#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zzv h GLN 2 N 0.00 0.52 -3.23 0.00 -0.00 -1.34 -3.46 115.11 107.60 1zzv h GLN 2 Ca 0.00 -0.41 -0.11 0.00 -0.00 0.00 0.00 58.65 58.13 1zzv h GLN 2 Cb 0.00 0.08 -0.19 0.00 0.00 0.00 0.00 27.48 27.37 1zzv h GLN 2 CO 0.00 1.03 -0.30 0.14 0.00 0.00 0.00 178.83 179.70 1zzv s VAL 3 N -3.72 0.07 -0.19 2.39 -7.23 -1.11 -4.91 120.40 105.71 1zzv s VAL 3 Ca -0.07 -0.62 -0.01 0.00 -1.81 0.00 0.00 61.98 59.47 1zzv s VAL 3 Cb 0.10 -0.74 0.05 0.00 0.56 0.00 0.00 36.38 36.35 1zzv s VAL 3 CO 0.85 -0.34 -0.01 0.20 -0.31 0.00 0.00 175.10 175.50 1zzv s ASN 4 N -1.67 3.01 -0.28 4.85 0.01 -1.26 -3.53 114.94 116.08 1zzv s ASN 4 Ca -0.10 -0.81 -0.07 0.00 -0.71 0.00 0.00 52.86 51.17 1zzv s ASN 4 Cb -0.03 -0.80 -0.01 0.00 0.41 0.00 0.00 41.25 40.82 1zzv s ASN 4 CO 0.01 -0.25 0.08 -0.63 -1.51 0.00 0.00 177.10 174.80 1zzv s ILE 5 N 1.70 4.15 0.53 0.60 -1.09 0.14 -4.95 121.20 122.28 1zzv s ILE 5 Ca -0.01 -0.48 -0.11 0.00 -2.23 0.00 0.00 60.65 57.82 1zzv s ILE 5 Cb -0.17 -3.06 -0.05 0.00 -1.58 0.00 0.00 42.46 37.60 1zzv s ILE 5 CO -0.07 0.17 0.92 0.00 -1.23 0.00 0.00 174.94 174.73 1zzv s ALA 6 N 1.55 3.21 0.52 9.38 0.00 -1.26 -1.26 121.76 133.90 1zzv s ALA 6 Ca 0.04 -0.15 -0.23 0.00 0.00 0.00 0.00 51.96 51.63 1zzv s ALA 6 Cb -0.16 -2.91 -0.06 0.00 0.00 0.00 0.00 23.12 19.99 1zzv s ALA 6 CO 0.03 -0.39 1.31 -0.35 0.00 0.00 0.00 175.76 176.36 1zzv n PRO 7 N -2.12 1.72 -1.74 0.00 -0.04 -1.21 -4.34 135.00 127.26 1zzv n PRO 7 Ca 0.04 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 64.13 1zzv n PRO 7 Cb 0.54 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 1zzv n PRO 7 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zzv n GLY 8 N 0.80 -0.36 3.71 0.55 0.00 -1.06 -4.97 105.19 103.86 1zzv n GLY 8 Ca 0.09 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 1zzv n GLY 8 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1zzv s SER 9 N -2.09 6.54 0.45 1.61 0.15 -1.26 -0.26 113.70 118.84 1zzv s SER 9 Ca 0.00 2.65 0.12 0.00 0.70 0.00 0.00 55.95 59.42 1zzv s SER 9 Cb 0.00 -2.59 1.01 0.00 -1.71 0.00 0.00 66.02 62.73 1zzv s SER 9 CO 0.00 -0.87 2.04 0.25 1.20 0.00 0.00 173.24 175.86 1zzv h LEU 10 N 7.23 0.16 -0.33 3.45 5.85 -0.44 -1.42 115.31 129.81 1zzv h LEU 10 Ca -0.43 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.35 1zzv h LEU 10 Cb 1.20 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 1zzv h LEU 10 CO 0.93 0.20 -0.31 -0.78 -0.34 0.00 0.00 178.44 178.14 1zzv h ASP 11 N 0.18 -1.00 0.60 1.25 1.82 -1.81 0.67 116.42 118.14 1zzv h ASP 11 Ca 0.04 0.17 -0.08 0.00 -0.39 0.00 0.00 57.03 56.78 1zzv h ASP 11 Cb 0.13 0.46 -0.01 0.00 0.68 0.00 0.00 39.33 40.60 1zzv h ASP 11 CO 0.00 -0.32 -0.38 0.50 -1.61 0.00 0.00 179.24 177.44 1zzv h LYS 12 N -0.27 0.00 0.43 0.28 1.63 -1.67 -0.77 116.57 116.21 1zzv h LYS 12 Ca 0.16 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.93 1zzv h LYS 12 Cb 0.52 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.16 1zzv h LYS 12 CO -0.48 0.38 -0.21 0.00 -3.45 0.00 0.00 179.45 175.69 1zzv h ALA 13 N 1.62 -0.58 -0.95 5.00 0.00 -0.39 0.20 119.26 124.16 1zzv h ALA 13 Ca -0.00 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1zzv h ALA 13 Cb 0.78 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1zzv h ALA 13 CO 0.05 -0.67 0.62 -0.07 0.00 0.00 0.00 179.25 179.18 1zzv h LEU 14 N -0.91 1.10 -1.25 0.00 3.38 -0.89 -1.90 115.31 114.83 1zzv h LEU 14 Ca -0.06 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1zzv h LEU 14 Cb 0.57 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1zzv h LEU 14 CO 0.10 0.81 0.21 -1.13 0.09 0.00 0.00 178.44 178.52 1zzv h ASN 15 N 1.29 0.66 -0.53 -0.43 -0.73 -1.07 0.90 115.58 115.66 1zzv h ASN 15 Ca 0.35 -0.07 -0.03 0.00 1.87 0.00 0.00 56.30 58.42 1zzv h ASN 15 Cb -0.13 -0.17 -0.02 0.00 0.27 0.00 0.00 38.32 38.27 1zzv h ASN 15 CO -0.07 0.59 0.23 -0.61 -0.37 0.00 0.00 177.43 177.20 1zzv h GLN 16 N 0.73 0.79 -0.21 6.67 -0.00 0.12 -2.81 115.11 120.40 1zzv h GLN 16 Ca 0.18 -0.13 -0.14 0.00 -0.00 0.00 0.00 58.65 58.55 1zzv h GLN 16 Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 27.47 1zzv h GLN 16 CO -0.02 0.68 -0.45 -0.92 0.00 0.00 0.00 178.83 178.12 1zzv h TYR 17 N 0.72 0.63 -1.00 3.99 5.03 -0.60 -2.75 116.97 122.98 1zzv h TYR 17 Ca 0.18 -0.19 0.17 0.00 2.58 0.00 0.00 58.73 61.47 1zzv h TYR 17 Cb 0.17 -0.13 -0.10 0.00 1.55 0.00 0.00 36.73 38.22 1zzv h TYR 17 CO 0.00 0.88 0.62 0.00 -1.32 0.00 0.00 178.16 178.34 1zzv h ALA 18 N 1.09 1.64 0.00 1.82 0.00 -0.62 0.10 119.26 123.29 1zzv h ALA 18 Ca 0.03 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1zzv h ALA 18 Cb 0.96 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1zzv h ALA 18 CO 0.08 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1zzv h ALA 19 N 1.61 1.00 0.57 0.00 0.00 -1.24 -0.08 119.26 121.13 1zzv h ALA 19 Ca 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.44 1zzv h ALA 19 Cb 0.79 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1zzv h ALA 19 CO -0.34 0.00 -0.38 1.25 0.00 0.00 0.00 179.25 179.78 1zzv h HIS 20 N 0.00 -1.01 0.00 0.00 6.17 -0.88 -3.31 115.15 116.12 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 