#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zr9 n PRO 29 N 0.00 -0.09 0.00 -0.67 -0.02 -1.26 -4.79 135.00 128.16 1zr9 n PRO 29 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.52 1zr9 n PRO 29 Cb 0.00 0.00 0.22 0.00 -0.02 0.00 0.00 33.50 33.70 1zr9 n PRO 29 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1zr9 n ASN 30 N -1.15 0.00 -1.95 2.55 5.15 -1.26 -4.81 115.26 113.79 1zr9 n ASN 30 Ca 0.00 -0.07 -0.11 0.00 -0.60 0.00 0.00 54.58 53.80 1zr9 n ASN 30 Cb 0.00 -0.12 0.04 0.00 -0.53 0.00 0.00 39.78 39.17 1zr9 n ASN 30 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1zr9 n ALA 31 N -1.12 -0.63 -3.54 5.20 0.00 -1.26 -4.99 120.51 114.16 1zr9 n ALA 31 Ca 0.05 0.17 -0.39 0.00 0.00 0.00 0.00 53.44 53.27 1zr9 n ALA 31 Cb 0.04 -2.72 -0.10 0.00 0.00 0.00 0.00 19.45 16.68 1zr9 n ALA 31 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1zr9 s GLU 32 N -5.53 2.39 -0.02 0.00 2.02 -1.26 -5.03 118.70 111.27 1zr9 s GLU 32 Ca 0.25 -1.68 0.00 0.00 0.02 0.00 0.00 54.97 53.56 1zr9 s GLU 32 Cb -0.11 -3.78 0.02 0.00 0.10 0.00 0.00 34.13 30.37 1zr9 s GLU 32 CO 0.34 -1.08 0.01 -0.06 0.02 0.00 0.00 175.26 174.48 1zr9 s PHE 33 N 1.32 0.16 -0.12 1.61 0.08 -1.26 -4.97 117.98 114.80 1zr9 s PHE 33 Ca 0.05 0.05 -0.29 0.00 0.12 0.00 0.00 56.93 56.86 1zr9 s PHE 33 Cb -0.24 -0.28 -0.01 0.00 -0.57 0.00 0.00 43.02 41.92 1zr9 s PHE 33 CO -0.01 -0.09 1.02 0.34 -0.10 0.00 0.00 175.22 176.38 1zr9 s ASP 34 N 0.87 7.21 0.00 1.36 -1.08 0.66 -4.92 116.67 120.76 1zr9 s ASP 34 Ca -0.08 1.53 0.29 0.00 -0.52 0.00 0.00 52.55 53.77 1zr9 s ASP 34 Cb -0.11 -2.55 1.20 0.00 -1.46 0.00 0.00 42.92 40.00 1zr9 s ASP 34 CO -0.02 -0.49 1.90 -0.81 0.52 0.00 0.00 175.17 176.27 1zr9 n PRO 35 N 5.21 0.03 -0.05 4.34 -0.05 -1.26 -3.43 135.00 139.80 1zr9 n PRO 35 Ca 0.09 -0.00 -0.11 0.00 -0.05 0.00 0.00 63.50 63.43 1zr9 n PRO 35 Cb 0.48 -1.50 -0.15 0.00 -0.05 0.00 0.00 33.50 32.29 1zr9 n PRO 35 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 1zr9 n ASP 36 N -1.48 0.78 -4.69 3.54 2.03 -1.26 -4.81 116.55 110.65 1zr9 n ASP 36 Ca 0.07 0.25 -0.39 0.00 0.52 0.00 0.00 54.79 55.24 1zr9 n ASP 36 Cb 0.33 0.17 -0.06 0.00 -0.72 0.00 0.00 41.12 40.84 1zr9 n ASP 36 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1zr9 s LEU 37 N -6.02 4.21 0.09 -2.67 2.01 -1.22 -5.01 118.68 110.08 1zr9 s LEU 37 Ca -0.09 0.78 -0.21 0.00 0.01 0.00 0.00 54.13 54.61 1zr9 s LEU 37 Cb 0.07 -2.74 -0.07 0.00 0.01 0.00 0.00 46.19 43.46 1zr9 s LEU 37 CO 