#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kz0 s GLY 2 N 0.00 1.60 -0.84 -1.23 0.00 -1.26 -4.95 107.32 100.63 2kz0 s GLY 2 Ca 0.00 0.06 -0.25 0.00 0.00 0.00 0.00 44.72 44.53 2kz0 s GLY 2 CO 0.00 2.27 1.79 -0.56 0.00 0.00 0.00 173.10 176.59 2kz0 s SER 3 N 1.57 5.50 -1.29 1.64 0.01 -1.26 -4.89 113.70 114.97 2kz0 s SER 3 Ca 0.46 -0.57 -0.18 0.00 1.31 0.00 0.00 55.95 56.97 2kz0 s SER 3 Cb -0.14 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.58 2kz0 s SER 3 CO 0.12 -2.37 1.83 1.15 0.41 0.00 0.00 173.24 174.39 2kz0 n MET 4 N 8.98 2.89 -2.98 12.44 0.00 -1.26 -4.92 117.12 132.27 2kz0 n MET 4 Ca 0.31 -3.05 -0.43 0.00 0.00 0.00 0.00 57.70 54.54 2kz0 n MET 4 Cb 0.49 -3.49 -0.05 0.00 0.00 0.00 0.00 33.22 30.16 2kz0 n MET 4 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2kz0 s THR 5 N 5.10 4.66 0.31 3.17 -4.23 -1.26 -5.05 115.64 118.35 2kz0 s THR 5 Ca 0.55 0.40 -0.08 0.00 -1.18 0.00 0.00 61.69 61.39 2kz0 s THR 5 Cb 0.05 -4.31 -0.06 0.00 1.34 0.00 0.00 72.50 69.52 2kz0 s THR 5 CO 0.07 -0.71 0.62 0.68 -0.54 0.00 0.00 174.62 174.74 2kz0 s VAL 6 N 3.25 4.92 0.41 2.29 -7.23 -1.26 -5.10 120.40 117.67 2kz0 s VAL 6 Ca 0.29 0.35 0.07 0.00 -1.81 0.00 0.00 61.98 60.89 2kz0 s VAL 6 Cb -0.12 -3.70 -0.05 0.00 0.56 0.00 0.00 36.38 33.07 2kz0 s VAL 6 CO 0.22 -0.31 0.19 0.42 -0.31 0.00 0.00 175.10 175.31 2kz0 s THR 7 N -2.09 2.38 -1.39 5.32 -4.23 -1.26 -5.02 115.64 109.35 2kz0 s THR 7 Ca 0.47 -1.68 -0.15 0.00 -1.18 0.00 0.00 61.69 59.15 2kz0 s THR 7 Cb -0.11 -2.99 0.04 0.00 1.34 0.00 0.00 72.50 70.78 2kz0 s THR 7 CO 0.28 -0.02 2.08 0.00 -0.54 0.00 0.00 174.62 176.42 2kz0 n GLN 8 N -1.25 2.89 -0.25 3.99 6.02 -1.26 -4.77 117.38 122.75 2kz0 n GLN 8 Ca -0.01 -2.76 -0.07 0.00 -0.01 0.00 0.00 57.00 54.15 2kz0 n GLN 8 Cb 0.64 -3.34 0.05 0.00 1.02 0.00 0.00 30.24 28.61 2kz0 n GLN 8 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2kz0 h SER 9 N 6.53 0.95 -0.64 1.08 0.87 -1.98 0.40 113.55 120.77 2kz0 h SER 9 Ca 0.53 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.91 2kz0 h SER 9 Cb 0.71 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.39 2kz0 h SER 9 CO 1.77 0.86 0.36 1.56 -0.53 0.00 0.00 176.83 180.85 2kz0 h GLN 10 N 0.99 0.88 -0.22 2.24 1.08 -1.98 0.28 115.11 118.38 2kz0 h GLN 10 Ca 0.23 -0.09 -0.04 0.00 -1.45 0.00 0.00 58.65 57.29 2kz0 h GLN 10 Cb 0.19 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.44 2kz0 h GLN 10 CO -0.02 0.65 -0.03 -0.07 -0.95 0.00 0.00 178.83 178.41 2kz0 h LEU 11 N 0.87 0.41 0.44 1.46 4.07 -1.84 0.40 