#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kzw n PHE 2 N 0.00 -2.73 -3.14 0.00 3.72 -1.26 -5.01 117.46 109.04 1kzw n PHE 2 Ca 0.00 1.00 -0.17 0.00 -0.05 0.00 0.00 57.45 58.24 1kzw n PHE 2 Cb 0.00 -4.12 -0.05 0.00 -0.94 0.00 0.00 39.48 34.36 1kzw n PHE 2 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 1kzw s ASP 3 N -3.19 0.22 0.05 4.37 -4.77 -1.26 -4.53 116.67 107.56 1kzw s ASP 3 Ca 0.22 -2.35 -0.28 0.00 -3.30 0.00 0.00 52.55 46.84 1kzw s ASP 3 Cb -0.03 0.62 0.10 0.00 -1.09 0.00 0.00 42.92 42.52 1kzw s ASP 3 CO 0.74 -0.13 1.16 -0.44 0.70 0.00 0.00 175.17 177.20 1kzw s SER 4 N 0.55 -0.10 -0.09 2.11 0.01 -0.67 -5.01 113.70 110.50 1kzw s SER 4 Ca 0.30 -0.25 -0.19 0.00 1.31 0.00 0.00 55.95 57.11 1kzw s SER 4 Cb 0.00 0.30 -0.04 0.00 0.21 0.00 0.00 66.02 66.48 1kzw s SER 4 CO -0.12 -0.55 0.54 -0.89 0.41 0.00 0.00 173.24 172.63 1kzw s THR 5 N -2.75 5.13 -0.15 1.44 2.01 -1.26 -1.26 115.64 118.79 1kzw s THR 5 Ca 0.14 1.09 -0.02 0.00 0.31 0.00 0.00 61.69 63.20 1kzw s THR 5 Cb 0.02 -3.88 0.05 0.00 0.01 0.00 0.00 72.50 68.70 1kzw s THR 5 CO -0.01 0.32 0.03 0.26 -0.69 0.00 0.00 174.62 174.53 1kzw s TRP 6 N 0.54 0.82 0.01 4.92 0.52 -0.28 -0.22 118.94 125.26 1kzw s TRP 6 Ca 0.29 -0.56 0.06 0.00 0.02 0.00 0.00 56.10 55.91 1kzw s TRP 6 Cb -0.16 -0.92 -0.03 0.00 -1.15 0.00 0.00 33.47 31.21 1kzw s TRP 6 CO 0.13 -0.50 -0.18 0.21 0.02 0.00 0.00 176.95 176.63 1kzw s LYS 7 N 1.92 2.17 -0.09 4.98 2.20 -0.17 -0.27 119.74 130.49 1kzw s LYS 7 Ca 0.01 -0.91 -0.29 0.00 -0.36 0.00 0.00 55.97 54.42 1kzw s LYS 7 Cb -0.15 -2.21 -0.06 0.00 -1.51 0.00 0.00 37.83 33.89 1kzw s LYS 7 CO -0.07 0.56 1.99 0.54 -0.36 0.00 0.00 175.35 178.01 1kzw s VAL 8 N -0.85 3.14 -0.19 4.02 0.11 -0.87 -0.83 120.40 124.93 1kzw s VAL 8 Ca 0.13 0.16 -0.20 0.00 -2.93 0.00 0.00 61.98 59.14 1kzw s VAL 8 Cb -0.10 -3.13 -0.21 0.00 -1.53 0.00 0.00 36.38 31.40 1kzw s VAL 8 CO 0.03 -0.05 0.28 -0.78 -3.33 0.00 0.00 175.10 171.26 1kzw h ASP 9 N 12.11 0.06 -3.18 3.54 3.58 -1.02 -3.47 116.42 128.04 1kzw h ASP 9 Ca -0.44 -0.60 -0.50 0.00 0.42 0.00 0.00 57.03 55.92 1kzw h ASP 9 Cb 1.22 -0.02 -0.40 0.00 1.72 0.00 0.00 39.33 41.85 1kzw h ASP 9 CO 0.96 1.50 -0.76 -0.13 -2.88 0.00 0.00 179.24 177.93 1kzw s ARG 10 N -2.38 0.43 -0.60 0.28 1.81 -1.06 -5.00 118.95 112.43 1kzw s ARG 10 Ca -0.27 -0.31 -0.20 0.00 -1.72 0.00 0.00 55.73 53.23 1kzw s ARG 10 Cb 0.05 -2.00 0.08 0.00 -0.45 0.00 0.00 34.95 32.64 1kzw s ARG 10 CO 0.62 -0.66 0.79 -1.54 -0.68 0.00 0.00 175.30 173.83 1kzw s SER 11 N 1.96 6.19 -0.32 0.23 1.04 -1.26 -0.74 113.70 120.80 1kzw s SER 11 Ca 0.00 -1.16 -0.08 0.00 0.48 0.00 0.00 55.95 55.19 1kzw s SER 11 Cb -0.17 -2.35 0.02 0.00 0.10 0.00 0.00 66.02 63.62 1kzw s SER 11 CO -0.09 -1.20 0.13 -1.61 0.98 0.00 0.00 173.24 171.44 1kzw s GLU 12 N 3.21 3.00 -0.77 4.02 2.02 -0.39 -4.47 118.70 125.32 1kzw s GLU 12 Ca 0.17 -0.94 0.00 0.00 0.02 0.00 0.00 54.97 54.22 1kzw s GLU 12 Cb -0.20 -3.50 0.00 0.00 0.10 0.00 0.00 34.13 30.52 1kzw s GLU 12 CO 0.09 -0.53 0.00 -1.71 0.02 0.00 0.00 175.26 173.13 1kzw n ASN 13 N 4.91 -4.39 -0.12 -0.19 5.15 -1.26 -1.45 115.26 117.91 1kzw n ASN 13 Ca -0.13 0.18 -0.07 0.00 -0.60 0.00 0.00 54.58 53.95 1kzw n ASN 13 Cb 0.47 -2.52 0.10 0.00 -0.53 0.00 0.00 39.78 37.29 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 0.93 -0.73 1.20 3.20 -1.87 -2.37 116.97 117.33 1kzw h TYR 14 Ca -0.15 -0.18 0.05 0.00 3.14 0.00 0.00 58.73 61.59 1kzw h TYR 14 Cb 0.64 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.62 1kzw h TYR 14 CO 0.31 0.91 0.44 0.38 -1.64 0.00 0.00 178.16 178.56 1kzw h ASP 15 N 0.76 0.68 -0.29 -2.11 3.04 -1.92 -1.03 116.42 115.54 1kzw h ASP 15 Ca 0.12 0.02 -0.10 0.00 -3.24 0.00 0.00 57.03 53.83 1kzw h ASP 15 Cb 0.62 -0.12 -0.01 0.00 -1.04 0.00 0.00 39.33 38.78 1kzw h ASP 15 CO 0.04 0.45 -0.23 0.11 -2.04 0.00 0.00 179.24 177.57 1kzw h LYS 16 N 0.82 0.66 -0.38 4.15 1.79 -1.97 -0.70 116.57 120.94 1kzw h LYS 16 Ca 0.31 -0.33 0.08 0.00 -2.18 0.00 0.00 60.65 58.53 1kzw h LYS 16 Cb 0.13 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.69 1kzw h LYS 16 CO -0.16 0.93 -0.32 0.35 -1.08 0.00 0.00 179.45 179.18 1kzw h PHE 17 N 0.40 -0.88 0.00 -1.35 3.57 -1.44 -0.79 116.94 116.45 1kzw h PHE 17 Ca 0.05 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1kzw h PHE 17 Cb 0.78 0.44 -0.00 0.00 