0.81 -0.11 1.36 -0.65 1.01 0.00 0.00 176.35 178.77 1zr9 h PRO 38 N 7.11 -0.20 -2.26 1.29 0.11 -1.83 -1.78 132.00 134.43 1zr9 h PRO 38 Ca -0.37 0.01 -0.41 0.00 0.11 0.00 0.00 66.00 65.34 1zr9 h PRO 38 Cb 1.17 0.05 -0.08 0.00 0.11 0.00 0.00 31.00 32.24 1zr9 h PRO 38 CO 0.75 -0.13 0.91 0.41 -0.21 0.00 0.00 178.00 179.72 1zr9 n GLY 39 N -1.23 3.79 2.51 -0.55 0.00 -0.19 -4.53 105.19 105.00 1zr9 n GLY 39 Ca -0.02 -1.51 -0.20 0.00 0.00 0.00 0.00 46.02 44.29 1zr9 n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zr9 n GLY 40 N 2.24 1.42 2.66 -0.02 0.00 -0.96 -0.32 105.19 110.22 1zr9 n GLY 40 Ca 0.53 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.38 1zr9 n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zr9 n GLY 41 N -0.50 1.69 0.22 -0.02 0.00 -0.71 -0.25 105.19 105.62 1zr9 n GLY 41 Ca -0.21 -0.01 0.04 0.00 0.00 0.00 0.00 46.02 45.85 1zr9 n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1zr9 n LEU 42 N -2.01 1.21 -3.82 0.99 4.77 0.56 -4.88 117.00 113.83 1zr9 n LEU 42 Ca -0.18 -0.79 -0.30 0.00 -0.03 0.00 0.00 56.01 54.71 1zr9 n LEU 42 Cb 0.66 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.59 1zr9 n LEU 42 CO 0.27 0.25 -0.35 -1.00 -1.33 0.00 0.00 177.39 175.23 1zr9 s HIS 43 N -1.21 2.16 0.01 -1.77 3.76 -1.17 -5.02 115.29 112.04 1zr9 s HIS 43 Ca 0.08 -1.91 -0.03 0.00 -0.15 0.00 0.00 55.06 53.05 1zr9 s HIS 43 Cb 0.07 -1.87 -0.01 0.00 1.11 0.00 0.00 32.58 31.88 1zr9 s HIS 43 CO 0.21 -0.85 0.04 -0.98 -0.85 0.00 0.00 174.74 172.31 1zr9 s ARG 44 N 1.46 0.32 -0.33 1.40 3.03 -1.26 -1.66 118.95 121.91 1zr9 s ARG 44 Ca 0.07 -0.40 -0.15 0.00 2.03 0.00 0.00 55.73 57.28 1zr9 s ARG 44 Cb -0.18 0.12 -0.02 0.00 -1.03 0.00 0.00 34.95 33.85 1zr9 s ARG 44 CO -0.17 -0.06 0.37 0.00 -1.13 0.00 0.00 175.30 174.30 1zr9 h LEU 46 N 8.75 0.45 -2.21 0.00 4.07 -1.97 0.40 115.31 124.79 1zr9 h LEU 46 Ca -0.30 -0.18 -0.01 0.00 0.08 0.00 0.00 57.88 57.47 1zr9 h LEU 46 Cb 1.15 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.76 1zr9 h LEU 46 CO 0.69 0.77 -0.05 0.00 -1.08 0.00 0.00 178.44 178.77 1zr9 h ALA 47 N 1.26 1.15 -0.01 1.53 0.00 -1.96 -1.98 119.26 119.25 1zr9 h ALA 47 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1zr9 h ALA 47 Cb 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1zr9 h ALA 47 CO 0.06 0.06 -0.25 0.00 0.00 0.00 0.00 179.25 179.13 1zr9 n ALA 49 N -0.26 -0.54 -2.56 0.00 0.00 0.04 -4.93 120.51 112.27 1zr9 n ALA 49 Ca 0.05 0.17 -0.19 0.00 0.00 0.00 0.00 53.44 53.47 