58 CO -0.01 0.49 0.74 -1.61 0.24 0.00 0.00 174.94 174.79 1kzw s GLU 59 N 0.17 3.13 -0.81 0.37 8.01 -1.26 -0.70 118.70 127.61 1kzw s GLU 59 Ca -0.10 -1.45 -0.18 0.00 0.01 0.00 0.00 54.97 53.24 1kzw s GLU 59 Cb -0.15 -4.33 0.13 0.00 -4.31 0.00 0.00 34.13 25.48 1kzw s GLU 59 CO 0.05 -1.54 0.95 0.08 0.01 0.00 0.00 175.26 174.81 1kzw s VAL 60 N 2.47 4.87 -0.64 2.63 1.01 -0.36 -4.90 120.40 125.48 1kzw s VAL 60 Ca 0.13 -1.48 -0.19 0.00 0.00 0.00 0.00 61.98 60.44 1kzw s VAL 60 Cb -0.22 -4.65 0.11 0.00 0.00 0.00 0.00 36.38 31.63 1kzw s VAL 60 CO 0.04 -1.33 0.76 -0.69 0.00 0.00 0.00 175.10 173.88 1kzw s VAL 61 N 2.37 4.83 -0.05 2.92 1.01 -1.26 -1.07 120.40 129.16 1kzw s VAL 61 Ca 0.24 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1kzw s VAL 61 Cb -0.11 -4.53 -0.03 0.00 0.00 0.00 0.00 36.38 31.71 1kzw s VAL 61 CO -0.04 -1.18 -0.05 0.72 0.00 0.00 0.00 175.10 174.55 1kzw s PHE 62 N 2.60 2.97 0.07 5.22 -0.12 -0.69 -4.97 117.98 123.06 1kzw s PHE 62 Ca 0.14 0.03 -0.21 0.00 -0.05 0.00 0.00 56.93 56.85 1kzw s PHE 62 Cb -0.21 -1.69 -0.07 0.00 -0.63 0.00 0.00 43.02 40.42 1kzw s PHE 62 CO 0.04 0.37 0.61 -2.00 -0.05 0.00 0.00 175.22 174.19 1kzw s GLU 63 N -1.04 4.28 0.18 1.99 2.12 -1.26 -0.81 118.70 124.16 1kzw s GLU 63 Ca 0.14 0.80 -0.32 0.00 0.36 0.00 0.00 54.97 55.96 1kzw s GLU 63 Cb -0.11 -3.27 -0.11 0.00 0.26 0.00 0.00 34.13 30.90 1kzw s GLU 63 CO 0.04 0.56 1.69 -0.51 -0.54 0.00 0.00 175.26 176.50 1kzw s LEU 64 N -0.89 4.37 0.00 2.70 1.43 -0.78 -2.39 118.68 123.12 1kzw s LEU 64 Ca 0.31 2.76 0.00 0.00 -1.03 0.00 0.00 54.13 56.16 1kzw s LEU 64 Cb -0.20 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.43 1kzw s LEU 64 CO 0.20 -0.93 0.00 0.61 0.23 0.00 0.00 176.35 176.46 1kzw n GLY 65 N 3.95 2.20 3.78 -3.19 0.00 -0.45 -4.97 105.19 106.51 1kzw n GLY 65 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.16 5.35 -0.56 1.61 1.01 -1.01 -4.87 120.40 118.77 1kzw s VAL 66 Ca 0.00 0.41 -0.28 0.00 0.00 0.00 0.00 61.98 62.11 1kzw s VAL 66 Cb 0.00 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.84 1kzw s VAL 66 CO 0.00 0.48 1.52 0.42 0.00 0.00 0.00 175.10 177.53 1kzw s THR 67 N -0.12 3.68 -0.04 3.92 -4.23 -1.26 -4.39 115.64 113.20 1kzw s THR 67 Ca 0.15 0.56 0.06 0.00 -1.18 0.00 0.00 61.69 61.27 1kzw s THR 67 Cb -0.13 -4.30 -0.02 0.00 1.34 0.00 0.00 72.50 69.39 1kzw s THR 67 CO 0.03 -1.09 -0.22 0.72 -0.54 0.00 0.00 174.62 