115.31 121.13 2kz0 h LEU 11 Ca 0.23 -0.34 -0.02 0.00 0.08 0.00 0.00 57.88 57.82 2kz0 h LEU 11 Cb 0.02 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.65 2kz0 h LEU 11 CO -0.04 0.66 -0.21 -0.08 -1.08 0.00 0.00 178.44 177.69 2kz0 h GLU 12 N 0.16 -0.57 -0.88 1.13 4.81 -0.62 -1.07 114.58 117.54 2kz0 h GLU 12 Ca 0.06 0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 2kz0 h GLU 12 Cb 0.47 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.93 2kz0 h GLU 12 CO 0.02 -0.37 0.58 1.25 -0.73 0.00 0.00 179.01 179.75 2kz0 h LEU 13 N -0.60 0.98 0.06 1.64 6.46 -0.46 0.43 115.31 123.82 2kz0 h LEU 13 Ca -0.06 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.68 2kz0 h LEU 13 Cb 0.46 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 40.15 2kz0 h LEU 13 CO 0.10 0.69 -0.03 0.25 -0.62 0.00 0.00 178.44 178.83 2kz0 h LEU 14 N 1.14 -0.07 -0.45 2.25 5.85 -0.62 -0.43 115.31 122.99 2kz0 h LEU 14 Ca 0.33 -0.17 -0.14 0.00 0.84 0.00 0.00 57.88 58.74 2kz0 h LEU 14 Cb -0.06 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2kz0 h LEU 14 CO -0.09 0.12 -0.29 0.40 -0.34 0.00 0.00 178.44 178.25 2kz0 h ILE 15 N -0.26 1.27 -0.20 4.05 1.08 -0.98 -0.71 117.51 121.75 2kz0 h ILE 15 Ca -0.01 -1.46 -0.11 0.00 -0.39 0.00 0.00 64.86 62.89 2kz0 h ILE 15 Cb 0.23 1.23 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 2kz0 h ILE 15 CO 0.01 0.50 -0.35 -0.09 -0.69 0.00 0.00 178.15 177.53 2kz0 h ARG 16 N 0.82 0.44 0.19 2.37 9.65 -0.84 0.25 114.38 127.26 2kz0 h ARG 16 Ca 0.09 -0.19 -0.32 0.00 -1.10 0.00 0.00 59.98 58.46 2kz0 h ARG 16 Cb 0.88 -0.01 0.03 0.00 -1.39 0.00 0.00 29.97 29.48 2kz0 h ARG 16 CO 0.08 0.73 -1.35 -0.91 2.80 0.00 0.00 179.97 181.32 2kz0 h ASN 17 N 0.37 0.87 -0.29 -3.80 2.35 -1.02 -3.03 115.58 111.03 2kz0 h ASN 17 Ca 0.04 -0.87 -0.05 0.00 -0.55 0.00 0.00 56.30 54.87 2kz0 h ASN 17 Cb 0.79 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 2kz0 h ASN 17 CO 0.06 1.66 -0.01 0.00 -1.65 0.00 0.00 177.43 177.50 2kz0 h ALA 18 N 0.21 0.39 -3.24 -0.83 0.00 -0.99 -3.38 119.26 111.43 2kz0 h ALA 18 Ca -0.22 -0.24 -0.63 0.00 0.00 0.00 0.00 54.91 53.83 2kz0 h ALA 18 Cb 2.04 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 19.32 2kz0 h ALA 18 CO 0.26 0.14 -0.70 -0.06 0.00 0.00 0.00 179.25 178.89 2kz0 s PHE 19 N -4.96 2.64 -1.03 0.00 0.08 0.87 -4.93 117.98 110.63 2kz0 s PHE 19 Ca -0.13 -2.73 0.14 0.00 0.12 0.00 0.00 56.93 54.33 2kz0 s PHE 19 Cb 0.08 -2.36 0.60 0.00 -0.57 0.00 0.00 43.02 40.78 2kz0 s PHE 19 CO 0.76 -0.80 1.44 -0.35 -0.10 0.00 0.00 