#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nzu n GLN 3 N 0.00 0.00 -3.95 0.00 10.64 -1.26 -1.45 117.38 121.36 2nzu n GLN 3 Ca 0.00 0.00 -0.10 0.00 -1.83 0.00 0.00 57.00 55.07 2nzu n GLN 3 Cb 0.00 0.00 -0.11 0.00 -0.86 0.00 0.00 30.24 29.27 2nzu n GLN 3 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 2nzu s LYS 4 N -2.00 0.34 0.01 2.61 2.47 -0.83 -5.03 119.74 117.32 2nzu s LYS 4 Ca 0.00 -0.53 0.06 0.00 -1.56 0.00 0.00 55.97 53.94 2nzu s LYS 4 Cb 0.00 0.13 -0.03 0.00 -1.46 0.00 0.00 37.83 36.47 2nzu s LYS 4 CO 0.00 -0.06 -0.16 0.99 0.16 0.00 0.00 175.35 176.27 2nzu s THR 5 N -1.38 2.92 0.26 3.43 2.01 -1.26 -1.78 115.64 119.84 2nzu s THR 5 Ca -0.15 -1.03 0.02 0.00 0.31 0.00 0.00 61.69 60.84 2nzu s THR 5 Cb -0.09 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 2nzu s THR 5 CO -0.00 0.41 0.15 -0.36 -0.69 0.00 0.00 174.62 174.13 2nzu s PHE 6 N -0.88 1.46 -0.14 4.92 0.40 0.07 -4.94 117.98 118.87 2nzu s PHE 6 Ca 0.14 -1.38 0.01 0.00 -0.60 0.00 0.00 56.93 55.09 2nzu s PHE 6 Cb -0.11 -0.74 0.02 0.00 0.51 0.00 0.00 43.02 42.70 2nzu s PHE 6 CO 0.04 -0.58 -0.14 0.95 0.70 0.00 0.00 175.22 176.19 2nzu s THR 7 N -3.80 1.55 0.04 0.64 -4.23 -0.89 -1.69 115.64 107.26 2nzu s THR 7 Ca 0.38 -0.63 -0.30 0.00 -1.18 0.00 0.00 61.69 59.96 2nzu s THR 7 Cb 0.06 -1.45 -0.06 0.00 1.34 0.00 0.00 72.50 72.38 2nzu s THR 7 CO 0.16 0.45 1.41 0.68 -0.54 0.00 0.00 174.62 176.78 2nzu s VAL 8 N 1.42 3.58 -0.14 2.29 -7.23 -0.63 -2.84 120.40 116.86 2nzu s VAL 8 Ca 0.03 1.03 0.18 0.00 -1.81 0.00 0.00 61.98 61.41 2nzu s VAL 8 Cb -0.13 -3.66 -0.26 0.00 0.56 0.00 0.00 36.38 32.89 2nzu s VAL 8 CO -0.09 0.02 0.18 1.07 -0.31 0.00 0.00 175.10 175.97 2nzu n THR 9 N 4.46 0.91 -1.64 5.32 5.66 0.38 -0.80 114.28 128.57 2nzu n THR 9 Ca 0.13 -0.70 -0.50 0.00 -3.05 0.00 0.00 64.05 59.93 2nzu n THR 9 Cb 0.43 -0.33 -0.05 0.00 -1.55 0.00 0.00 70.33 68.82 2nzu n THR 9 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2nzu n ALA 10 N -2.55 0.13 0.23 1.79 0.00 -0.91 -4.82 120.51 114.37 2nzu n ALA 10 Ca -0.23 0.46 0.07 0.00 0.00 0.00 0.00 53.44 53.75 2nzu n ALA 10 Cb 0.94 -2.22 0.54 0.00 0.00 0.00 0.00 19.45 18.71 2nzu n ALA 10 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2nzu h ASP 11 N 5.60 0.00 0.07 0.00 5.19 -1.93 -0.90 116.42 124.45 2nzu h ASP 11 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 2nzu h ASP 11 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.81 2nzu h ASP 11 CO 0.85 0.22 -0.07 -1.20 -3.12 0.00 0.00 179.24 175.92 2nzu n SER 12 N -3.94 1.22 0.00 6.45 7.64 -1.26 -4.55 113.62 119.18 2nzu n SER 12 Ca -0.02 -1.27 0.00 0.00 1.01 0.00 0.00 58.87 58.60 2nzu n SER 12 Cb 0.30 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 2nzu n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2nzu n GLY 13 N 1.21 0.30 3.44 0.23 0.00 -0.34 -4.10 105.19 105.93 2nzu n GLY 13 Ca 0.17 -0.95 -0.44 