#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zzv n GLN 2 N 0.00 4.72 -3.82 0.00 1.13 0.13 -4.69 117.38 114.84 1zzv n GLN 2 Ca 0.00 -0.10 -0.12 0.00 -1.94 0.00 0.00 57.00 54.84 1zzv n GLN 2 Cb 0.00 -0.78 -0.11 0.00 0.11 0.00 0.00 30.24 29.46 1zzv n GLN 2 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1zzv s VAL 3 N -1.34 0.03 -0.36 5.09 -7.23 -0.73 -4.81 120.40 111.04 1zzv s VAL 3 Ca 0.02 -0.22 0.01 0.00 -1.81 0.00 0.00 61.98 59.99 1zzv s VAL 3 Cb 0.04 -0.35 0.11 0.00 0.56 0.00 0.00 36.38 36.74 1zzv s VAL 3 CO 0.19 -0.12 0.13 0.54 -0.31 0.00 0.00 175.10 175.53 1zzv s ASN 4 N -0.39 4.08 0.13 4.85 4.22 -1.26 -3.53 114.94 123.05 1zzv s ASN 4 Ca -0.05 -2.06 0.05 0.00 -2.14 0.00 0.00 52.86 48.66 1zzv s ASN 4 Cb -0.03 -1.09 -0.04 0.00 1.28 0.00 0.00 41.25 41.37 1zzv s ASN 4 CO 0.01 -0.36 -0.12 -0.63 -2.04 0.00 0.00 177.10 173.96 1zzv s ILE 5 N 1.06 1.21 0.33 0.54 1.01 -0.47 -5.00 121.20 119.89 1zzv s ILE 5 Ca 0.12 -1.88 -0.18 0.00 0.00 0.00 0.00 60.65 58.72 1zzv s ILE 5 Cb -0.20 -1.66 0.06 0.00 0.01 0.00 0.00 42.46 40.67 1zzv s ILE 5 CO -0.14 -0.60 0.86 0.00 0.00 0.00 0.00 174.94 175.06 1zzv s ALA 6 N -2.76 -0.99 -0.03 9.38 0.00 -1.26 -2.85 121.76 123.24 1zzv s ALA 6 Ca 0.12 -0.62 -0.39 0.00 0.00 0.00 0.00 51.96 51.07 1zzv s ALA 6 Cb -0.01 0.70 -0.19 0.00 0.00 0.00 0.00 23.12 23.62 1zzv s ALA 6 CO 0.02 -1.01 1.07 -2.30 0.00 0.00 0.00 175.76 173.53 1zzv n PRO 7 N -0.58 0.00 0.00 0.00 -0.02 -1.03 -4.15 135.00 129.22 1zzv n PRO 7 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1zzv n PRO 7 Cb 0.60 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 1zzv n PRO 7 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zzv n GLY 8 N 1.60 2.56 3.76 -1.23 0.00 -1.21 -4.99 105.19 105.68 1zzv n GLY 8 Ca 0.20 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 1zzv n GLY 8 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zzv s SER 9 N 0.00 6.43 0.45 1.61 1.04 -1.26 -0.81 113.70 121.16 1zzv s SER 9 Ca 0.00 2.94 0.11 0.00 0.48 0.00 0.00 55.95 59.48 1zzv s SER 9 Cb 0.00 -2.65 1.02 0.00 0.10 0.00 0.00 66.02 64.49 1zzv s SER 9 CO 0.00 -0.84 2.09 0.25 0.98 0.00 0.00 173.24 175.72 1zzv h LEU 10 N 3.93 0.28 -0.27 2.42 5.85 -0.99 -0.72 115.31 125.80 1zzv h LEU 10 Ca -0.49 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.29 1zzv h LEU 10 Cb 1.23 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 1zzv h LEU 10 CO 0.71 0.21 -0.29 -0.78 -0.34 0.00 0.00 178.44 177.95 1zzv h ASP 11 N 0.33 -0.93 0.14 1.25 1.82 -1.83 0.31 116.42 117.51 1zzv h ASP 11 Ca 0.09 0.16 -0.08 0.00 -0.39 0.00 0.00 57.03 56.80 1zzv h ASP 11 Cb -0.03 0.43 -0.01 0.00 0.68 0.00 0.00 39.33 