175.22 176.18 2kz0 n PRO 20 N 3.58 0.02 -0.10 0.24 -0.04 -1.14 -1.53 135.00 136.02 2kz0 n PRO 20 Ca 0.06 0.25 0.11 0.00 -0.04 0.00 0.00 63.50 63.88 2kz0 n PRO 20 Cb 0.35 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.63 2kz0 n PRO 20 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2kz0 n GLU 21 N -1.48 1.98 -4.87 0.54 1.02 -1.26 -4.88 120.64 111.68 2kz0 n GLU 21 Ca 0.04 -1.46 -0.33 0.00 -0.02 0.00 0.00 57.16 55.39 2kz0 n GLU 21 Cb 0.16 -1.44 -0.15 0.00 -0.02 0.00 0.00 31.44 29.99 2kz0 n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2kz0 s ALA 22 N -1.74 2.49 -0.04 0.62 0.00 -0.58 -4.56 121.76 117.94 2kz0 s ALA 22 Ca 0.34 -0.92 -0.27 0.00 0.00 0.00 0.00 51.96 51.10 2kz0 s ALA 22 Cb 0.19 -1.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.17 2kz0 s ALA 22 CO 0.28 0.23 0.88 -1.21 0.00 0.00 0.00 175.76 175.95 2kz0 s GLU 23 N 0.39 4.49 -0.44 0.00 0.41 0.98 -4.79 118.70 119.74 2kz0 s GLU 23 Ca -0.13 1.21 -0.24 0.00 -0.41 0.00 0.00 54.97 55.41 2kz0 s GLU 23 Cb -0.16 -3.47 0.02 0.00 -1.78 0.00 0.00 34.13 28.74 2kz0 s GLU 23 CO 0.06 -0.05 0.83 0.42 -0.49 0.00 0.00 175.26 176.03 2kz0 s ILE 24 N 1.10 4.60 -0.34 -1.63 -1.09 -1.26 -1.11 121.20 121.48 2kz0 s ILE 24 Ca 0.46 0.58 -0.06 0.00 -2.23 0.00 0.00 60.65 59.39 2kz0 s ILE 24 Cb -0.19 -4.35 0.04 0.00 -1.58 0.00 0.00 42.46 36.38 2kz0 s ILE 24 CO 0.23 -0.72 0.10 -0.89 -1.23 0.00 0.00 174.94 172.43 2kz0 s THR 25 N 3.42 3.79 -0.35 2.92 2.01 0.28 -4.99 115.64 122.72 2kz0 s THR 25 Ca 0.32 -1.11 -0.21 0.00 0.31 0.00 0.00 61.69 61.00 2kz0 s THR 25 Cb -0.12 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.26 2kz0 s THR 25 CO 0.23 -0.16 0.69 0.68 -0.69 0.00 0.00 174.62 175.37 2kz0 s VAL 26 N 1.41 4.84 -0.51 3.82 -7.23 -1.26 0.11 120.40 121.58 2kz0 s VAL 26 Ca -0.01 0.76 -0.19 0.00 -1.81 0.00 0.00 61.98 60.73 2kz0 s VAL 26 Cb -0.19 -4.11 0.06 0.00 0.56 0.00 0.00 36.38 32.69 2kz0 s VAL 26 CO 0.03 -0.32 0.63 -0.89 -0.31 0.00 0.00 175.10 174.24 2kz0 s THR 27 N 2.84 4.87 -0.34 5.32 2.01 0.13 -4.97 115.64 125.48 2kz0 s THR 27 Ca 0.27 -0.47 -0.18 0.00 0.31 0.00 0.00 61.69 61.62 2kz0 s THR 27 Cb -0.14 -4.30 -0.01 0.00 0.01 0.00 0.00 72.50 68.06 2kz0 s THR 27 CO 0.15 -0.81 0.51 -0.94 -0.69 0.00 0.00 174.62 172.83 2kz0 s SER 28 N 2.69 6.32 -0.71 3.53 1.04 -1.26 -1.05 113.70 124.26 2kz0 s SER 28 Ca 0.15 0.00 -0.23 0.00 0.48 0.00 0.00 55.95 56.36 2kz0 s SER 28 Cb -0.19 -2.27 0.07 0.00 0.10 0.00 0.00 66.02 63.73 2kz0 s SER 28 CO 0.12 -0.46 1.05 -0.76 0.98 0.00 0.00 173.24 174.18 2kz0 s LEU 