0.11 0.37 0.00 0.00 2.52 0.00 0.00 27.41 30.41 1zzv h HIS 20 CO 0.00 -0.57 -0.79 0.45 0.71 0.00 0.00 177.93 177.73 1zzv n SER 21 N -5.51 0.97 -1.80 3.26 2.88 -1.20 -5.03 113.62 107.20 1zzv n SER 21 Ca -0.12 -0.58 -0.05 0.00 -1.33 0.00 0.00 58.87 56.79 1zzv n SER 21 Cb 0.40 1.13 0.02 0.00 -0.75 0.00 0.00 64.21 65.02 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 0.26 3.94 0.46 0.00 -0.05 -5.07 105.19 106.14 1zzv n GLY 22 Ca 0.01 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.10 2.36 -0.48 1.61 -0.71 -1.20 -5.05 117.98 111.40 1zzv s PHE 23 Ca 0.05 -0.56 -0.20 0.00 -1.04 0.00 0.00 56.93 55.17 1zzv s PHE 23 Cb -0.01 -2.19 0.04 0.00 -1.21 0.00 0.00 43.02 39.65 1zzv s PHE 23 CO 0.21 -0.42 0.67 0.99 -1.34 0.00 0.00 175.22 175.32 1zzv s THR 24 N -2.52 4.79 -0.22 -4.49 2.01 -1.25 -4.93 115.64 109.03 1zzv s THR 24 Ca 0.50 -0.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.28 1zzv s THR 24 Cb -0.05 -4.28 -0.05 0.00 0.01 0.00 0.00 72.50 68.13 1zzv s THR 24 CO 0.30 -0.74 0.23 -0.22 -0.69 0.00 0.00 174.62 173.50 1zzv s LEU 25 N 2.88 4.15 -0.59 4.42 0.20 -1.26 -0.68 118.68 127.79 1zzv s LEU 25 Ca 0.21 0.26 -0.14 0.00 0.69 0.00 0.00 54.13 55.15 1zzv s LEU 25 Cb -0.16 -2.23 0.15 0.00 -0.43 0.00 0.00 46.19 43.52 1zzv s LEU 25 CO 0.16 0.04 0.54 -0.44 -0.29 0.00 0.00 176.35 176.36 1zzv s SER 26 N 0.92 6.23 -0.12 3.68 0.01 -0.18 -4.96 113.70 119.29 1zzv s SER 26 Ca 0.11 -2.02 -0.08 0.00 1.31 0.00 0.00 55.95 55.28 1zzv s SER 26 Cb -0.13 -2.18 0.04 0.00 0.21 0.00 0.00 66.02 63.96 1zzv s SER 26 CO 0.05 -0.77 0.29 0.54 0.41 0.00 0.00 173.24 173.76 1zzv s VAL 27 N 1.23 -0.02 -0.15 3.43 0.11 -1.26 -1.82 120.40 121.92 1zzv s VAL 27 Ca 0.07 0.08 -0.16 0.00 -2.93 0.00 0.00 61.98 59.05 1zzv s VAL 27 Cb -0.25 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.12 1zzv s VAL 27 CO -0.00 0.03 0.37 -1.81 -3.33 0.00 0.00 175.10 170.36 1zzv s ASP 28 N 0.89 6.53 0.05 3.54 1.01 -1.26 -4.95 116.67 122.48 1zzv s ASP 28 Ca -0.06 0.63 0.03 0.00 0.71 0.00 0.00 52.55 53.86 1zzv s ASP 28 Cb -0.07 -2.23 0.17 0.00 1.01 0.00 0.00 42.92 41.81 1zzv s ASP 28 CO -0.06 0.05 1.05 0.00 0.21 0.00 0.00 175.17 176.42 1zzv n ALA 29 N 3.68 0.91 -0.06 5.23 0.00 -1.26 -1.72 120.51 127.28 1zzv n ALA 29 Ca -0.10 0.03 -0.15 0.00 0.00 0.00 0.00 53.44 53.22 1zzv n ALA 29 Cb 0.52 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.96 1zzv n ALA 29 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1zzv h SER 30 N 0.00 0.79 -0.60 0.00 4.64 -1.97 -2.01 113.55 114.40 1zzv h SER 30 Ca 0.00 -0.56 -0.04 0.00 -0.47 0.00 0.00 61.79 60.72 1zzv h