173.53 1kzw s PHE 68 N 6.66 2.48 -0.28 3.99 -0.71 -0.86 -4.80 117.98 124.46 1kzw s PHE 68 Ca 0.57 -0.42 -0.29 0.00 -1.04 0.00 0.00 56.93 55.75 1kzw s PHE 68 Cb -0.12 -1.57 -0.00 0.00 -1.21 0.00 0.00 43.02 40.12 1kzw s PHE 68 CO 0.24 -0.01 1.35 -0.80 -1.34 0.00 0.00 175.22 174.66 1kzw s ASN 69 N -0.53 6.64 0.13 1.98 0.01 -1.26 -2.09 114.94 119.83 1kzw s ASN 69 Ca 0.07 1.31 0.07 0.00 -0.71 0.00 0.00 52.86 53.60 1kzw s ASN 69 Cb -0.11 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 38.97 1kzw s ASN 69 CO 0.01 -1.09 -0.05 -0.47 -1.51 0.00 0.00 177.10 173.99 1kzw s TYR 70 N 4.44 2.81 -0.05 2.20 5.04 0.72 -4.85 117.35 127.66 1kzw s TYR 70 Ca 0.59 -0.13 0.06 0.00 -2.44 0.00 0.00 57.07 55.15 1kzw s TYR 70 Cb -0.18 -1.42 -0.01 0.00 0.35 0.00 0.00 41.96 40.69 1kzw s TYR 70 CO 0.23 0.48 -0.25 0.54 -1.34 0.00 0.00 175.55 175.21 1kzw s ASN 71 N -2.54 3.10 -0.92 4.32 2.20 -1.26 -1.32 114.94 118.52 1kzw s ASN 71 Ca 0.25 -0.49 0.00 0.00 -0.94 0.00 0.00 52.86 51.67 1kzw s ASN 71 Cb -0.10 -0.74 0.31 0.00 -2.00 0.00 0.00 41.25 38.72 1kzw s ASN 71 CO 0.16 0.26 1.44 0.18 -2.94 0.00 0.00 177.10 176.21 1kzw n LEU 72 N 2.83 6.16 0.00 3.54 4.77 -1.25 -4.97 117.00 128.07 1kzw n LEU 72 Ca -0.17 -5.40 0.00 0.00 -0.03 0.00 0.00 56.01 50.41 1kzw n LEU 72 Cb 0.52 -1.03 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1kzw n LEU 72 CO 0.25 2.00 0.00 0.00 -1.33 0.00 0.00 177.39 178.31 1kzw n ALA 73 N 0.41 0.00 0.29 -1.18 0.00 -1.26 -4.48 120.51 114.28 1kzw n ALA 73 Ca 0.36 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.99 1kzw n ALA 73 Cb 0.32 0.00 0.97 0.00 0.00 0.00 0.00 19.45 20.74 1kzw n ALA 73 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1kzw h ASP 74 N 0.00 0.00 0.00 0.00 3.04 -1.93 -3.47 116.42 114.06 1kzw h ASP 74 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1kzw h ASP 74 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1kzw h ASP 74 CO 0.00 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.81 1kzw n GLY 75 N -1.24 1.38 3.57 7.15 0.00 -1.26 -5.10 105.19 109.69 1kzw n GLY 75 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.00 4.24 -0.01 2.61 2.01 -1.26 -4.95 115.64 116.27 1kzw s THR 76 Ca 0.00 0.84 -0.30 0.00 0.31 0.00 0.00 61.69 62.54 1kzw s THR 76 Cb 0.00 -4.60 -0.03 0.00 0.01 0.00 0.00 72.50 67.88 1kzw s THR 76 CO 0.00 -1.10 1.05 -1.61 -0.69 0.00 0.00 174.62 172.28 1kzw s GLU 77 N 4.37 