#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 1.72 -0.02 0.55 0.00 -1.26 -5.13 107.32 103.18 2kz0 s GLY 2 Ca 0.00 -1.42 0.01 0.00 0.00 0.00 0.00 44.72 43.31 2kz0 s GLY 2 CO 0.00 -1.42 -0.02 -0.45 0.00 0.00 0.00 173.10 171.22 2kz0 s SER 3 N -2.46 0.46 -1.00 1.64 0.15 -1.26 -5.07 113.70 106.16 2kz0 s SER 3 Ca 0.21 -0.05 -0.03 0.00 0.70 0.00 0.00 55.95 56.79 2kz0 s SER 3 Cb -0.10 -0.18 0.29 0.00 -1.71 0.00 0.00 66.02 64.32 2kz0 s SER 3 CO 0.12 -0.05 1.31 0.23 1.20 0.00 0.00 173.24 176.05 2kz0 n MET 4 N 3.74 4.02 -2.46 5.44 2.81 -1.26 -5.01 117.12 124.41 2kz0 n MET 4 Ca -0.22 -4.57 -0.43 0.00 -1.81 0.00 0.00 57.70 50.67 2kz0 n MET 4 Cb 0.53 -2.47 -0.02 0.00 -0.71 0.00 0.00 33.22 30.55 2kz0 n MET 4 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2kz0 s THR 5 N -2.59 4.06 -0.11 2.03 2.01 -1.26 -5.00 115.64 114.78 2kz0 s THR 5 Ca 0.32 1.11 -0.14 0.00 0.31 0.00 0.00 61.69 63.29 2kz0 s THR 5 Cb 0.05 -4.34 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 2kz0 s THR 5 CO 0.07 -0.79 0.34 0.54 -0.69 0.00 0.00 174.62 174.09 2kz0 s VAL 6 N 4.88 5.24 0.64 3.82 0.11 -1.26 -5.09 120.40 128.74 2kz0 s VAL 6 Ca 0.55 0.66 0.03 0.00 -2.93 0.00 0.00 61.98 60.29 2kz0 s VAL 6 Cb -0.12 -3.66 0.10 0.00 -1.53 0.00 0.00 36.38 31.17 2kz0 s VAL 6 CO 0.30 0.44 0.88 -0.89 -3.33 0.00 0.00 175.10 172.50 2kz0 s THR 7 N 0.03 2.24 -0.70 5.04 2.01 -1.26 -4.98 115.64 118.03 2kz0 s THR 7 Ca 0.20 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 61.49 2kz0 s THR 7 Cb -0.14 -2.49 0.17 0.00 0.01 0.00 0.00 72.50 70.05 2kz0 s THR 7 CO 0.07 0.00 0.49 -1.10 -0.69 0.00 0.00 174.62 173.39 2kz0 s GLN 8 N -4.91 2.48 0.15 4.92 -1.52 -1.26 -4.98 119.66 114.54 2kz0 s GLN 8 Ca 0.63 -3.26 -0.22 0.00 -1.95 0.00 0.00 55.36 50.56 2kz0 s GLN 8 Cb -0.06 -3.46 0.02 0.00 -0.22 0.00 0.00 33.01 29.29 2kz0 s GLN 8 CO 0.41 -1.26 1.64 0.66 -0.25 0.00 0.00 175.29 176.49 2kz0 h SER 9 N 5.58 -0.71 0.80 5.90 4.64 -1.99 0.30 113.55 128.06 2kz0 h SER 9 Ca 0.12 0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.51 2kz0 h SER 9 Cb 0.77 0.34 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 2kz0 h SER 9 CO 0.73 -0.26 -0.29 0.06 -0.87 0.00 0.00 176.83 176.20 2kz0 h GLN 10 N -0.24 0.00 0.04 4.77 3.07 -1.98 -0.73 115.11 120.04 2kz0 h GLN 10 Ca 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.87 2kz0 h GLN 10 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.00 2kz0 h GLN 10 CO -0.36 0.29 -0.02 1.25 0.09 0.00 0.00 178.83 180.08 2kz0 h LEU 11 N 