SER 30 Cb 0.11 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.94 1zzv h SER 30 CO 0.00 1.20 0.20 -0.07 -0.87 0.00 0.00 176.83 177.30 1zzv h LEU 31 N 0.41 0.86 -1.91 5.97 4.07 -1.76 -2.74 115.31 120.21 1zzv h LEU 31 Ca 0.00 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.76 1zzv h LEU 31 Cb 1.08 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.60 1zzv h LEU 31 CO 0.10 0.83 0.00 0.35 -1.08 0.00 0.00 178.44 178.64 1zzv n THR 32 N -4.42 0.93 -2.04 0.22 -2.24 -1.22 -4.79 114.28 100.72 1zzv n THR 32 Ca 0.03 -0.66 -0.43 0.00 -2.27 0.00 0.00 64.05 60.72 1zzv n THR 32 Cb 0.20 0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 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 -1.63 3.57 0.00 -0.78 3.52 -0.76 -1.53 118.95 121.35 1zzv s ARG 33 Ca 0.30 1.56 0.00 0.00 -0.13 0.00 0.00 55.73 57.47 1zzv s ARG 33 Cb 0.18 -4.12 0.00 0.00 -1.56 0.00 0.00 34.95 29.45 1zzv s ARG 33 CO 0.16 -1.57 0.00 0.41 -0.81 0.00 0.00 175.30 173.49 1zzv n GLY 34 N 5.06 0.91 3.60 8.12 0.00 -1.26 -5.01 105.19 116.60 1zzv n GLY 34 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1zzv n GLY 34 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1zzv s LYS 35 N -0.35 3.80 0.32 1.61 2.47 -0.58 -5.03 119.74 121.99 1zzv s LYS 35 Ca 0.00 0.44 0.07 0.00 -1.56 0.00 0.00 55.97 54.92 1zzv s LYS 35 Cb 0.00 -3.80 -0.03 0.00 -1.46 0.00 0.00 37.83 32.54 1zzv s LYS 35 CO 0.00 -0.87 0.27 1.14 0.16 0.00 0.00 175.35 176.05 1zzv s GLN 36 N 3.23 2.74 -0.03 4.03 -2.07 -1.26 0.26 119.66 126.56 1zzv s GLN 36 Ca 0.34 -1.27 0.01 0.00 -1.82 0.00 0.00 55.36 52.62 1zzv s GLN 36 Cb -0.13 -2.47 0.02 0.00 -1.09 0.00 0.00 33.01 29.34 1zzv s GLN 36 CO 0.17 0.14 -0.01 0.45 -1.32 0.00 0.00 175.29 174.72 1zzv s SER 37 N -3.97 0.48 0.64 12.60 0.15 0.64 -4.57 113.70 119.67 1zzv s SER 37 Ca 0.40 -0.05 0.40 0.00 0.70 0.00 0.00 55.95 57.39 1zzv s SER 37 Cb -0.06 -0.22 2.18 0.00 -1.71 0.00 0.00 66.02 66.21 1zzv s SER 37 CO 0.26 -0.06 2.31 0.78 1.20 0.00 0.00 173.24 177.73 1zzv h ASN 38 N 6.99 0.00 -4.58 5.45 -0.26 -1.87 -2.81 115.58 118.50 1zzv h ASN 38 Ca -0.39 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.35 1zzv h ASN 38 Cb 1.15 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.41 1zzv h ASN 38 CO 0.48 0.01 0.00 0.61 -1.06 0.00 0.00 177.43 177.47 1zzv n GLY 39 N -1.06 0.76 3.64 2.83 0.00 -1.26 -3.32 105.19 106.77 1zzv n GLY 39 Ca -0.03 -2.16 -0.06 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.00 -0.30 0.99 2.96 -0.39 -4.78 118.68 116.16 1zzv s LEU 40 Ca 0.00 1.53 -0.03 0.00 -0.22 0.00 0.00 54.13 55.41 1zzv s LEU 40 Cb 0.00 