1zr9 n ALA 49 Cb 0.24 -1.69 -0.11 0.00 0.00 0.00 0.00 19.45 17.88 1zr9 n ALA 49 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1zr9 s ARG 50 N -4.40 0.97 -0.03 0.00 1.70 -1.19 -5.02 118.95 110.99 1zr9 s ARG 50 Ca 0.00 -1.15 0.01 0.00 -0.47 0.00 0.00 55.73 54.12 1zr9 s ARG 50 Cb 0.00 -0.93 -0.03 0.00 -0.57 0.00 0.00 34.95 33.42 1zr9 s ARG 50 CO 0.00 0.19 -0.01 0.71 -1.08 0.00 0.00 175.30 175.11 1zr9 s TYR 51 N -1.79 3.06 0.29 5.89 1.51 -1.26 -2.26 117.35 122.78 1zr9 s TYR 51 Ca 0.05 0.09 0.10 0.00 -1.01 0.00 0.00 57.07 56.30 1zr9 s TYR 51 Cb -0.07 -1.69 -0.05 0.00 -0.11 0.00 0.00 41.96 40.03 1zr9 s TYR 51 CO 0.03 0.44 -0.14 -0.06 -1.11 0.00 0.00 175.55 174.71 1zr9 s PHE 52 N -1.01 2.16 0.36 2.71 0.40 -0.66 -4.78 117.98 117.17 1zr9 s PHE 52 Ca 0.17 -0.48 0.10 0.00 -0.60 0.00 0.00 56.93 56.12 1zr9 s PHE 52 Cb -0.11 -1.09 0.69 0.00 0.51 0.00 0.00 43.02 43.02 1zr9 s PHE 52 CO 0.07 0.54 1.83 -0.84 0.70 0.00 0.00 175.22 177.53 1zr9 h ILE 53 N 2.25 1.24 -3.76 0.64 3.07 -1.85 -0.48 117.51 118.63 1zr9 h ILE 53 Ca -0.40 -1.15 -0.08 0.00 1.55 0.00 0.00 64.86 64.78 1zr9 h ILE 53 Cb 1.25 1.52 -0.10 0.00 -0.27 0.00 0.00 36.82 39.22 1zr9 h ILE 53 CO 0.65 0.34 -0.18 1.51 -1.05 0.00 0.00 178.15 179.42 1zr9 s ASP 54 N -6.91 -0.06 0.34 2.16 -4.77 -1.26 -3.95 116.67 102.22 1zr9 s ASP 54 Ca -0.04 -0.97 0.18 0.00 -3.30 0.00 0.00 52.55 48.41 1zr9 s ASP 54 Cb 0.15 0.56 0.43 0.00 -1.09 0.00 0.00 42.92 42.96 1zr9 s ASP 54 CO 0.74 -1.10 1.61 -1.28 0.70 0.00 0.00 175.17 175.84 1zr9 h SER 55 N 2.30 0.00 -0.10 2.11 0.87 -1.94 -2.73 113.55 114.06 1zr9 h SER 55 Ca -0.27 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.18 1zr9 h SER 55 Cb 1.25 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.20 1zr9 h SER 55 CO 0.38 0.42 -0.29 0.74 -0.53 0.00 0.00 176.83 177.54 1zr9 h THR 56 N 0.00 1.28 -0.76 2.23 2.02 -1.98 0.46 112.91 116.16 1zr9 h THR 56 Ca -0.00 -1.38 -0.02 0.00 0.77 0.00 0.00 66.41 65.77 1zr9 h THR 56 Cb 1.11 1.38 -0.04 0.00 -1.74 0.00 0.00 68.15 68.86 1zr9 h THR 56 CO 0.05 0.44 0.39 0.78 0.37 0.00 0.00 175.52 177.55 1zr9 h ASN 57 N 0.49 0.99 0.34 4.18 2.35 -1.91 0.64 115.58 122.66 1zr9 h ASN 57 Ca 0.06 -0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1zr9 h ASN 57 Cb 0.76 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1zr9 h ASN 57 CO 0.06 0.83 -0.17 -0.07 -1.65 0.00 0.00 177.43 176.43 1zr9 h LEU 58 N 1.07 -0.39 -0.76 1.61 -0.00 -1.15 -0.17 115.31 115.52 1zr9 h LEU 58 Ca 0.26 -0.05 0.10 