2.79 0.00 0.00 35.95 39.96 1kzw h PHE 17 CO 0.07 -0.38 -0.16 0.52 -2.23 0.00 0.00 178.31 176.13 1kzw h MET 18 N -0.26 0.00 -0.37 1.11 2.86 -1.22 -2.11 114.93 114.94 1kzw h MET 18 Ca 0.17 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.72 1kzw h MET 18 Cb 0.53 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1kzw h MET 18 CO -0.52 0.16 -0.11 1.49 1.06 0.00 0.00 176.91 178.99 1kzw h GLU 19 N 0.00 0.73 -0.49 1.72 4.81 -0.86 -2.05 114.58 118.44 1kzw h GLU 19 Ca -0.00 -0.29 0.07 0.00 -0.13 0.00 0.00 59.36 59.01 1kzw h GLU 19 Cb 0.46 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1kzw h GLU 19 CO 0.02 0.89 0.33 -0.22 -0.73 0.00 0.00 179.01 179.30 1kzw h LYS 20 N 0.53 0.37 -0.56 1.92 1.63 -1.01 -2.68 116.57 116.76 1kzw h LYS 20 Ca 0.09 -0.02 -0.05 0.00 -0.85 0.00 0.00 60.65 59.82 1kzw h LYS 20 Cb 0.63 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.16 1kzw h LYS 20 CO 0.04 0.24 0.17 0.52 -3.45 0.00 0.00 179.45 176.98 1kzw h MET 21 N 0.38 0.87 -0.02 1.90 2.86 -1.32 -3.49 114.93 116.11 1kzw h MET 21 Ca 0.22 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1kzw h MET 21 Cb 0.38 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1kzw h MET 21 CO -0.05 0.79 0.00 0.41 1.06 0.00 0.00 176.91 179.12 1kzw n GLY 22 N -0.70 0.76 3.44 8.32 0.00 -0.78 -5.11 105.19 111.12 1kzw n GLY 22 Ca 0.03 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 1kzw n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kzw s VAL 23 N -1.64 2.62 0.34 1.61 0.11 -1.14 -5.06 120.40 117.24 1kzw s VAL 23 Ca 0.00 -1.45 -0.28 0.00 -2.93 0.00 0.00 61.98 57.32 1kzw s VAL 23 Cb 0.00 -2.15 -0.12 0.00 -1.53 0.00 0.00 36.38 32.58 1kzw s VAL 23 CO 0.00 0.20 1.33 0.59 -3.33 0.00 0.00 175.10 173.89 1kzw n ASN 24 N 1.16 2.96 -0.27 3.54 3.02 -1.26 -4.68 115.26 119.74 1kzw n ASN 24 Ca -0.16 1.21 0.08 0.00 -0.03 0.00 0.00 54.58 55.68 1kzw n ASN 24 Cb 0.52 -1.51 0.22 0.00 -0.61 0.00 0.00 39.78 38.41 1kzw n ASN 24 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1kzw h ILE 25 N 2.65 0.41 0.52 2.41 -0.00 -2.00 0.16 117.51 121.66 1kzw h ILE 25 Ca -0.47 -0.08 -0.02 0.00 -0.00 0.00 0.00 64.86 64.30 1kzw h ILE 25 Cb 1.27 0.17 -0.02 0.00 -0.00 0.00 0.00 36.82 38.24 1kzw h ILE 25 CO 0.64 0.04 -0.51 0.58 -0.00 0.00 0.00 178.15 178.89 1kzw h VAL 26 N 0.22 0.00 -0.70 2.19 2.07 -2.00 -0.81 116.25 117.22 1kzw h VAL 26 Ca 0.47 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.94 1kzw h VAL 26 Cb 0.86 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1kzw h VAL 26 CO -0.59 0.00 0.26 0.11 0.02 0.00 0.00 177.57 177.37 1kzw h LYS 27 N -1.03 1.05 -0.13 1.57 1.79 -1.87 -2.18 116.57 115.78 1kzw h LYS 27 Ca -0.07 -0.19 0.02 0.00 -2.18 0.00 0.00 60.65 58.24 1kzw h LYS 27 Cb 0.89 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.35 1kzw h LYS 27 CO -0.06 0.87 -0.00 -0.09 -1.08 0.00 0.00 179.45 179.09 1kzw h ARG 28 N 1.03 0.04 -0.26 3.15 2.43 -0.69 0.43 114.38 120.51 1kzw h ARG 28 Ca 0.24 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.42 1kzw h ARG 28 Cb 0.22 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1kzw h ARG 28 CO -0.02 0.03 0.14 0.87 -1.51 0.00 0.00 179.97 179.48 1kzw h LYS 29 N 0.04 0.28 -0.87 0.20 1.79 -1.16 -2.29 116.57 114.57 1kzw h LYS 29 Ca 0.06 -0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.54 1kzw h LYS 29 Cb 0.07 -0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 30.61 1kzw h LYS 29 CO -0.10 0.19 0.56 -0.07 -1.08 0.00 0.00 179.45 178.95 1kzw h LEU 30 N 0.29 0.94 -0.49 2.94 3.38 -1.35 -0.54 115.31 120.48 1kzw h LEU 30 Ca 0.10 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1kzw h LEU 30 Cb 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1kzw h LEU 30 CO -0.06 0.66 -0.06 0.00 0.09 0.00 0.00 178.44 179.07 1kzw h ALA 31 N 1.35 0.67 0.15 1.53 0.00 -0.90 -2.01 119.26 120.04 1kzw h ALA 31 Ca 0.34 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1kzw h ALA 31 Cb -0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1kzw h ALA 31 CO -0.11 0.53 -0.16 0.00 0.00 0.00 0.00 179.25 179.52 1kzw h ALA 32 N 0.91 -0.31 -0.57 0.00 0.00 -1.43 -3.32 119.26 114.55 1kzw h ALA 32 Ca 0.13 -0.04 -0.35 0.00 0.00 0.00 0.00 54.91 54.65 1kzw h ALA 32 Cb 0.60 0.23 -0.17 0.00 0.00 0.00 0.00 17.79 18.45 1kzw h ALA 32 CO 0.04 -0.70 0.45 0.72 0.00 0.00 0.00 179.25 179.76 1kzw