#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kz0 n GLY 2 N 0.00 3.90 2.27 0.55 0.00 -1.26 -4.94 105.19 105.71 2kz0 n GLY 2 Ca 0.00 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 2kz0 n GLY 2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2kz0 n SER 3 N 0.00 -4.16 -4.53 1.61 3.41 -1.26 -4.94 113.62 103.76 2kz0 n SER 3 Ca 0.00 0.33 -0.29 0.00 -0.26 0.00 0.00 58.87 58.66 2kz0 n SER 3 Cb 0.00 -3.61 0.13 0.00 -0.26 0.00 0.00 64.21 60.47 2kz0 n SER 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kz0 s MET 4 N -3.07 1.36 -0.04 4.33 0.23 -1.26 -5.09 119.30 115.75 2kz0 s MET 4 Ca 0.00 -0.25 -0.01 0.00 -1.03 0.00 0.00 55.69 54.39 2kz0 s MET 4 Cb 0.00 -1.95 0.03 0.00 -1.53 0.00 0.00 34.83 31.38 2kz0 s MET 4 CO 0.00 -1.93 0.07 -0.08 -2.03 0.00 0.00 175.02 171.06 2kz0 s THR 5 N -3.66 -0.10 0.08 3.16 -1.32 -1.26 -5.15 115.64 107.39 2kz0 s THR 5 Ca 0.68 0.30 0.03 0.00 -1.21 0.00 0.00 61.69 61.49 2kz0 s THR 5 Cb -0.07 -0.15 -0.03 0.00 -1.51 0.00 0.00 72.50 70.73 2kz0 s THR 5 CO 0.50 0.12 -0.09 0.68 -2.21 0.00 0.00 174.62 173.62 2kz0 s VAL 6 N 1.60 0.80 0.65 5.08 -7.23 -1.26 -5.15 120.40 114.88 2kz0 s VAL 6 Ca -0.03 -1.52 -0.11 0.00 -1.81 0.00 0.00 61.98 58.51 2kz0 s VAL 6 Cb -0.12 -1.19 -0.02 0.00 0.56 0.00 0.00 36.38 35.60 2kz0 s VAL 6 CO -0.04 -0.54 1.04 0.42 -0.31 0.00 0.00 175.10 175.67 2kz0 s THR 7 N -2.28 4.25 -1.63 5.32 -4.23 -1.26 -3.78 115.64 112.03 2kz0 s THR 7 Ca 0.02 0.69 0.00 0.00 -1.18 0.00 0.00 61.69 61.22 2kz0 s THR 7 Cb -0.04 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 70.08 2kz0 s THR 7 CO -0.01 -0.94 0.00 1.67 -0.54 0.00 0.00 174.62 174.81 2kz0 n GLN 8 N -2.82 -1.38 0.28 3.99 -0.06 -1.26 -4.87 117.38 111.26 2kz0 n GLN 8 Ca 0.06 0.94 0.16 0.00 -2.00 0.00 0.00 57.00 56.16 2kz0 n GLN 8 Cb 0.55 -5.37 0.83 0.00 -4.06 0.00 0.00 30.24 22.19 2kz0 n GLN 8 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2kz0 h SER 9 N 0.00 0.00 -0.46 1.69 4.64 -1.99 -1.10 113.55 116.33 2kz0 h SER 9 Ca -0.41 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.81 2kz0 h SER 9 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 2kz0 h SER 9 CO 0.51 0.07 -0.11 1.56 -0.87 0.00 0.00 176.83 177.99 2kz0 h GLN 10 N 0.00 0.89 -0.41 4.77 4.20 -1.91 0.55 115.11 123.19 2kz0 h GLN 10 Ca -0.00 -0.34 -0.15 0.00 0.06 0.00 0.00 58.65 58.22 2kz0 h GLN 10 Cb 0.30 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2kz0 h GLN 10 CO 0.01 0.98 -0.33 1.25 -0.67 0.00 0.00 178.83 180.07 2kz0 h LEU 11 N 0.73 