0.00 0.00 0.00 0.00 46.02 44.80 2nzu n GLY 13 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nzu s ILE 14 N 0.00 4.93 0.29 -0.61 1.01 -0.27 -4.83 121.20 121.72 2nzu s ILE 14 Ca 0.00 -2.06 -0.08 0.00 0.00 0.00 0.00 60.65 58.52 2nzu s ILE 14 Cb 0.00 -4.80 -0.00 0.00 0.01 0.00 0.00 42.46 37.67 2nzu s ILE 14 CO 0.00 -1.51 0.47 -1.00 0.00 0.00 0.00 174.94 172.90 2nzu s HIS 15 N 2.02 0.72 0.00 3.97 3.76 -1.26 -4.45 115.29 120.04 2nzu s HIS 15 Ca 0.35 -1.03 0.00 0.00 -0.15 0.00 0.00 55.06 54.23 2nzu s HIS 15 Cb -0.05 0.05 0.00 0.00 1.11 0.00 0.00 32.58 33.69 2nzu s HIS 15 CO -0.06 -1.06 0.00 0.00 -0.85 0.00 0.00 174.74 172.77 2nzu n ALA 16 N -0.46 0.00 -0.28 -1.40 0.00 -1.26 -2.44 120.51 114.67 2nzu n ALA 16 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.52 2nzu n ALA 16 Cb 0.62 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.29 2nzu n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nzu h ARG 17 N 0.00 0.17 0.00 0.00 3.08 -2.00 0.50 114.38 116.13 2nzu h ARG 17 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2nzu h ARG 17 Cb 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2nzu h ARG 17 CO 0.00 0.11 0.00 -1.35 -1.07 0.00 0.00 179.97 177.66 2nzu h PRO 18 N 0.18 0.00 0.05 0.04 0.11 -1.95 0.32 132.00 130.75 2nzu h PRO 18 Ca 0.48 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 66.29 2nzu h PRO 18 Cb 0.90 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 2nzu h PRO 18 CO -0.64 0.00 -1.64 0.00 -0.21 0.00 0.00 178.00 175.50 2nzu h ALA 19 N 2.00 0.54 0.00 -0.75 0.00 0.30 -2.85 119.26 118.50 2nzu h ALA 19 Ca 0.00 -1.31 -0.11 0.00 0.00 0.00 0.00 54.91 53.50 2nzu h ALA 19 Cb 0.02 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2nzu h ALA 19 CO 0.00 1.39 -0.50 1.15 0.00 0.00 0.00 179.25 181.29 2nzu h THR 20 N 0.03 1.30 -0.16 0.00 2.02 0.12 -2.15 112.91 114.07 2nzu h THR 20 Ca -0.27 -1.75 -0.17 0.00 0.77 0.00 0.00 66.41 64.98 2nzu h THR 20 Cb 1.99 1.96 0.01 0.00 -1.74 0.00 0.00 68.15 70.37 2nzu h THR 20 CO 0.11 0.49 -0.57 0.74 0.37 0.00 0.00 175.52 176.66 2nzu h THR 21 N 0.00 1.32 0.00 3.16 2.02 -0.56 -1.14 112.91 117.71 2nzu h THR 21 Ca -0.01 -1.81 -0.07 0.00 0.77 0.00 0.00 66.41 65.29 2nzu h THR 21 Cb 0.92 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 69.30 2nzu h THR 21 CO 0.07 0.56 -0.34 0.25 0.37 0.00 0.00 175.52 176.43 2nzu h LEU 22 N 0.36 0.00 0.04 2.58 5.85 -1.35 -1.56 115.31 121.23 2nzu h LEU 22 Ca -0.02 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2nzu h LEU 22 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2nzu h LEU 22 CO 0.12 0.34 -0.02 0.58 -0.34 0.00 0.00 178.44 179.12 2nzu h VAL 23 N 0.00 1.35 -0.64 1.05 2.07 -1.33 -2.88 116.25 115.86 2nzu h VAL 23 Ca -0.00 -1.56 0.13 0.00 0.82 0.00 0.00 66.70 66.09 2nzu h VAL 23 Cb 0.68 2.34 -0.12 0.00 -1.52 0.00 0.00 31.29 32.67 2nzu h VAL 23 CO 0.04 0.38 -0.11 -0.61 0.02 0.00 