4.48 -0.23 4.92 2.02 -1.26 -3.89 118.70 129.12 1kzw s GLU 77 Ca 0.41 1.51 -0.04 0.00 0.02 0.00 0.00 54.97 56.87 1kzw s GLU 77 Cb -0.09 -3.46 0.08 0.00 0.10 0.00 0.00 34.13 30.76 1kzw s GLU 77 CO 0.26 -0.19 0.12 -0.51 0.02 0.00 0.00 175.26 174.96 1kzw s LEU 78 N 1.35 0.40 -0.15 1.80 1.43 -0.43 -1.20 118.68 121.88 1kzw s LEU 78 Ca 0.53 -0.92 -0.28 0.00 -1.03 0.00 0.00 54.13 52.44 1kzw s LEU 78 Cb -0.23 -0.25 -0.01 0.00 0.03 0.00 0.00 46.19 45.74 1kzw s LEU 78 CO 0.26 -0.39 0.94 -0.60 0.23 0.00 0.00 176.35 176.79 1kzw s ARG 79 N 2.13 4.34 0.26 1.70 3.52 -0.20 -0.20 118.95 130.51 1kzw s ARG 79 Ca 0.06 1.24 -0.20 0.00 -0.13 0.00 0.00 55.73 56.69 1kzw s ARG 79 Cb -0.16 -3.57 0.06 0.00 -1.56 0.00 0.00 34.95 29.72 1kzw s ARG 79 CO -0.23 -0.37 0.91 0.20 -0.81 0.00 0.00 175.30 175.00 1kzw s GLY 80 N 1.14 0.14 -0.07 8.12 0.00 -0.89 -0.70 107.32 115.05 1kzw s GLY 80 Ca 0.44 -0.43 0.03 0.00 0.00 0.00 0.00 44.72 44.76 1kzw s GLY 80 CO 0.14 0.84 -0.16 -0.51 0.00 0.00 0.00 173.10 173.41 1kzw s THR 81 N -2.53 1.42 -0.24 0.90 -4.23 -0.95 -2.03 115.64 107.98 1kzw s THR 81 Ca 0.17 -0.65 -0.13 0.00 -1.18 0.00 0.00 61.69 59.90 1kzw s THR 81 Cb -0.04 -1.27 -0.04 0.00 1.34 0.00 0.00 72.50 72.49 1kzw s THR 81 CO 0.07 0.42 0.27 0.26 -0.54 0.00 0.00 174.62 175.10 1kzw s TRP 82 N 0.54 3.31 -0.25 3.99 0.52 -1.26 -0.93 118.94 124.86 1kzw s TRP 82 Ca -0.16 0.35 -0.07 0.00 0.02 0.00 0.00 56.10 56.24 1kzw s TRP 82 Cb -0.16 -2.41 -0.03 0.00 -1.15 0.00 0.00 33.47 29.72 1kzw s TRP 82 CO 0.05 -0.04 0.07 -1.12 0.02 0.00 0.00 176.95 175.93 1kzw s SER 83 N 1.26 5.15 -0.22 2.95 0.01 -0.66 -1.35 113.70 120.84 1kzw s SER 83 Ca 0.12 -0.20 -0.25 0.00 1.31 0.00 0.00 55.95 56.93 1kzw s SER 83 Cb -0.15 -1.93 -0.01 0.00 0.21 0.00 0.00 66.02 64.15 1kzw s SER 83 CO 0.07 -0.03 0.85 -0.22 0.41 0.00 0.00 173.24 174.33 1kzw s LEU 84 N 1.59 4.11 -0.19 2.44 2.96 -1.26 -2.06 118.68 126.27 1kzw s LEU 84 Ca 0.06 1.12 -0.19 0.00 -0.22 0.00 0.00 54.13 54.90 1kzw s LEU 84 Cb -0.15 -3.24 -0.21 0.00 0.50 0.00 0.00 46.19 43.09 1kzw s LEU 84 CO 0.04 -0.50 0.27 -0.08 -1.32 0.00 0.00 176.35 174.76 1kzw h GLU 85 N 7.54 0.05 0.00 1.98 4.22 -1.53 -3.50 114.58 123.35 1kzw h GLU 85 Ca -0.25 -0.09 0.00 0.00 0.08 0.00 0.00 59.36 59.11 1kzw h GLU 85 Cb 1.10 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1kzw h GLU 85 CO 0.87 1.04 0.00 0.41 -2.18 0.00 0.00 179.01 179.16 1kzw n