1.00 0.20 1.46 7.12 -1.69 0.43 115.31 124.56 2kz0 h LEU 11 Ca 0.12 -0.44 0.01 0.00 0.13 0.00 0.00 57.88 57.69 2kz0 h LEU 11 Cb 0.66 -0.28 -0.03 0.00 -0.53 0.00 0.00 40.66 40.48 2kz0 h LEU 11 CO 0.05 1.23 -0.26 -0.08 -0.13 0.00 0.00 178.44 179.25 2kz0 h GLU 12 N 0.78 -0.50 -0.64 1.25 4.22 -1.06 -2.00 114.58 116.62 2kz0 h GLU 12 Ca 0.08 0.03 0.05 0.00 0.08 0.00 0.00 59.36 59.60 2kz0 h GLU 12 Cb 0.92 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.25 2kz0 h GLU 12 CO 0.09 -0.33 0.42 1.25 -2.18 0.00 0.00 179.01 178.26 2kz0 h LEU 13 N -0.52 0.61 -0.15 1.64 6.46 0.21 0.48 115.31 124.04 2kz0 h LEU 13 Ca 0.01 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 2kz0 h LEU 13 Cb 0.50 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 2kz0 h LEU 13 CO -0.09 0.41 0.09 0.25 -0.62 0.00 0.00 178.44 178.48 2kz0 h LEU 14 N 0.70 0.17 -0.85 2.25 6.46 -0.47 -0.06 115.31 123.52 2kz0 h LEU 14 Ca 0.27 -0.03 -0.11 0.00 -0.12 0.00 0.00 57.88 57.89 2kz0 h LEU 14 Cb 0.17 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 2kz0 h LEU 14 CO -0.08 0.15 -0.36 0.40 -0.62 0.00 0.00 178.44 177.93 2kz0 h ILE 15 N 0.18 1.29 -0.73 4.05 2.04 -0.68 0.94 117.51 124.60 2kz0 h ILE 15 Ca 0.05 -1.46 -0.02 0.00 1.00 0.00 0.00 64.86 64.44 2kz0 h ILE 15 Cb 0.00 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2kz0 h ILE 15 CO -0.01 0.45 0.39 -0.09 0.00 0.00 0.00 178.15 178.89 2kz0 h ARG 16 N 0.36 1.03 0.00 2.37 9.65 -0.47 0.48 114.38 127.80 2kz0 h ARG 16 Ca 0.04 -0.12 -0.15 0.00 -1.10 0.00 0.00 59.98 58.65 2kz0 h ARG 16 Cb 0.80 -0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 29.15 2kz0 h ARG 16 CO 0.06 0.76 -0.93 -0.91 2.80 0.00 0.00 179.97 181.76 2kz0 h ASN 17 N 1.03 0.00 0.05 -3.80 2.35 -0.74 -2.80 115.58 111.66 2kz0 h ASN 17 Ca 0.26 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.01 2kz0 h ASN 17 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 2kz0 h ASN 17 CO -0.04 0.63 -0.03 0.00 -1.65 0.00 0.00 177.43 176.35 2kz0 h ALA 18 N 1.37 -0.07 -2.78 -0.83 0.00 -0.17 -3.42 119.26 113.36 2kz0 h ALA 18 Ca -0.07 -0.28 -0.58 0.00 0.00 0.00 0.00 54.91 53.98 2kz0 h ALA 18 Cb 1.54 0.03 -0.40 0.00 0.00 0.00 0.00 17.79 18.97 2kz0 h ALA 18 CO 0.07 -0.24 -0.80 -0.06 0.00 0.00 0.00 179.25 178.22 2kz0 s PHE 19 N -3.72 1.05 0.04 0.00 0.08 0.16 -4.97 117.98 110.62 2kz0 s PHE 19 Ca -0.15 -1.69 0.32 0.00 0.12 0.00 0.00 56.93 55.52 2kz0 s PHE 19 Cb 0.01 -1.23 1.46 0.00 -0.57 0.00 0.00 43.02 42.69 2kz0 s PHE 19 CO 0.62 -0.82 1.96 -1.35 -0.10 0.00 0.00 175.22 175.53 2kz0 h PRO 20 N 7.31 0.00 -0.74 0.24 0.11 -1.68 -2.28 132.00 134.97 2kz0 h PRO 20 Ca -0.02 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.95 2kz0 h PRO 20 Cb 0.97 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.00 2kz0 h PRO 20 CO 0.37 0.00 0.17 -0.85 -0.21 0.00 0.00 178.00 177.48 2kz0 n GLU 21 N -2.80 3.80 -4.68 1.05 0.28 -1.26 -4.88 120.64 112.15 2kz0 n GLU 21 Ca 0.00 -2.77 -0.33 0.00 -0.16 0.00 0.00 57.16 53.90 2kz0 n GLU 21 Cb 0.22 -2.15 -0.13 0.00 1.43 0.00 0.00 31.44 30.81 2kz0 n GLU 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2kz0 s ALA 22 N -2.67 2.80 -0.69 -1.84 0.00 -0.86 -4.57 121.76 113.92 2kz0 s ALA 22 Ca 0.49 -0.89 -0.27 0.00 0.00 0.00 0.00 51.96 51.29 2kz0 s ALA 22 Cb 0.39 -1.25 0.02 0.00 0.00 0.00 0.00 23.12 22.28 2kz0 s ALA 22 CO 0.13 0.37 1.36 -1.21 0.00 0.00 0.00 175.76 176.40 2kz0 s GLU 23 N -0.10 3.16 -0.43 0.00 0.41 0.14 -4.88 118.70 116.99 2kz0 s GLU 23 Ca -0.00 -0.02 -0.23 0.00 -0.41 0.00 0.00 54.97 54.30 2kz0 s GLU 23 Cb -0.13 -4.18 0.02 0.00 -1.78 0.00 0.00 34.13 28.05 2kz0 s GLU 23 CO 0.03 -2.16 0.80 0.42 -0.49 0.00 0.00 175.26 173.87 2kz0 s ILE 24 N 6.10 4.64 -0.32 -1.63 1.01 -1.26 -1.28 121.20 128.46 2kz0 s ILE 24 Ca 0.41 0.56 -0.07 0.00 0.00 0.00 0.00 60.65 61.56 2kz0 s ILE 24 Cb -0.09 -4.32 0.03 0.00 0.01 0.00 0.00 42.46 38.10 2kz0 s ILE 24 CO 0.18 -0.68 0.10 -0.89 0.00 0.00 0.00 174.94 173.64 2kz0 s THR 25 N 3.32 3.84 -0.09 2.92 2.01 0.52 -4.97 115.64 123.19 2kz0 s THR 25 Ca 0.31 -0.98 -0.27 0.00 0.31 0.00 0.00 61.69 61.06 2kz0 s THR 25 Cb -0.12 -3.11 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 2kz0 s THR 25 CO 0.22 -0.09 0.87 0.68 -0.69 0.00 0.00 174.62 175.61 2kz0 s VAL 26 N 1.44 4.90 -0.17 3.82 -7.23 -1.26 -0.78 120.40 121.11 2kz0 s VAL 26 Ca -0.00 1.77 0.00 0.00 -1.81 0.00 0.00 61.98 61.94 2kz0 s VAL 26 Cb -0.19 -4.19 0.04 0.00 0.56 0.00 0.00 36.38 32.60 2kz0 s VAL 26 CO 0.03 0.11 -0.10 -0.89 -0.31 0.00 0.00 175.10 173.93 2kz0 s THR 27 N 1.54 1.49 -0.43 5.32 2.01 0.81 -4.96 115.64 121.41 2kz0 s THR 27 Ca 0.43 -0.80 -0.25 0.00 0.31 0.00 0.00 61.69 61.39 2kz0 s THR 27 Cb -0.18 -1.53 0.02 0.00 0.01 0.00 0.00 72.50 70.82 2kz0 s THR 27 CO 0.18 0.25 0.90 -0.94 -0.69 0.00 0.00 174.62 174.32 2kz0 s SER 28 N 1.48 6.53 -0.31 3.53 1.04 -1.26 0.28 113.70 124.99 2kz0 s SER 28 Ca 0.01 0.21 -0.08 0.00 0.48 0.00 0.00 55.95 56.57 2kz0 s SER 28 Cb -0.15 -2.44 0.01 0.00 0.10 0.00 0.00 66.02 63.54 2kz0 s SER 28 CO -0.09 -0.97 