29 N 2.37 4.18 -0.10 2.42 1.02 -1.26 -5.00 118.68 122.30 2kz0 s LEU 29 Ca 0.19 -0.99 -0.30 0.00 0.02 0.00 0.00 54.13 53.05 2kz0 s LEU 29 Cb -0.15 -2.45 -0.03 0.00 0.02 0.00 0.00 46.19 43.58 2kz0 s LEU 29 CO 0.13 -1.49 1.24 -0.69 0.02 0.00 0.00 176.35 175.55 2kz0 s VAL 30 N 4.31 4.25 0.00 -1.59 1.01 -1.26 -4.21 120.40 122.90 2kz0 s VAL 30 Ca 0.26 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.79 2kz0 s VAL 30 Cb -0.14 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.25 2kz0 s VAL 30 CO 0.09 -0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2kz0 n GLY 31 N 3.48 0.24 3.01 4.51 0.00 -1.26 -5.10 105.19 110.07 2kz0 n GLY 31 Ca 0.12 0.15 -0.21 0.00 0.00 0.00 0.00 46.02 46.09 2kz0 n GLY 31 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kz0 s ASP 32 N 0.00 1.31 -1.23 1.61 1.01 -1.26 -5.05 116.67 113.06 2kz0 s ASP 32 Ca 0.00 -0.21 -0.16 0.00 0.71 0.00 0.00 52.55 52.89 2kz0 s ASP 32 Cb 0.00 -0.39 -0.03 0.00 1.01 0.00 0.00 42.92 43.51 2kz0 s ASP 32 CO 0.00 0.06 2.16 0.59 0.21 0.00 0.00 175.17 178.19 2kz0 n ASN 33 N 3.36 3.64 0.00 0.27 3.02 -1.26 -4.57 115.26 119.72 2kz0 n ASN 33 Ca -0.19 -2.77 0.00 0.00 -0.03 0.00 0.00 54.58 51.59 2kz0 n ASN 33 Cb 0.54 -1.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.24 2kz0 n ASN 33 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2kz0 n ASN 34 N 6.40 0.00 -3.81 6.41 2.85 -1.26 -5.07 115.26 120.78 2kz0 n ASN 34 Ca 0.52 0.03 -0.12 0.00 -0.11 0.00 0.00 54.58 54.90 2kz0 n ASN 34 Cb 0.38 -0.13 -0.10 0.00 1.24 0.00 0.00 39.78 41.16 2kz0 n ASN 34 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2kz0 s HIS 35 N -0.27 -0.15 0.04 1.20 3.76 -1.26 -5.16 115.29 113.44 2kz0 s HIS 35 Ca 0.00 0.32 0.06 0.00 -0.15 0.00 0.00 55.06 55.29 2kz0 s HIS 35 Cb 0.00 0.05 -0.03 0.00 1.11 0.00 0.00 32.58 33.71 2kz0 s HIS 35 CO 0.00 -0.24 -0.13 0.71 -0.85 0.00 0.00 174.74 174.24 2kz0 s TYR 36 N -0.67 2.71 -0.04 1.40 2.02 -1.26 -4.69 117.35 116.81 2kz0 s TYR 36 Ca -0.08 -0.16 -0.23 0.00 -0.37 0.00 0.00 57.07 56.23 2kz0 s TYR 36 Cb -0.04 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 39.97 2kz0 s TYR 36 CO 0.02 0.33 0.70 0.45 -1.57 0.00 0.00 175.55 175.48 2kz0 s SER 37 N -1.58 7.03 -0.50 2.29 0.15 -0.22 -4.61 113.70 116.26 2kz0 s SER 37 Ca 0.17 1.24 -0.15 0.00 0.70 0.00 0.00 55.95 57.90 2kz0 s SER 37 Cb -0.11 -2.42 0.10 0.00 -1.71 0.00 0.00 66.02 61.88 2kz0 s SER 37 CO 0.08 -0.07 0.44 -0.63 1.20 0.00 0.00 173.24 174.25 2kz0 s ILE 38 N 0.56 5.15 -0.36 6.45 -1.09 -0.08 0.17 121.20 131.99 2kz0 s