0.00 -0.00 0.00 0.00 57.88 58.20 1zr9 h LEU 58 Cb 0.09 0.10 -0.08 0.00 -0.00 0.00 0.00 40.66 40.78 1zr9 h LEU 58 CO -0.04 -0.19 0.39 0.50 -0.00 0.00 0.00 178.44 179.10 1zr9 h LYS 59 N -0.57 0.62 -0.28 1.13 3.11 0.08 0.17 116.57 120.83 1zr9 h LYS 59 Ca -0.05 -0.04 -0.13 0.00 -2.81 0.00 0.00 60.65 57.63 1zr9 h LYS 59 Cb 0.42 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.50 1zr9 h LYS 59 CO 0.08 0.41 -0.34 1.15 -2.81 0.00 0.00 179.45 177.93 1zr9 h THR 60 N 0.64 1.29 -0.41 1.00 2.02 -0.82 -2.76 112.91 113.86 1zr9 h THR 60 Ca 0.38 -1.48 -0.02 0.00 0.77 0.00 0.00 66.41 66.05 1zr9 h THR 60 Cb 0.42 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 1zr9 h THR 60 CO -0.28 0.48 0.15 -0.74 0.37 0.00 0.00 175.52 175.49 1zr9 h HIS 61 N 0.53 0.57 -0.01 3.16 -0.00 0.99 -2.05 115.15 118.35 1zr9 h HIS 61 Ca 0.06 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 1zr9 h HIS 61 Cb 0.84 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 28.07 1zr9 h HIS 61 CO 0.04 0.46 -0.08 1.19 -0.00 0.00 0.00 177.93 179.54 1zr9 n PHE 62 N -4.37 0.00 0.30 5.26 3.72 0.38 -3.47 117.46 119.28 1zr9 n PHE 62 Ca 0.03 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.60 1zr9 n PHE 62 Cb 0.15 -0.10 0.77 0.00 -0.94 0.00 0.00 39.48 39.37 1zr9 n PHE 62 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1zr9 h ARG 63 N 0.99 0.00 -5.99 -1.08 3.08 -1.13 -3.41 114.38 106.84 1zr9 h ARG 63 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.51 1zr9 h ARG 63 Cb 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1zr9 h ARG 63 CO 0.00 0.00 1.43 -1.12 -1.07 0.00 0.00 179.97 179.21 1zr9 s SER 64 N -5.04 5.31 0.47 7.04 0.01 -1.23 -4.84 113.70 115.43 1zr9 s SER 64 Ca -0.00 1.20 0.15 0.00 1.31 0.00 0.00 55.95 58.60 1zr9 s SER 64 Cb 0.10 -2.52 1.10 0.00 0.21 0.00 0.00 66.02 64.91 1zr9 s SER 64 CO 0.43 -2.19 2.05 0.07 0.41 0.00 0.00 173.24 174.02 1zr9 h LYS 65 N 15.42 0.01 -0.02 12.44 5.09 -1.93 -1.77 116.57 145.80 1zr9 h LYS 65 Ca -0.32 -0.00 -0.12 0.00 0.09 0.00 0.00 60.65 60.30 1zr9 h LYS 65 Cb 1.21 -0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.52 1zr9 h LYS 65 CO 1.08 0.11 -0.57 0.22 -2.09 0.00 0.00 179.45 178.21 1zr9 h ASP 66 N 0.01 0.08 0.43 7.07 3.58 -1.94 -1.09 116.42 124.56 1zr9 h ASP 66 Ca 0.00 -0.04 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 1zr9 h ASP 66 Cb 0.19 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1zr9 h ASP 66 CO 0.01 0.63 -0.21 -0.74 -2.88 0.00 0.00 179.24 176.06 