0.11 -1.48 0.98 0.00 0.00 173.24 171.80 2kz0 s LEU 29 N 3.58 4.02 -0.81 2.42 2.34 -0.43 -5.00 118.68 124.80 2kz0 s LEU 29 Ca 0.36 -0.69 -0.19 0.00 0.06 0.00 0.00 54.13 53.67 2kz0 s LEU 29 Cb -0.11 -1.93 0.12 0.00 -0.56 0.00 0.00 46.19 43.72 2kz0 s LEU 29 CO 0.23 -0.21 0.99 -0.69 -1.06 0.00 0.00 176.35 175.61 2kz0 s VAL 30 N 1.53 4.75 0.00 1.48 1.01 -1.26 -3.03 120.40 124.89 2kz0 s VAL 30 Ca 0.03 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 60.67 2kz0 s VAL 30 Cb -0.17 -4.68 0.00 0.00 0.00 0.00 0.00 36.38 31.52 2kz0 s VAL 30 CO 0.04 -1.39 0.00 0.61 0.00 0.00 0.00 175.10 174.36 2kz0 n GLY 31 N 5.27 1.58 0.01 4.51 0.00 -1.26 -4.94 105.19 110.37 2kz0 n GLY 31 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 2kz0 n GLY 31 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2kz0 n ASP 32 N 0.00 0.30 -3.68 1.61 8.00 -1.26 -4.81 116.55 116.70 2kz0 n ASP 32 Ca 0.00 0.22 -0.13 0.00 0.71 0.00 0.00 54.79 55.60 2kz0 n ASP 32 Cb 0.00 -0.22 -0.09 0.00 -0.02 0.00 0.00 41.12 40.79 2kz0 n ASP 32 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2kz0 s ASN 33 N -3.23 -0.60 -0.83 -2.24 3.84 -1.26 -5.09 114.94 105.53 2kz0 s ASN 33 Ca 0.12 1.12 -0.25 0.00 0.21 0.00 0.00 52.86 54.06 2kz0 s ASN 33 Cb 0.17 1.11 -0.01 0.00 -0.55 0.00 0.00 41.25 41.97 2kz0 s ASN 33 CO 0.61 -0.20 1.76 0.20 -2.79 0.00 0.00 177.10 176.69 2kz0 s ASN 34 N 0.56 5.52 0.23 -4.21 0.01 -1.26 -4.65 114.94 111.14 2kz0 s ASN 34 Ca -0.02 -0.51 0.10 0.00 -0.71 0.00 0.00 52.86 51.72 2kz0 s ASN 34 Cb -0.04 -2.55 -0.05 0.00 0.41 0.00 0.00 41.25 39.01 2kz0 s ASN 34 CO -0.03 -2.33 -0.18 -2.28 -1.51 0.00 0.00 177.10 170.77 2kz0 s HIS 35 N 8.45 2.05 -0.12 2.20 2.46 -1.17 -5.01 115.29 124.15 2kz0 s HIS 35 Ca 0.61 -0.43 0.01 0.00 0.47 0.00 0.00 55.06 55.73 2kz0 s HIS 35 Cb -0.07 -0.93 -0.01 0.00 -0.13 0.00 0.00 32.58 31.43 2kz0 s HIS 35 CO 0.05 0.54 -0.16 0.71 -2.47 0.00 0.00 174.74 173.40 2kz0 s TYR 36 N -2.51 2.73 -0.02 3.88 1.51 -1.26 -1.31 117.35 120.37 2kz0 s TYR 36 Ca 0.25 -0.73 -0.02 0.00 -1.01 0.00 0.00 57.07 55.56 2kz0 s TYR 36 Cb -0.04 -1.79 -0.04 0.00 -0.11 0.00 0.00 41.96 39.98 2kz0 s TYR 36 CO 0.11 -0.24 0.14 0.45 -1.11 0.00 0.00 175.55 174.89 2kz0 s SER 37 N 0.27 6.07 -0.32 2.29 0.15 0.14 -4.89 113.70 117.42 2kz0 s SER 37 Ca -0.12 0.27 -0.04 0.00 0.70 0.00 0.00 55.95 56.77 2kz0 s SER 37 Cb -0.16 -1.85 0.05 0.00 -1.71 0.00 0.00 66.02 62.35 2kz0 s SER 37 CO 0.06 0.28 0.06 -0.63 1.20 0.00 0.00 173.24 174.21 2kz0 s ILE 38 N -1.24 3.32 -0.31 6.45 -1.09 0.62 -0.14 121.20 128.81 2kz0 s ILE 38 Ca 0.24 -1.34 -0.21 0.00 -2.23 0.00 0.00 60.65 57.11 2kz0 s ILE 38 Cb -0.12 -2.93 -0.00 0.00 -1.58 0.00 0.00 42.46 37.82 2kz0 s ILE 38 CO 0.15 -0.18 0.67 -0.54 -1.23 0.00 0.00 174.94 173.81 2kz0 s LYS 39 N 1.30 3.88 -0.43 2.79 1.02 0.04 -0.25 119.74 128.10 2kz0 s LYS 39 Ca -0.03 0.33 -0.09 0.00 0.02 0.00 0.00 55.97 56.19 2kz0 s LYS 39 Cb -0.20 -3.74 0.08 0.00 -0.52 0.00 0.00 37.83 33.45 2kz0 s LYS 39 CO 0.00 -0.63 0.27 0.08 -0.92 0.00 0.00 175.35 174.16 2kz0 s VAL 40 N 2.72 4.28 -0.36 3.17 1.01 0.15 -0.35 120.40 131.02 2kz0 s VAL 40 Ca 0.27 -1.41 -0.12 0.00 0.00 0.00 0.00 61.98 60.72 2kz0 s VAL 40 Cb -0.15 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.61 2kz0 s VAL 40 CO 0.13 -0.53 0.22 -0.63 0.00 0.00 0.00 175.10 174.28 2kz0 s ILE 41 N 1.43 4.85 -0.05 2.22 -1.09 -0.40 -0.77 121.20 127.38 2kz0 s ILE 41 Ca 0.03 -0.59 -0.18 0.00 -2.23 0.00 0.00 60.65 57.68 2kz0 s ILE 41 Cb -0.23 -3.61 0.04 0.00 -1.58 0.00 0.00 42.46 37.07 2kz0 s ILE 41 CO 0.02 -0.13 0.41 -0.55 -1.23 0.00 0.00 174.94 173.45 2kz0 s SER 42 N 1.63 -0.34 0.52 3.58 0.15 -1.26 0.25 113.70 118.23 2kz0 s SER 42 Ca 0.04 0.38 0.35 0.00 0.70 0.00 0.00 55.95 57.42 2kz0 s SER 42 Cb -0.18 0.48 1.72 0.00 -1.71 0.00 0.00 66.02 66.33 2kz0 s SER 42 CO 0.08 -0.41 2.06 0.77 1.20 0.00 0.00 173.24 176.93 2kz0 h SER 43 N 4.06 0.00 0.88 5.45 4.64 -1.92 -0.68 113.55 125.98 2kz0 h SER 43 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2kz0 h SER 43 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2kz0 h SER 43 CO 0.36 0.00 0.00 1.56 -0.87 0.00 0.00 176.83 177.88 2kz0 h GLN 44 N 0.00 0.00 -0.00 4.77 1.08 -1.95 -2.58 115.11 116.43 2kz0 h GLN 44 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2kz0 h GLN 44 Cb 0.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2kz0 h GLN 44 CO 0.00 0.00 -0.39 1.19 -0.95 0.00 0.00 178.83 178.68 2kz0 n PHE 45 N -2.50 0.00 -3.06 2.96 3.72 -0.31 -4.89 117.46 113.39 2kz0 n PHE 45 Ca 0.02 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.02 2kz0 n PHE 45 Cb 0.27 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.76 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 -1.77 4.29 -0.07 -1.08 0.74 -0.93 -3.67 119.66 117.17 2kz0 s GLN 46 Ca 0.05 0.76 0.00 0.00 0.05 0.00 0.00 55.36 56.22 2kz0 s GLN 46 Cb 0.07 -3.54 0.00 0.00 1.10 0.00 0.00 33.01 30.65 2kz0 s GLN 46 CO 0.36 -0.16 0.00 0.41 -0.55 0.00 0.00 175.29 175.34 2kz0 n GLY 47 N 3.52 0.43 3.83 2.59 0.00 -1.14 -4.92 105.19 109.49 2kz0 n GLY 47 Ca -0.00 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.03 2.98 0.25 1.61 -0.14 -1.24 -5.07 119.74 116.10 2kz0 s LYS 48 Ca 0.00 -0.92 -0.31 0.00 -1.36 0.00 0.00 55.97 53.38 2kz0 s LYS 48 Cb 0.00 -2.65 -0.12 0.00 -1.68 0.00 0.00 37.83 33.39 2kz0 s LYS 48 CO 0.00 0.45 1.64 -1.12 -0.76 0.00 0.00 175.35 175.56 2kz0 s SER 49 N -3.47 6.38 0.23 2.83 0.01 -1.26 -4.84 113.70 113.59 2kz0 s SER 49 Ca 0.32 2.90 -0.07 0.00 1.31 0.00 0.00 55.95 60.41 2kz0 s SER 49 Cb -0.09 -2.62 0.20 0.00 0.21 0.00 0.00 66.02 63.72 2kz0 s SER 49 CO 0.25 -0.93 1.85 0.11 0.41 0.00 0.00 173.24 174.92 2kz0 h LYS 50 N 5.72 1.24 -0.53 12.44 1.57 -1.97 -1.65 116.57 133.40 2kz0 h LYS 50 Ca -0.45 -0.15 0.08 0.00 -1.87 0.00 0.00 60.65 58.26 2kz0 h LYS 50 Cb 1.21 -0.24 -0.07 0.00 0.08 0.00 0.00 32.23 33.22 2kz0 h LYS 50 CO 0.87 0.91 0.16 -0.07 -0.57 0.00 0.00 179.45 180.75 2kz0 h LEU 51 N 1.24 0.13 -0.55 2.94 3.38 -1.99 -0.52 115.31 119.93 2kz0 h LEU 51 Ca 0.31 0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.32 2kz0 h LEU 51 Cb 0.04 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2kz0 h LEU 51 CO -0.05 0.09 0.21 -0.33 0.09 0.00 0.00 178.44 178.46 2kz0 h GLU 52 N 0.32 0.84 -0.31 1.13 4.39 -1.76 0.11 114.58 119.29 2kz0 h GLU 52 Ca 0.26 -0.16 0.03 0.00 0.34 0.00 0.00 59.36 59.83 2kz0 h GLU 52 Cb 0.32 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 2kz0 h GLU 52 CO -0.29 0.74 0.13 1.96 -1.16 0.00 0.00 179.01 180.38 2kz0 h GLN 53 N 0.76 0.27 -0.43 2.33 4.20 -0.68 -1.20 115.11 120.36 2kz0 h GLN 53 Ca 0.18 -0.02 -0.14 0.00 0.06 0.00 0.00 58.65 58.73 2kz0 h GLN 53 Cb 0.22 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2kz0 h GLN 53 CO -0.01 0.18 -0.30 0.45 -0.67 0.00 0.00 178.83 178.47 2kz0 h HIS 54 N 0.28 1.12 -0.02 2.96 3.86 -0.77 -1.19 115.15 121.39 2kz0 h HIS 54 Ca 0.13 -0.30 0.03 0.00 -1.16 0.00 0.00 60.37 59.08 2kz0 h HIS 54 Cb 0.08 -0.25 -0.05 0.00 1.06 0.00 0.00 27.41 28.26 2kz0 h HIS 54 CO -0.12 1.12 -0.25 0.00 0.86 0.00 0.00 177.93 179.54 2kz0 h ARG 55 N 0.80 -0.36 -0.31 2.45 3.08 -0.53 0.13 114.38 119.63 2kz0 h ARG 55 Ca 0.09 0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 2kz0 h ARG 55 Cb 0.88 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.00 2kz0 h ARG 55 CO 0.08 -0.24 0.13 0.52 -1.07 0.00 0.00 179.97 179.39 2kz0 h MET 56 N -0.38 0.46 -0.52 0.04 2.86 -1.03 0.19 114.93 116.55 2kz0 h MET 56 Ca 0.07 -0.08 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 2kz0 h MET 