GLY 86 N 1.54 -1.83 0.06 1.92 0.00 -1.26 -4.84 105.19 100.77 1kzw n GLY 86 Ca -0.31 0.65 0.15 0.00 0.00 0.00 0.00 46.02 46.50 1kzw n GLY 86 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1kzw n ASN 87 N 0.00 0.23 -4.66 1.61 3.02 -1.26 -4.72 115.26 109.48 1kzw n ASN 87 Ca 0.00 -0.48 -0.35 0.00 -0.03 0.00 0.00 54.58 53.72 1kzw n ASN 87 Cb 0.00 -0.15 -0.10 0.00 -0.61 0.00 0.00 39.78 38.93 1kzw n ASN 87 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1kzw s LYS 88 N -2.43 3.13 -0.09 3.52 -0.14 -1.26 -2.50 119.74 119.97 1kzw s LYS 88 Ca 0.32 -0.42 0.01 0.00 -1.36 0.00 0.00 55.97 54.52 1kzw s LYS 88 Cb 0.20 -2.83 0.02 0.00 -1.68 0.00 0.00 37.83 33.54 1kzw s LYS 88 CO 0.45 0.62 -0.08 -0.51 -0.76 0.00 0.00 175.35 175.07 1kzw s LEU 89 N -0.65 1.33 -0.22 3.17 1.43 -0.17 -1.11 118.68 122.46 1kzw s LEU 89 Ca 0.11 -0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 52.90 1kzw s LEU 89 Cb -0.12 -0.77 -0.00 0.00 0.03 0.00 0.00 46.19 45.33 1kzw s LEU 89 CO 0.02 -0.06 -0.06 -0.51 0.23 0.00 0.00 176.35 175.97 1kzw s ILE 90 N 1.27 3.18 -0.39 -0.59 -1.16 -0.88 -0.74 121.20 121.90 1kzw s ILE 90 Ca -0.04 -0.60 -0.10 0.00 -0.51 0.00 0.00 60.65 59.40 1kzw s ILE 90 Cb -0.14 -2.46 0.04 0.00 0.61 0.00 0.00 42.46 40.52 1kzw s ILE 90 CO -0.03 0.41 0.22 -0.83 -2.81 0.00 0.00 174.94 171.89 1kzw s GLY 91 N 1.44 1.93 -0.75 1.50 0.00 -0.07 -1.64 107.32 109.73 1kzw s GLY 91 Ca 0.05 -1.83 -0.17 0.00 0.00 0.00 0.00 44.72 42.77 1kzw s GLY 91 CO -0.04 0.87 0.82 0.54 0.00 0.00 0.00 173.10 175.29 1kzw s LYS 92 N 1.52 3.37 -0.04 2.90 1.02 -0.10 -1.40 119.74 127.01 1kzw s LYS 92 Ca 0.02 -1.85 0.02 0.00 0.02 0.00 0.00 55.97 54.18 1kzw s LYS 92 Cb -0.20 -4.49 -0.03 0.00 -0.52 0.00 0.00 37.83 32.59 1kzw s LYS 92 CO 0.05 -1.50 -0.05 -0.06 -0.92 0.00 0.00 175.35 172.87 1kzw s PHE 93 N 1.75 2.96 -0.03 3.18 0.08 -0.28 -2.23 117.98 123.41 1kzw s PHE 93 Ca 0.18 0.02 0.06 0.00 0.12 0.00 0.00 56.93 57.31 1kzw s PHE 93 Cb -0.15 -1.68 -0.01 0.00 -0.57 0.00 0.00 43.02 40.61 1kzw s PHE 93 CO -0.03 0.38 -0.19 0.15 -0.10 0.00 0.00 175.22 175.42 1kzw s LYS 94 N -1.13 1.73 -0.49 0.44 3.01 0.12 -0.41 119.74 123.01 1kzw s LYS 94 Ca 0.15 -0.70 -0.28 0.00 -1.01 0.00 0.00 55.97 54.13 1kzw s LYS 94 Cb -0.11 -1.60 0.02 0.00 -1.01 0.00 0.00 37.83 35.12 1kzw s LYS 94 CO 0.05 0.37 1.35 0.50 0.51 0.00 0.00 175.35 178.13 1kzw s ARG 95 N -0.30 3.50 -1.33 1.68 3.52 -1.05 -1.03 118.95 123.94 1kzw s ARG 95 Ca 0.04 0.64 -0.15 0.00 -0.13 0.00 0.00 55.73 56.12 1kzw s ARG 95 Cb -0.09 -4.04 -0.00 0.00 -1.56 0.00 0.00 34.95 29.26 1kzw s ARG 95 CO 0.00 -1.68 2.19 0.25 -0.81 0.00 0.00 175.30 175.25 1kzw n THR 96 N 6.93 3.14 0.00 4.11 -2.24 -0.34 -0.08 114.28 125.81 1kzw n THR 96 Ca 0.14 -2.72 0.00 0.00 -2.27 0.00 0.00 64.05 59.20 1kzw n THR 96 Cb 0.49 -2.55 0.00 0.00 -2.10 0.00 0.00 70.33 66.17 1kzw n THR 96 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1kzw n ASP 97 N 6.31 0.00 0.00 3.42 2.03 -1.26 -4.71 116.55 122.33 1kzw n ASP 97 Ca 0.52 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.83 1kzw n ASP 97 Cb 0.39 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.79 1kzw n ASP 97 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1kzw n ASN 98 N 0.00 0.00 0.00 1.67 2.85 -0.60 -5.08 115.26 114.10 1kzw n ASN 98 Ca 0.00 -0.45 0.00 0.00 -0.11 0.00 0.00 54.58 54.02 1kzw n ASN 98 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1kzw n ASN 98 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1kzw n GLY 99 N 0.00 1.48 3.73 8.20 0.00 0.89 -4.92 105.19 114.58 1kzw n GLY 99 Ca 0.00 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 4.69 -0.06 1.61 0.01 -1.26 -3.44 114.94 116.49 1kzw s ASN 100 Ca 0.00 2.63 -0.29 0.00 -0.71 0.00 0.00 52.86 54.49 1kzw s ASN 100 Cb 0.00 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.02 1kzw s ASN 100 CO 0.00 -1.95 0.95 -1.83 -1.51 0.00 0.00 177.10 172.76 1kzw s GLU 101 N -3.33 4.47 -0.22 -0.60 1.03 -1.26 -2.53 118.70 116.25 1kzw s GLU 101 Ca 0.81 1.31 0.02 0.00 0.03 0.00 0.00 54.97 57.15 1kzw s GLU 101 Cb -0.37 -3.50 0.04 0.00 -0.80 0.00 0.00 34.13 29.49 1kzw s GLU 101 CO 0.40 -0.16 -0.15 -1.17 -1.33 0.00 0.00 175.26 172.85 1kzw s LEU 102 N 1.46 2.77 -0.29 1.83 0.20 0.46 -3.08 118.68 122.03 1kzw s LEU 102 Ca 0.48 -1.00 -0.10 0.00 0.69 0.00 0.00 54.13 54.20 1kzw s LEU 102 Cb -0.19 -1.52 -0.03 0.00 -0.43 0.00 0.00 46.19 44.02 1kzw s LEU 102 CO 0.22 -0.09 0.17 0.54 -0.29 0.00 0.00 176.35 176.90 1kzw s ASN 103 N 1.21 5.77 -0.39 3.68 2.20 -0.38 -1.13 114.94 125.90 1kzw s ASN 103 Ca -0.01 -0.23 -0.14 0.00 -0.94 0.00 0.00 52.86 51.53 1kzw s ASN 103 Cb -0.16 -2.06 0.01 0.00 -2.00 0.00 0.00 41.25 37.04 1kzw s ASN 103 CO -0.09 -0.11 0.28 -0.89 -2.94 0.00 0.00 177.10 173.35 1kzw s THR 104 N 1.70 5.22 -0.44 0.54 2.01 -0.49 -1.48 115.64 122.70 