0.00 177.57 177.29 2nzu h GLN 24 N -0.78 0.03 0.39 1.57 5.75 -1.03 -1.04 115.11 120.01 2nzu h GLN 24 Ca -0.01 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 2nzu h GLN 24 Cb 0.66 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.19 2nzu h GLN 24 CO 0.01 0.02 -0.26 0.00 -2.65 0.00 0.00 178.83 175.94 2nzu h ALA 25 N 1.63 -0.64 -0.31 3.38 0.00 -1.34 -2.61 119.26 119.37 2nzu h ALA 25 Ca 0.32 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2nzu h ALA 25 Cb 0.51 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2nzu h ALA 25 CO -0.63 -0.88 0.21 0.00 0.00 0.00 0.00 179.25 177.95 2nzu h ALA 26 N -0.09 1.79 0.00 0.00 0.00 -1.22 -1.83 119.26 117.91 2nzu h ALA 26 Ca -0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2nzu h ALA 26 Cb 0.54 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2nzu h ALA 26 CO 0.02 0.19 -0.02 0.77 0.00 0.00 0.00 179.25 180.21 2nzu h SER 27 N 0.41 0.00 0.00 0.00 0.02 -0.82 -2.77 113.55 110.39 2nzu h SER 27 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2nzu h SER 27 Cb -0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.51 2nzu h SER 27 CO -0.03 0.02 0.00 0.29 -1.14 0.00 0.00 176.83 175.98 2nzu n LYS 28 N -3.18 0.94 -4.77 3.45 5.02 -0.69 -4.85 118.16 114.09 2nzu n LYS 28 Ca -0.01 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.94 2nzu n LYS 28 Cb 0.20 -1.13 -0.07 0.00 -0.02 0.00 0.00 35.03 34.01 2nzu n LYS 28 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2nzu s PHE 29 N -1.73 1.83 -0.20 2.13 0.08 -1.05 -5.07 117.98 113.97 2nzu s PHE 29 Ca 0.00 -0.97 0.04 0.00 0.12 0.00 0.00 56.93 56.12 2nzu s PHE 29 Cb 0.00 -1.60 -0.15 0.00 -0.57 0.00 0.00 43.02 40.70 2nzu s PHE 29 CO 0.00 0.22 -0.14 -0.25 -0.10 0.00 0.00 175.22 174.95 2nzu n ASP 30 N -1.28 2.14 -3.68 1.36 10.43 -1.26 -5.02 116.55 119.24 2nzu n ASP 30 Ca -0.20 -0.09 -0.24 0.00 2.57 0.00 0.00 54.79 56.83 2nzu n ASP 30 Cb 0.67 -0.10 0.20 0.00 1.84 0.00 0.00 41.12 43.73 2nzu n ASP 30 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 2nzu n SER 31 N -3.01 -3.15 -4.24 -2.24 7.64 -1.26 -4.87 113.62 102.49 2nzu n SER 31 Ca -0.35 -0.47 -0.39 0.00 1.01 0.00 0.00 58.87 58.67 2nzu n SER 31 Cb 0.92 -0.90 -0.10 0.00 -1.01 0.00 0.00 64.21 63.11 2nzu n SER 31 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2nzu s ASP 32 N -2.29 5.55 -0.15 6.43 1.11 0.91 -4.84 116.67 123.39 2nzu s ASP 32 Ca 0.50 -1.60 -0.13 0.00 0.18 0.00 0.00 52.55 51.50 2nzu s ASP 32 Cb -0.10 -1.95 -0.05 0.00 1.07 0.00 0.00 42.92 41.89 2nzu s ASP 32 CO 0.48 -0.54 0.28 -0.63 1.18 0.00 0.00 175.17 175.93 2nzu s ILE 33 N 1.37 5.31 0.23 0.77 1.09 -1.25 -1.88 121.20 126.83 2nzu s ILE 33 Ca 0.03 0.51 0.04 0.00 -1.10 0.00 0.00 60.65 60.14 2nzu s ILE 33 Cb -0.23 -3.60 -0.05 0.00 -1.06 0.00 0.00 42.46 37.51 2nzu s ILE 33 CO 0.01 0.43 -0.01 0.20 -0.10 0.00 0.00 174.94 175.46 2nzu s ASN 34 N 0.18 1.89 -0.11 