56 Cb 0.47 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 2kz0 h MET 56 CO -0.24 0.46 0.14 0.82 1.06 0.00 0.00 176.91 179.15 2kz0 h ILE 57 N 0.36 1.24 -0.18 -1.22 1.08 -1.06 -0.42 117.51 117.31 2kz0 h ILE 57 Ca 0.11 -0.85 -0.08 0.00 -0.39 0.00 0.00 64.86 63.65 2kz0 h ILE 57 Cb 0.16 0.79 -0.01 0.00 -3.07 0.00 0.00 36.82 34.69 2kz0 h ILE 57 CO -0.01 0.31 -0.23 1.88 -0.69 0.00 0.00 178.15 179.41 2kz0 h TYR 58 N 0.73 0.36 -0.15 1.37 0.05 -0.57 0.14 116.97 118.90 2kz0 h TYR 58 Ca 0.17 -0.06 -0.21 0.00 0.05 0.00 0.00 58.73 58.68 2kz0 h TYR 58 Cb 0.32 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.98 2kz0 h TYR 58 CO 0.02 0.54 -0.73 -0.22 -1.05 0.00 0.00 178.16 176.72 2kz0 h LYS 59 N 0.30 0.70 0.04 4.88 3.11 -0.51 -1.72 116.57 123.36 2kz0 h LYS 59 Ca 0.05 -0.55 -0.23 0.00 -2.81 0.00 0.00 60.65 57.11 2kz0 h LYS 59 Cb 0.57 0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 31.88 2kz0 h LYS 59 CO 0.04 1.16 -1.11 -0.24 -2.81 0.00 0.00 179.45 176.49 2kz0 h VAL 60 N 0.49 1.61 -0.15 2.00 3.04 -0.90 -3.08 116.25 119.26 2kz0 h VAL 60 Ca -0.04 -3.29 0.00 0.00 -1.01 0.00 0.00 66.70 62.37 2kz0 h VAL 60 Cb 1.34 2.86 0.00 0.00 -2.01 0.00 0.00 31.29 33.47 2kz0 h VAL 60 CO 0.14 0.93 0.00 0.18 -1.01 0.00 0.00 177.57 177.82 2kz0 n LEU 61 N -3.39 1.08 -4.65 3.16 7.99 0.47 -4.84 117.00 116.82 2kz0 n LEU 61 Ca -0.03 -0.50 -0.42 0.00 -0.01 0.00 0.00 56.01 55.05 2kz0 n LEU 61 Cb 0.97 -0.10 -0.03 0.00 -0.11 0.00 0.00 43.42 44.15 2kz0 n LEU 61 CO 0.49 0.25 1.41 -0.62 -1.51 0.00 0.00 177.39 177.41 2kz0 s ASP 62 N -1.31 6.54 0.00 -1.43 2.15 -0.65 -3.96 116.67 118.01 2kz0 s ASP 62 Ca 0.23 2.13 0.00 0.00 0.43 0.00 0.00 52.55 55.35 2kz0 s ASP 62 Cb 0.12 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 2kz0 s ASP 62 CO 0.18 -1.05 0.00 0.61 -0.17 0.00 0.00 175.17 174.74 2kz0 n GLY 63 N 4.34 0.85 3.92 2.66 0.00 -1.26 -5.05 105.19 110.65 2kz0 n GLY 63 Ca 0.18 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2kz0 n GLY 63 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2kz0 s LEU 64 N 0.00 4.02 0.24 0.99 0.05 -1.25 -5.00 118.68 117.73 2kz0 s LEU 64 Ca 0.00 0.63 0.00 0.00 0.05 0.00 0.00 54.13 54.81 2kz0 s LEU 64 Cb 0.00 -3.47 0.00 0.00 -2.05 0.00 0.00 46.19 40.67 2kz0 s LEU 64 CO 0.00 -0.24 0.00 0.59 -0.55 0.00 0.00 176.35 176.15 2kz0 n ASN 65 N -1.26 -0.13 -0.08 1.48 4.13 -1.26 -4.99 115.26 113.15 2kz0 n ASN 65 Ca -0.03 0.40 -0.07 0.00 1.68 0.00 0.00 54.58 56.57 2kz0 n ASN 65 Cb 0.55 0.33 -0.02 0.00 -1.54 0.00 