ILE 38 Ca 0.37 -1.30 -0.17 0.00 -2.23 0.00 0.00 60.65 57.32 2kz0 s ILE 38 Cb -0.18 -4.19 -0.00 0.00 -1.58 0.00 0.00 42.46 36.50 2kz0 s ILE 38 CO 0.19 -0.71 0.47 -0.75 -1.23 0.00 0.00 174.94 172.91 2kz0 s LYS 39 N 1.61 3.51 -0.36 2.79 2.20 0.12 -0.71 119.74 128.90 2kz0 s LYS 39 Ca 0.04 -0.32 -0.20 0.00 -0.36 0.00 0.00 55.97 55.12 2kz0 s LYS 39 Cb -0.27 -3.84 0.00 0.00 -1.51 0.00 0.00 37.83 32.22 2kz0 s LYS 39 CO 0.05 -0.66 0.63 0.08 -0.36 0.00 0.00 175.35 175.08 2kz0 s VAL 40 N 2.29 4.90 -0.46 4.02 1.01 0.21 -0.56 120.40 131.80 2kz0 s VAL 40 Ca 0.16 0.53 -0.14 0.00 0.00 0.00 0.00 61.98 62.53 2kz0 s VAL 40 Cb -0.16 -4.08 0.08 0.00 0.00 0.00 0.00 36.38 32.22 2kz0 s VAL 40 CO 0.13 -0.33 0.37 -0.63 0.00 0.00 0.00 175.10 174.64 2kz0 s ILE 41 N 2.69 4.99 -0.16 2.22 -1.09 -0.26 -0.51 121.20 129.08 2kz0 s ILE 41 Ca 0.24 -1.16 -0.09 0.00 -2.23 0.00 0.00 60.65 57.40 2kz0 s ILE 41 Cb -0.15 -4.01 0.05 0.00 -1.58 0.00 0.00 42.46 36.78 2kz0 s ILE 41 CO 0.15 -0.57 0.38 -0.55 -1.23 0.00 0.00 174.94 173.11 2kz0 s SER 42 N 2.53 -0.46 0.00 3.58 0.15 -1.26 -0.01 113.70 118.22 2kz0 s SER 42 Ca 0.04 0.82 0.12 0.00 0.70 0.00 0.00 55.95 57.62 2kz0 s SER 42 Cb -0.24 0.71 0.63 0.00 -1.71 0.00 0.00 66.02 65.41 2kz0 s SER 42 CO 0.05 -0.18 1.26 -1.20 1.20 0.00 0.00 173.24 174.38 2kz0 n SER 43 N 4.08 0.00 -0.09 5.45 7.64 -1.26 -1.32 113.62 128.12 2kz0 n SER 43 Ca -0.22 0.02 0.14 0.00 1.01 0.00 0.00 58.87 59.82 2kz0 n SER 43 Cb 0.55 -0.23 0.55 0.00 -1.01 0.00 0.00 64.21 64.07 2kz0 n SER 43 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kz0 n GLN 44 N -1.23 0.49 0.00 1.43 10.64 -1.26 -2.64 117.38 124.81 2kz0 n GLN 44 Ca 0.06 -0.18 0.11 0.00 -1.83 0.00 0.00 57.00 55.17 2kz0 n GLN 44 Cb 0.08 -1.50 0.06 0.00 -0.86 0.00 0.00 30.24 28.03 2kz0 n GLN 44 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2kz0 n PHE 45 N -1.10 0.03 -2.38 2.61 3.72 -0.43 -4.86 117.46 115.06 2kz0 n PHE 45 Ca 0.12 0.01 -0.42 0.00 -0.05 0.00 0.00 57.45 57.10 2kz0 n PHE 45 Cb 0.30 -0.17 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 2kz0 n PHE 45 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 2kz0 s GLN 46 N -3.03 4.30 0.00 -1.08 2.00 -1.08 -2.53 119.66 118.24 2kz0 s GLN 46 Ca 0.09 1.76 0.00 0.00 -2.00 0.00 0.00 55.36 55.21 2kz0 s GLN 46 Cb 0.16 -3.63 0.00 0.00 0.80 0.00 0.00 33.01 30.35 2kz0 s GLN 46 CO 0.79 -0.56 0.00 0.41 -0.50 0.00 0.00 175.29 175.43 2kz0 n GLY 47 N 3.52 0.47 3.93 2.59 0.00 -1.26 -5.06 105.19 109.37 2kz0 n GLY 47 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2kz0 