3.58 0.01 -0.23 -1.71 114.94 118.55 2nzu s ASN 34 Ca 0.16 -1.20 0.03 0.00 -0.71 0.00 0.00 52.86 51.14 2nzu s ASN 34 Cb -0.13 -0.00 0.01 0.00 0.41 0.00 0.00 41.25 41.53 2nzu s ASN 34 CO 0.04 -0.49 -0.21 -0.22 -1.51 0.00 0.00 177.10 174.71 2nzu s LEU 35 N -3.31 2.00 -0.22 0.60 2.96 0.77 -0.98 118.68 120.50 2nzu s LEU 35 Ca 0.28 -0.53 -0.06 0.00 -0.22 0.00 0.00 54.13 53.59 2nzu s LEU 35 Cb 0.05 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.39 2nzu s LEU 35 CO 0.08 0.10 0.03 -0.70 -1.32 0.00 0.00 176.35 174.55 2nzu s GLU 36 N 0.61 3.63 -0.15 1.98 -6.30 -0.53 -1.00 118.70 116.94 2nzu s GLU 36 Ca -0.13 -0.50 -0.07 0.00 -2.50 0.00 0.00 54.97 51.77 2nzu s GLU 36 Cb -0.17 -3.19 0.06 0.00 0.00 0.00 0.00 34.13 30.83 2nzu s GLU 36 CO 0.04 -0.08 0.35 0.12 0.02 0.00 0.00 175.26 175.71 2nzu s PHE 37 N 1.28 -0.53 -0.93 5.30 2.19 0.13 -1.52 117.98 123.91 2nzu s PHE 37 Ca 0.04 1.14 0.00 0.00 0.33 0.00 0.00 56.93 58.44 2nzu s PHE 37 Cb -0.15 0.18 0.00 0.00 -1.31 0.00 0.00 43.02 41.75 2nzu s PHE 37 CO 0.02 -0.33 0.00 -1.71 1.83 0.00 0.00 175.22 175.03 2nzu n ASN 38 N 4.45 -3.51 0.00 6.13 5.15 -1.26 0.35 115.26 126.57 2nzu n ASN 38 Ca -0.21 0.24 0.00 0.00 -0.60 0.00 0.00 54.58 54.00 2nzu n ASN 38 Cb 0.54 -3.01 0.00 0.00 -0.53 0.00 0.00 39.78 36.77 2nzu n ASN 38 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2nzu n GLY 39 N -0.75 0.57 2.95 8.20 0.00 -1.26 -5.06 105.19 109.85 2nzu n GLY 39 Ca -0.13 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 44.85 2nzu n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nzu s LYS 40 N -1.94 1.34 -0.09 1.61 1.02 0.16 -5.14 119.74 116.70 2nzu s LYS 40 Ca 0.00 -0.27 0.01 0.00 0.02 0.00 0.00 55.97 55.73 2nzu s LYS 40 Cb 0.00 -1.22 -0.02 0.00 -0.52 0.00 0.00 37.83 36.06 2nzu s LYS 40 CO 0.00 -0.06 -0.12 0.99 -0.92 0.00 0.00 175.35 175.24 2nzu s THR 41 N 0.94 3.22 0.19 2.17 2.01 -1.25 0.21 115.64 123.13 2nzu s THR 41 Ca -0.10 -0.64 0.01 0.00 0.31 0.00 0.00 61.69 61.27 2nzu s THR 41 Cb -0.15 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.00 2nzu s THR 41 CO 0.00 0.56 0.06 -0.69 -0.69 0.00 0.00 174.62 173.86 2nzu s VAL 42 N -0.24 0.41 -0.42 3.82 1.01 -0.17 -4.92 120.40 119.89 2nzu s VAL 42 Ca 0.02 -1.97 -0.29 0.00 0.00 0.00 0.00 61.98 59.74 2nzu s VAL 42 Cb -0.13 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 33.98 2nzu s VAL 42 CO 0.03 -0.28 1.12 0.21 0.00 0.00 0.00 175.10 176.18 2nzu s ASN 43 N -3.18 6.74 0.00 3.32 2.47 -1.26 -0.16 114.94 122.86 2nzu s ASN 43 Ca 0.30 0.70 0.04 0.00 0.42 0.00 0.00 52.86 54.32 2nzu s ASN 43 Cb 0.07 -2.55 0.22 0.00 -1.45 0.00 0.00 41.25 37.54 2nzu s ASN 43 CO 0.07 -1.12 0.83 -0.11 -3.72 0.00 0.00 177.10 173.05 2nzu n LEU 44 N 7.51 0.00 -3.68 3.21 -0.00 -0.69 -4.47 117.00 118.88 2nzu n LEU 44 Ca 0.12 0.13 -0.40 0.00 -0.00 0.00 0.00 56.01 55.86 2nzu n LEU 44 Cb 0.48 -0.13 0.01 0.00 -0.00 0.00 0.00 43.42 