0.00 -0.04 -0.60 0.06 7.12 -1.52 0.92 115.31 121.25 2kz0 h LEU 11 Ca -0.00 -0.55 0.12 0.00 0.13 0.00 0.00 57.88 57.58 2kz0 h LEU 11 Cb 0.76 0.01 -0.09 0.00 -0.53 0.00 0.00 40.66 40.82 2kz0 h LEU 11 CO 0.04 0.54 0.09 -0.33 -0.13 0.00 0.00 178.44 178.65 2kz0 h GLU 12 N -0.65 0.21 -0.31 1.25 3.07 -0.34 0.11 114.58 117.91 2kz0 h GLU 12 Ca -0.01 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.86 2kz0 h GLU 12 Cb 0.59 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.42 2kz0 h GLU 12 CO 0.01 0.14 0.15 1.25 -1.40 0.00 0.00 179.01 179.16 2kz0 h LEU 13 N 0.22 0.22 -0.20 1.33 6.46 -1.09 0.40 115.31 122.65 2kz0 h LEU 13 Ca 0.31 0.02 0.02 0.00 -0.12 0.00 0.00 57.88 58.10 2kz0 h LEU 13 Cb 0.48 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.36 2kz0 h LEU 13 CO -0.43 0.17 0.08 0.25 -0.62 0.00 0.00 178.44 177.89 2kz0 h LEU 14 N 0.32 0.11 -0.65 2.25 5.85 0.35 0.47 115.31 124.00 2kz0 h LEU 14 Ca 0.13 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 2kz0 h LEU 14 Cb 0.05 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 2kz0 h LEU 14 CO -0.09 0.09 0.19 0.40 -0.34 0.00 0.00 178.44 178.68 2kz0 h ILE 15 N 0.18 1.25 -0.06 4.05 1.08 -0.63 0.89 117.51 124.27 2kz0 h ILE 15 Ca 0.08 -0.89 -0.07 0.00 -0.39 0.00 0.00 64.86 63.60 2kz0 h ILE 15 Cb 0.04 0.59 -0.01 0.00 -3.07 0.00 0.00 36.82 34.37 2kz0 h ILE 15 CO -0.07 0.34 -0.27 -0.09 -0.69 0.00 0.00 178.15 177.37 2kz0 h ARG 16 N 0.95 0.11 0.08 2.37 9.65 -0.54 0.45 114.38 127.44 2kz0 h ARG 16 Ca 0.21 -0.03 -0.25 0.00 -1.10 0.00 0.00 59.98 58.80 2kz0 h ARG 16 Cb 0.32 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 2kz0 h ARG 16 CO -0.00 0.37 -1.17 -0.91 2.80 0.00 0.00 179.97 181.06 2kz0 h ASN 17 N 0.10 0.25 -0.04 -3.80 2.35 -0.45 -2.85 115.58 111.13 2kz0 h ASN 17 Ca 0.01 -0.28 -0.06 0.00 -0.55 0.00 0.00 56.30 55.43 2kz0 h ASN 17 Cb 0.53 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2kz0 h ASN 17 CO 0.04 1.22 -0.20 0.00 -1.65 0.00 0.00 177.43 176.84 2kz0 h ALA 18 N 0.74 0.08 -3.16 -0.83 0.00 -0.43 -3.42 119.26 112.25 2kz0 h ALA 18 Ca -0.09 -0.40 -0.59 0.00 0.00 0.00 0.00 54.91 53.83 2kz0 h ALA 18 Cb 1.90 -0.00 -0.40 0.00 0.00 0.00 0.00 17.79 19.28 2kz0 h ALA 18 CO 0.17 0.05 -0.75 -0.06 0.00 0.00 0.00 179.25 178.66 2kz0 s PHE 19 N -3.62 1.77 0.36 0.00 0.08 0.15 -4.99 117.98 111.74 2kz0 s PHE 19 Ca -0.15 -1.80 0.21 0.00 0.12 0.00 0.00 56.93 55.30 2kz0 s PHE 19 Cb 0.02 -1.75 1.09 0.00 -0.57 0.00 0.00 43.02 41.81 2kz0 s PHE 19 CO 0.74 -0.88 1.94 -1.35 -0.10 0.00 0.00 175.22 175.58 2kz0 h PRO 20 N 8.00 0.00 -1.09 0.24 0.11 -1.71 -2.81 132.00 134.74 2kz0 h PRO 20 Ca -0.13 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.48 2kz0 h PRO 20 Cb 1.01 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 31.87 2kz0 h PRO 20 CO 0.47 0.23 0.64 0.39 -0.21 0.00 0.00 178.00 179.52 2kz0 n GLU 21 N -3.80 2.23 -4.91 1.05 -0.58 -1.26 -4.93 120.64 108.44 2kz0 n GLU 21 Ca -0.02 -2.61 -0.33 0.00 -0.42 0.00 0.00 57.16 53.79 2kz0 n GLU 21 Cb 0.33 -2.02 -0.13 0.00 -0.57 0.00 0.00 31.44 29.04 2kz0 n GLU 21 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2kz0 s ALA 22 N -2.96 2.64 -0.26 0.62 0.00 -1.06 -3.68 121.76 117.05 2kz0 s ALA 22 Ca 0.51 -0.99 -0.19 0.00 0.00 0.00 0.00 51.96 51.29 2kz0 s ALA 22 Cb 0.41 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 2kz0 s ALA 22 CO 0.04 0.55 0.56 -1.21 0.00 0.00 0.00 175.76 175.69 2kz0 s GLU 23 N -0.71 4.06 -0.40 0.00 0.41 0.14 -4.90 118.70 117.30 2kz0 s GLU 23 Ca 0.11 0.37 -0.15 0.00 -0.41 0.00 0.00 54.97 54.90 2kz0 s GLU 23 Cb -0.11 -3.66 0.01 0.00 -1.78 0.00 0.00 34.13 28.60 2kz0 s GLU 23 CO 0.00 -0.39 0.29 0.42 -0.49 0.00 0.00 175.26 175.10 2kz0 s ILE 24 N 2.39 5.26 -0.32 -1.63 1.09 -1.26 -0.93 121.20 125.80 2kz0 s ILE 24 Ca 0.23 -0.57 -0.01 0.00 -1.10 0.00 0.00 60.65 59.20 2kz0 s ILE 24 Cb -0.16 -3.89 0.06 0.00 -1.06 0.00 0.00 42.46 37.41 2kz0 s ILE 24 CO 0.09 -0.26 0.02 -0.89 -0.10 0.00 0.00 174.94 173.81 2kz0 s THR 25 N 1.70 2.91 -0.52 2.92 2.01 0.48 -4.97 115.64 120.17 2kz0 s THR 25 Ca 0.05 -1.58 -0.26 0.00 0.31 0.00 0.00 61.69 60.22 2kz0 s THR 25 Cb -0.19 -2.76 0.03 0.00 0.01 0.00 0.00 72.50 69.60 2kz0 s THR 25 CO 0.10 -0.22 1.00 -0.69 -0.69 0.00 0.00 174.62 174.12 2kz0 s VAL 26 N 1.20 4.33 -0.03 3.82 1.01 -1.26 -0.40 120.40 129.07 2kz0 s VAL 26 Ca -0.02 0.66 0.01 0.00 0.00 0.00 0.00 61.98 62.63 2kz0 s VAL 26 Cb -0.20 -4.55 -0.03 0.00 0.00 0.00 0.00 36.38 31.60 2kz0 s VAL 26 CO -0.02 -1.05 -0.04 0.28 0.00 0.00 0.00 175.10 174.27 2kz0 s THR 27 N 4.13 3.91 -0.12 3.92 -1.32 0.12 -4.94 115.64 121.34 2kz0 s THR 27 Ca 0.37 -0.57 -0.16 0.00 -1.21 0.00 0.00 61.69 60.12 2kz0 s THR 27 Cb -0.10 -2.68 -0.04 0.00 -1.51 0.00 0.00 72.50 68.16 2kz0 s THR 27 CO 0.24 0.47 0.40 -0.44 -2.21 0.00 0.00 174.62 173.08 2kz0 s SER 28 N -1.23 6.60 0.20 8.08 0.01 -1.26 -1.14 113.70 124.96 2kz0 s SER 28 Ca 0.16 0.71 -0.04 0.00 1.31 0.00 0.00 55.95 58.09 2kz0 s SER 28 Cb -0.11 -2.24 0.14 0.00 0.21 0.00 0.00 66.02 64.01 2kz0 s SER 28 CO 0.06 