40.39 1zzv h ASP 11 CO -0.02 -0.31 -0.29 0.50 -1.61 0.00 0.00 179.24 177.51 1zzv h LYS 12 N -0.28 0.25 0.36 0.28 3.64 -1.57 -1.74 116.57 117.51 1zzv h LYS 12 Ca 0.14 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1zzv h LYS 12 Cb 0.51 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1zzv h LYS 12 CO -0.43 0.53 -0.17 0.00 -2.27 0.00 0.00 179.45 177.10 1zzv h ALA 13 N 1.48 -0.48 -0.83 5.00 0.00 -0.33 0.15 119.26 124.23 1zzv h ALA 13 Ca 0.03 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1zzv h ALA 13 Cb 0.64 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 1zzv h ALA 13 CO 0.05 -0.67 0.53 -0.07 0.00 0.00 0.00 179.25 179.09 1zzv h LEU 14 N -0.70 0.85 -1.27 0.00 3.38 -0.95 -2.01 115.31 114.61 1zzv h LEU 14 Ca -0.05 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1zzv h LEU 14 Cb 0.49 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1zzv h LEU 14 CO 0.08 0.57 0.14 -1.13 0.09 0.00 0.00 178.44 178.18 1zzv h ASN 15 N 0.99 0.58 -0.31 -0.43 -1.24 -1.10 -1.41 115.58 112.67 1zzv h ASN 15 Ca 0.35 -0.08 -0.00 0.00 0.71 0.00 0.00 56.30 57.28 1zzv h ASN 15 Cb 0.08 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 1zzv h ASN 15 CO -0.14 0.56 0.18 -0.61 -1.29 0.00 0.00 177.43 176.13 1zzv h GLN 16 N 0.63 0.42 -0.11 6.67 -0.00 0.01 -2.90 115.11 119.83 1zzv h GLN 16 Ca 0.15 -0.04 -0.09 0.00 -0.00 0.00 0.00 58.65 58.67 1zzv h GLN 16 Cb 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.57 1zzv h GLN 16 CO -0.01 0.34 -0.34 -0.92 0.00 0.00 0.00 178.83 177.90 1zzv h TYR 17 N 0.38 0.24 -0.95 3.99 5.03 -0.94 -2.19 116.97 122.53 1zzv h TYR 17 Ca 0.11 -0.05 0.23 0.00 2.58 0.00 0.00 58.73 61.60 1zzv h TYR 17 Cb 0.03 -0.06 -0.07 0.00 1.55 0.00 0.00 36.73 38.18 1zzv h TYR 17 CO -0.04 0.53 0.63 0.00 -1.32 0.00 0.00 178.16 177.96 1zzv h ALA 18 N 1.47 2.28 0.00 1.82 0.00 -1.07 0.15 119.26 123.92 1zzv h ALA 18 Ca 0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1zzv h ALA 18 Cb 0.69 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1zzv h ALA 18 CO 0.05 -0.61 0.00 0.00 0.00 0.00 0.00 179.25 178.70 1zzv h ALA 19 N 1.60 1.00 0.21 0.00 0.00 -1.39 -1.31 119.26 119.37 1zzv h ALA 19 Ca 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.41 1zzv h ALA 19 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1zzv h ALA 19 CO -0.19 0.00 -0.11 1.25 0.00 0.00 0.00 179.25 180.20 1zzv h HIS 20 N 0.00 -0.27 -0.01 0.00 6.17 -0.84 -3.35 115.15 116.85 1zzv h HIS 20 Ca 0.00 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.07 1zzv h HIS 20 Cb 0.10 0.09 0.00 0.00 2.52 0.00 0.00 27.41 30.12 1zzv h HIS 20 CO 0.00 -0.17 -0.63 0.45 0.71 0.00 0.00 177.93 178.29 