1zr9 h HIS 67 N 0.06 -0.54 0.00 0.28 2.76 -1.69 0.35 115.15 116.37 1zr9 h HIS 67 Ca -0.00 -0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.07 1zr9 h HIS 67 Cb 1.02 0.18 -0.01 0.00 1.55 0.00 0.00 27.41 30.15 1zr9 h HIS 67 CO 0.01 -0.22 -0.40 0.87 -1.30 0.00 0.00 177.93 176.89 1zr9 h LYS 68 N -0.90 0.00 -0.29 5.26 1.57 -1.51 -0.41 116.57 120.29 1zr9 h LYS 68 Ca -0.06 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1zr9 h LYS 68 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1zr9 h LYS 68 CO 0.10 0.40 0.18 -0.22 -0.57 0.00 0.00 179.45 179.34 1zr9 h LYS 69 N 0.00 0.39 -0.88 3.15 3.64 -1.09 -0.72 116.57 121.07 1zr9 h LYS 69 Ca -0.00 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1zr9 h LYS 69 Cb 0.73 -0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.41 1zr9 h LYS 69 CO 0.05 0.29 0.55 -0.09 -2.27 0.00 0.00 179.45 177.99 1zr9 h ARG 70 N 0.38 1.00 -0.36 1.90 9.65 0.11 -0.31 114.38 126.75 1zr9 h ARG 70 Ca 0.11 -0.06 -0.10 0.00 -1.10 0.00 0.00 59.98 58.82 1zr9 h ARG 70 Cb -0.00 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 28.34 1zr9 h ARG 70 CO -0.02 0.66 -0.17 -0.07 2.80 0.00 0.00 179.97 183.18 1zr9 h LEU 71 N 1.03 0.77 -0.79 3.80 3.38 -0.84 0.19 115.31 122.85 1zr9 h LEU 71 Ca 0.37 -0.40 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1zr9 h LEU 71 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1zr9 h LEU 71 CO -0.15 1.00 -0.52 0.07 0.09 0.00 0.00 178.44 178.93 1zr9 h LYS 72 N 0.54 0.00 -0.03 1.13 2.10 -0.65 -0.61 116.57 119.05 1zr9 h LYS 72 Ca 0.08 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.55 1zr9 h LYS 72 Cb 0.71 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.03 1zr9 h LYS 72 CO 0.05 0.52 -0.76 1.96 -2.00 0.00 0.00 179.45 179.22 1zr9 h GLN 73 N 0.00 0.23 0.00 0.07 1.08 -0.77 -2.95 115.11 112.76 1zr9 h GLN 73 Ca -0.01 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 56.99 1zr9 h GLN 73 Cb 1.04 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 1zr9 h GLN 73 CO 0.07 0.88 0.00 -0.07 -0.95 0.00 0.00 178.83 178.76 1zr9 h LEU 74 N 0.14 0.00 -9.98 1.46 3.38 -0.55 -3.45 115.31 106.31 1zr9 h LEU 74 Ca -0.03 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.41 1zr9 h LEU 74 Cb 1.34 0.00 0.10 0.00 0.09 0.00 0.00 40.66 42.19 1zr9 h LEU 74 CO 0.12 0.00 0.61 -0.44 0.09 0.00 0.00 178.44 178.82 1zr9 s SER 75 N -5.40 5.98 0.30 -0.43 0.01 -0.27 -4.90 113.70 109.00 1zr9 s SER 75 Ca 0.04 2.68 -0.01 0.00 1.31 0.00 0.00 55.95 59.98 