2.37 0.11 0.00 0.50 0.00 0.00 46.19 49.17 1zzv s LEU 40 CO 0.00 -0.24 0.15 -1.00 -1.32 0.00 0.00 176.35 173.94 1zzv s HIS 41 N 1.93 0.40 0.14 5.38 3.76 -1.26 0.29 115.29 125.93 1zzv s HIS 41 Ca -0.09 -1.04 -0.24 0.00 -0.15 0.00 0.00 55.06 53.54 1zzv s HIS 41 Cb -0.07 -0.90 0.08 0.00 1.11 0.00 0.00 32.58 32.80 1zzv s HIS 41 CO -0.20 -0.83 1.07 0.20 -0.85 0.00 0.00 174.74 174.13 1zzv s GLY 42 N 1.88 -0.05 -1.25 -2.22 0.00 -1.23 -5.04 107.32 99.41 1zzv s GLY 42 Ca 0.11 -0.08 -0.12 0.00 0.00 0.00 0.00 44.72 44.63 1zzv s GLY 42 CO -0.29 1.85 1.64 1.34 0.00 0.00 0.00 173.10 177.64 1zzv n ASP 43 N -0.94 5.11 -4.90 1.64 2.03 -1.26 -0.96 116.55 117.26 1zzv n ASP 43 Ca -0.04 -3.02 -0.32 0.00 0.52 0.00 0.00 54.79 51.94 1zzv n ASP 43 Cb 0.60 -1.55 -0.05 0.00 -0.72 0.00 0.00 41.12 39.40 1zzv n ASP 43 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1zzv s TYR 44 N 1.36 3.50 0.54 -0.67 1.51 -1.26 -4.73 117.35 117.60 1zzv s TYR 44 Ca 0.43 0.48 -0.02 0.00 -1.01 0.00 0.00 57.07 56.94 1zzv s TYR 44 Cb 0.03 -1.94 0.02 0.00 -0.11 0.00 0.00 41.96 39.96 1zzv s TYR 44 CO 0.01 0.50 0.80 0.34 -1.11 0.00 0.00 175.55 176.08 1zzv s ASP 45 N -2.36 5.47 0.00 2.29 2.15 -1.26 -4.78 116.67 118.18 1zzv s ASP 45 Ca 0.38 0.31 0.00 0.00 0.43 0.00 0.00 52.55 53.67 1zzv s ASP 45 Cb -0.13 -1.31 0.00 0.00 -0.30 0.00 0.00 42.92 41.18 1zzv s ASP 45 CO 0.24 -1.03 0.85 0.52 -0.17 0.00 0.00 175.17 175.58 1zzv n VAL 46 N -2.38 0.00 0.22 1.11 0.31 -1.26 -0.95 118.33 115.38 1zzv n VAL 46 Ca 0.05 1.35 0.05 0.00 -0.01 0.00 0.00 64.34 65.78 1zzv n VAL 46 Cb 0.59 -2.03 0.48 0.00 -0.91 0.00 0.00 33.84 31.96 1zzv n VAL 46 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1zzv h GLU 47 N 0.00 0.00 -0.09 5.55 5.08 -2.00 -2.40 114.58 120.72 1zzv h GLU 47 Ca 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 1zzv h GLU 47 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1zzv h GLU 47 CO 0.00 0.24 -0.56 0.77 -1.00 0.00 0.00 179.01 178.46 1zzv h SER 48 N 0.00 0.31 0.55 1.42 0.02 -1.90 -2.21 113.55 111.74 1zzv h SER 48 Ca -0.00 -0.17 -0.21 0.00 -0.84 0.00 0.00 61.79 60.57 1zzv h SER 48 Cb 0.43 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1zzv h SER 48 CO 0.03 0.80 -0.93 1.23 -1.14 0.00 0.00 176.83 176.83 1zzv h GLY 49 N 1.38 0.27 0.99 -3.77 0.00 -0.55 -3.08 103.07 98.31 1zzv h GLY 49 Ca 0.00 -0.49 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 1zzv h GLY 49 CO 0.09 0.44 -0.14 1.41 0.00 0.00 0.00 176.54 178.33 1zzv h LEU 50 N 0.13 0.79 -1.13 3.11 3.38 -1.37 -2.89 115.31 117.33 1zzv h LEU 50 Ca -0.06 -0.38 0.09 0.00 0.09 0.00 0.00 