1zzv n SER 21 N -2.80 1.60 -2.12 3.26 2.88 -1.21 -4.99 113.62 110.24 1zzv n SER 21 Ca -0.04 -1.30 -0.09 0.00 -1.33 0.00 0.00 58.87 56.11 1zzv n SER 21 Cb 0.11 0.66 0.04 0.00 -0.75 0.00 0.00 64.21 64.28 1zzv n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1zzv n GLY 22 N 1.41 0.11 4.00 0.46 0.00 -0.50 -5.04 105.19 105.63 1zzv n GLY 22 Ca 0.07 -0.21 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 1zzv n GLY 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1zzv s PHE 23 N -3.17 2.77 -0.42 1.61 -0.71 -1.23 -5.06 117.98 111.77 1zzv s PHE 23 Ca 0.09 -0.42 -0.21 0.00 -1.04 0.00 0.00 56.93 55.36 1zzv s PHE 23 Cb -0.04 -2.36 0.02 0.00 -1.21 0.00 0.00 43.02 39.43 1zzv s PHE 23 CO 0.35 -0.41 0.64 0.99 -1.34 0.00 0.00 175.22 175.45 1zzv s THR 24 N -2.37 4.85 -0.19 -4.49 2.01 -1.26 -4.95 115.64 109.24 1zzv s THR 24 Ca 0.54 0.22 -0.17 0.00 0.31 0.00 0.00 61.69 62.60 1zzv s THR 24 Cb -0.09 -4.17 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 1zzv s THR 24 CO 0.33 -0.53 0.44 -0.22 -0.69 0.00 0.00 174.62 173.95 1zzv s LEU 25 N 2.79 4.17 -0.75 4.42 0.20 -1.26 -2.42 118.68 125.82 1zzv s LEU 25 Ca 0.23 0.60 -0.15 0.00 0.69 0.00 0.00 54.13 55.50 1zzv s LEU 25 Cb -0.14 -2.59 0.19 0.00 -0.43 0.00 0.00 46.19 43.22 1zzv s LEU 25 CO 0.18 -0.09 0.72 -0.44 -0.29 0.00 0.00 176.35 176.43 1zzv s SER 26 N 0.99 6.59 -0.03 3.68 0.01 -0.54 -4.97 113.70 119.43 1zzv s SER 26 Ca 0.21 -2.37 0.04 0.00 1.31 0.00 0.00 55.95 55.14 1zzv s SER 26 Cb -0.15 -2.23 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 1zzv s SER 26 CO 0.09 -0.70 -0.13 0.54 0.41 0.00 0.00 173.24 173.45 1zzv s VAL 27 N 0.79 3.17 -0.22 3.43 0.11 -1.26 -0.89 120.40 125.53 1zzv s VAL 27 Ca 0.15 -0.79 -0.12 0.00 -2.93 0.00 0.00 61.98 58.28 1zzv s VAL 27 Cb -0.15 -2.28 -0.05 0.00 -1.53 0.00 0.00 36.38 32.37 1zzv s VAL 27 CO -0.05 0.52 0.24 -0.62 -3.33 0.00 0.00 175.10 171.85 1zzv s ASP 28 N -0.97 6.24 -0.34 3.54 2.15 -1.26 -4.97 116.67 121.06 1zzv s ASP 28 Ca 0.13 0.27 -0.02 0.00 0.43 0.00 0.00 52.55 53.35 1zzv s ASP 28 Cb -0.11 -2.15 -0.03 0.00 -0.30 0.00 0.00 42.92 40.33 1zzv s ASP 28 CO 0.03 0.03 1.47 0.00 -0.17 0.00 0.00 175.17 176.52 1zzv n ALA 29 N 4.27 2.64 0.00 3.66 0.00 -1.26 -1.63 120.51 128.19 1zzv n ALA 29 Ca -0.13 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1zzv n ALA 29 Cb 0.52 -2.63 0.00 0.00 0.00 0.00 0.00 19.45 17.33 1zzv n ALA 29 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1zzv n SER 30 N 4.27 0.00 0.08 0.00 2.88 -1.26 -4.97 113.62 114.63 1zzv n SER 30 Ca 0.19 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.61 1zzv n SER 30 Cb 0.10 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.50 