n HIS 33 N -5.28 1.81 0.19 0.00 8.25 -0.21 -4.70 115.22 115.27 1kzw n HIS 33 Ca -0.07 -1.78 0.08 0.00 -0.26 0.00 0.00 57.72 55.69 1kzw n HIS 33 Cb 0.20 -0.88 0.20 0.00 1.12 0.00 0.00 29.99 30.63 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 1.14 0.00 -4.64 0.41 2.03 -1.46 -3.48 116.42 110.42 1kzw h ASP 34 Ca 0.35 0.00 -0.16 0.00 -0.73 0.00 0.00 57.03 56.50 1kzw h ASP 34 Cb 1.40 0.00 0.13 0.00 -0.83 0.00 0.00 39.33 40.02 1kzw h ASP 34 CO 0.79 0.24 -0.54 0.59 -1.03 0.00 0.00 179.24 179.29 1kzw n ASN 35 N -3.20 -5.17 -4.64 4.15 3.02 -1.26 -0.52 115.26 107.64 1kzw n ASN 35 Ca 0.02 -0.45 -0.41 0.00 -0.03 0.00 0.00 54.58 53.71 1kzw n ASN 35 Cb 0.58 -3.67 -0.05 0.00 -0.61 0.00 0.00 39.78 36.03 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 -4.52 4.09 -0.27 3.41 2.96 -1.26 -4.30 118.68 118.80 1kzw s LEU 36 Ca 0.29 0.94 -0.12 0.00 -0.22 0.00 0.00 54.13 55.01 1kzw s LEU 36 Cb -0.04 -3.07 -0.05 0.00 0.50 0.00 0.00 46.19 43.54 1kzw s LEU 36 CO 0.50 -0.43 0.25 -0.75 -1.32 0.00 0.00 176.35 174.59 1kzw s LYS 37 N 2.55 4.00 -0.50 1.98 2.20 0.12 -2.05 119.74 128.04 1kzw s LYS 37 Ca 0.32 -0.17 -0.14 0.00 -0.36 0.00 0.00 55.97 55.62 1kzw s LYS 37 Cb -0.16 -3.63 0.11 0.00 -1.51 0.00 0.00 37.83 32.64 1kzw s LYS 37 CO 0.09 -0.16 0.43 -0.51 -0.36 0.00 0.00 175.35 174.84 1kzw s LEU 38 N 1.70 5.88 -0.79 5.43 1.43 0.63 -1.57 118.68 131.39 1kzw s LEU 38 Ca 0.10 -1.68 -0.21 0.00 -1.03 0.00 0.00 54.13 51.32 1kzw s LEU 38 Cb -0.15 -2.15 0.10 0.00 0.03 0.00 0.00 46.19 44.01 1kzw s LEU 38 CO 0.09 -0.75 1.04 -0.89 0.23 0.00 0.00 176.35 176.07 1kzw s THR 39 N 1.55 4.52 -0.29 5.49 2.01 -0.55 -1.13 115.64 127.25 1kzw s THR 39 Ca 0.04 -0.97 -0.18 0.00 0.31 0.00 0.00 61.69 60.89 1kzw s THR 39 Cb -0.27 -4.73 -0.02 0.00 0.01 0.00 0.00 72.50 67.48 1kzw s THR 39 CO 0.03 -1.48 0.50 -0.63 -0.69 0.00 0.00 174.62 172.35 1kzw s ILE 40 N 3.38 5.07 0.02 1.82 1.01 -0.39 -1.35 121.20 130.77 1kzw s ILE 40 Ca 0.27 0.71 0.02 0.00 0.00 0.00 0.00 60.65 61.64 1kzw s ILE 40 Cb -0.11 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.49 1kzw s ILE 40 CO 0.00 0.02 -0.06 0.28 0.00 0.00 0.00 174.94 175.18 1kzw s THR 41 N 2.31 0.39 0.14 2.92 -1.32 -0.77 -1.68 115.64 117.64 1kzw s THR 41 Ca 0.20 -0.76 0.05 0.00 -1.21 0.00 0.00 61.69 59.97 1kzw s THR 41 Cb -0.16 -0.44 -0.04 0.00 -1.51 0.00 0.00 72.50 70.36 1kzw s THR 41 CO 0.10 -0.25 -0.12 0.00 -2.21 0.00 0.00 174.62 172.15 1kzw s GLN 42 N -1.08 1.06 -0.54 7.08 -2.07 -1.26 -0.81 119.66 122.04 1kzw s GLN 42 Ca -0.07 -1.37 0.04 0.00 -1.82 0.00 0.00 55.36 52.13 1kzw s GLN 42 Cb -0.07 -0.75 0.15 0.00 -1.09 0.00 0.00 33.01 31.25 1kzw s GLN 42 CO -0.00 0.12 0.36 -2.00 -1.32 0.00 0.00 175.29 172.44 1kzw s GLU 43 N -3.31 1.69 0.44 9.60 2.12 0.51 -5.01 118.70 124.74 1kzw s GLU 43 Ca 0.14 -2.57 0.00 0.00 0.36 0.00 0.00 54.97 52.89 1kzw s GLU 43 Cb -0.01 -2.62 0.00 0.00 0.26 0.00 0.00 34.13 31.76 1kzw s GLU 43 CO 0.02 -1.25 0.00 0.41 -0.54 0.00 0.00 175.26 173.90 1kzw n GLY 44 N 2.78 1.84 0.00 -1.50 0.00 -1.26 -2.68 105.19 104.38 1kzw n GLY 44 Ca 0.17 0.21 0.02 0.00 0.00 0.00 0.00 46.02 46.42 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 4.22 2.62 -4.72 1.61 3.02 -1.26 -5.04 115.26 115.71 1kzw n ASN 45 Ca 0.00 -0.22 -0.40 0.00 -0.03 0.00 0.00 54.58 53.93 1kzw n ASN 45 Cb 0.00 1.12 -0.05 0.00 -0.61 0.00 0.00 39.78 40.25 1kzw n ASN 45 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1kzw s LYS 46 N -1.97 4.45 -0.12 3.52 1.02 -1.09 -1.33 119.74 124.22 1kzw s LYS 46 Ca -0.00 0.95 -0.00 0.00 0.02 0.00 0.00 55.97 56.94 1kzw s LYS 46 Cb 0.03 -3.43 -0.02 0.00 -0.52 0.00 0.00 37.83 33.90 1kzw s LYS 46 CO 0.18 0.12 -0.12 -0.06 -0.92 0.00 0.00 175.35 174.54 1kzw s PHE 47 N 0.59 2.82 -0.36 3.18 0.40 0.50 -0.37 117.98 124.75 1kzw s PHE 47 Ca 0.39 -0.55 -0.11 0.00 -0.60 0.00 0.00 56.93 56.05 1kzw s PHE 47 Cb -0.19 -1.83 0.02 0.00 0.51 0.00 0.00 43.02 41.53 1kzw s PHE 47 CO 0.20 -0.15 0.20 0.99 0.70 0.00 0.00 175.22 177.17 1kzw s THR 48 N 0.22 4.69 -0.42 0.64 2.01 0.01 -1.63 115.64 121.17 1kzw s THR 48 Ca -0.08 -0.69 -0.07 0.00 0.31 0.00 0.00 61.69 61.16 1kzw s THR 48 Cb -0.15 -3.55 0.09 0.00 0.01 0.00 0.00 72.50 68.90 1kzw s THR 48 CO 0.05 -0.15 0.25 -0.69 -0.69 0.00 0.00 174.62 173.38 1kzw s VAL 49 N 1.59 3.89 -0.47 3.82 1.01 -0.40 -1.84 120.40 128.01 1kzw s VAL 49 Ca 