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kz0 s LYS 48 N -0.91 1.26 0.22 1.61 3.01 -1.05 -5.11 119.74 118.76 2kz0 s LYS 48 Ca 0.00 -0.29 0.06 0.00 -1.01 0.00 0.00 55.97 54.73 2kz0 s LYS 48 Cb 0.00 -1.94 -0.05 0.00 -1.01 0.00 0.00 37.83 34.83 2kz0 s LYS 48 CO 0.00 -1.99 -0.09 -1.12 0.51 0.00 0.00 175.35 172.66 2kz0 s SER 49 N -4.75 2.31 0.13 2.83 0.01 -1.26 -4.99 113.70 107.98 2kz0 s SER 49 Ca 0.69 -1.10 -0.33 0.00 1.31 0.00 0.00 55.95 56.52 2kz0 s SER 49 Cb -0.07 -0.09 -0.11 0.00 0.21 0.00 0.00 66.02 65.96 2kz0 s SER 49 CO 0.50 -0.31 1.54 0.11 0.41 0.00 0.00 173.24 175.49 2kz0 h LYS 50 N 2.52 -0.38 -0.72 12.44 1.57 -1.99 0.38 116.57 130.39 2kz0 h LYS 50 Ca -0.38 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.50 2kz0 h LYS 50 Cb 1.22 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 33.55 2kz0 h LYS 50 CO 0.64 -0.25 0.40 -0.07 -0.57 0.00 0.00 179.45 179.59 2kz0 h LEU 51 N -0.40 0.57 -0.21 2.94 4.07 -1.98 0.34 115.31 120.64 2kz0 h LEU 51 Ca 0.07 0.04 -0.08 0.00 0.08 0.00 0.00 57.88 57.99 2kz0 h LEU 51 Cb 0.59 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.26 2kz0 h LEU 51 CO -0.59 0.35 -0.18 -0.08 -1.08 0.00 0.00 178.44 176.86 2kz0 h GLU 52 N 0.71 0.49 -0.26 1.13 4.81 -1.76 -1.10 114.58 118.60 2kz0 h GLU 52 Ca 0.34 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2kz0 h GLU 52 Cb 0.26 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2kz0 h GLU 52 CO -0.21 0.82 0.16 1.96 -0.73 0.00 0.00 179.01 181.00 2kz0 h GLN 53 N 0.17 0.34 -0.24 1.92 4.20 0.38 -0.89 115.11 121.00 2kz0 h GLN 53 Ca 0.04 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2kz0 h GLN 53 Cb 0.71 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 2kz0 h GLN 53 CO 0.05 0.25 0.14 0.45 -0.67 0.00 0.00 178.83 179.05 2kz0 h HIS 54 N 0.33 0.31 -0.58 2.96 3.86 -0.30 -1.11 115.15 120.62 2kz0 h HIS 54 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 2kz0 h HIS 54 Cb -0.01 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.33 2kz0 h HIS 54 CO -0.05 0.23 0.38 -0.09 0.86 0.00 0.00 177.93 179.26 2kz0 h ARG 55 N 0.29 0.76 -0.66 2.45 2.43 -1.03 -0.64 114.38 117.98 2kz0 h ARG 55 Ca 0.08 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2kz0 h ARG 55 Cb 0.01 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.35 2kz0 h ARG 55 CO -0.02 0.51 0.41 0.52 -1.51 0.00 0.00 179.97 179.89 2kz0 h MET 56 N 0.78 0.79 -0.18 0.20 2.86 -0.84 0.40 114.93 118.95 2kz0 h MET 56 Ca 0.21 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.84 