1zzv n SER 30 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1zzv h LEU 31 N 0.00 0.33 -2.00 2.46 3.38 -1.73 -3.10 115.31 114.66 1zzv h LEU 31 Ca 0.00 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1zzv h LEU 31 Cb 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1zzv h LEU 31 CO 0.00 1.14 0.00 0.35 0.09 0.00 0.00 178.44 180.02 1zzv n THR 32 N -3.62 0.98 -2.28 0.22 -2.24 -1.25 -4.86 114.28 101.23 1zzv n THR 32 Ca -0.05 -0.70 -0.43 0.00 -2.27 0.00 0.00 64.05 60.60 1zzv n THR 32 Cb 0.87 0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 69.17 1zzv n THR 32 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1zzv s ARG 33 N -1.62 3.81 0.00 -0.78 3.52 -1.17 -2.47 118.95 120.24 1zzv s ARG 33 Ca 0.32 1.37 0.00 0.00 -0.13 0.00 0.00 55.73 57.29 1zzv s ARG 33 Cb 0.19 -3.97 0.00 0.00 -1.56 0.00 0.00 34.95 29.62 1zzv s ARG 33 CO 0.17 -1.26 0.00 0.41 -0.81 0.00 0.00 175.30 173.81 1zzv n GLY 34 N 4.57 0.53 3.46 8.12 0.00 -1.26 -5.04 105.19 115.57 1zzv n GLY 34 Ca 0.17 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 1zzv n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zzv s LYS 35 N -1.80 3.66 -0.00 1.61 3.01 -1.03 -5.06 119.74 120.12 1zzv s LYS 35 Ca 0.00 -0.49 0.03 0.00 -1.01 0.00 0.00 55.97 54.50 1zzv s LYS 35 Cb 0.00 -3.15 -0.01 0.00 -1.01 0.00 0.00 37.83 33.66 1zzv s LYS 35 CO 0.00 -0.01 -0.11 -1.14 0.51 0.00 0.00 175.35 174.60 1zzv s GLN 36 N 1.09 0.86 -0.16 1.68 0.74 -1.26 -0.39 119.66 122.22 1zzv s GLN 36 Ca 0.03 -0.44 0.01 0.00 0.05 0.00 0.00 55.36 55.01 1zzv s GLN 36 Cb -0.14 -0.83 0.02 0.00 1.10 0.00 0.00 33.01 33.15 1zzv s GLN 36 CO 0.02 0.22 -0.18 0.45 -0.55 0.00 0.00 175.29 175.25 1zzv s SER 37 N -0.41 2.94 0.00 6.67 0.15 0.01 -4.67 113.70 118.38 1zzv s SER 37 Ca 0.03 -0.58 0.17 0.00 0.70 0.00 0.00 55.95 56.28 1zzv s SER 37 Cb -0.05 -1.35 1.00 0.00 -1.71 0.00 0.00 66.02 63.91 1zzv s SER 37 CO -0.00 -0.01 1.43 0.59 1.20 0.00 0.00 173.24 176.45 1zzv n ASN 38 N 4.56 0.00 0.00 5.45 3.02 -1.26 -3.31 115.26 123.72 1zzv n ASN 38 Ca -0.19 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 1zzv n ASN 38 Cb 0.50 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 1zzv n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zzv n GLY 39 N 0.07 3.23 3.64 7.41 0.00 -1.26 -2.47 105.19 115.81 1zzv n GLY 39 Ca 0.12 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.26 1zzv n GLY 39 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1zzv s LEU 40 N 0.00 -0.89 -0.31 0.99 2.96 -1.13 -4.85 118.68 115.46 1zzv s LEU 40 Ca 0.00 1.46 -0.01 0.00 -0.22 0.00 0.00 54.13 55.36 1zzv s LEU 40 Cb 0.00 2.36 0.13 0.00 0.50 