43.78 2nzu n LEU 44 CO 0.67 -0.12 1.28 0.29 -0.00 0.00 0.00 177.39 179.51 2nzu n LYS 45 N -1.13 5.07 0.04 1.96 5.02 -1.26 -4.38 118.16 123.48 2nzu n LYS 45 Ca 0.02 -4.66 0.00 0.00 -2.02 0.00 0.00 58.31 51.66 2nzu n LYS 45 Cb 0.02 -2.46 0.00 0.00 -0.02 0.00 0.00 35.03 32.57 2nzu n LYS 45 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2nzu n ILE 47 N 0.25 0.32 -0.11 -0.18 2.08 -1.26 -4.90 119.36 115.55 2nzu n ILE 47 Ca 0.41 0.11 -0.07 0.00 0.56 0.00 0.00 62.75 63.75 2nzu n ILE 47 Cb 0.29 -1.11 0.01 0.00 -0.75 0.00 0.00 39.64 38.07 2nzu n ILE 47 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 2nzu h MET 48 N 0.00 0.43 0.65 0.38 2.86 -1.97 0.78 114.93 118.06 2nzu h MET 48 Ca 0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 2nzu h MET 48 Cb 0.33 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 2nzu h MET 48 CO 0.00 0.29 -0.38 0.78 1.06 0.00 0.00 176.91 178.65 2nzu h GLY 49 N 0.44 -1.04 0.75 8.32 0.00 -1.98 0.95 103.07 110.51 2nzu h GLY 49 Ca 0.15 0.42 0.06 0.00 0.00 0.00 0.00 47.33 47.96 2nzu h GLY 49 CO -0.07 -0.37 0.59 -2.08 0.00 0.00 0.00 176.54 174.60 2nzu h VAL 50 N -0.97 1.08 0.00 4.60 2.07 -1.75 -2.21 116.25 119.06 2nzu h VAL 50 Ca -0.08 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2nzu h VAL 50 Cb 0.78 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2nzu h VAL 50 CO 0.09 0.20 0.00 0.23 0.02 0.00 0.00 177.57 178.11 2nzu n MET 51 N -4.56 0.22 0.00 1.57 2.81 0.25 -3.17 117.12 114.24 2nzu n MET 51 Ca 0.13 0.18 0.14 0.00 -1.81 0.00 0.00 57.70 56.34 2nzu n MET 51 Cb 0.17 -1.75 0.57 0.00 -0.71 0.00 0.00 33.22 31.49 2nzu n MET 51 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2nzu n SER 52 N -2.13 0.08 0.05 7.83 3.41 0.31 -3.38 113.62 119.79 2nzu n SER 52 Ca 0.06 0.39 -0.02 0.00 -0.26 0.00 0.00 58.87 59.04 2nzu n SER 52 Cb 0.41 -0.39 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 2nzu n SER 52 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2nzu h LEU 53 N 0.00 0.00 -2.97 1.04 3.38 -1.53 -3.49 115.31 111.73 2nzu h LEU 53 Ca 0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2nzu h LEU 53 Cb 0.50 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.28 2nzu h LEU 53 CO 0.00 0.68 -0.56 0.61 0.09 0.00 0.00 178.44 179.26 2nzu n GLY 54 N 1.38 -1.22 3.55 0.83 0.00 -1.22 -4.87 105.19 103.64 2nzu n GLY 54 Ca -0.07 0.52 -0.43 0.00 0.00 0.00 0.00 46.02 46.04 2nzu n GLY 54 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nzu s ILE 55 N -3.10 4.30 0.91 -0.61 1.01 -1.26 -5.03 121.20 117.42 2nzu s ILE 55 Ca 0.11 0.60 -0.15 0.00 0.00 0.00 0.00 60.65 61.22 2nzu s ILE 55 Cb -0.03 -4.57 0.16 0.00 0.01 0.00 0.00 42.46 38.02 2nzu s ILE 55 CO 0.82 -1.11 1.26 0.00 0.00 0.00 0.00 174.94 175.91 2nzu s GLN 56 N 4.20 1.09 0.31 2.79 -2.07 -1.26 -1.12 119.66 123.61 2nzu s GLN 56 Ca 0.36 -0.19 -0.29 0.00 -1.82 0.00 0.00 55.36 53.43 2nzu s GLN 56 