0.03 -1.66 -0.25 0.00 0.00 0.00 0.00 61.98 60.10 1kzw s VAL 49 Cb -0.18 -3.48 0.03 0.00 0.00 0.00 0.00 36.38 32.74 1kzw s VAL 49 CO 0.07 -0.59 0.93 -0.54 0.00 0.00 0.00 175.10 174.98 1kzw s LYS 50 N 1.32 3.53 -0.42 2.72 1.02 -0.45 -0.85 119.74 126.61 1kzw s LYS 50 Ca 0.04 0.15 -0.08 0.00 0.02 0.00 0.00 55.97 56.11 1kzw s LYS 50 Cb -0.23 -3.93 0.09 0.00 -0.52 0.00 0.00 37.83 33.23 1kzw s LYS 50 CO -0.00 -1.24 0.24 -1.21 -0.92 0.00 0.00 175.35 172.22 1kzw s GLU 51 N 3.79 2.49 -0.21 1.68 2.02 -0.10 -1.48 118.70 126.89 1kzw s GLU 51 Ca 0.37 -1.53 -0.02 0.00 0.02 0.00 0.00 54.97 53.81 1kzw s GLU 51 Cb -0.10 -3.73 0.01 0.00 0.10 0.00 0.00 34.13 30.41 1kzw s GLU 51 CO 0.26 -0.98 -0.10 0.45 0.02 0.00 0.00 175.26 174.92 1kzw s SER 52 N 2.08 3.91 0.29 -0.19 0.15 -0.61 -2.23 113.70 117.11 1kzw s SER 52 Ca 0.04 -0.58 0.04 0.00 0.70 0.00 0.00 55.95 56.14 1kzw s SER 52 Cb -0.23 -1.64 -0.03 0.00 -1.71 0.00 0.00 66.02 62.41 1kzw s SER 52 CO 0.01 -0.04 0.20 -0.94 1.20 0.00 0.00 173.24 173.67 1kzw s SER 53 N 1.38 1.30 -1.17 5.45 1.04 -0.93 -0.71 113.70 120.06 1kzw s SER 53 Ca 0.04 -1.61 -0.10 0.00 0.48 0.00 0.00 55.95 54.77 1kzw s SER 53 Cb -0.14 0.46 -0.07 0.00 0.10 0.00 0.00 66.02 66.37 1kzw s SER 53 CO -0.07 -0.95 2.36 0.00 0.98 0.00 0.00 173.24 175.56 1kzw n ALA 54 N -0.53 5.51 0.12 5.32 0.00 0.32 -3.97 120.51 127.28 1kzw n ALA 54 Ca 0.04 -2.82 0.00 0.00 0.00 0.00 0.00 53.44 50.66 1kzw n ALA 54 Cb 0.64 -3.25 0.00 0.00 0.00 0.00 0.00 19.45 16.84 1kzw n ALA 54 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1kzw n PHE 55 N 4.61 -3.54 -3.85 0.00 -0.00 -1.26 -4.80 117.46 108.61 1kzw n PHE 55 Ca 0.57 0.84 -0.12 0.00 -0.00 0.00 0.00 57.45 58.73 1kzw n PHE 55 Cb 0.22 2.30 -0.13 0.00 -0.00 0.00 0.00 39.48 41.87 1kzw n PHE 55 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 1kzw s ARG 56 N -1.90 0.15 -0.41 -4.13 1.70 -1.25 -5.05 118.95 108.06 1kzw s ARG 56 Ca 0.00 0.03 0.02 0.00 -0.47 0.00 0.00 55.73 55.31 1kzw s ARG 56 Cb 0.00 0.07 0.13 0.00 -0.57 0.00 0.00 34.95 34.57 1kzw s ARG 56 CO 0.00 -0.02 0.20 -0.80 -1.08 0.00 0.00 175.30 173.60 1kzw s ASN 57 N -0.17 3.78 0.04 -2.89 0.01 -1.25 -2.19 114.94 112.27 1kzw s ASN 57 Ca -0.02 -2.40 0.00 0.00 -0.71 0.00 0.00 52.86 49.73 1kzw s ASN 57 Cb -0.02 -1.03 -0.03 0.00 0.41 0.00 0.00 41.25 40.59 1kzw s ASN 57 CO 0.00 -0.30 -0.04 0.27 -1.51 0.00 0.00 177.10 175.52 1kzw s ILE 58 N 0.64 0.23 -0.49 0.60 -0.00 -0.95 -5.00 121.20 116.24 1kzw s ILE 58 Ca 0.16 -1.21 -0.24 0.00 -0.00 0.00 0.00 60.65 59.36 1kzw s ILE 58 Cb -0.23 -0.70 0.03 0.00 -0.00 0.00 0.00 42.46 41.56 1kzw s ILE 58 CO -0.05 -0.63 0.86 -1.61 -0.00 0.00 0.00 174.94 173.51 1kzw s GLU 59 N -2.22 3.39 -0.71 0.37 2.02 -1.26 -0.92 118.70 119.37 1kzw s GLU 59 Ca -0.08 -0.14 -0.21 0.00 0.02 0.00 0.00 54.97 54.56 1kzw s GLU 59 Cb -0.05 -3.98 0.09 0.00 0.10 0.00 0.00 34.13 30.29 1kzw s GLU 59 CO -0.03 -1.26 0.95 0.08 0.02 0.00 0.00 175.26 175.01 1kzw s VAL 60 N 3.56 4.52 -0.22 2.63 1.01 -0.03 -4.92 120.40 126.95 1kzw s VAL 60 Ca 0.31 -0.77 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 1kzw s VAL 60 Cb -0.12 -4.66 -0.04 0.00 0.00 0.00 0.00 36.38 31.55 1kzw s VAL 60 CO 0.22 -1.40 0.10 -0.69 0.00 0.00 0.00 175.10 173.33 1kzw s VAL 61 N 3.46 4.92 -0.00 2.92 1.01 -1.26 -1.27 120.40 130.17 1kzw s VAL 61 Ca 0.22 0.02 -0.16 0.00 0.00 0.00 0.00 61.98 62.06 1kzw s VAL 61 Cb -0.16 -3.27 0.03 0.00 0.00 0.00 0.00 36.38 32.98 1kzw s VAL 61 CO 0.05 0.38 0.35 0.72 0.00 0.00 0.00 175.10 176.60 1kzw s PHE 62 N 0.94 -0.22 -0.00 5.22 -0.12 -0.64 -5.02 117.98 118.14 1kzw s PHE 62 Ca 0.05 0.29 -0.07 0.00 -0.05 0.00 0.00 56.93 57.15 1kzw s PHE 62 Cb -0.14 0.13 -0.05 0.00 -0.63 0.00 0.00 43.02 42.34 1kzw s PHE 62 CO 0.03 -0.44 0.27 -2.00 -0.05 0.00 0.00 175.22 173.03 1kzw s GLU 63 N -1.58 3.60 0.01 1.99 2.12 -1.26 -0.37 118.70 123.21 1kzw s GLU 63 Ca -0.12 -0.03 -0.32 0.00 0.36 0.00 0.00 54.97 54.86 1kzw s GLU 63 Cb -0.04 -3.10 -0.11 0.00 0.26 0.00 0.00 34.13 31.15 1kzw s GLU 63 CO 0.03 0.66 1.87 1.28 -0.54 0.00 0.00 175.26 178.56 1kzw n LEU 64 N 1.25 3.73 0.00 2.70 4.77 -0.44 -1.88 117.00 127.13 1kzw n LEU 64 Ca -0.12 0.97 0.00 0.00 -0.03 0.00 0.00 56.01 56.82 1kzw n LEU 64 Cb 0.53 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1kzw n LEU 64 CO 0.40 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1kzw