0.07 1.55 -0.07 0.41 0.00 0.00 173.24 175.25 2kz0 h LEU 29 N 6.53 0.68 -2.21 2.44 -0.00 -1.85 -3.49 115.31 117.41 2kz0 h LEU 29 Ca -0.42 -0.32 0.00 0.00 -0.00 0.00 0.00 57.88 57.14 2kz0 h LEU 29 Cb 1.18 -0.19 0.00 0.00 -0.00 0.00 0.00 40.66 41.64 2kz0 h LEU 29 CO 0.74 1.03 -0.91 0.52 -0.00 0.00 0.00 178.44 179.82 2kz0 n VAL 30 N -4.01-11.25 0.00 1.22 0.31 -1.26 -4.67 118.33 98.67 2kz0 n VAL 30 Ca -0.02 1.70 0.00 0.00 -0.01 0.00 0.00 64.34 66.01 2kz0 n VAL 30 Cb 0.55 -6.71 0.00 0.00 -0.91 0.00 0.00 33.84 26.77 2kz0 n VAL 30 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kz0 n GLY 31 N 0.64 3.86 3.07 2.92 0.00 -1.26 -5.02 105.19 109.41 2kz0 n GLY 31 Ca 0.00 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 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 4.88 -0.12 1.61 1.01 -1.26 -4.97 116.67 117.82 2kz0 s ASP 32 Ca 0.00 -1.93 0.15 0.00 0.71 0.00 0.00 52.55 51.48 2kz0 s ASP 32 Cb 0.00 -1.68 0.43 0.00 1.01 0.00 0.00 42.92 42.67 2kz0 s ASP 32 CO 0.00 -0.39 1.33 -0.46 0.21 0.00 0.00 175.17 175.86 2kz0 n ASN 33 N 4.41 3.39 0.18 0.27 0.23 -1.26 -4.26 115.26 118.22 2kz0 n ASN 33 Ca -0.02 -2.76 0.02 0.00 -0.53 0.00 0.00 54.58 51.29 2kz0 n ASN 33 Cb 0.42 -0.44 0.32 0.00 -2.08 0.00 0.00 39.78 38.01 2kz0 n ASN 33 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 2kz0 h ASN 34 N 1.54 0.00 -5.00 0.53 4.21 -2.04 -3.46 115.58 111.36 2kz0 h ASN 34 Ca 0.00 -0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.53 2kz0 h ASN 34 Cb 1.19 -0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 38.29 2kz0 h ASN 34 CO 0.14 0.42 0.23 -1.00 -1.29 0.00 0.00 177.43 175.93 2kz0 s HIS 35 N -4.09 -0.40 0.14 1.19 3.76 -1.26 -5.17 115.29 109.46 2kz0 s HIS 35 Ca -0.03 0.10 0.04 0.00 -0.15 0.00 0.00 55.06 55.02 2kz0 s HIS 35 Cb 0.14 0.62 -0.04 0.00 1.11 0.00 0.00 32.58 34.41 2kz0 s HIS 35 CO 0.73 -0.98 0.11 0.71 -0.85 0.00 0.00 174.74 174.47 2kz0 s TYR 36 N -3.78 3.15 -0.06 1.40 2.02 -1.26 -4.73 117.35 114.09 2kz0 s TYR 36 Ca 0.05 0.01 -0.18 0.00 -0.37 0.00 0.00 57.07 56.58 2kz0 s TYR 36 Cb -0.03 -1.54 -0.05 0.00 -0.40 0.00 0.00 41.96 39.94 2kz0 s TYR 36 CO -0.05 0.52 0.48 -1.12 -1.57 0.00 0.00 175.55 173.80 2kz0 s SER 37 N -2.88 6.78 -0.45 2.29 0.01 -0.29 -4.83 113.70 114.33 2kz0 s SER 37 Ca 0.30 0.92 -0.16 0.00 1.31 0.00 0.00 55.95 58.33 2kz0 s SER 37 Cb -0.11 -2.29 0.05 0.00 0.21 0.00 0.00 66.02 63.88 2kz0 s SER 37 CO 0.23 0.12 0.37 -0.63 0.41 0.00 0.00 173.24 173.74 2kz0 s ILE 38 N -0.05 5.22 -0.24 1.44 -1.09 0.30 -0.70 121.20 126.08 2kz0 s ILE 38 Ca 0.26 -0.85 -0.18 0.00 -2.23 0.00 0.00 60.65 57.65 2kz0 s ILE 38 Cb -0.16 -4.05 -0.03 0.00 -1.58 0.00 0.00 42.46 36.63 2kz0 s ILE 38 CO 0.12 -0.48 0.50 -0.54 -1.23 0.00 0.00 174.94 173.32 2kz0 s LYS 39 N 1.72 4.11 -0.31 2.79 1.02 0.46 -0.57 119.74 128.96 2kz0 s LYS 39 Ca 0.05 0.33 -0.05 0.00 0.02 0.00 0.00 55.97 56.32 2kz0 s LYS 39 Cb -0.22 -3.62 0.03 0.00 -0.52 0.00 0.00 37.83 33.51 2kz0 s LYS 39 CO 0.08 -0.27 0.06 0.08 -0.92 0.00 0.00 175.35 174.38 2kz0 s VAL 40 N 2.05 3.58 -0.52 3.17 1.01 0.10 -0.39 120.40 129.40 2kz0 s VAL 40 Ca 0.22 -1.05 -0.10 0.00 0.00 0.00 0.00 61.98 61.04 2kz0 s VAL 40 Cb -0.15 -2.96 0.13 0.00 0.00 0.00 0.00 36.38 33.40 2kz0 s VAL 40 CO 0.09 -0.05 0.41 -0.63 0.00 0.00 0.00 175.10 174.92 2kz0 s ILE 41 N 1.39 4.45 0.01 2.22 -1.09 -0.11 -3.77 121.20 124.30 2kz0 s ILE 41 Ca -0.01 -1.87 0.03 0.00 -2.23 0.00 0.00 60.65 56.57 2kz0 s ILE 41 Cb -0.19 -3.90 -0.01 0.00 -1.58 0.00 0.00 42.46 36.78 2kz0 s ILE 41 CO 0.01 -0.82 -0.11 -0.55 -1.23 0.00 0.00 174.94 172.24 2kz0 s SER 42 N 2.66 1.28 0.00 3.58 0.15 -1.26 0.29 113.70 120.40 2kz0 s SER 42 Ca 0.07 -0.27 0.10 0.00 0.70 0.00 0.00 55.95 56.55 2kz0 s SER 42 Cb -0.25 -0.12 0.51 0.00 -1.71 0.00 0.00 66.02 64.45 2kz0 s SER 42 CO -0.01 0.08 1.19 -1.20 1.20 0.00 0.00 173.24 174.50 2kz0 n SER 43 N 2.52 0.00 -0.08 5.45 7.64 -1.24 -1.31 113.62 126.60 2kz0 n SER 43 Ca -0.15 0.10 0.14 0.00 1.01 0.00 0.00 58.87 59.96 2kz0 n SER 43 Cb 0.56 -0.26 0.55 0.00 -1.01 0.00 0.00 64.21 64.05 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 -1.26 0.47 -0.27 1.43 1.13 -1.26 -3.61 117.38 114.01 2kz0 n GLN 44 Ca 0.05 -0.16 0.10 0.00 -1.94 0.00 0.00 57.00 55.05 2kz0 n GLN 44 Cb 0.07 -1.50 0.25 0.00 0.11 0.00 0.00 30.24 29.18 2kz0 n GLN 44 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 2kz0 n PHE 45 N -1.12 0.72 -2.29 1.08 3.72 -0.43 -4.91 117.46 114.23 2kz0 n PHE 45 Ca 0.12 -0.42 -0.42 0.00 -0.05 0.00 0.00 57.45 56.67 2kz0 n PHE 45 Cb 0.30 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.81 2kz0 n PHE 45 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 2kz0 s GLN 46 N -1.11 4.27 0.00 -1.08 -2.07 -1.24 -2.42 119.66 116.01 2kz0 s GLN 46 Ca 0.40 1.87 0.00 0.00 -1.82 0.00 0.00 55.36 55.81 2kz0 s GLN 46 Cb 0.21 -3.66 0.00 0.00 -1.09 0.00 0.00 33.01 28.48 2kz0 s GLN 46 CO 0.29 -0.61 0.00 0.41 -1.32 0.00 0.00 175.29 174.06 2kz0 n GLY 47 N 3.64 0.54 3.72 2.60 0.00 -1.26 -5.01 105.19 109.42 2kz0 n GLY 47 