Cb -0.10 -1.88 -0.10 0.00 -1.09 0.00 0.00 33.01 29.84 2nzu s GLN 56 CO 0.23 -2.14 1.16 0.21 -1.32 0.00 0.00 175.29 173.43 2nzu s LYS 57 N -5.75 4.48 0.00 9.60 2.20 -1.26 -3.32 119.74 125.69 2nzu s LYS 57 Ca 0.69 1.91 0.00 0.00 -0.36 0.00 0.00 55.97 58.21 2nzu s LYS 57 Cb -0.07 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 2nzu s LYS 57 CO 0.52 0.03 0.00 0.41 -0.36 0.00 0.00 175.35 175.95 2nzu n GLY 58 N 0.99 1.34 3.79 5.54 0.00 0.02 -5.01 105.19 111.86 2nzu n GLY 58 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2nzu n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nzu s ALA 59 N -2.34 2.31 -0.17 4.61 0.00 -1.21 -4.70 121.76 120.26 2nzu s ALA 59 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 51.96 52.00 2nzu s ALA 59 Cb 0.00 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.91 2nzu s ALA 59 CO 0.00 -1.65 -0.07 0.95 0.00 0.00 0.00 175.76 174.99 2nzu s THR 60 N -3.01 3.43 0.19 0.00 -4.23 -1.26 -1.60 115.64 109.16 2nzu s THR 60 Ca 0.60 -0.51 0.08 0.00 -1.18 0.00 0.00 61.69 60.68 2nzu s THR 60 Cb -0.16 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 2nzu s THR 60 CO 0.55 0.48 -0.15 0.27 -0.54 0.00 0.00 174.62 175.23 2nzu s ILE 61 N 0.77 1.71 -0.24 2.99 -4.36 -0.68 -4.51 121.20 116.89 2nzu s ILE 61 Ca -0.03 -2.10 -0.03 0.00 -0.26 0.00 0.00 60.65 58.23 2nzu s ILE 61 Cb -0.15 -1.95 0.08 0.00 1.25 0.00 0.00 42.46 41.69 2nzu s ILE 61 CO 0.02 -0.52 0.08 -0.89 0.24 0.00 0.00 174.94 173.87 2nzu s THR 62 N -2.70 0.37 -0.05 8.37 2.01 -0.58 -0.75 115.64 122.31 2nzu s THR 62 Ca 0.20 -0.74 -0.27 0.00 0.31 0.00 0.00 61.69 61.18 2nzu s THR 62 Cb -0.02 -1.10 -0.03 0.00 0.01 0.00 0.00 72.50 71.36 2nzu s THR 62 CO 0.06 -0.45 0.87 0.27 -0.69 0.00 0.00 174.62 174.69 2nzu s ILE 63 N 1.90 4.92 0.15 1.82 -4.36 -0.73 -1.45 121.20 123.45 2nzu s ILE 63 Ca 0.04 1.81 0.09 0.00 -0.26 0.00 0.00 60.65 62.34 2nzu s ILE 63 Cb -0.17 -4.21 -0.04 0.00 1.25 0.00 0.00 42.46 39.29 2nzu s ILE 63 CO -0.19 0.17 -0.17 -0.94 0.24 0.00 0.00 174.94 174.05 2nzu s SER 64 N 0.96 3.91 -0.03 4.36 1.04 -0.16 -1.96 113.70 121.83 2nzu s SER 64 Ca 0.46 -0.62 0.01 0.00 0.48 0.00 0.00 55.95 56.27 2nzu s SER 64 Cb -0.19 -0.54 0.01 0.00 0.10 0.00 0.00 66.02 65.40 2nzu s SER 64 CO 0.22 0.15 -0.03 0.00 0.98 0.00 0.00 173.24 174.56 2nzu s ALA 65 N -1.40 0.48 -0.28 5.32 0.00 -0.53 -1.07 121.76 124.28 2nzu s ALA 65 Ca 0.20 -0.04 -0.04 0.00 0.00 0.00 0.00 51.96 52.09 2nzu s ALA 65 Cb -0.10 -0.28 0.09 0.00 0.00 0.00 0.00 23.12 22.84 2nzu s ALA 65 CO 0.12 0.01 0.12 -1.21 0.00 0.00 0.00 175.76 174.80 2nzu s GLU 66 N 0.59 0.23 0.00 0.00 0.41 -0.79 -4.72 118.70 114.42 2nzu s GLU 66 Ca -0.07 -0.52 0.00 0.00 -0.41 0.00 0.00 54.97 53.97 2nzu s GLU 66 Cb -0.10 -1.32 0.00 0.00 -1.78 0.00 0.00 34.13 30.93 2nzu s GLU 66 CO -0.00 -0.97 0.00 0.41 -0.49 0.00 0.00 175.26 174.20 2nzu n GLY 67 N 5.22 -1.27 0.00 -1.39 0.00 -1.26 -0.06 105.19 106.42 2nzu n GLY 67 Ca -0.06 -0.88 0.09 0.00 0.00 0.00 0.00 46.02 45.17 2nzu n GLY 67 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2nzu n SER 68 N 0.40 0.00 -2.58 1.61 3.41 -1.26 -3.30 113.62 111.91 2nzu n SER 68 Ca 0.00 0.43 -0.07 0.00 -0.26 0.00 0.00 58.87 58.96 2nzu n SER 68 Cb 0.00 -0.47 0.04 0.00 -0.26 0.00 0.00 64.21 63.52 2nzu n SER 68 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2nzu n ASP 69 N -1.47 2.61 0.00 4.04 5.75 -1.26 -4.97 116.55 121.26 2nzu n ASP 69 Ca 0.05 -2.56 0.00 0.00 -0.01 0.00 0.00 54.79 52.27 2nzu n ASP 69 Cb 0.21 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.86 2nzu n ASP 69 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2nzu n GLU 70 N -0.63 0.00 -0.29 0.11 1.02 -1.21 -1.20 120.64 118.44 2nzu n GLU 70 Ca 0.18 0.73 0.22 0.00 -0.02 0.00 0.00 57.16 58.28 2nzu n GLU 70 Cb 0.85 -1.48 0.51 0.00 -0.02 0.00 0.00 31.44 31.31 2nzu n GLU 70 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2nzu h ALA 71 N -1.51 2.25 -0.19 0.62 0.00 -1.93 0.93 119.26 119.43 2nzu h ALA 71 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2nzu h ALA 71 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2nzu h ALA 71 CO 0.00 -0.60 -0.05 -0.44 0.00 0.00 0.00 179.25 178.16 2nzu h ASP 72 N 0.39 0.37 0.59 0.00 3.32 -1.89 0.79 116.42 120.00 2nzu h ASP 72 Ca 0.54 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 2nzu h ASP 72 Cb 1.39 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 40.85 2nzu h ASP 72 CO -0.24 0.66 -0.28 0.00 -1.72 0.00 0.00 179.24 177.66 2nzu h ALA 73 N 0.72 -0.79 -0.90 3.45 0.00 0.35 0.10 119.26 122.20 2nzu h ALA 73 Ca 0.05 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.89 2nzu h ALA 73 Cb 0.50 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 2nzu h ALA 73 CO 0.02 -0.87 0.58 1.25 0.00 0.00 0.00 179.25 180.22 2nzu h LEU 74 N -0.93 0.71 -0.02 0.00 5.85 -0.92 0.11 115.31 120.10 2nzu h LEU 74 Ca -0.08 0.04 -0.26 0.00 0.84 0.00 0.00 57.88 58.42 2nzu h LEU 74 Cb 0.65 -0.10 0.02 0.00 0.37 0.00 0.00 40.66 41.60 2nzu h LEU 74 CO 0.13 0.37 -1.02 0.00 -0.34 0.00 0.00 178.44 177.59 2nzu h ALA 75 N 1.59 0.16 -0.32 1.25 0.00 -0.73 -2.09 119.26 119.11 2nzu h ALA 75 Ca 0.44 -0.69 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 2nzu h ALA 75 Cb 0.64 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2nzu h ALA 75 CO -0.21 0.69 -0.19 0.00 0.00 0.00 0.00 179.25 179.54 2nzu h ALA 76 N 0.43 1.07 -0.09 0.00 0.00 -0.23 -2.24 119.26 118.20 2nzu h ALA 76 Ca -0.12 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.28 2nzu h ALA 76 Cb 1.67 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 2nzu h ALA 76 CO 0.20 0.57 -0.71 -0.07 0.00 0.00 0.00 179.25 179.24 2nzu h LEU 77 N 0.53 0.49 -1.41 0.00 3.38 -0.83 -0.75 115.31 116.71 2nzu h LEU 77 Ca 0.08 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 2nzu