57.88 57.62 1zzv h LEU 50 Cb 1.57 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 42.03 1zzv h LEU 50 CO 0.15 1.00 0.60 -0.61 0.09 0.00 0.00 178.44 179.67 1zzv h GLN 51 N 0.58 0.95 0.57 1.13 5.75 -1.39 -1.09 115.11 121.61 1zzv h GLN 51 Ca 0.09 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 1zzv h GLN 51 Cb 0.68 -0.21 0.01 0.00 1.07 0.00 0.00 27.48 29.02 1zzv h GLN 51 CO 0.05 0.63 -0.27 1.96 -2.65 0.00 0.00 178.83 178.54 1zzv h GLN 52 N 0.98 -0.74 -0.54 1.69 1.08 -1.43 -2.03 115.11 114.12 1zzv h GLN 52 Ca 0.43 0.05 0.07 0.00 -1.45 0.00 0.00 58.65 57.75 1zzv h GLN 52 Cb 0.34 0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 27.91 1zzv h GLN 52 CO -0.18 -0.45 0.36 -0.07 -0.95 0.00 0.00 178.83 177.53 1zzv h LEU 53 N -0.88 0.40 -2.94 1.46 3.38 -1.27 -1.89 115.31 113.57 1zzv h LEU 53 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1zzv h LEU 53 Cb 0.63 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1zzv h LEU 53 CO 0.13 0.26 0.00 0.18 0.09 0.00 0.00 178.44 179.09 1zzv n LEU 54 N -4.47 4.48 -4.61 1.67 4.32 -0.45 -4.90 117.00 113.04 1zzv n LEU 54 Ca 0.08 -2.25 -0.43 0.00 -0.02 0.00 0.00 56.01 53.38 1zzv n LEU 54 Cb 0.27 -0.55 -0.03 0.00 -1.62 0.00 0.00 43.42 41.49 1zzv n LEU 54 CO 0.34 0.82 1.82 -0.62 -1.22 0.00 0.00 177.39 178.53 1zzv s ASP 55 N -0.90 5.56 -0.98 -1.43 2.15 -0.71 -2.17 116.67 118.19 1zzv s ASP 55 Ca 0.49 1.97 -0.06 0.00 0.43 0.00 0.00 52.55 55.38 1zzv s ASP 55 Cb 0.31 -2.51 0.01 0.00 -0.30 0.00 0.00 42.92 40.42 1zzv s ASP 55 CO 0.26 -1.87 0.76 0.61 -0.17 0.00 0.00 175.17 174.76 1zzv n GLY 56 N 5.63 -0.11 0.02 2.66 0.00 -1.26 -4.92 105.19 107.20 1zzv n GLY 56 Ca 0.29 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.37 1zzv n GLY 56 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1zzv n SER 57 N -1.59 0.35 0.00 1.61 3.41 -0.92 -4.95 113.62 111.53 1zzv n SER 57 Ca -0.01 -0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 1zzv n SER 57 Cb 0.55 1.54 0.00 0.00 -0.26 0.00 0.00 64.21 66.04 1zzv n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1zzv n GLY 58 N 1.32 0.68 3.69 5.00 0.00 -1.26 -5.02 105.19 109.60 1zzv n GLY 58 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 3.12 -0.13 0.99 1.43 -1.26 -1.52 118.68 121.32 1zzv s LEU 59 Ca 0.00 -0.91 -0.04 0.00 -1.03 0.00 0.00 54.13 52.15 1zzv s LEU 59 Cb 0.00 -1.53 0.06 0.00 0.03 0.00 0.00 46.19 44.75 1zzv s LEU 59 CO 0.00 -0.31 0.22 -1.58 0.23 0.00 0.00 176.35 174.90 1zzv s GLN 60 N -3.80 0.12 -0.13 1.70 0.74 0.14 -4.55 119.66 113.87 1zzv s GLN 60 Ca 0.37 0.57 -0.17 0.00 0.05 0.00 0.00 55.36 56.18 1zzv