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.02 4.55 0.60 1.61 3.01 -1.02 -5.04 119.74 123.42 2kz0 s LYS 48 Ca 0.00 1.28 -0.07 0.00 -1.01 0.00 0.00 55.97 56.17 2kz0 s LYS 48 Cb 0.00 -3.44 0.00 0.00 -1.01 0.00 0.00 37.83 33.38 2kz0 s LYS 48 CO 0.00 0.03 0.93 -1.54 0.51 0.00 0.00 175.35 175.27 2kz0 s SER 49 N 0.77 5.69 0.26 2.83 1.04 -1.26 -4.85 113.70 118.18 2kz0 s SER 49 Ca 0.47 0.85 -0.05 0.00 0.48 0.00 0.00 55.95 57.71 2kz0 s SER 49 Cb -0.21 -1.86 0.31 0.00 0.10 0.00 0.00 66.02 64.37 2kz0 s SER 49 CO 0.26 -1.04 1.91 0.07 0.98 0.00 0.00 173.24 175.43 2kz0 h LYS 50 N -0.21 1.26 -0.08 4.02 2.10 -1.98 0.19 116.57 121.87 2kz0 h LYS 50 Ca -0.45 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 2kz0 h LYS 50 Cb 1.25 -0.29 -0.00 0.00 -0.90 0.00 0.00 32.23 32.29 2kz0 h LYS 50 CO 0.61 0.84 0.05 -0.07 -2.00 0.00 0.00 179.45 178.88 2kz0 h LEU 51 N 1.30 0.10 -0.06 7.07 3.38 -1.99 0.38 115.31 125.50 2kz0 h LEU 51 Ca 0.39 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.34 2kz0 h LEU 51 Cb -0.05 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2kz0 h LEU 51 CO -0.11 0.09 0.02 -0.08 0.09 0.00 0.00 178.44 178.45 2kz0 h GLU 52 N 0.10 0.05 -0.42 1.13 4.81 -1.83 -1.19 114.58 117.23 2kz0 h GLU 52 Ca 0.03 -0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 2kz0 h GLU 52 Cb 0.01 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.32 2kz0 h GLU 52 CO -0.01 0.03 0.11 1.96 -0.73 0.00 0.00 179.01 180.38 2kz0 h GLN 53 N 0.05 0.24 -0.40 1.92 4.20 -0.24 0.74 115.11 121.63 2kz0 h GLN 53 Ca 0.02 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2kz0 h GLN 53 Cb 0.01 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 2kz0 h GLN 53 CO -0.02 0.16 0.25 0.45 -0.67 0.00 0.00 178.83 179.00 2kz0 h HIS 54 N 0.25 0.51 -0.66 2.96 3.86 -0.03 0.48 115.15 122.53 2kz0 h HIS 54 Ca 0.20 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.41 2kz0 h HIS 54 Cb 0.23 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.50 2kz0 h HIS 54 CO -0.19 0.34 0.37 -0.09 0.86 0.00 0.00 177.93 179.23 2kz0 h ARG 55 N 0.54 0.91 -0.25 2.45 2.43 -0.71 0.39 114.38 120.14 2kz0 h ARG 55 Ca 0.15 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2kz0 h ARG 55 Cb -0.03 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 2kz0 h ARG 55 CO -0.03 0.68 0.10 0.52 -1.51 0.00 0.00 179.97 179.72 2kz0 h MET 56 N 0.90 0.38 -0.29 0.20 2.86 -0.34 0.18 114.93 118.81 2kz0 h MET 56 Ca 0.23 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.81 2kz0 h MET 56 