1kzw s THR 104 Ca 0.06 -0.59 -0.17 0.00 0.31 0.00 0.00 61.69 61.31 1kzw s THR 104 Cb -0.16 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.52 1kzw s THR 104 CO 0.09 -0.25 0.42 -0.69 -0.69 0.00 0.00 174.62 173.50 1kzw s VAL 105 N 1.68 5.12 -0.16 3.82 1.01 -0.04 -0.89 120.40 130.95 1kzw s VAL 105 Ca 0.05 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1kzw s VAL 105 Cb -0.19 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 1kzw s VAL 105 CO 0.10 -0.47 0.33 -0.13 0.00 0.00 0.00 175.10 174.92 1kzw s ARG 106 N 2.01 4.26 -0.08 2.72 0.52 0.08 -0.54 118.95 127.93 1kzw s ARG 106 Ca 0.09 0.15 -0.06 0.00 -0.52 0.00 0.00 55.73 55.39 1kzw s ARG 106 Cb -0.19 -3.44 0.02 0.00 0.52 0.00 0.00 34.95 31.86 1kzw s ARG 106 CO 0.11 0.19 0.20 -2.00 0.02 0.00 0.00 175.30 173.82 1kzw s GLU 107 N 0.60 0.21 -0.47 3.54 2.12 -0.72 -0.99 118.70 122.99 1kzw s GLU 107 Ca 0.18 0.32 -0.24 0.00 0.36 0.00 0.00 54.97 55.59 1kzw s GLU 107 Cb -0.13 0.04 0.03 0.00 0.26 0.00 0.00 34.13 34.33 1kzw s GLU 107 CO 0.05 -0.06 0.83 0.42 -0.54 0.00 0.00 175.26 175.96 1kzw s ILE 108 N 0.39 4.58 -1.21 -3.70 1.09 -1.04 -0.46 121.20 120.86 1kzw s ILE 108 Ca -0.02 0.45 -0.10 0.00 -1.10 0.00 0.00 60.65 59.88 1kzw s ILE 108 Cb -0.04 -4.37 0.20 0.00 -1.06 0.00 0.00 42.46 37.19 1kzw s ILE 108 CO -0.02 -0.80 1.60 0.00 -0.10 0.00 0.00 174.94 175.63 1kzw n ILE 109 N 6.20 4.51 0.00 2.92 0.13 0.03 -4.95 119.36 128.19 1kzw n ILE 109 Ca 0.03 -4.86 0.00 0.00 -1.10 0.00 0.00 62.75 56.82 1kzw n ILE 109 Cb 0.48 -2.37 0.00 0.00 -0.84 0.00 0.00 39.64 36.91 1kzw n ILE 109 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1kzw n GLY 110 N 2.93 1.27 0.30 4.50 0.00 -1.26 -3.27 105.19 109.65 1kzw n GLY 110 Ca 0.35 0.26 0.14 0.00 0.00 0.00 0.00 46.02 46.77 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 6.92 1.01 -3.90 1.61 5.68 -1.26 -4.94 116.55 121.67 1kzw n ASP 111 Ca 0.00 -1.11 -0.23 0.00 -0.50 0.00 0.00 54.79 52.95 1kzw n ASP 111 Cb 0.00 0.02 -0.17 0.00 -1.14 0.00 0.00 41.12 39.83 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 -2.21 1.15 -0.35 0.11 2.02 -1.20 -2.01 118.70 116.20 1kzw s GLU 112 Ca 0.34 -0.17 -0.26 0.00 0.02 0.00 0.00 54.97 54.89 1kzw s GLU 112 Cb 0.20 -1.16 0.01 0.00 0.10 0.00 0.00 34.13 33.29 1kzw s GLU 112 CO 0.41 -0.14 0.96 -1.17 0.02 0.00 0.00 175.26 175.34 1kzw s LEU 113 N 1.22 3.97 -0.52 1.80 2.96 0.33 -0.79 118.68 127.65 