s GLN 60 Cb -0.00 -0.36 -0.04 0.00 1.10 0.00 0.00 33.01 33.71 1zzv s GLN 60 CO 0.21 -0.37 0.44 0.54 -0.55 0.00 0.00 175.29 175.56 1zzv s VAL 61 N 2.36 5.21 -0.09 1.34 0.11 -1.26 -0.84 120.40 127.22 1zzv s VAL 61 Ca 0.03 0.87 0.00 0.00 -2.93 0.00 0.00 61.98 59.95 1zzv s VAL 61 Cb -0.13 -3.78 0.02 0.00 -1.53 0.00 0.00 36.38 30.96 1zzv s VAL 61 CO -0.08 0.33 -0.07 -0.54 -3.33 0.00 0.00 175.10 171.40 1zzv s LYS 62 N 0.66 1.39 -0.03 1.54 1.02 -0.81 -4.98 119.74 118.52 1zzv s LYS 62 Ca 0.24 -0.22 -0.30 0.00 0.02 0.00 0.00 55.97 55.71 1zzv s LYS 62 Cb -0.15 -1.43 -0.08 0.00 -0.52 0.00 0.00 37.83 35.66 1zzv s LYS 62 CO 0.09 -0.21 1.99 -2.14 -0.92 0.00 0.00 175.35 174.16 1zzv s PRO 63 N 1.51 3.92 0.17 -1.68 0.02 -1.26 -0.78 135.00 136.88 1zzv s PRO 63 Ca 0.01 2.42 -0.13 0.00 0.02 0.00 0.00 61.00 63.32 1zzv s PRO 63 Cb -0.13 -4.19 0.06 0.00 0.02 0.00 0.00 34.50 30.26 1zzv s PRO 63 CO -0.05 -1.21 1.76 1.25 -0.33 0.00 0.00 177.00 178.42 1zzv h LEU 64 N 11.58 0.72 0.00 -5.54 7.12 -0.44 -3.47 115.31 125.28 1zzv h LEU 64 Ca -0.46 -0.12 0.00 0.00 0.13 0.00 0.00 57.88 57.42 1zzv h LEU 64 Cb 1.23 -0.18 0.00 0.00 -0.53 0.00 0.00 40.66 41.18 1zzv h LEU 64 CO 0.95 0.63 0.00 0.61 -0.13 0.00 0.00 178.44 180.50 1zzv n GLY 65 N -0.95 0.89 2.30 3.75 0.00 -1.25 -5.00 105.19 104.92 1zzv n GLY 65 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1zzv n GLY 65 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1zzv n ASN 66 N 0.00 7.74 -3.70 1.61 4.13 -1.26 -4.59 115.26 119.19 1zzv n ASN 66 Ca 0.00 -2.72 -0.24 0.00 1.68 0.00 0.00 54.58 53.30 1zzv n ASN 66 Cb 0.00 -1.47 0.05 0.00 -1.54 0.00 0.00 39.78 36.83 1zzv n ASN 66 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1zzv n ASN 67 N 2.77 -3.81 -3.45 6.41 5.15 -1.26 -4.96 115.26 116.10 1zzv n ASN 67 Ca 0.66 -0.71 -0.17 0.00 -0.60 0.00 0.00 54.58 53.77 1zzv n ASN 67 Cb 0.40 -4.41 -0.07 0.00 -0.53 0.00 0.00 39.78 35.16 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 -3.76 1.24 0.07 1.20 0.01 -1.26 -3.93 113.70 107.26 1zzv s SER 68 Ca 0.37 -1.62 0.01 0.00 1.31 0.00 0.00 55.95 56.02 1zzv s SER 68 Cb -0.18 0.56 -0.03 0.00 0.21 0.00 0.00 66.02 66.58 1zzv s SER 68 CO 0.78 -1.10 -0.06 0.26 0.41 0.00 0.00 173.24 173.54 1zzv s TRP 69 N -3.45 0.71 -0.02 2.43 0.51 0.14 0.30 118.94 119.56 1zzv s TRP 69 Ca 0.38 -0.75 0.00 0.00 -2.12 0.00 0.00 56.10 53.60 1zzv s TRP 69 Cb 0.02 -0.43 0.02 0.00 -0.81 0.00 0.00 33.47 32.27 1zzv s TRP 69 CO 0.23 -0.16 0.02 0.95 -0.51 0.00 0.00 176.95 177.48 1zzv s THR 70 N -2.68 0.01 -0.53 2.01 -4.23 0.04 -1.01 115.64 109.24 1zzv s THR 70 Ca 0.01 