0.00 39.78 39.09 2kz0 n ASN 65 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2kz0 n ILE 66 N -3.30 1.44 -3.65 2.41 -0.00 -1.26 -5.03 119.36 109.97 2kz0 n ILE 66 Ca 0.00 0.19 -0.12 0.00 -0.00 0.00 0.00 62.75 62.81 2kz0 n ILE 66 Cb 0.00 -2.36 -0.08 0.00 -0.00 0.00 0.00 39.64 37.20 2kz0 n ILE 66 CO 0.00 0.00 0.00 -2.28 -0.00 0.00 0.00 176.55 174.27 2kz0 s HIS 67 N -2.35 -0.78 -0.17 1.39 2.46 -1.26 -5.08 115.29 109.51 2kz0 s HIS 67 Ca -0.18 1.79 -0.06 0.00 0.47 0.00 0.00 55.06 57.08 2kz0 s HIS 67 Cb 0.03 0.33 -0.08 0.00 -0.13 0.00 0.00 32.58 32.72 2kz0 s HIS 67 CO 0.27 -0.38 -0.20 0.00 -2.47 0.00 0.00 174.74 171.96 2kz0 n ALA 68 N 3.18 1.83 -2.42 1.58 0.00 -1.26 -4.83 120.51 118.58 2kz0 n ALA 68 Ca -0.16 -0.68 -0.42 0.00 0.00 0.00 0.00 53.44 52.18 2kz0 n ALA 68 Cb 0.56 0.24 -0.00 0.00 0.00 0.00 0.00 19.45 20.25 2kz0 n ALA 68 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2kz0 n ILE 69 N -3.54 3.80 -1.37 0.00 -5.35 -1.26 -4.29 119.36 107.35 2kz0 n ILE 69 Ca -0.32 -3.86 0.04 0.00 -0.27 0.00 0.00 62.75 58.34 2kz0 n ILE 69 Cb 0.76 -2.38 0.05 0.00 -1.74 0.00 0.00 39.64 36.32 2kz0 n ILE 69 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kz0 n GLN 70 N 8.03 0.75 -3.88 6.28 0.00 -1.26 -5.02 117.38 122.28 2kz0 n GLN 70 Ca 0.49 -1.58 -0.35 0.00 0.00 0.00 0.00 57.00 55.56 2kz0 n GLN 70 Cb 0.45 -0.92 -0.14 0.00 0.00 0.00 0.00 30.24 29.63 2kz0 n GLN 70 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.06 175.56 2kz0 s ILE 71 N -1.17 3.51 -0.32 -0.39 2.07 -1.26 -0.27 121.20 123.36 2kz0 s ILE 71 Ca 0.12 -0.52 -0.03 0.00 -1.41 0.00 0.00 60.65 58.82 2kz0 s ILE 71 Cb 0.10 -2.64 0.06 0.00 0.13 0.00 0.00 42.46 40.11 2kz0 s ILE 71 CO 0.01 0.36 0.05 -1.10 -1.91 0.00 0.00 174.94 172.35 2kz0 s GLN 72 N 1.49 2.40 0.06 3.50 -0.21 0.65 -4.98 119.66 122.57 2kz0 s GLN 72 Ca 0.05 -1.33 -0.20 0.00 0.02 0.00 0.00 55.36 53.90 2kz0 s GLN 72 Cb -0.15 -3.30 -0.06 0.00 1.00 0.00 0.00 33.01 30.50 2kz0 s GLN 72 CO -0.02 -0.69 0.59 0.95 -2.12 0.00 0.00 175.29 173.99 2kz0 s THR 73 N 1.27 4.76 -1.09 -0.19 -4.23 -1.26 0.33 115.64 115.23 2kz0 s THR 73 Ca -0.03 1.26 -0.23 0.00 -1.18 0.00 0.00 61.69 61.51 2kz0 s THR 73 Cb -0.20 -3.92 -0.05 0.00 1.34 0.00 0.00 72.50 69.67 2kz0 s THR 73 CO -0.01 0.52 1.88 -0.83 -0.54 0.00 0.00 174.62 175.65 2kz0 s GLY 74 N -0.88 0.40 0.19 3.99 0.00 0.05 -4.91 107.32 106.15 2kz0 s GLY 74 Ca 0.30 -2.01 -0.28 0.00 0.00 0.00 0.00 44.72 42.73 2kz0 s GLY 74 CO 0.19 3.39 0.88 0.00 0.00 0.00 0.00 173.10 177.56