1kzw s LEU 113 Ca -0.06 0.70 -0.20 0.00 -0.22 0.00 0.00 54.13 54.36 1kzw s LEU 113 Cb -0.14 -3.33 0.06 0.00 0.50 0.00 0.00 46.19 43.28 1kzw s LEU 113 CO -0.02 -0.85 0.70 0.68 -1.32 0.00 0.00 176.35 175.54 1kzw s VAL 114 N 3.51 4.76 -0.56 1.68 -7.23 0.40 -0.55 120.40 122.41 1kzw s VAL 114 Ca 0.40 -0.36 -0.14 0.00 -1.81 0.00 0.00 61.98 60.06 1kzw s VAL 114 Cb -0.12 -4.37 0.14 0.00 0.56 0.00 0.00 36.38 32.59 1kzw s VAL 114 CO 0.18 -0.90 0.50 -1.58 -0.31 0.00 0.00 175.10 172.98 1kzw s GLN 115 N 2.94 2.95 -0.29 4.82 0.74 -0.15 -1.76 119.66 128.91 1kzw s GLN 115 Ca 0.18 -1.80 -0.10 0.00 0.05 0.00 0.00 55.36 53.69 1kzw s GLN 115 Cb -0.18 -4.24 -0.03 0.00 1.10 0.00 0.00 33.01 29.66 1kzw s GLN 115 CO 0.13 -1.30 0.17 0.99 -0.55 0.00 0.00 175.29 174.73 1kzw s THR 116 N 1.40 4.95 -0.44 -0.34 2.01 0.30 -1.75 115.64 121.76 1kzw s THR 116 Ca 0.05 -0.10 -0.15 0.00 0.31 0.00 0.00 61.69 61.80 1kzw s THR 116 Cb -0.27 -3.42 0.05 0.00 0.01 0.00 0.00 72.50 68.87 1kzw s THR 116 CO 0.01 0.18 0.35 -0.31 -0.69 0.00 0.00 174.62 174.16 1kzw s TYR 117 N 1.69 3.24 -0.39 4.92 2.02 0.18 -0.86 117.35 128.16 1kzw s TYR 117 Ca 0.06 -0.80 -0.09 0.00 -0.37 0.00 0.00 57.07 55.86 1kzw s TYR 117 Cb -0.16 -2.92 0.05 0.00 -0.40 0.00 0.00 41.96 38.53 1kzw s TYR 117 CO 0.08 -0.71 0.21 0.08 -1.57 0.00 0.00 175.55 173.64 1kzw s VAL 118 N 1.65 4.28 -0.20 0.71 1.01 -0.55 -1.03 120.40 126.28 1kzw s VAL 118 Ca 0.04 -1.14 0.00 0.00 0.00 0.00 0.00 61.98 60.88 1kzw s VAL 118 Cb -0.22 -3.50 0.02 0.00 0.00 0.00 0.00 36.38 32.68 1kzw s VAL 118 CO 0.08 -0.34 -0.16 -0.47 0.00 0.00 0.00 175.10 174.21 1kzw s TYR 119 N 1.47 2.86 0.00 5.22 5.04 -0.86 -1.25 117.35 129.84 1kzw s TYR 119 Ca 0.02 -1.58 0.00 0.00 -2.44 0.00 0.00 57.07 53.07 1kzw s TYR 119 Cb -0.21 -1.96 0.00 0.00 0.35 0.00 0.00 41.96 40.14 1kzw s TYR 119 CO 0.04 -0.77 0.00 0.39 -1.34 0.00 0.00 175.55 173.87 1kzw n GLU 120 N 4.64 0.00 -2.72 4.97 1.02 -1.18 -1.85 120.64 125.52 1kzw n GLU 120 Ca -0.20 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 56.89 1kzw n GLU 120 Cb 0.49 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 31.98 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 0.00 1.63 2.76 0.62 0.00 -1.26 -5.09 105.19 103.84 1kzw n GLY 121 Ca 0.00 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.21 0.39 -0.24 1.61 1.01 -0.77 -5.14 120.40 115.04 1kzw s VAL 122 Ca 0.23 -0.05 -0.10 0.00 0.00 