#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zzv s GLN 2 N 0.00 0.90 0.03 0.00 -2.07 -1.11 -2.75 119.66 114.65 1zzv s GLN 2 Ca 0.00 0.08 -0.00 0.00 -1.82 0.00 0.00 55.36 53.62 1zzv s GLN 2 Cb 0.00 0.42 -0.03 0.00 -1.09 0.00 0.00 33.01 32.31 1zzv s GLN 2 CO 0.00 -0.27 -0.03 0.14 -1.32 0.00 0.00 175.29 173.81 1zzv s VAL 3 N -1.24 0.14 -0.36 3.63 -7.23 -0.80 -4.76 120.40 109.79 1zzv s VAL 3 Ca -0.12 -1.15 0.01 0.00 -1.81 0.00 0.00 61.98 58.91 1zzv s VAL 3 Cb -0.02 -0.60 0.11 0.00 0.56 0.00 0.00 36.38 36.43 1zzv s VAL 3 CO 0.08 -0.63 0.13 0.54 -0.31 0.00 0.00 175.10 174.90 1zzv s ASN 4 N -1.85 4.13 -0.10 4.85 4.22 -1.26 -3.52 114.94 121.40 1zzv s ASN 4 Ca -0.10 -2.07 -0.01 0.00 -2.14 0.00 0.00 52.86 48.54 1zzv s ASN 4 Cb -0.05 -1.13 0.03 0.00 1.28 0.00 0.00 41.25 41.39 1zzv s ASN 4 CO -0.03 -0.36 -0.01 -0.63 -2.04 0.00 0.00 177.10 174.02 1zzv s ILE 5 N 1.05 0.55 0.80 0.54 1.01 -0.04 -5.03 121.20 120.08 1zzv s ILE 5 Ca 0.12 -0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.56 1zzv s ILE 5 Cb -0.20 -0.74 0.09 0.00 0.01 0.00 0.00 42.46 41.62 1zzv s ILE 5 CO -0.14 0.19 1.16 0.00 0.00 0.00 0.00 174.94 176.15 1zzv s ALA 6 N 1.89 2.72 0.37 9.38 0.00 -1.26 -0.80 121.76 134.06 1zzv s ALA 6 Ca 0.04 -0.76 -0.27 0.00 0.00 0.00 0.00 51.96 50.97 1zzv s ALA 6 Cb -0.13 -2.86 -0.12 0.00 0.00 0.00 0.00 23.12 20.01 1zzv s ALA 6 CO -0.06 -1.67 1.21 -2.30 0.00 0.00 0.00 175.76 172.94 1zzv n PRO 7 N -3.28 1.88 0.00 0.00 -0.02 -1.21 -4.07 135.00 128.30 1zzv n PRO 7 Ca 0.09 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1zzv n PRO 7 Cb 0.61 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 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 0.89 -0.75 3.33 -1.23 0.00 0.35 -4.89 105.19 102.88 1zzv n GLY 8 Ca 0.06 0.04 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 1zzv n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zzv s SER 9 N -4.00 2.67 0.29 1.61 0.01 -1.26 -0.38 113.70 112.64 1zzv s SER 9 Ca 0.00 -0.88 0.01 0.00 1.31 0.00 0.00 55.95 56.38 1zzv s SER 9 Cb 0.00 -0.16 0.52 0.00 0.21 0.00 0.00 66.02 66.60 1zzv s SER 9 CO 0.00 -0.05 1.88 -0.07 0.41 0.00 0.00 173.24 175.40 1zzv h LEU 10 N 3.15 0.93 -0.43 2.44 -0.00 -1.25 -2.62 115.31 117.54 1zzv h LEU 10 Ca -0.42 0.02 0.08 0.00 -0.00 0.00 0.00 57.88 57.56 1zzv h LEU 10 Cb 1.21 -0.17 -0.09 0.00 -0.00 0.00 0.00 40.66 41.60 1zzv h LEU 10 CO 0.53 0.56 -0.40 -0.78 -0.00 0.00 0.00 178.44 178.35 1zzv h ASP 11 N 1.04 -1.34 0.20 -0.43 1.82 -1.83 0.02 116.42 115.90 1zzv h ASP 11 Ca 0.44 0.21 -0.07 0.00 -0.39 0.00 0.00 57.03 57.23 1zzv h ASP 11 Cb 0.32 0.60 -0.01 0.00 0.68 0.00 0.00 39.33 40.91 1zzv h ASP 11 CO -0.19 -0.35 -0.27 0.50 -1.61 0.00 0.00 179.24 177.32 1zzv h LYS 