0.13 -0.20 0.00 -1.18 0.00 0.00 61.69 60.46 1zzv s THR 70 Cb -0.01 -0.11 0.06 0.00 1.34 0.00 0.00 72.50 73.79 1zzv s THR 70 CO -0.03 0.08 0.69 -0.22 -0.54 0.00 0.00 174.62 174.60 1zzv s LEU 71 N 0.80 4.92 -0.19 4.79 2.96 -0.76 -1.93 118.68 129.27 1zzv s LEU 71 Ca -0.07 -0.95 -0.19 0.00 -0.22 0.00 0.00 54.13 52.70 1zzv s LEU 71 Cb -0.10 -2.46 -0.03 0.00 0.50 0.00 0.00 46.19 44.10 1zzv s LEU 71 CO -0.02 -0.99 0.56 -1.61 -1.32 0.00 0.00 176.35 172.97 1zzv s GLU 72 N 2.85 4.21 -0.31 1.98 0.41 -0.02 -4.95 118.70 122.86 1zzv s GLU 72 Ca 0.16 0.49 -0.29 0.00 -0.41 0.00 0.00 54.97 54.93 1zzv s GLU 72 Cb -0.19 -3.56 -0.00 0.00 -1.78 0.00 0.00 34.13 28.60 1zzv s GLU 72 CO 0.12 -0.16 1.41 -2.14 -0.49 0.00 0.00 175.26 173.99 1zzv s PRO 73 N 1.67 3.78 0.00 0.39 0.02 -1.26 0.26 135.00 139.86 1zzv s PRO 73 Ca 0.26 1.26 0.00 0.00 0.02 0.00 0.00 61.00 62.54 1zzv s PRO 73 Cb -0.16 -3.96 0.00 0.00 0.02 0.00 0.00 34.50 30.41 1zzv s PRO 73 CO 0.10 -1.30 0.00 0.00 -0.33 0.00 0.00 177.00 175.47 1zzv n ALA 74 N 8.19 0.00 -0.70 -1.55 0.00 -0.57 -4.90 120.51 120.98 1zzv n ALA 74 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.55 1zzv n ALA 74 Cb 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.85 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 0.00 1.39 -3.38 0.00 -0.04 -1.15 -3.84 135.00 127.98 1zzv n PRO 75 Ca 0.00 -0.40 -0.14 0.00 -0.04 0.00 0.00 63.50 62.92 1zzv n PRO 75 Cb 0.00 -1.38 0.02 0.00 -0.04 0.00 0.00 33.50 32.09 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 1.85 -2.58 -2.85 0.55 0.00 -1.26 -4.99 120.51 111.23 1zzv n ALA 76 Ca 0.17 -0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.29 1zzv n ALA 76 Cb 0.66 -2.48 0.08 0.00 0.00 0.00 0.00 19.45 17.71 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 -2.67 0.35 -2.44 0.00 -0.04 -1.26 -5.00 135.00 123.94 1zzv n PRO 77 Ca -0.10 -2.74 -0.41 0.00 -0.04 0.00 0.00 63.50 60.21 1zzv n PRO 77 Cb 0.58 -0.38 0.01 0.00 -0.04 0.00 0.00 33.50 33.66 1zzv n PRO 77 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1zzv n LYS 78 N -2.39 4.83 -2.36 0.54 3.00 -1.26 -4.88 118.16 115.64 1zzv n LYS 78 Ca 0.15 -4.12 -0.01 0.00 -0.00 0.00 0.00 58.31 54.34 1zzv n LYS 78 Cb 0.55 -2.58 -0.01 0.00 0.00 0.00 0.00 35.03 33.00 1zzv n LYS 78 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1zzv n GLU 79 N 1.17 -5.07 0.00 1.64 -0.58 -1.26 -5.29 120.64 111.26 1zzv n GLU 79 Ca 0.48 3.70 0.02 0.00 -0.42 0.00 0.00 57.16 60.94 1zzv n GLU 79 Cb 0.28 -4.72 0.13 0.00 -0.57 0.00 0.00 31.44 26.56 1zzv n GLU 79 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25