0.00 0.00 61.98 62.06 1kzw s VAL 122 Cb 0.41 -0.66 -0.05 0.00 0.00 0.00 0.00 36.38 36.09 1kzw s VAL 122 CO -0.03 0.12 0.15 -0.70 0.00 0.00 0.00 175.10 174.64 1kzw s GLU 123 N 1.95 4.00 -0.20 2.72 2.12 -1.26 -2.02 118.70 126.01 1kzw s GLU 123 Ca 0.03 -0.31 -0.02 0.00 0.36 0.00 0.00 54.97 55.04 1kzw s GLU 123 Cb -0.14 -3.51 0.01 0.00 0.26 0.00 0.00 34.13 30.75 1kzw s GLU 123 CO -0.06 0.01 -0.12 0.00 -0.54 0.00 0.00 175.26 174.56 1kzw s ALA 124 N 1.17 2.58 -0.53 6.30 0.00 -0.19 -4.75 121.76 126.33 1kzw s ALA 124 Ca 0.07 -1.19 -0.17 0.00 0.00 0.00 0.00 51.96 50.67 1kzw s ALA 124 Cb -0.14 -1.45 0.11 0.00 0.00 0.00 0.00 23.12 21.63 1kzw s ALA 124 CO 0.05 -0.39 0.52 0.15 0.00 0.00 0.00 175.76 176.09 1kzw s LYS 125 N 1.39 3.01 -0.44 0.00 1.02 -0.43 -0.65 119.74 123.64 1kzw s LYS 125 Ca 0.05 -1.49 -0.26 0.00 0.02 0.00 0.00 55.97 54.30 1kzw s LYS 125 Cb -0.14 -4.24 0.02 0.00 -0.52 0.00 0.00 37.83 32.96 1kzw s LYS 125 CO -0.08 -1.28 0.95 1.03 -0.92 0.00 0.00 175.35 175.05 1kzw s ARG 126 N 1.88 3.65 -0.30 1.68 0.52 -0.72 -1.50 118.95 124.15 1kzw s ARG 126 Ca 0.06 0.33 -0.20 0.00 -0.52 0.00 0.00 55.73 55.40 1kzw s ARG 126 Cb -0.27 -3.89 -0.01 0.00 0.52 0.00 0.00 34.95 31.31 1kzw s ARG 126 CO 0.05 -1.16 0.62 0.42 0.02 0.00 0.00 175.30 175.25 1kzw s ILE 127 N 3.76 4.95 -0.24 1.52 1.01 -0.22 -0.98 121.20 131.00 1kzw s ILE 127 Ca 0.39 0.83 -0.07 0.00 0.00 0.00 0.00 60.65 61.80 1kzw s ILE 127 Cb -0.10 -3.99 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 1kzw s ILE 127 CO 0.25 -0.13 0.06 -0.36 0.00 0.00 0.00 174.94 174.76 1kzw s PHE 128 N 2.58 3.08 0.22 3.97 0.40 0.29 -0.24 117.98 128.27 1kzw s PHE 128 Ca 0.25 -0.44 -0.22 0.00 -0.60 0.00 0.00 56.93 55.92 1kzw s PHE 128 Cb -0.15 -2.22 -0.08 0.00 0.51 0.00 0.00 43.02 41.08 1kzw s PHE 128 CO 0.12 -0.35 0.75 0.21 0.70 0.00 0.00 175.22 176.65 1kzw s LYS 129 N 1.54 4.36 -0.38 0.44 2.36 0.01 -0.51 119.74 127.55 1kzw s LYS 129 Ca 0.06 0.98 -0.27 0.00 -2.55 0.00 0.00 55.97 54.19 1kzw s LYS 129 Cb -0.15 -2.97 -0.05 0.00 -1.05 0.00 0.00 37.83 33.62 1kzw s LYS 129 CO 0.03 0.43 2.16 0.21 1.55 0.00 0.00 175.35 179.73 1kzw s LYS 130 N -1.77 2.76 0.00 4.03 2.47 -0.85 -0.89 119.74 125.50 1kzw s LYS 130 Ca 0.42 1.52 0.00 0.00 -1.56 0.00 0.00 55.97 56.35 1kzw s LYS 130 Cb -0.18 -4.41 0.00 0.00 -1.46 0.00 0.00 37.83 31.77 1kzw s LYS 130 CO 0.22 -2.53 0.00 -0.25 0.16 0.00 0.00 175.35 172.95