12 N -0.30 0.12 0.55 0.28 1.63 -1.87 -1.25 116.57 115.73 1zzv h LYS 12 Ca 0.15 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.89 1zzv h LYS 12 Cb 0.57 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 32.20 1zzv h LYS 12 CO -0.58 0.39 -0.26 0.00 -3.45 0.00 0.00 179.45 175.54 1zzv h ALA 13 N 1.62 -0.74 -0.93 5.00 0.00 -0.80 -0.18 119.26 123.23 1zzv h ALA 13 Ca 0.02 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1zzv h ALA 13 Cb 0.54 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 1zzv h ALA 13 CO 0.04 -0.76 0.61 -0.07 0.00 0.00 0.00 179.25 179.07 1zzv h LEU 14 N -1.05 1.05 -0.88 0.00 3.38 -1.07 -1.60 115.31 115.14 1zzv h LEU 14 Ca -0.08 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1zzv h LEU 14 Cb 0.63 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 1zzv h LEU 14 CO 0.12 0.75 0.55 -1.13 0.09 0.00 0.00 178.44 178.83 1zzv h ASN 15 N 1.24 0.88 -0.14 -0.43 -0.73 -1.15 -0.82 115.58 114.43 1zzv h ASN 15 Ca 0.35 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.52 1zzv h ASN 15 Cb -0.11 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.30 1zzv h ASN 15 CO -0.08 0.57 0.05 -0.61 -0.37 0.00 0.00 177.43 176.99 1zzv h GLN 16 N 1.02 0.21 -0.28 6.67 -0.00 -0.11 -3.25 115.11 119.38 1zzv h GLN 16 Ca 0.38 -0.04 -0.16 0.00 -0.00 0.00 0.00 58.65 58.83 1zzv h GLN 16 Cb 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.59 1zzv h GLN 16 CO -0.17 0.31 -0.46 -0.92 0.00 0.00 0.00 178.83 177.60 1zzv h TYR 17 N 0.06 0.88 -0.81 3.99 5.03 -0.83 -2.83 116.97 122.46 1zzv h TYR 17 Ca 0.05 -0.28 0.19 0.00 2.58 0.00 0.00 58.73 61.26 1zzv h TYR 17 Cb 0.19 -0.18 -0.12 0.00 1.55 0.00 0.00 36.73 38.17 1zzv h TYR 17 CO -0.01 1.05 0.24 0.00 -1.32 0.00 0.00 178.16 178.12 1zzv h ALA 18 N 0.90 1.15 0.00 1.82 0.00 -1.20 0.30 119.26 122.22 1zzv h ALA 18 Ca 0.03 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1zzv h ALA 18 Cb 1.02 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1zzv h ALA 18 CO 0.10 -0.37 -0.02 0.00 0.00 0.00 0.00 179.25 178.96 1zzv h ALA 19 N 1.68 1.09 0.78 0.00 0.00 -1.53 -1.30 119.26 119.97 1zzv h ALA 19 Ca 0.48 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.34 1zzv h ALA 19 Cb 0.89 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1zzv h ALA 19 CO -0.56 0.03 -0.42 1.25 0.00 0.00 0.00 179.25 179.55 1zzv h HIS 20 N 0.00 -1.10 -0.00 0.00 6.17 -0.43 -3.28 115.15 116.51 1zzv h HIS 20 Ca -0.00 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.06 1zzv h HIS 20 Cb 0.20 0.38 0.00 0.00 2.52 0.00 0.00 27.41 30.51 1zzv h HIS 20 CO 0.00 -0.65 -0.87 0.45 0.71 0.00 0.00 177.93 177.57 1zzv n SER 21 N -5.11 1.14 -1.99 3.26 2.88 -1.23 -5.00 113.62 107.57 1zzv n SER 21 Ca -0.14 -1.07 -0.05 0.00 -1.33 0.00 0.00 58.87 56.28 1zzv n SER 21 Cb 0.45 0.91 0.03 0.00 -0.75 0.00 0.00 64.21 64.84 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 1.46 0.21 3.72 0.46 0.00 -0.51 -5.08 105.19 105.46 1zzv n GLY 22 Ca 0.05 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.13 2.32 -0.41 1.61 -0.71 -1.13 -5.06 117.98 111.47 1zzv s PHE 23 Ca 0.10 -0.72 -0.19 0.00 -1.04 0.00 0.00 56.93 55.08 1zzv s PHE 23 Cb -0.01 -1.83 0.02 0.00 -1.21 0.00 0.00 43.02 39.99 1zzv s PHE 23 CO 0.25 0.21 0.52 0.99 -1.34 0.00 0.00 175.22 175.84 1zzv s THR 24 N -2.71 4.98 -0.30 -4.49 2.01 -1.26 -4.86 115.64 109.01 1zzv s THR 24 Ca 0.31 -0.06 -0.17 0.00 0.31 0.00 0.00 61.69 62.07 1zzv s THR 24 Cb 0.05 -4.08 -0.02 0.00 0.01 0.00 0.00 72.50 68.46 1zzv s THR 24 CO 0.17 -0.44 0.48 -0.22 -0.69 0.00 0.00 174.62 173.92 1zzv s LEU 25 N 2.42 4.18 -0.46 4.42 0.20 -1.26 -1.66 118.68 126.52 1zzv s LEU 25 Ca 0.17 0.23 -0.11 0.00 0.69 0.00 0.00 54.13 55.10 1zzv s LEU 25 Cb -0.16 -2.57 0.09 0.00 -0.43 0.00 0.00 46.19 43.12 1zzv s LEU 25 CO 0.15 -0.35 0.34 -0.44 -0.29 0.00 0.00 176.35 175.76 1zzv s SER 26 N 1.66 5.82 -0.03 3.68 0.01 -0.19 -4.98 113.70 119.67 1zzv s SER 26 Ca 0.19 -1.61 0.00 0.00 1.31 0.00 0.00 55.95 55.84 1zzv s SER 26 Cb -0.16 -2.06 0.03 0.00 0.21 0.00 0.00 66.02 64.05 1zzv s SER 26 CO 0.11 -0.64 0.02 0.54 0.41 0.00 0.00 173.24 173.68 1zzv s VAL 27 N 1.47 0.06 -0.09 3.43 0.11 -1.26 -1.26 120.40 122.86 1zzv s VAL 27 Ca 0.04 0.16 -0.30 0.00 -2.93 0.00 0.00 61.98 58.95 1zzv s VAL 27 Cb -0.25 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 1zzv s VAL 27 CO 0.02 0.12 1.37 -0.62 -3.33 0.00 0.00 175.10 172.66 1zzv s ASP 28 N 1.08 6.88 -0.80 3.54 2.15 -1.26 -4.90 116.67 123.35 1zzv s ASP 28 Ca -0.09 1.91 -0.28 0.00 0.43 0.00 0.00 52.55 54.52 1zzv s ASP 28 Cb -0.13 -2.54 -0.27 0.00 -0.30 0.00 0.00 42.92 39.67 1zzv s ASP 28 CO -0.02 -0.76 1.97 0.00 -0.17 0.00 0.00 175.17 176.19 1zzv n ALA 29 N 6.28 0.42 0.00 3.66 0.00 -1.26 -2.08 120.51 127.52 1zzv n ALA 29 Ca 0.14 -2.38 0.00 0.00 0.00 0.00 0.00 53.44 51.20 1zzv n ALA 29 Cb 0.44 -3.46 0.00 0.00 0.00 0.00 0.00 19.45 16.43 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 16.95 0.00 0.15 0.00 2.88 -1.26 -4.99 113.62 127.36 1zzv n SER 30 Ca 0.43 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.83 1zzv n SER 30 Cb 0.46 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.84 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 -0.29 -5.58 2.46 3.38 -1.83 -3.19 115.31 110.26 1zzv h LEU 31 Ca 0.00 -0.10 -0.72 0.00 0.09 0.00 0.00 57.88 57.15 1zzv h LEU 31 Cb 0.00 0.08 -0.16 0.00 0.09 0.00 0.00 40.66 40.66 1zzv h LEU 31 CO 0.00 -0.08 1.84 0.35 0.09 0.00 0.00 178.44 180.64 1zzv n THR 32 N -5.17 5.09 -2.14 0.22 -2.24 -1.26 -4.94 114.28 103.83 1zzv n THR 32 Ca -0.10 -4.44 -0.41 0.00 -2.27 0.00 0.00 64.05 56.83 1zzv n THR 32 Cb 0.21 -1.88 -0.03 0.00 -2.10 0.00 0.00 70.33 66.53 1zzv n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zzv s ARG 33 N -1.91 3.13 2.65 -0.78 1.70 -1.21 -4.48 118.95 118.06 1zzv s ARG 33 Ca 0.52 0.90 0.00 0.00 -0.47 0.00 0.00 55.73 56.68 1zzv s ARG 33 Cb 0.22 -4.22 0.00 0.00 -0.57 0.00 0.00 34.95 30.38 1zzv s ARG 33 CO -0.13 -2.11 0.00 0.41 -1.08 0.00 0.00 175.30 172.38 1zzv n GLY 34 N 5.43 1.03 2.89 3.88 0.00 -1.26 -4.90 105.19 112.25 1zzv n GLY 34 Ca 0.19 0.38 -0.01 0.00 0.00 0.00 0.00 46.02 46.58 1zzv n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1zzv n LYS 35 N 0.00 -2.50 -3.97 1.61 3.00 -1.26 -4.48 118.16 110.55 1zzv n LYS 35 Ca 0.00 2.13 -0.27 0.00 -0.00 0.00 0.00 58.31 60.17 1zzv n LYS 35 Cb 0.00 -3.28 -0.04 0.00 0.00 0.00 0.00 35.03 31.71 1zzv n LYS 35 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 1zzv s GLN 36 N -0.92 3.31 -0.02 1.64 -2.07 -1.26 -0.92 119.66 119.42 1zzv s GLN 36 Ca -0.07 -0.63 0.04 0.00 -1.82 0.00 0.00 55.36 52.89 1zzv s GLN 36 Cb 0.00 -2.91 -0.01 0.00 -1.09 0.00 0.00 33.01 29.01 1zzv s GLN 36 CO 0.43 0.53 -0.15 0.45 -1.32 0.00 0.00 175.29 175.23 1zzv s SER 37 N -3.04 1.82 0.00 12.60 0.15 0.49 -4.68 113.70 121.05 1zzv s SER 37 Ca 0.34 -0.29 0.07 0.00 0.70 0.00 0.00 55.95 56.77 1zzv s SER 37 Cb -0.11 -0.29 0.32 0.00 -1.71 0.00 0.00 66.02 64.22 1zzv s SER 37 CO 0.27 0.17 1.19 0.59 1.20 0.00 0.00 173.24 176.67 1zzv n ASN 38 N 2.85 0.00 0.00 5.45 5.03 -1.26 -0.50 115.26 126.83 1zzv n ASN 38 Ca -0.15 0.42 0.00 0.00 0.87 0.00 0.00 54.58 55.72 1zzv n ASN 38 Cb 0.54 -0.45 0.00 0.00 -1.02 0.00 0.00 39.78 38.85 1zzv n ASN 38 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1zzv n GLY 39 N -0.75 0.40 3.14 7.41 0.00 -1.26 -3.31 105.19 110.82 1zzv n GLY 39 Ca 0.02 -2.31 0.03 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.37 -0.30 0.99 2.96 0.02 -4.93 118.68 116.05 1zzv s LEU 40 Ca 0.00 0.82 -0.01 0.00 -0.22 0.00 0.00 54.13 54.72 1zzv s LEU 40 Cb 0.00 2.12 0.13 0.00 0.50 0.00 0.00 46.19 48.94 1zzv s LEU 40 CO 0.00 -0.26 0.25 -1.38 -1.32 0.00 0.00 176.35 173.64 1zzv s HIS 41 N 2.84 -0.14 0.00 5.38 -3.43 -1.26 -0.86 115.29 117.83 1zzv s HIS 41 Ca 0.20 -0.55 0.00 0.00 -0.80 0.00 0.00 55.06 53.91 1zzv s HIS 41 Cb -0.15 -0.61 0.00 0.00 -1.43 0.00 0.00 32.58 30.39 1zzv s HIS 41 CO -0.21 -0.89 0.00 0.41 -2.00 0.00 0.00 174.74 172.04 1zzv n GLY 42 N 5.09 1.20 3.19 -1.38 0.00 -1.23 -5.03 105.19 107.02 1zzv n GLY 42 Ca -0.01 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 1zzv n GLY 42 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1zzv n ASP 43 N -0.49 