1zr9 s SER 75 Cb 0.08 -2.64 0.47 0.00 0.21 0.00 0.00 66.02 64.15 1zr9 s SER 75 CO 0.55 -1.08 1.93 0.58 0.41 0.00 0.00 173.24 175.63 1zr9 h VAL 76 N 2.14 1.20 -3.57 3.43 2.07 -1.87 -3.36 116.25 116.29 1zr9 h VAL 76 Ca -0.50 -0.51 -0.63 0.00 0.82 0.00 0.00 66.70 65.88 1zr9 h VAL 76 Cb 1.26 0.28 -0.13 0.00 -1.52 0.00 0.00 31.29 31.19 1zr9 h VAL 76 CO 0.61 0.23 0.24 -1.83 0.02 0.00 0.00 177.57 176.84 1zr9 s GLU 77 N -5.63 3.57 -0.10 1.57 -1.05 -1.26 -4.93 118.70 110.87 1zr9 s GLU 77 Ca -0.11 0.01 0.01 0.00 -0.15 0.00 0.00 54.97 54.73 1zr9 s GLU 77 Cb 0.17 -3.86 0.15 0.00 -0.44 0.00 0.00 34.13 30.15 1zr9 s GLU 77 CO 0.79 -0.89 1.19 -0.35 0.95 0.00 0.00 175.26 176.95 1zr9 n PRO 78 N 6.31 1.30 -3.37 -4.83 -0.04 -1.26 -4.33 135.00 128.78 1zr9 n PRO 78 Ca 0.00 -0.67 -0.21 0.00 -0.04 0.00 0.00 63.50 62.58 1zr9 n PRO 78 Cb 0.48 -1.28 -0.09 0.00 -0.04 0.00 0.00 33.50 32.58 1zr9 n PRO 78 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1zr9 s TYR 79 N -0.76 0.10 -0.71 0.54 2.02 -1.26 -4.98 117.35 112.30 1zr9 s TYR 79 Ca 0.13 -1.22 0.02 0.00 -0.37 0.00 0.00 57.07 55.63 1zr9 s TYR 79 Cb 0.11 -0.58 0.17 0.00 -0.40 0.00 0.00 41.96 41.26 1zr9 s TYR 79 CO 0.02 -0.93 0.52 0.45 -1.57 0.00 0.00 175.55 174.05 1zr9 s SER 80 N 1.15 5.08 0.00 2.29 0.15 -1.26 -4.77 113.70 116.33 1zr9 s SER 80 Ca 0.19 -3.55 0.00 0.00 0.70 0.00 0.00 55.95 53.30 1zr9 s SER 80 Cb -0.15 -1.73 0.00 0.00 -1.71 0.00 0.00 66.02 62.42 1zr9 s SER 80 CO -0.03 -0.17 0.00 1.67 1.20 0.00 0.00 173.24 175.91 1zr9 n GLN 81 N 2.45 -0.51 0.00 5.44 7.27 -1.26 -4.68 117.38 126.09 1zr9 n GLN 81 Ca 0.16 0.13 0.10 0.00 0.07 0.00 0.00 57.00 57.46 1zr9 n GLN 81 Cb 0.35 -4.18 0.04 0.00 2.41 0.00 0.00 30.24 28.86 1zr9 n GLN 81 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1zr9 n GLU 82 N -1.31 1.64 -0.12 3.69 2.13 -1.26 -2.98 120.64 122.43 1zr9 n GLU 82 Ca 0.00 -1.29 -0.26 0.00 0.66 0.00 0.00 57.16 56.27 1zr9 n GLU 82 Cb 0.13 -1.39 -0.11 0.00 0.27 0.00 0.00 31.44 30.34 1zr9 n GLU 82 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1zr9 n GLU 83 N 0.51 0.59 -3.43 5.31 0.00 -1.26 -4.83 120.64 117.52 1zr9 n GLU 83 Ca 0.10 0.39 -0.24 0.00 0.00 0.00 0.00 57.16 57.41 1zr9 n GLU 83 Cb 0.46 -1.61 -0.11 0.00 0.00 0.00 0.00 31.44 30.18 1zr9 n GLU 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1zr9 s ALA 84 N -2.45 0.28 0.03 4.31 0.00 -1.26 -4.97 121.76 117.70 1zr9 s ALA 84 Ca -0.34 -1.27 -0.00 0.00 0.00 0.00 0.00 51.96 50.35 1zr9 s ALA 84 Cb 0.10 -1.73 -0.26 0.00 0.00 0.00 0.00 23.12 21.23 1zr9 s ALA 84 CO 0.55 -2.00 0.94 1.05 0.00 0.00 0.00 175.76 176.31 1zr9 h GLU 85 N 7.40 0.19 -4.59 0.00 4.11 -1.86 -3.40 114.58 116.43 1zr9 h GLU 85 Ca -0.01 -0.33 -0.73 0.00 0.07 0.00 0.00 59.36 58.36 1zr9 h GLU 85 Cb 1.02 0.12 -0.20 0.00 0.50 0.00 0.00 28.75 30.19 1zr9 h GLU 85 CO 0.28 1.06 0.88 0.50 0.07 0.00 0.00 179.01 181.79 1zr9 s ARG 86 N -2.63 3.85 -0.42 1.06 6.06 -1.26 -4.77 118.95 120.84 1zr9 s ARG 86 Ca -0.06 -2.33 0.04 0.00 -2.50 0.00 0.00 55.73 50.88 1zr9 s ARG 86 Cb 0.07 -4.86 0.19 0.00 0.06 0.00 0.00 34.95 30.41 1zr9 s ARG 86 CO 0.85 -1.64 0.74 0.00 -2.50 0.00 0.00 175.30 172.75 1zr9 s ALA 87 N 1.46 -2.74 -0.44 6.12 0.00 -1.26 -5.05 121.76 119.86 1zr9 s ALA 87 Ca 0.34 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.55 1zr9 s ALA 87 Cb -0.05 -2.79 0.22 0.00 0.00 0.00 0.00 23.12 20.49 1zr9 s ALA 87 CO -0.06 -2.28 0.93 0.00 0.00 0.00 0.00 175.76 174.35 1zr9 n ALA 88 N 3.85 -2.63 -2.70 0.00 0.00 -1.26 -5.14 120.51 112.62 1zr9 n ALA 88 Ca 0.12 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1zr9 n ALA 88 Cb 0.58 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.77 1zr9 n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zr9 n GLY 89 N 2.46 4.55 2.54 0.00 0.00 -1.26 -4.95 105.19 108.53 1zr9 n GLY 89 Ca 0.13 -0.52 -0.03 0.00 0.00 0.00 0.00 46.02 45.59 1zr9 n GLY 89 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1zr9 n MET 90 N 0.00 -1.13 -3.01 1.61 2.81 -1.26 -4.91 117.12 111.23 1zr9 n MET 90 Ca 0.00 0.47 -0.44 0.00 -1.81 0.00 0.00 57.70 55.92 1zr9 n MET 90 Cb 0.00 -4.41 0.00 0.00 -0.71 0.00 0.00 33.22 28.11 1zr9 n MET 90 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1zr9 n GLY 91 N -0.80 4.51 3.81 3.03 0.00 -1.26 -5.00 105.19 109.48 1zr9 n GLY 91 Ca -0.03 -2.46 -0.33 0.00 0.00 0.00 0.00 46.02 43.20 1zr9 n GLY 91 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zr9 s SER 92 N 0.37 6.52 -0.06 1.61 1.04 -1.26 -5.06 113.70 116.86 1zr9 s SER 92 Ca 0.34 1.79 0.06 0.00 0.48 0.00 0.00 55.95 58.62 1zr9 s SER 92 Cb -0.01 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.56 1zr9 s SER 92 CO 0.01 -0.66 -0.25 -0.47 0.98 0.00 0.00 173.24 172.86 1zr9 s TYR 93 N -2.18 2.44 -2.88 5.02 6.14 -1.26 -5.30 117.35 119.34 1zr9 s TYR 93 Ca 0.64 -0.74 0.25 0.00 0.64 0.00 0.00 57.07 57.86 1zr9 s TYR 93 Cb -0.13 -1.60 0.40 0.00 0.42 0.00 0.00 41.96 41.05 1zr9 s TYR 93 CO 0.21 -0.23 1.38 1.55 0.64 0.00 0.00 175.55 179.10