2kz0 h MET 56 Cb -0.08 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.36 2kz0 h MET 56 CO -0.05 0.53 -0.08 0.82 1.06 0.00 0.00 176.91 179.19 2kz0 h ILE 57 N 0.82 0.75 -0.10 -1.22 2.04 -0.62 -0.01 117.51 119.17 2kz0 h ILE 57 Ca 0.26 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.07 2kz0 h ILE 57 Cb 0.00 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 2kz0 h ILE 57 CO -0.10 0.00 -0.16 1.88 0.00 0.00 0.00 178.15 179.77 2kz0 h TYR 58 N -0.05 0.17 0.01 1.37 0.05 -0.47 0.24 116.97 118.28 2kz0 h TYR 58 Ca 0.09 -0.02 -0.22 0.00 0.05 0.00 0.00 58.73 58.63 2kz0 h TYR 58 Cb 0.19 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 2kz0 h TYR 58 CO -0.23 0.32 -1.09 0.87 -1.05 0.00 0.00 178.16 176.98 2kz0 h LYS 59 N 0.15 0.01 0.06 4.88 1.57 -0.45 -2.88 116.57 119.92 2kz0 h LYS 59 Ca 0.03 -0.02 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 2kz0 h LYS 59 Cb 0.38 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 2kz0 h LYS 59 CO 0.02 0.96 -1.72 -0.24 -0.57 0.00 0.00 179.45 177.90 2kz0 h VAL 60 N 0.00 0.88 -0.90 0.50 3.04 -0.71 -3.33 116.25 115.73 2kz0 h VAL 60 Ca -0.05 -2.65 -0.50 0.00 -1.01 0.00 0.00 66.70 62.49 2kz0 h VAL 60 Cb 1.81 2.54 -0.28 0.00 -2.01 0.00 0.00 31.29 33.35 2kz0 h VAL 60 CO 0.13 0.70 0.64 -0.11 -1.01 0.00 0.00 177.57 177.92 2kz0 n LEU 61 N -3.27 6.65 -4.57 3.16 -0.00 0.82 -4.88 117.00 114.90 2kz0 n LEU 61 Ca -0.20 -3.57 -0.34 0.00 -0.00 0.00 0.00 56.01 51.90 2kz0 n LEU 61 Cb 1.04 -0.85 -0.04 0.00 -0.00 0.00 0.00 43.42 43.58 2kz0 n LEU 61 CO 0.46 1.10 1.50 -0.62 -0.00 0.00 0.00 177.39 179.82 2kz0 s ASP 62 N -1.17 5.80 -0.05 1.96 2.15 -1.09 -4.51 116.67 119.77 2kz0 s ASP 62 Ca 0.53 -1.32 0.19 0.00 0.43 0.00 0.00 52.55 52.39 2kz0 s ASP 62 Cb 0.44 -2.57 0.34 0.00 -0.30 0.00 0.00 42.92 40.83 2kz0 s ASP 62 CO 0.07 -2.17 1.14 0.61 -0.17 0.00 0.00 175.17 174.65 2kz0 n GLY 63 N 6.52 1.03 2.43 2.66 0.00 -1.26 -4.98 105.19 111.59 2kz0 n GLY 63 Ca 0.40 -0.65 -0.21 0.00 0.00 0.00 0.00 46.02 45.56 2kz0 n GLY 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kz0 n LEU 64 N 0.15 -1.85 -4.27 0.99 4.77 -1.26 -4.94 117.00 110.59 2kz0 n LEU 64 Ca -0.03 0.09 -0.43 0.00 -0.03 0.00 0.00 56.01 55.61 2kz0 n LEU 64 Cb 0.99 -2.90 -0.03 0.00 -2.33 0.00 0.00 43.42 39.16 2kz0 n LEU 64 CO -0.05 -0.39 0.53 0.20 -1.33 0.00 0.00 177.39 176.35 2kz0 s ASN 65 N -2.21 6.73 -0.68 -1.43 0.02 -1.26 -5.02 114.94 111.09 2kz0 s ASN 65 Ca 0.00 -3.27 -0.26 0.00 -1.02 0.00 0.00 52.86 48.31 2kz0 s ASN 65 Cb 0.00 -2.12 0.04 0.00 0.02 0.00 