n GLY 65 N 4.32 1.79 3.75 -0.72 0.00 -0.66 -4.98 105.19 108.69 1kzw n GLY 65 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.38 5.20 -0.21 1.61 1.01 -0.79 -4.94 120.40 118.90 1kzw s VAL 66 Ca 0.00 0.79 -0.29 0.00 0.00 0.00 0.00 61.98 62.48 1kzw s VAL 66 Cb 0.00 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 1kzw s VAL 66 CO 0.00 0.40 1.31 0.28 0.00 0.00 0.00 175.10 177.09 1kzw s THR 67 N 0.21 4.18 0.13 3.92 -1.32 -1.26 -4.51 115.64 116.99 1kzw s THR 67 Ca 0.22 1.39 0.02 0.00 -1.21 0.00 0.00 61.69 62.12 1kzw s THR 67 Cb -0.15 -4.02 -0.04 0.00 -1.51 0.00 0.00 72.50 66.78 1kzw s THR 67 CO 0.09 -0.26 -0.06 0.72 -2.21 0.00 0.00 174.62 172.90 1kzw s PHE 68 N 3.92 1.04 -0.33 9.09 -0.71 -0.11 -4.82 117.98 126.05 1kzw s PHE 68 Ca 0.57 -0.91 -0.21 0.00 -1.04 0.00 0.00 56.93 55.33 1kzw s PHE 68 Cb -0.20 -0.58 -0.00 0.00 -1.21 0.00 0.00 43.02 41.02 1kzw s PHE 68 CO 0.19 -0.12 0.68 -0.80 -1.34 0.00 0.00 175.22 173.83 1kzw s ASN 69 N -3.10 6.51 -0.13 1.98 0.01 -1.26 -1.28 114.94 117.66 1kzw s ASN 69 Ca 0.16 0.35 -0.01 0.00 -0.71 0.00 0.00 52.86 52.65 1kzw s ASN 69 Cb 0.05 -2.35 -0.02 0.00 0.41 0.00 0.00 41.25 39.34 1kzw s ASN 69 CO -0.02 -0.58 -0.11 -0.47 -1.51 0.00 0.00 177.10 174.41 1kzw s TYR 70 N 2.78 2.85 -0.17 2.20 5.04 0.15 -4.87 117.35 125.33 1kzw s TYR 70 Ca 0.27 -0.59 -0.11 0.00 -2.44 0.00 0.00 57.07 54.20 1kzw s TYR 70 Cb -0.14 -1.86 -0.05 0.00 0.35 0.00 0.00 41.96 40.26 1kzw s TYR 70 CO 0.14 -0.18 0.20 1.21 -1.34 0.00 0.00 175.55 175.57 1kzw s ASN 71 N 0.36 6.32 0.04 4.32 2.47 -1.26 -0.49 114.94 126.70 1kzw s ASN 71 Ca -0.10 0.37 -0.29 0.00 0.42 0.00 0.00 52.86 53.26 1kzw s ASN 71 Cb -0.16 -2.12 -0.17 0.00 -1.45 0.00 0.00 41.25 37.35 1kzw s ASN 71 CO 0.05 0.18 1.44 -0.07 -3.72 0.00 0.00 177.10 174.98 1kzw h LEU 72 N 6.45 -0.61 0.00 3.21 3.38 -1.96 -3.48 115.31 122.30 1kzw h LEU 72 Ca -0.43 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1kzw h LEU 72 Cb 1.16 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1kzw h LEU 72 CO 0.74 -0.33 0.00 0.00 0.09 0.00 0.00 178.44 178.93 1kzw n ALA 73 N -2.49 0.76 -0.61 1.53 0.00 -1.26 -5.07 120.51 113.37 1kzw n ALA 73 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1kzw n ALA 73 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 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 -2.98 0.00 -2.82 0.00 2.03 -1.26 -4.78 116.55 106.74 1kzw n ASP 74 Ca 0.00 0.16 -0.11 0.00 0.52 0.00 0.00 54.79 55.36 1kzw n ASP 74 Cb 0.00 -0.20 0.06 0.00 -0.72 0.00 0.00 41.12 40.27 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 2.26 1.40 3.22 0.27 0.00 -1.26 -5.08 105.19 106.00 1kzw n GLY 75 Ca 0.00 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.49 4.68 -0.29 2.61 2.01 -1.26 -5.03 115.64 117.86 1kzw s THR 76 Ca 0.26 -2.64 -0.27 0.00 0.31 0.00 0.00 61.69 59.35 1kzw s THR 76 Cb 0.33 -3.96 0.01 0.00 0.01 0.00 0.00 72.50 68.88 1kzw s THR 76 CO -0.06 -0.95 0.95 -0.70 -0.69 0.00 0.00 174.62 173.18 1kzw s GLU 77 N 0.15 4.08 -0.31 4.92 2.12 -1.26 -3.35 118.70 125.05 1kzw s GLU 77 Ca 0.17 0.96 -0.01 0.00 0.36 0.00 0.00 54.97 56.44 1kzw s GLU 77 Cb -0.16 -3.71 0.06 0.00 0.26 0.00 0.00 34.13 30.58 1kzw s GLU 77 CO -0.06 -0.74 0.00 -0.51 -0.54 0.00 0.00 175.26 173.41 1kzw s LEU 78 N 3.27 3.99 -0.65 2.70 1.43 0.35 -1.95 118.68 127.82 1kzw s LEU 78 Ca 0.40 -1.40 -0.16 0.00 -1.03 0.00 0.00 54.13 51.94 1kzw s LEU 78 Cb -0.14 -1.69 0.15 0.00 0.03 0.00 0.00 46.19 44.54 1kzw s LEU 78 CO 0.12 -0.28 0.66 -0.60 0.23 0.00 0.00 176.35 176.48 1kzw s ARG 79 N 1.20 3.21 0.00 1.70 3.52 -0.75 -0.67 118.95 127.16 1kzw s ARG 79 Ca -0.04 -1.82 0.00 0.00 -0.13 0.00 0.00 55.73 53.74 1kzw s ARG 79 Cb -0.20 -4.36 0.00 0.00 -1.56 0.00 0.00 34.95 28.83 1kzw s ARG 79 CO -0.02 -1.40 0.00 0.41 -0.81 0.00 0.00 175.30 173.48 1kzw n GLY 80 N 4.93 1.19 2.99 8.12 0.00 -0.41 -4.12 105.19 117.90 1kzw n GLY 80 Ca -0.03 -0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.39 1.03 -0.27 2.61 -4.23 -0.21 -0.94 115.64 112.24 1kzw s THR 81 Ca 0.00 -0.40 -0.19 0.00 -1.18 0.00 0.00 61.69 59.92 1kzw s THR 81 Cb 0.00 -0.97 -0.02 0.00 1.34 0.00 0.00 72.50 72.85 1kzw s THR 81 CO 0.00 0.34 0.57 0.26 -0.54 0.00 0.00 174.62 175.24 1kzw s TRP 82 N 0.82 3.26 -0.05 3.99 0.52 -1.26 -0.40 118.94 125.82 1kzw s TRP 82 Ca -0.12 0.68 0.06 0.00 0.02 0.00 