0.00 0.00 46.19 49.18 1zzv s LEU 40 CO 0.00 -0.23 0.25 -2.28 -1.32 0.00 0.00 176.35 172.76 1zzv s HIS 41 N 1.41 -0.10 0.13 5.38 5.65 -1.26 -1.37 115.29 125.13 1zzv s HIS 41 Ca -0.08 -0.60 -0.24 0.00 0.25 0.00 0.00 55.06 54.38 1zzv s HIS 41 Cb -0.05 -0.63 0.08 0.00 -1.18 0.00 0.00 32.58 30.81 1zzv s HIS 41 CO -0.16 -0.89 1.08 0.20 -0.65 0.00 0.00 174.74 174.31 1zzv s GLY 42 N 2.05 -0.06 -0.86 1.59 0.00 -1.23 -5.01 107.32 103.79 1zzv s GLY 42 Ca 0.11 -0.07 -0.23 0.00 0.00 0.00 0.00 44.72 44.53 1zzv s GLY 42 CO -0.27 1.91 1.24 -0.35 0.00 0.00 0.00 173.10 175.63 1zzv s ASP 43 N -3.29 6.38 -0.15 1.64 2.15 -1.26 0.17 116.67 122.31 1zzv s ASP 43 Ca 0.19 -1.25 -0.00 0.00 0.43 0.00 0.00 52.55 51.93 1zzv s ASP 43 Cb -0.01 -2.50 -0.01 0.00 -0.30 0.00 0.00 42.92 40.10 1zzv s ASP 43 CO 0.03 -1.48 -0.13 -0.31 -0.17 0.00 0.00 175.17 173.10 1zzv s TYR 44 N 4.49 2.81 1.06 -5.34 1.51 -1.26 -4.76 117.35 115.85 1zzv s TYR 44 Ca 0.36 -0.88 -0.13 0.00 -1.01 0.00 0.00 57.07 55.40 1zzv s TYR 44 Cb -0.06 -1.89 0.22 0.00 -0.11 0.00 0.00 41.96 40.11 1zzv s TYR 44 CO 0.00 -0.38 1.08 -0.51 -1.11 0.00 0.00 175.55 174.62 1zzv s ASP 45 N 0.71 2.09 0.05 2.29 1.01 -1.26 -4.62 116.67 116.94 1zzv s ASP 45 Ca -0.06 1.20 -0.15 0.00 0.71 0.00 0.00 52.55 54.25 1zzv s ASP 45 Cb -0.15 -1.89 -0.06 0.00 1.01 0.00 0.00 42.92 41.83 1zzv s ASP 45 CO 0.02 -3.47 1.25 0.58 0.21 0.00 0.00 175.17 173.75 1zzv h VAL 46 N -2.12 0.00 -0.68 -1.27 2.07 -1.99 0.18 116.25 112.44 1zzv h VAL 46 Ca -0.57 0.00 0.02 0.00 0.82 0.00 0.00 66.70 66.98 1zzv h VAL 46 Cb 1.34 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1zzv h VAL 46 CO 0.56 0.00 0.43 1.05 0.02 0.00 0.00 177.57 179.63 1zzv h GLU 47 N -0.26 0.83 -0.09 1.57 4.11 -2.00 -2.73 114.58 116.01 1zzv h GLU 47 Ca 0.01 -0.05 -0.14 0.00 0.07 0.00 0.00 59.36 59.25 1zzv h GLU 47 Cb 0.30 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1zzv h GLU 47 CO -0.20 0.55 -0.56 1.03 0.07 0.00 0.00 179.01 179.89 1zzv h SER 48 N 0.85 0.32 -0.09 3.06 0.87 -1.83 -2.47 113.55 114.26 1zzv h SER 48 Ca 0.27 -0.17 -0.23 0.00 -1.23 0.00 0.00 61.79 60.43 1zzv h SER 48 Cb -0.01 -0.09 0.01 0.00 -0.44 0.00 0.00 62.40 61.86 1zzv h SER 48 CO -0.09 0.82 -0.81 1.23 -0.53 0.00 0.00 176.83 177.45 1zzv h GLY 49 N 1.37 0.83 1.09 5.77 0.00 -0.47 -3.03 103.07 108.63 1zzv h GLY 49 Ca 0.00 -1.20 -0.12 0.00 0.00 0.00 0.00 47.33 46.00 1zzv h GLY 49 CO 0.09 1.07 -0.18 1.41 0.00 0.00 0.00 176.54 178.93 1zzv h LEU 50 N 0.50 1.00 -0.28 3.11 3.38 -1.43 -2.38 115.31 119.22 1zzv h LEU 50 Ca -0.06 -0.38 0.06 0.00 0.09 0.00 0.00 57.88 57.58 1zzv h LEU 50 Cb 1.43 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 