0.00 41.25 39.18 2kz0 s ASN 65 CO 0.00 -0.36 1.17 -0.63 0.02 0.00 0.00 177.10 177.29 2kz0 s ILE 66 N -0.73 3.96 0.00 0.60 1.01 -1.26 -3.80 121.20 120.98 2kz0 s ILE 66 Ca 0.25 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.23 2kz0 s ILE 66 Cb -0.11 -4.80 0.00 0.00 0.01 0.00 0.00 42.46 37.56 2kz0 s ILE 66 CO -0.09 -1.62 0.00 1.41 0.00 0.00 0.00 174.94 174.65 2kz0 n HIS 67 N 8.70 0.00 0.14 3.97 8.25 -1.26 -4.82 115.22 130.19 2kz0 n HIS 67 Ca 0.02 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2kz0 n HIS 67 Cb 0.48 -1.34 0.16 0.00 1.12 0.00 0.00 29.99 30.41 2kz0 n HIS 67 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2kz0 h ALA 68 N 0.00 0.88 -3.19 -1.41 0.00 -1.97 -3.43 119.26 110.13 2kz0 h ALA 68 Ca 0.00 -0.55 -0.61 0.00 0.00 0.00 0.00 54.91 53.74 2kz0 h ALA 68 Cb 0.62 -0.10 -0.12 0.00 0.00 0.00 0.00 17.79 18.19 2kz0 h ALA 68 CO 0.00 0.76 -0.51 0.42 0.00 0.00 0.00 179.25 179.92 2kz0 s ILE 69 N -3.44 5.26 -1.08 0.00 -1.09 -1.26 -5.03 121.20 114.55 2kz0 s ILE 69 Ca -0.00 0.13 -0.22 0.00 -2.23 0.00 0.00 60.65 58.33 2kz0 s ILE 69 Cb 0.12 -3.38 0.06 0.00 -1.58 0.00 0.00 42.46 37.67 2kz0 s ILE 69 CO 0.75 0.47 1.51 -1.10 -1.23 0.00 0.00 174.94 175.35 2kz0 s GLN 70 N 0.16 3.68 -0.29 2.79 1.11 -1.26 -4.96 119.66 120.89 2kz0 s GLN 70 Ca 0.08 -1.34 -0.13 0.00 0.01 0.00 0.00 55.36 53.98 2kz0 s GLN 70 Cb -0.11 -5.40 -0.04 0.00 -1.01 0.00 0.00 33.01 26.45 2kz0 s GLN 70 CO -0.01 -2.22 0.30 -1.50 0.01 0.00 0.00 175.29 171.88 2kz0 s ILE 71 N 4.77 5.23 -0.14 1.08 1.10 -1.26 -0.90 121.20 131.07 2kz0 s ILE 71 Ca 0.48 0.32 -0.00 0.00 -0.51 0.00 0.00 60.65 60.94 2kz0 s ILE 71 Cb 0.01 -3.65 0.03 0.00 0.15 0.00 0.00 42.46 38.99 2kz0 s ILE 71 CO -0.06 0.15 -0.09 -1.10 -2.11 0.00 0.00 174.94 171.73 2kz0 s GLN 72 N 1.94 1.78 -0.20 3.50 -1.52 0.11 -4.97 119.66 120.30 2kz0 s GLN 72 Ca 0.11 -0.42 -0.18 0.00 -1.95 0.00 0.00 55.36 52.92 2kz0 s GLN 72 Cb -0.16 -1.86 -0.03 0.00 -0.22 0.00 0.00 33.01 30.73 2kz0 s GLN 72 CO 0.11 -0.29 0.49 0.95 -0.25 0.00 0.00 175.29 176.30 2kz0 s THR 73 N 1.61 5.13 0.43 -0.19 -4.23 -1.26 0.67 115.64 117.80 2kz0 s THR 73 Ca 0.04 0.90 -0.08 0.00 -1.18 0.00 0.00 61.69 61.37 2kz0 s THR 73 Cb -0.13 -3.82 -0.05 0.00 1.34 0.00 0.00 72.50 69.84 2kz0 s THR 73 CO -0.09 0.20 0.76 -0.83 -0.54 0.00 0.00 174.62 174.12 2kz0 s GLY 74 N 1.12 1.76 0.19 3.99 0.00 0.33 -4.90 107.32 109.81 2kz0 s GLY 74 Ca 0.23 -0.35 0.02 0.00 0.00 0.00 0.00 44.72 44.62 2kz0 s GLY 74 CO 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 173.10 173.02