h LEU 77 Cb 0.63 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2nzu h LEU 77 CO 0.04 1.04 -0.29 -0.33 0.09 0.00 0.00 178.44 179.00 2nzu h GLU 78 N 0.28 0.01 -0.00 1.13 5.08 -1.16 0.64 114.58 120.57 2nzu h GLU 78 Ca -0.03 -0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.11 2nzu h GLU 78 Cb 1.28 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2nzu h GLU 78 CO 0.12 0.30 -0.94 0.22 -1.00 0.00 0.00 179.01 177.72 2nzu h ASP 79 N 0.01 0.52 0.15 1.42 1.82 -1.11 -3.04 116.42 116.20 2nzu h ASP 79 Ca -0.00 -0.42 -0.19 0.00 -0.39 0.00 0.00 57.03 56.03 2nzu h ASP 79 Cb 0.52 -0.16 -0.00 0.00 0.68 0.00 0.00 39.33 40.37 2nzu h ASP 79 CO 0.04 1.22 -0.73 0.74 -1.61 0.00 0.00 179.24 178.89 2nzu h THR 80 N 0.23 1.35 -0.30 2.25 2.02 -0.26 0.66 112.91 118.86 2nzu h THR 80 Ca -0.08 -2.08 0.06 0.00 0.77 0.00 0.00 66.41 65.08 2nzu h THR 80 Cb 1.57 2.06 -0.06 0.00 -1.74 0.00 0.00 68.15 69.98 2nzu h THR 80 CO 0.16 0.63 -0.10 -0.03 0.37 0.00 0.00 175.52 176.56 2nzu h MET 81 N 0.35 -0.04 0.04 6.66 1.85 0.30 0.96 114.93 125.05 2nzu h MET 81 Ca -0.03 0.00 -0.26 0.00 -0.61 0.00 0.00 59.70 58.79 2nzu h MET 81 Cb 1.32 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 33.33 2nzu h MET 81 CO 0.13 -0.02 -1.37 0.66 -0.40 0.00 0.00 176.91 175.91 2nzu h SER 82 N -0.04 0.14 -0.16 1.39 4.64 -1.54 0.20 113.55 118.18 2nzu h SER 82 Ca 0.15 -0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 2nzu h SER 82 Cb 0.26 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2nzu h SER 82 CO -0.33 1.15 0.04 0.50 -0.87 0.00 0.00 176.83 177.33 2nzu h LYS 83 N 0.02 0.33 -0.13 4.77 1.63 -0.63 -1.58 116.57 120.99 2nzu h LYS 83 Ca -0.16 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.59 2nzu h LYS 83 Cb 1.92 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 33.49 2nzu h LYS 83 CO 0.13 0.32 0.00 0.39 -3.45 0.00 0.00 179.45 176.84 2nzu n GLU 84 N -4.39 2.14 -1.55 1.90 -0.58 0.31 -4.95 120.64 113.52 2nzu n GLU 84 Ca 0.00 -1.67 -0.16 0.00 -0.42 0.00 0.00 57.16 54.91 2nzu n GLU 84 Cb 0.16 -1.47 -0.06 0.00 -0.57 0.00 0.00 31.44 29.51 2nzu n GLU 84 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2nzu n GLY 85 N 1.32 1.38 0.10 0.62 0.00 -0.60 -4.90 105.19 103.11 2nzu n GLY 85 Ca 0.17 -0.28 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 2nzu n GLY 85 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nzu h LEU 86 N 0.00 0.25 0.00 0.99 3.38 -0.86 -3.09 115.31 115.97 2nzu h LEU 86 Ca -0.33 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.02 2nzu h LEU 86 Cb 1.05 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2nzu h LEU 86 CO 0.46 0.83 0.00 0.61 0.09 0.00 0.00 178.44 180.44 2nzu n GLY 87 N 0.62 -1.62 0.00 0.83 0.00 -1.08 0.14 105.19 104.08 2nzu n GLY 87 Ca -0.08 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.86 2nzu n GLY 87 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48