1zzv h LEU 50 CO 0.16 1.16 -0.08 -0.61 0.09 0.00 0.00 178.44 179.16 1zzv h GLN 51 N 0.83 -0.01 -0.47 1.13 -0.00 -1.43 -2.24 115.11 112.93 1zzv h GLN 51 Ca 0.11 0.00 -0.12 0.00 -0.00 0.00 0.00 58.65 58.64 1zzv h GLN 51 Cb 0.76 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.23 1zzv h GLN 51 CO 0.06 -0.01 -0.19 0.37 0.00 0.00 0.00 178.83 179.06 1zzv h GLN 52 N -0.01 0.95 -0.83 1.69 5.75 -1.47 -2.98 115.11 118.21 1zzv h GLN 52 Ca 0.13 -0.40 0.07 0.00 -0.15 0.00 0.00 58.65 58.30 1zzv h GLN 52 Cb 0.22 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.67 1zzv h GLN 52 CO -0.29 1.07 0.50 -0.07 -2.65 0.00 0.00 178.83 177.38 1zzv h LEU 53 N 0.80 0.76 -0.25 -2.39 3.38 -1.09 -2.22 115.31 114.30 1zzv h LEU 53 Ca 0.11 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1zzv h LEU 53 Cb 0.76 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1zzv h LEU 53 CO 0.06 0.48 -0.13 0.18 0.09 0.00 0.00 178.44 179.12 1zzv n LEU 54 N -4.67 0.51 -4.58 1.67 4.32 -0.87 -4.78 117.00 108.60 1zzv n LEU 54 Ca 0.12 -0.01 -0.41 0.00 -0.02 0.00 0.00 56.01 55.70 1zzv n LEU 54 Cb 0.20 -0.19 -0.03 0.00 -1.62 0.00 0.00 43.42 41.79 1zzv n LEU 54 CO 0.30 0.10 1.66 -0.62 -1.22 0.00 0.00 177.39 177.60 1zzv s ASP 55 N -2.50 5.46 0.00 -1.43 2.15 -0.84 -0.68 116.67 118.84 1zzv s ASP 55 Ca 0.28 1.05 0.00 0.00 0.43 0.00 0.00 52.55 54.31 1zzv s ASP 55 Cb 0.20 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.30 1zzv s ASP 55 CO 0.49 -2.09 0.00 0.61 -0.17 0.00 0.00 175.17 174.00 1zzv n GLY 56 N 5.62 1.11 3.73 2.66 0.00 -1.26 -5.03 105.19 112.01 1zzv n GLY 56 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 1zzv n GLY 56 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zzv s SER 57 N -0.64 4.09 -0.13 1.61 1.04 0.15 -5.06 113.70 114.76 1zzv s SER 57 Ca 0.00 -1.55 0.15 0.00 0.48 0.00 0.00 55.95 55.03 1zzv s SER 57 Cb 0.00 0.25 0.40 0.00 0.10 0.00 0.00 66.02 66.77 1zzv s SER 57 CO 0.00 -0.75 1.30 0.61 0.98 0.00 0.00 173.24 175.38 1zzv n GLY 58 N -1.20 3.96 3.99 7.32 0.00 -1.26 -5.02 105.19 112.97 1zzv n GLY 58 Ca -0.14 -0.88 -0.23 0.00 0.00 0.00 0.00 46.02 44.77 1zzv n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1zzv s LEU 59 N -2.41 3.05 -0.06 0.99 1.43 -1.26 -3.24 118.68 117.18 1zzv s LEU 59 Ca 0.34 -0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 53.16 1zzv s LEU 59 Cb 0.27 -2.24 0.03 0.00 0.03 0.00 0.00 46.19 44.28 1zzv s LEU 59 CO 0.08 -1.65 0.05 -1.10 0.23 0.00 0.00 176.35 173.96 1zzv s GLN 60 N -5.03 0.08 -0.21 1.70 1.11 -0.96 -4.97 119.66 111.38 1zzv s GLN 60 Ca 0.64 0.27 -0.12 0.00 0.01 0.00 0.00 55.36 56.16 1zzv s GLN 60 Cb -0.07 -0.74 -0.05 0.00 -1.01 