Cb 0.02 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 2kz0 h MET 56 CO -0.04 0.42 0.18 0.82 1.06 0.00 0.00 176.91 179.35 2kz0 h ILE 57 N 0.25 1.05 -0.23 -1.22 2.04 -0.77 0.72 117.51 119.35 2kz0 h ILE 57 Ca 0.08 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 2kz0 h ILE 57 Cb 0.19 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2kz0 h ILE 57 CO -0.01 0.07 0.09 0.22 0.00 0.00 0.00 178.15 178.52 2kz0 h TYR 58 N 0.37 0.31 0.02 1.37 3.20 -0.71 -0.81 116.97 120.72 2kz0 h TYR 58 Ca 0.11 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 2kz0 h TYR 58 Cb -0.02 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.15 2kz0 h TYR 58 CO -0.07 0.26 -0.01 -0.22 -1.64 0.00 0.00 178.16 176.48 2kz0 h LYS 59 N 0.32 -0.02 -0.20 1.82 3.64 0.07 -0.64 116.57 121.56 2kz0 h LYS 59 Ca 0.08 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.34 2kz0 h LYS 59 Cb 0.08 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2kz0 h LYS 59 CO -0.01 0.70 -0.39 -0.24 -2.27 0.00 0.00 179.45 177.24 2kz0 h VAL 60 N -0.78 1.30 0.19 2.00 3.04 -0.75 -3.01 116.25 118.24 2kz0 h VAL 60 Ca -0.00 -1.53 -0.31 0.00 -1.01 0.00 0.00 66.70 63.85 2kz0 h VAL 60 Cb 0.72 1.58 0.03 0.00 -2.01 0.00 0.00 31.29 31.61 2kz0 h VAL 60 CO 0.00 0.47 -1.36 0.25 -1.01 0.00 0.00 177.57 175.93 2kz0 h LEU 61 N 0.38 0.77 -2.96 3.16 7.12 -1.26 -3.49 115.31 119.03 2kz0 h LEU 61 Ca 0.04 -0.79 -0.21 0.00 0.13 0.00 0.00 57.88 57.05 2kz0 h LEU 61 Cb 0.85 -0.25 0.01 0.00 -0.53 0.00 0.00 40.66 40.74 2kz0 h LEU 61 CO 0.07 1.61 -0.70 -0.67 -0.13 0.00 0.00 178.44 178.62 2kz0 n ASP 62 N -3.71 -6.60 0.00 1.25 2.03 -0.25 -4.97 116.55 104.31 2kz0 n ASP 62 Ca -0.14 -0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.04 2kz0 n ASP 62 Cb 1.05 -3.58 0.00 0.00 -0.72 0.00 0.00 41.12 37.87 2kz0 n ASP 62 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kz0 n GLY 63 N -0.93 -0.73 3.54 0.27 0.00 -1.26 -5.09 105.19 101.00 2kz0 n GLY 63 Ca -0.06 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 2kz0 n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kz0 s LEU 64 N 0.00 4.48 -0.35 0.99 2.01 -1.26 -4.99 118.68 119.56 2kz0 s LEU 64 Ca 0.00 -0.27 -0.19 0.00 0.01 0.00 0.00 54.13 53.69 2kz0 s LEU 64 Cb 0.00 -2.36 -0.00 0.00 0.01 0.00 0.00 46.19 43.84 2kz0 s LEU 64 CO 0.00 -0.37 0.54 0.21 1.01 0.00 0.00 176.35 177.74 2kz0 s ASN 65 N 1.74 6.34 0.34 2.29 3.84 -1.26 -5.04 114.94 123.19 2kz0 s ASN 65 Ca 0.12 0.01 -0.29 0.00 0.21 0.00 0.00 52.86 52.92 2kz0 s ASN 65 Cb -0.17 -2.28 -0.11 0.00 -0.55 0.00 0.00 41.25 38.15 2kz0 s ASN 65 CO 0.12 -0.50 1.43 -0.63 -2.79 0.00 0.00 177.10 174.73 2kz0 s ILE 66 N 2.46 2.35 -1.09 -5.21 -1.09 -1.26 -4.87 121.20 112.48 2kz0 s ILE 66 Ca 0.20 0.34 -0.23 0.00 -2.23 0.00 0.00 60.65 58.73 2kz0 s ILE 66 Cb -0.15 -3.21 -0.04 0.00 -1.58 0.00 0.00 42.46 37.47 2kz0 s ILE 66 CO 0.14 0.07 1.87 -1.00 -1.23 0.00 0.00 174.94 174.79 2kz0 s HIS 67 N -0.87 2.07 0.14 3.97 3.76 -1.26 -4.78 115.29 118.31 2kz0 s HIS 67 Ca 0.53 0.12 -0.05 0.00 -0.15 0.00 0.00 55.06 55.51 2kz0 s HIS 67 Cb -0.44 -4.18 0.02 0.00 1.11 0.00 0.00 32.58 29.09 2kz0 s HIS 67 CO 0.56 -1.52 0.26 0.00 -0.85 0.00 0.00 174.74 173.19 2kz0 n ALA 68 N 12.94 -0.55 -3.03 -1.40 0.00 -1.26 -5.09 120.51 122.12 2kz0 n ALA 68 Ca 0.43 -0.47 -0.44 0.00 0.00 0.00 0.00 53.44 52.96 2kz0 n ALA 68 Cb 0.47 0.38 0.00 0.00 0.00 0.00 0.00 19.45 20.30 2kz0 n ALA 68 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2kz0 n ILE 69 N -0.19 4.55 -0.09 0.00 2.08 -1.26 -4.60 119.36 119.85 2kz0 n ILE 69 Ca -0.03 -5.12 -0.23 0.00 0.56 0.00 0.00 62.75 57.94 2kz0 n ILE 69 Cb 0.21 -2.44 -0.12 0.00 -0.75 0.00 0.00 39.64 36.54 2kz0 n ILE 69 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2kz0 n GLN 70 N 3.64 0.64 -4.48 0.38 3.00 -1.26 -4.35 117.38 114.95 2kz0 n GLN 70 Ca 0.31 0.33 -0.33 0.00 -0.01 0.00 0.00 57.00 57.30 2kz0 n GLN 70 Cb 0.39 -1.63 -0.15 0.00 0.00 0.00 0.00 30.24 28.85 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 -2.48 2.98 -0.13 5.09 1.10 -1.26 -0.54 121.20 125.95 2kz0 s ILE 71 Ca -0.30 -0.66 0.00 0.00 -0.51 0.00 0.00 60.65 59.17 2kz0 s ILE 71 Cb 0.09 -2.28 0.02 0.00 0.15 0.00 0.00 42.46 40.44 2kz0 s ILE 71 CO 0.62 0.50 -0.11 -1.10 -2.11 0.00 0.00 174.94 172.74 2kz0 s GLN 72 N 0.77 1.92 -0.20 3.50 -1.52 0.26 -4.93 119.66 119.46 2kz0 s GLN 72 Ca -0.05 -0.41 -0.01 0.00 -1.95 0.00 0.00 55.36 52.94 2kz0 s GLN 72 Cb -0.15 -1.84 0.01 0.00 -0.22 0.00 0.00 33.01 30.81 2kz0 s GLN 72 CO 0.01 -0.24 -0.12 0.99 -0.25 0.00 0.00 175.29 175.68 2kz0 s THR 73 N 1.56 2.70 0.00 -0.19 2.01 -1.26 0.03 115.64 120.48 2kz0 s THR 73 Ca 0.04 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.32 2kz0 s THR 73 Cb -0.13 -2.19 0.00 0.00 0.01 0.00 0.00 72.50 70.19 2kz0 s THR 73 CO -0.09 0.48 0.00 0.61 -0.69 0.00 0.00 174.62 174.93 2kz0 n GLY 74 N 4.71 1.72 3.29 4.40 0.00 -1.25 -5.00 105.19 113.07 2kz0 n GLY 74 Ca -0.20 -2.18 -0.16 0.00 0.00 0.00 0.00 46.02 43.49 2kz0 n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32