0.00 56.10 56.74 1kzw s TRP 82 Cb -0.15 -2.80 -0.01 0.00 -1.15 0.00 0.00 33.47 29.36 1kzw s TRP 82 CO 0.02 -0.33 -0.23 -1.12 0.02 0.00 0.00 176.95 175.31 1kzw s SER 83 N 1.54 2.76 -0.48 2.95 0.01 -0.58 -1.66 113.70 118.24 1kzw s SER 83 Ca 0.23 -0.45 -0.25 0.00 1.31 0.00 0.00 55.95 56.79 1kzw s SER 83 Cb -0.15 -0.69 0.03 0.00 0.21 0.00 0.00 66.02 65.42 1kzw s SER 83 CO 0.09 0.23 0.90 -0.22 0.41 0.00 0.00 173.24 174.65 1kzw s LEU 84 N -0.17 4.08 -0.01 2.44 2.96 -1.26 -0.63 118.68 126.10 1kzw s LEU 84 Ca -0.02 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 1kzw s LEU 84 Cb -0.12 -3.06 0.08 0.00 0.50 0.00 0.00 46.19 43.59 1kzw s LEU 84 CO 0.03 -1.06 0.85 -1.84 -1.32 0.00 0.00 176.35 173.00 1kzw n GLU 85 N 7.13 1.32 0.00 1.98 -0.00 -0.62 -4.97 120.64 125.48 1kzw n GLU 85 Ca 0.04 -0.33 0.00 0.00 -0.00 0.00 0.00 57.16 56.88 1kzw n GLU 85 Cb 0.48 -1.33 0.00 0.00 -0.00 0.00 0.00 31.44 30.59 1kzw n GLU 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1kzw n GLY 86 N 0.35 2.21 0.08 -1.84 0.00 -1.26 -4.72 105.19 100.01 1kzw n GLY 86 Ca 0.03 -0.67 -0.05 0.00 0.00 0.00 0.00 46.02 45.33 1kzw n GLY 86 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1kzw h ASN 87 N 0.00 0.00 -4.37 1.61 2.35 -1.99 -3.43 115.58 109.75 1kzw h ASN 87 Ca 0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.18 1kzw h ASN 87 Cb 0.00 0.00 -0.29 0.00 0.05 0.00 0.00 38.32 38.08 1kzw h ASN 87 CO 0.00 0.88 -0.84 -0.54 -1.65 0.00 0.00 177.43 175.28 1kzw s LYS 88 N -2.74 1.53 -0.56 0.81 1.02 -1.26 -4.68 119.74 113.86 1kzw s LYS 88 Ca -0.01 -0.68 -0.22 0.00 0.02 0.00 0.00 55.97 55.08 1kzw s LYS 88 Cb 0.09 -1.48 0.05 0.00 -0.52 0.00 0.00 37.83 35.97 1kzw s LYS 88 CO 0.81 0.41 0.84 -0.51 -0.92 0.00 0.00 175.35 175.98 1kzw s LEU 89 N -0.45 4.45 -0.32 3.17 1.43 -0.56 -1.59 118.68 124.81 1kzw s LEU 89 Ca 0.07 -0.66 -0.17 0.00 -1.03 0.00 0.00 54.13 52.34 1kzw s LEU 89 Cb -0.07 -2.63 -0.01 0.00 0.03 0.00 0.00 46.19 43.51 1kzw s LEU 89 CO -0.01 -1.16 0.48 0.27 0.23 0.00 0.00 176.35 176.17 1kzw s ILE 90 N 3.53 5.06 -0.64 -0.59 -4.36 0.20 -0.72 121.20 123.68 1kzw s ILE 90 Ca 0.24 0.43 -0.22 0.00 -0.26 0.00 0.00 60.65 60.85 1kzw s ILE 90 Cb -0.16 -3.90 0.08 0.00 1.25 0.00 0.00 42.46 39.74 1kzw s ILE 90 CO 0.15 -0.11 0.90 -0.83 0.24 0.00 0.00 174.94 175.29 1kzw s GLY 91 N 1.71 1.48 -0.61 6.27 0.00 0.52 -1.52 107.32 115.15 1kzw s GLY 91 Ca 0.18 -1.95 -0.17 0.00 0.00 0.00 0.00 44.72 42.78 1kzw s GLY 91 CO 0.12 1.94 0.65 0.54 0.00 0.00 0.00 173.10 176.35 1kzw s LYS 92 N 3.70 3.11 0.28 2.90 1.02 0.46 -1.32 119.74 129.90 1kzw s LYS 92 Ca 0.19 -1.61 0.04 0.00 0.02 0.00 0.00 55.97 54.61 1kzw s LYS 92 Cb -0.19 -4.33 -0.06 0.00 -0.52 0.00 0.00 37.83 32.74 1kzw s LYS 92 CO 0.09 -1.45 0.01 -0.06 -0.92 0.00 0.00 175.35 173.03 1kzw s PHE 93 N 2.00 1.83 0.04 3.18 0.08 -0.36 -1.05 117.98 123.70 1kzw s PHE 93 Ca 0.10 -0.89 -0.17 0.00 0.12 0.00 0.00 56.93 56.09 1kzw s PHE 93 Cb -0.24 -1.12 0.03 0.00 -0.57 0.00 0.00 43.02 41.12 1kzw s PHE 93 CO 0.03 0.05 0.37 -1.59 -0.10 0.00 0.00 175.22 173.98 1kzw s LYS 94 N -3.85 0.88 -0.36 0.44 0.00 -1.26 -0.56 119.74 115.03 1kzw s LYS 94 Ca 0.32 -0.40 -0.29 0.00 0.00 0.00 0.00 55.97 55.60 1kzw s LYS 94 Cb 0.07 0.39 -0.01 0.00 0.00 0.00 0.00 37.83 38.28 1kzw s LYS 94 CO 0.13 -0.29 1.65 1.03 0.00 0.00 0.00 175.35 177.86 1kzw s ARG 95 N -2.47 3.43 0.47 1.78 0.52 -0.44 -1.82 118.95 120.43 1kzw s ARG 95 Ca -0.05 1.25 0.32 0.00 -0.52 0.00 0.00 55.73 56.72 1kzw s ARG 95 Cb -0.01 -4.13 1.48 0.00 0.52 0.00 0.00 34.95 32.81 1kzw s ARG 95 CO -0.02 -1.74 1.96 0.00 0.02 0.00 0.00 175.30 175.51 1kzw h THR 96 N 6.67 0.00 0.00 0.02 1.03 -1.75 0.17 112.91 119.06 1kzw h THR 96 Ca -0.31 -0.25 -0.06 0.00 -0.01 0.00 0.00 66.41 65.78 1kzw h THR 96 Cb 1.14 1.11 -0.01 0.00 -1.07 0.00 0.00 68.15 69.32 1kzw h THR 96 CO 1.05 0.00 -0.68 0.44 -0.01 0.00 0.00 175.52 176.32 1kzw h ASP 97 N 0.00 0.00 0.00 0.00 3.32 -1.92 -3.43 116.42 114.39 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 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1kzw h ASP 97 CO 0.00 0.22 -0.99 -3.20 -1.72 0.00 0.00 179.24 173.55 1kzw n ASN 98 N -2.96 4.97 0.00 6.45 2.85 -0.97 -5.07 115.26 120.52 1kzw n ASN 98 Ca -0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1kzw n ASN 98 Cb 0.64 0.87 0.00 0.00 1.24 0.00 0.00 39.78 42.53 