0.00 0.00 33.01 31.14 1zzv s GLN 60 CO 0.43 -0.36 0.21 0.54 0.01 0.00 0.00 175.29 176.12 1zzv s VAL 61 N 2.12 5.34 -0.01 1.09 0.11 -1.26 -1.58 120.40 126.21 1zzv s VAL 61 Ca 0.05 0.32 -0.01 0.00 -2.93 0.00 0.00 61.98 59.41 1zzv s VAL 61 Cb -0.12 -3.55 0.01 0.00 -1.53 0.00 0.00 36.38 31.19 1zzv s VAL 61 CO -0.04 0.36 0.03 -1.59 -3.33 0.00 0.00 175.10 170.53 1zzv s LYS 62 N 0.83 0.01 0.16 1.54 0.00 -1.10 -4.97 119.74 116.20 1zzv s LYS 62 Ca 0.11 0.08 -0.32 0.00 0.00 0.00 0.00 55.97 55.85 1zzv s LYS 62 Cb -0.13 -0.06 -0.10 0.00 0.00 0.00 0.00 37.83 37.53 1zzv s LYS 62 CO 0.03 -0.05 1.65 -2.14 0.00 0.00 0.00 175.35 174.84 1zzv s PRO 63 N 0.33 4.18 0.12 1.78 0.02 -1.26 -1.51 135.00 138.65 1zzv s PRO 63 Ca -0.03 2.46 -0.15 0.00 0.02 0.00 0.00 61.00 63.30 1zzv s PRO 63 Cb -0.04 -3.24 -0.04 0.00 0.02 0.00 0.00 34.50 31.20 1zzv s PRO 63 CO -0.01 -0.69 1.54 1.25 -0.33 0.00 0.00 177.00 178.76 1zzv h LEU 64 N 7.25 0.66 0.00 -5.54 7.12 -1.00 -3.46 115.31 120.33 1zzv h LEU 64 Ca -0.43 -0.33 0.00 0.00 0.13 0.00 0.00 57.88 57.25 1zzv h LEU 64 Cb 1.20 -0.18 0.00 0.00 -0.53 0.00 0.00 40.66 41.16 1zzv h LEU 64 CO 0.93 0.83 0.00 0.61 -0.13 0.00 0.00 178.44 180.68 1zzv n GLY 65 N -0.29 -0.38 2.77 3.75 0.00 -1.24 -5.03 105.19 104.76 1zzv n GLY 65 Ca -0.02 0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 1zzv n GLY 65 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1zzv n ASN 66 N 0.00 5.09 -0.34 1.61 5.15 -1.26 -4.54 115.26 120.96 1zzv n ASN 66 Ca 0.00 -3.01 -0.04 0.00 -0.60 0.00 0.00 54.58 50.93 1zzv n ASN 66 Cb 0.00 -1.53 -0.02 0.00 -0.53 0.00 0.00 39.78 37.70 1zzv n ASN 66 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1zzv n ASN 67 N 4.38 -5.58 -4.59 1.20 5.15 -1.26 -4.90 115.26 109.66 1zzv n ASN 67 Ca 0.47 0.11 -0.31 0.00 -0.60 0.00 0.00 54.58 54.25 1zzv n ASN 67 Cb 0.36 -3.62 -0.08 0.00 -0.53 0.00 0.00 39.78 35.91 1zzv n ASN 67 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1zzv s SER 68 N -2.06 3.78 0.17 1.20 0.01 -1.26 -4.65 113.70 110.89 1zzv s SER 68 Ca 0.00 -1.64 0.00 0.00 1.31 0.00 0.00 55.95 55.62 1zzv s SER 68 Cb 0.00 0.47 -0.04 0.00 0.21 0.00 0.00 66.02 66.66 1zzv s SER 68 CO 0.00 -0.85 0.05 0.26 0.41 0.00 0.00 173.24 173.11 1zzv s TRP 69 N -2.95 1.11 -0.03 2.43 0.51 -1.02 -0.45 118.94 118.54 1zzv s TRP 69 Ca 0.12 -1.17 -0.12 0.00 -2.12 0.00 0.00 56.10 52.81 1zzv s TRP 69 Cb 0.02 -0.62 0.02 0.00 -0.81 0.00 0.00 33.47 32.08 1zzv s TRP 69 CO 0.07 -0.40 0.26 -0.08 -0.51 0.00 0.00 176.95 176.29 1zzv s THR 70 N -3.88 0.05 -0.55 2.01 -1.32 -0.57 -1.46 115.64 109.91 1zzv s THR 70 Ca 0.28 -0.41 -0.20 0.00 -1.21 0.00 0.00 61.69 60.14 1zzv s THR 70 Cb 0.07 -0.52 0.07 0.00 -1.51 0.00 0.00 72.50 70.60 1zzv s THR 70 CO 0.05 -0.23 0.74 -0.22 -2.21 0.00 0.00 174.62 172.75 1zzv s LEU 71 N -0.99 4.83 -0.26 9.08 2.96 -0.07 -2.73 118.68 131.51 1zzv s LEU 71 Ca -0.11 -0.92 -0.22 0.00 -0.22 0.00 0.00 54.13 52.66 1zzv s LEU 71 Cb -0.05 -2.48 -0.01 0.00 0.50 0.00 0.00 46.19 44.15 1zzv s LEU 71 CO 0.03 -1.06 0.70 -0.70 -1.32 0.00 0.00 176.35 174.00 1zzv s GLU 72 N 3.04 4.10 -0.35 1.98 2.12 -0.61 -4.85 118.70 124.12 1zzv s GLU 72 Ca 0.18 0.64 -0.21 0.00 0.36 0.00 0.00 54.97 55.94 1zzv s GLU 72 Cb -0.19 -3.66 0.00 0.00 0.26 0.00 0.00 34.13 30.54 1zzv s GLU 72 CO 0.12 -0.48 0.65 -1.25 -0.54 0.00 0.00 175.26 173.76 1zzv s PRO 73 N 2.65 3.73 -0.46 4.30 0.04 -1.26 -2.26 135.00 141.73 1zzv s PRO 73 Ca 0.29 0.13 0.04 0.00 0.04 0.00 0.00 61.00 61.50 1zzv s PRO 73 Cb -0.15 -3.79 0.23 0.00 0.04 0.00 0.00 34.50 30.82 1zzv s PRO 73 CO 0.09 -0.72 0.91 0.00 0.04 0.00 0.00 177.00 177.32 1zzv n ALA 74 N 6.06 -2.06 -1.30 8.56 0.00 -1.26 -5.03 120.51 125.48 1zzv n ALA 74 Ca -0.01 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.42 1zzv n ALA 74 Cb 0.49 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1zzv n ALA 74 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1zzv n PRO 75 N 2.06 2.28 -3.32 0.00 -0.04 -1.20 -4.86 135.00 129.93 1zzv n PRO 75 Ca 0.11 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.24 1zzv n PRO 75 Cb 0.62 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 34.03 1zzv n PRO 75 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1zzv n ALA 76 N -3.00 4.39 -2.08 0.55 0.00 -1.26 -4.98 120.51 114.13 1zzv n ALA 76 Ca 0.00 -4.77 -0.40 0.00 0.00 0.00 0.00 53.44 48.26 1zzv n ALA 76 Cb 0.00 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.07 1zzv n ALA 76 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1zzv n PRO 77 N 1.07 4.64 -0.06 0.00 -0.04 -1.26 -4.41 135.00 134.94 1zzv n PRO 77 Ca 0.28 -3.59 0.03 0.00 -0.04 0.00 0.00 63.50 60.18 1zzv n PRO 77 Cb 0.38 -2.63 0.04 0.00 -0.04 0.00 0.00 33.50 31.26 1zzv n PRO 77 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1zzv n LYS 78 N 1.64 1.86 -2.84 0.54 5.02 -1.26 -4.83 118.16 118.29 1zzv n LYS 78 Ca 0.60 -1.66 -0.11 0.00 -2.02 0.00 0.00 58.31 55.12 1zzv n LYS 78 Cb 0.25 -1.05 0.06 0.00 -0.02 0.00 0.00 35.03 34.27 1zzv n LYS 78 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1zzv n GLU 79 N -0.68 0.99 0.00 1.97 2.13 -1.26 -5.34 120.64 118.45 1zzv n GLU 79 Ca 0.05 -2.25 0.00 0.00 0.66 0.00 0.00 57.16 55.62 1zzv n GLU 79 Cb 0.44 -1.20 0.00 0.00 0.27 0.00 0.00 31.44 30.95 1zzv n GLU 79 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25