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 2.61 2.91 3.77 8.20 0.00 0.57 -5.02 105.19 118.22 1kzw n GLY 99 Ca 0.00 -0.74 -0.38 0.00 0.00 0.00 0.00 46.02 44.90 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 6.57 0.33 1.61 0.01 -1.26 -4.53 114.94 117.73 1kzw s ASN 100 Ca 0.00 2.24 -0.28 0.00 -0.71 0.00 0.00 52.86 54.10 1kzw s ASN 100 Cb 0.00 -2.60 -0.10 0.00 0.41 0.00 0.00 41.25 38.96 1kzw s ASN 100 CO 0.00 -0.63 1.25 -1.83 -1.51 0.00 0.00 177.10 174.38 1kzw s GLU 101 N -2.38 4.38 -0.09 -0.60 1.03 -1.26 -1.33 118.70 118.44 1kzw s GLU 101 Ca 0.58 2.10 0.02 0.00 0.03 0.00 0.00 54.97 57.70 1kzw s GLU 101 Cb -0.28 -3.06 0.01 0.00 -0.80 0.00 0.00 34.13 30.01 1kzw s GLU 101 CO 0.35 -0.13 -0.15 -1.17 -1.33 0.00 0.00 175.26 172.83 1kzw s LEU 102 N -1.80 1.70 0.10 1.83 0.20 0.27 -3.69 118.68 117.30 1kzw s LEU 102 Ca 0.49 -0.39 -0.04 0.00 0.69 0.00 0.00 54.13 54.88 1kzw s LEU 102 Cb -0.37 -1.02 -0.05 0.00 -0.43 0.00 0.00 46.19 44.32 1kzw s LEU 102 CO 0.49 0.03 0.33 0.20 -0.29 0.00 0.00 176.35 177.11 1kzw s ASN 103 N 0.84 6.47 -0.24 3.68 0.01 -0.07 -1.23 114.94 124.40 1kzw s ASN 103 Ca -0.10 0.53 -0.03 0.00 -0.71 0.00 0.00 52.86 52.55 1kzw s ASN 103 Cb -0.15 -2.07 0.11 0.00 0.41 0.00 0.00 41.25 39.55 1kzw s ASN 103 CO 0.01 0.11 0.24 -0.89 -1.51 0.00 0.00 177.10 175.06 1kzw s THR 104 N -1.57 -0.33 -0.36 1.60 2.01 -0.43 -1.12 115.64 115.44 1kzw s THR 104 Ca 0.38 -0.31 -0.19 0.00 0.31 0.00 0.00 61.69 61.88 1kzw s THR 104 Cb -0.13 -0.82 0.00 0.00 0.01 0.00 0.00 72.50 71.57 1kzw s THR 104 CO 0.24 -0.35 0.54 -0.69 -0.69 0.00 0.00 174.62 173.67 1kzw s VAL 105 N 2.32 4.98 -0.23 3.82 1.01 -0.86 -0.36 120.40 131.08 1kzw s VAL 105 Ca 0.08 0.34 -0.21 0.00 0.00 0.00 0.00 61.98 62.19 1kzw s VAL 105 Cb -0.15 -4.01 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 1kzw s VAL 105 CO -0.22 -0.28 0.65 -0.13 0.00 0.00 0.00 175.10 175.12 1kzw s ARG 106 N 2.48 4.16 -0.04 2.72 0.52 0.10 -1.70 118.95 127.19 1kzw s ARG 106 Ca 0.20 0.61 -0.05 0.00 -0.52 0.00 0.00 55.73 55.97 1kzw s ARG 106 Cb -0.15 -3.62 0.01 0.00 0.52 0.00 0.00 34.95 31.71 1kzw s ARG 106 CO 0.14 -0.34 0.13 -2.00 0.02 0.00 0.00 175.30 173.24 1kzw s GLU 107 N 2.26 0.20 -0.14 3.54 2.12 -0.79 -1.49 118.70 124.39 1kzw s GLU 107 Ca 0.28 0.09 -0.22 0.00 0.36 0.00 0.00 54.97 55.48 1kzw s GLU 107 Cb -0.16 0.09 -0.03 0.00 0.26 0.00 0.00 34.13 34.29 1kzw s GLU 107 CO 0.09 -0.03 0.65 0.42 -0.54 0.00 0.00 175.26 175.85 1kzw s ILE 108 N -0.15 5.04 -0.54 -3.70 1.09 -1.26 -0.45 121.20 121.23 1kzw s ILE 108 Ca -0.02 1.28 0.01 0.00 -1.10 0.00 0.00 60.65 60.81 1kzw s ILE 108 Cb -0.02 -3.97 0.14 0.00 -1.06 0.00 0.00 42.46 37.54 1kzw s ILE 108 CO 0.00 0.18 0.31 -0.51 -0.10 0.00 0.00 174.94 174.83 1kzw s ILE 109 N 1.38 3.06 0.00 2.92 1.10 0.43 -4.99 121.20 125.11 1kzw s ILE 109 Ca 0.32 -3.02 0.00 0.00 -0.51 0.00 0.00 60.65 57.44 1kzw s ILE 109 Cb -0.16 -3.07 0.00 0.00 0.15 0.00 0.00 42.46 39.37 1kzw s ILE 109 CO 0.13 -0.81 0.00 0.61 -2.11 0.00 0.00 174.94 172.76 1kzw n GLY 110 N 3.45 1.90 1.89 1.50 0.00 -1.26 -2.15 105.19 110.52 1kzw n GLY 110 Ca 0.06 -0.02 0.06 0.00 0.00 0.00 0.00 46.02 46.11 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 10.46 5.64 -4.05 1.61 5.75 -1.26 -4.97 116.55 129.72 1kzw n ASP 111 Ca 0.00 -2.94 -0.27 0.00 -0.01 0.00 0.00 54.79 51.56 1kzw n ASP 111 Cb 0.00 -0.69 -0.17 0.00 -1.03 0.00 0.00 41.12 39.23 1kzw n ASP 111 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1kzw s GLU 112 N -2.76 2.09 -0.36 0.11 2.02 -0.91 -1.31 118.70 117.58 1kzw s GLU 112 Ca 0.54 -0.53 -0.23 0.00 0.02 0.00 0.00 54.97 54.78 1kzw s GLU 112 Cb 0.41 -1.75 0.01 0.00 0.10 0.00 0.00 34.13 32.90 1kzw s GLU 112 CO 0.16 -0.02 0.77 -1.17 0.02 0.00 0.00 175.26 175.02 1kzw s LEU 113 N 0.85 4.13 -0.27 1.80 2.96 0.71 -0.43 118.68 128.44 1kzw s LEU 113 Ca -0.10 0.38 -0.19 0.00 -0.22 0.00 0.00 54.13 54.00 1kzw s LEU 113 Cb -0.15 -3.01 -0.02 0.00 0.50 0.00 0.00 46.19 43.50 1kzw s LEU 113 CO 0.01 -0.70 0.56 0.68 -1.32 0.00 0.00 176.35 175.58 1kzw s VAL 114 N 3.05 5.02 -0.49 1.68 -7.23 0.41 -0.37 120.40 122.46 1kzw s VAL 114 Ca 0.31 0.93 -0.16 0.00 -1.81 0.00 0.00 61.98 61.25 1kzw s VAL 114 Cb -0.13 -3.89 0.09 0.00 0.56 0.00 0.00 36.38 33.01 1kzw s VAL 114 CO 0.16 0.03 0.44 -1.10 -0.31 0.00 0.00 175.10 174.31 1kzw s GLN 115 N 2.41 2.99 -0.79 4.82 -0.21 -0.21 -1.89 119.66 126.78 1kzw s GLN 115 Ca 0.23 -1.43 -0.20 0.00 0.02 0.00 0.00 55.36 53.98 1kzw s GLN 115 Cb -0.15 -4.18 0.11 0.00 1.00 0.00 0.00 33.01 29.78 1kzw s GLN 115 CO 0.09 -1.13 1.01 0.99 -2.12 0.00 0.00 175.29 174.13 1kzw s THR 116 N 1.68 4.60 0.02 -0.19 2.01 -0.69 -1.47 115.64 121.61 1kzw s THR 116 Ca 0.04 -1.07 -0.29 0.00 0.31 0.00 0.00 61.69 60.68 1kzw s THR 116 Cb -0.26 -4.70 -0.04 0.00 0.01 0.00 0.00 72.50 67.51 1kzw s THR 116 CO 0.06 -1.43 0.93 -0.31 -0.69 0.00 0.00 174.62 173.17 1kzw s TYR 117 N 3.16 3.69 -0.14 4.92 1.51 -0.07 -2.02 117.35 128.40 1kzw s TYR 117 Ca 0.26 1.66 -0.02 0.00 -1.01 0.00 0.00 57.07 57.95 1kzw s TYR 117 Cb -0.12 -3.05 0.05 0.00 -0.11 0.00 0.00 41.96 38.73 1kzw s TYR 117 CO -0.00 0.07 0.02 0.08 -1.11 0.00 0.00 175.55 174.61 1kzw s VAL 118 N 0.66 0.46 -0.19 0.71 1.01 -0.28 -0.69 120.40 122.09 1kzw s VAL 118 Ca 0.48 -0.26 -0.02 0.00 0.00 0.00 0.00 61.98 62.18 1kzw s VAL 118 Cb -0.21 -0.82 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 1kzw s VAL 118 CO 0.27 -0.00 -0.09 -0.47 0.00 0.00 0.00 175.10 174.80 1kzw s TYR 119 N 1.91 2.89 0.00 5.22 5.04 -1.21 -0.89 117.35 130.31 1kzw s TYR 119 Ca 0.02 -1.01 0.00 0.00 -2.44 0.00 0.00 57.07 53.64 1kzw s TYR 119 Cb -0.15 -2.01 0.00 0.00 0.35 0.00 0.00 41.96 40.15 1kzw s TYR 119 CO -0.07 -0.53 0.00 0.39 -1.34 0.00 0.00 175.55 174.00 1kzw n GLU 120 N 4.49 0.00 -2.69 4.97 -0.58 -1.24 -2.32 120.64 123.26 1kzw n GLU 120 Ca -0.19 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.47 1kzw n GLU 120 Cb 0.51 0.00 0.08 0.00 -0.57 0.00 0.00 31.44 31.46 1kzw n GLU 120 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1kzw n GLY 121 N 0.00 1.43 2.92 0.62 0.00 -1.26 -5.10 105.19 103.80 1kzw n GLY 121 Ca 0.00 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.24 1.46 0.01 1.61 1.01 -0.98 -5.12 120.40 117.15 1kzw s VAL 122 Ca 0.24 -1.23 -0.30 0.00 0.00 0.00 0.00 61.98 60.69 1kzw s VAL 122 Cb 0.42 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 1kzw s VAL 122 CO -0.03 -0.16 1.07 -1.61 0.00 0.00 0.00 175.10 174.36 1kzw s GLU 123 N 1.42 4.50 -0.20 2.72 2.02 -1.26 -3.32 118.70 124.57 1kzw s GLU 123 Ca -0.04 1.55 0.01 0.00 0.02 0.00 0.00 54.97 56.51 1kzw s GLU 123 Cb -0.19 -3.43 0.04 0.00 0.10 0.00 0.00 34.13 30.66 1kzw s GLU 123 CO -0.07 -0.15 -0.10 0.00 0.02 0.00 0.00 175.26 174.96 1kzw s ALA 124 N 1.12 2.03 -0.49 5.21 0.00 0.14 -4.73 121.76 125.04 1kzw s ALA 124 Ca 0.54 -1.24 -0.16 0.00 0.00 0.00 0.00 51.96 51.11 1kzw s ALA 124 Cb -0.24 -1.30 0.08 0.00 0.00 0.00 0.00 23.12 21.66 1kzw s ALA 124 CO 0.28 -0.84 0.42 0.15 0.00 0.00 0.00 175.76 175.77 1kzw s LYS 125 N 1.38 2.99 -0.39 0.00 1.02 -0.53 -0.89 119.74 123.32 1kzw s LYS 125 Ca -0.02 -1.38 -0.19 0.00 0.02 0.00 0.00 55.97 54.40 1kzw s LYS 125 Cb -0.16 -4.16 0.01 0.00 -0.52 0.00 0.00 37.83 33.00 1kzw s LYS 125 CO -0.08 -1.09 0.55 1.03 -0.92 0.00 0.00 175.35 174.85 1kzw s ARG 126 N 1.69 3.45 -0.35 1.68 0.52 -0.54 -1.26 118.95 124.14 1kzw s ARG 126 Ca 0.04 -0.29 -0.14 0.00 -0.52 0.00 0.00 55.73 54.82 1kzw s ARG 126 Cb -0.25 -3.87 -0.01 0.00 0.52 0.00 0.00 34.95 31.33 1kzw s ARG 126 CO 0.06 -0.79 0.29 0.42 0.02 0.00 0.00 175.30 175.30 1kzw s ILE 127 N 2.51 5.25 -0.33 1.52 1.01 0.08 -1.05 121.20 130.19 1kzw s ILE 127 Ca 0.19 -0.18 -0.07 0.00 0.00 0.00 0.00 60.65 60.59 1kzw s ILE 127 Cb -0.15 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.57 1kzw s ILE 127 CO 0.15 -0.07 0.11 -0.36 0.00 0.00 0.00 174.94 174.78 1kzw s PHE 128 N 1.81 3.22 0.33 3.97 0.40 0.50 -0.31 117.98 127.91 1kzw s PHE 128 Ca 0.08 -1.23 -0.26 0.00 -0.60 0.00 0.00 56.93 54.92 1kzw s PHE 128 Cb -0.17 -2.29 -0.10 0.00 0.51 0.00 0.00 43.02 40.96 1kzw s PHE 128 CO 0.11 -0.68 0.95 0.21 0.70 0.00 0.00 175.22 176.51 1kzw s LYS 129 N 1.45 4.56 -0.04 0.44 2.20 -0.01 -0.21 119.74 128.14 1kzw s LYS 129 Ca 0.00 1.31 -0.30 0.00 -0.36 0.00 0.00 55.97 56.63 1kzw s LYS 129 Cb -0.19 -2.75 -0.06 0.00 -1.51 0.00 0.00 37.83 33.32 1kzw s LYS 129 CO 0.03 0.25 1.69 0.21 -0.36 0.00 0.00 175.35 177.17 1kzw s LYS 130 N -2.14 4.18 0.00 4.03 2.20 -0.43 -1.00 119.74 126.59 1kzw s LYS 130 Ca 0.51 2.24 0.00 0.00 -0.36 0.00 0.00 55.97 58.36 1kzw s LYS 130 Cb -0.18 -3.98 0.00 0.00 -1.51 0.00 0.00 37.83 32.16 1kzw s LYS 130 CO 0.23 -0.85 0.29 -3.47 -0.36 0.00 0.00 175.35 171.19