4.63 -4.39 1.61 8.00 -1.26 -1.91 116.55 122.74 1zzv n ASP 43 Ca 0.00 -2.92 -0.35 0.00 0.71 0.00 0.00 54.79 52.23 1zzv n ASP 43 Cb 0.00 -1.66 -0.13 0.00 -0.02 0.00 0.00 41.12 39.31 1zzv n ASP 43 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1zzv s TYR 44 N 3.05 2.99 0.00 1.24 1.51 -1.11 -4.73 117.35 120.31 1zzv s TYR 44 Ca 0.48 -0.64 0.00 0.00 -1.01 0.00 0.00 57.07 55.90 1zzv s TYR 44 Cb 0.07 -2.08 0.00 0.00 -0.11 0.00 0.00 41.96 39.84 1zzv s TYR 44 CO 0.00 -0.36 0.00 -3.47 -1.11 0.00 0.00 175.55 170.62 1zzv n ASP 45 N 4.43 0.00 0.00 2.29 2.03 -1.26 -2.77 116.55 121.27 1zzv n ASP 45 Ca -0.18 -0.31 0.00 0.00 0.52 0.00 0.00 54.79 54.82 1zzv n ASP 45 Cb 0.51 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 1zzv n ASP 45 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1zzv n VAL 46 N -0.48 0.00 -0.24 5.18 0.31 -1.26 -1.90 118.33 119.94 1zzv n VAL 46 Ca 0.00 1.41 -0.06 0.00 -0.01 0.00 0.00 64.34 65.68 1zzv n VAL 46 Cb 0.00 -2.24 0.05 0.00 -0.91 0.00 0.00 33.84 30.74 1zzv n VAL 46 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1zzv h GLU 47 N 0.00 0.95 0.00 5.55 4.11 -1.99 -2.29 114.58 120.91 1zzv h GLU 47 Ca 0.00 -0.12 -0.09 0.00 0.07 0.00 0.00 59.36 59.22 1zzv h GLU 47 Cb 0.00 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1zzv h GLU 47 CO 0.00 0.73 -0.44 0.77 0.07 0.00 0.00 179.01 180.13 1zzv h SER 48 N 0.93 0.00 1.01 3.06 0.02 -1.95 -1.19 113.55 115.44 1zzv h SER 48 Ca 0.24 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.98 1zzv h SER 48 Cb 0.06 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 1zzv h SER 48 CO -0.04 0.44 -0.99 1.23 -1.14 0.00 0.00 176.83 176.34 1zzv h GLY 49 N 1.33 0.00 0.68 -3.77 0.00 -1.06 -3.08 103.07 97.18 1zzv h GLY 49 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 1zzv h GLY 49 CO 0.06 0.00 -0.41 1.41 0.00 0.00 0.00 176.54 177.59 1zzv h LEU 50 N 0.00 0.42 -0.89 3.11 3.38 -1.01 -2.87 115.31 117.46 1zzv h LEU 50 Ca -0.01 -0.71 0.09 0.00 0.09 0.00 0.00 57.88 57.34 1zzv h LEU 50 Cb 1.76 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 42.31 1zzv h LEU 50 CO 0.13 1.07 0.54 -0.61 0.09 0.00 0.00 178.44 179.66 1zzv h GLN 51 N -0.19 0.89 -0.13 1.13 5.75 -1.31 -2.30 115.11 118.94 1zzv h GLN 51 Ca -0.04 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 1zzv h GLN 51 Cb 1.11 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 29.45 1zzv h GLN 51 CO 0.08 0.59 0.04 0.37 -2.65 0.00 0.00 178.83 177.26 1zzv h GLN 52 N 0.91 0.19 -0.05 1.69 5.75 -1.55 -2.73 115.11 119.32 1zzv h GLN 52 Ca 0.42 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.90 1zzv h GLN 52 Cb 0.34 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.86 1zzv h GLN 52 CO -0.23 0.32 0.08 -0.07 -2.65 0.00 0.00 178.83 176.28 1zzv h LEU 53 N 0.03 0.00 -0.25 -2.39 3.38 -1.20 -1.63 115.31 113.25 1zzv h LEU 53 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1zzv h LEU 53 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1zzv h LEU 53 CO -0.00 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.46 1zzv h LEU 54 N 0.00 0.00 -8.59 1.67 3.38 -1.10 -3.44 115.31 107.22 1zzv h LEU 54 Ca 0.02 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.50 1zzv h LEU 54 Cb 0.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1zzv h LEU 54 CO -0.00 0.00 1.46 -0.62 0.09 0.00 0.00 178.44 179.37 1zzv s ASP 55 N -6.01 5.00 0.00 -0.43 2.15 -0.61 -0.75 116.67 116.02 1zzv s ASP 55 Ca 0.06 0.78 0.00 0.00 0.43 0.00 0.00 52.55 53.82 1zzv s ASP 55 Cb 0.06 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 1zzv s ASP 55 CO 0.64 -2.50 0.00 0.61 -0.17 0.00 0.00 175.17 173.75 1zzv n GLY 56 N 5.80 0.85 3.67 2.66 0.00 -1.26 -5.05 105.19 111.85 1zzv n GLY 56 Ca 0.27 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.02 1zzv n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zzv s SER 57 N -0.59 4.06 -0.20 1.61 0.01 0.07 -5.03 113.70 113.63 1zzv s SER 57 Ca 0.00 -1.30 0.14 0.00 1.31 0.00 0.00 55.95 56.10 1zzv s SER 57 Cb 0.00 -0.35 0.45 0.00 0.21 0.00 0.00 66.02 66.33 1zzv s SER 57 CO 0.00 -0.51 1.34 0.61 0.41 0.00 0.00 173.24 175.08 1zzv n GLY 58 N -1.08 4.68 4.00 3.44 0.00 -1.26 -5.03 105.19 109.94 1zzv n GLY 58 Ca -0.05 -1.16 -0.20 0.00 0.00 0.00 0.00 46.02 44.62 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 -3.03 3.26 -0.10 0.99 1.43 -1.26 -1.88 118.68 118.09 1zzv s LEU 59 Ca 0.40 -0.75 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1zzv s LEU 59 Cb 0.35 -1.94 0.03 0.00 0.03 0.00 0.00 46.19 44.67 1zzv s LEU 59 CO 0.02 -1.08 -0.01 -1.10 0.23 0.00 0.00 176.35 174.41 1zzv s GLN 60 N -4.49 0.84 -0.39 1.70 -0.21 -0.19 -4.83 119.66 112.10 1zzv s GLN 60 Ca 0.56 -0.07 -0.24 0.00 0.02 0.00 0.00 55.36 55.62 1zzv s GLN 60 Cb -0.06 -1.32 0.01 0.00 1.00 0.00 0.00 33.01 32.64 1zzv s GLN 60 CO 0.34 -0.35 0.83 0.54 -2.12 0.00 0.00 175.29 174.54 1zzv s VAL 61 N 1.89 4.66 -0.03 1.09 0.11 -1.26 -0.64 120.40 126.21 1zzv s VAL 61 Ca 0.04 0.89 0.01 0.00 -2.93 0.00 0.00 61.98 59.99 1zzv s VAL 61 Cb -0.13 -4.28 0.02 0.00 -1.53 0.00 0.00 36.38 30.46 1zzv s VAL 61 CO -0.06 -0.53 -0.02 -0.75 -3.33 0.00 0.00 175.10 170.40 1zzv s LYS 62 N 3.29 0.54 0.17 1.54 2.20 -0.33 -4.99 119.74 122.15 1zzv s LYS 62 Ca 0.33 -0.02 -0.34 0.00 -0.36 0.00 0.00 55.97 55.59 1zzv s LYS 62 Cb -0.12 -0.62 -0.14 0.00 -1.51 0.00 0.00 37.83 35.43 1zzv s LYS 62 CO 0.19 -0.09 1.54 -2.30 -0.36 0.00 0.00 175.35 174.33 1zzv n PRO 63 N 4.00 2.10 -0.02 4.03 -0.02 -1.26 0.23 135.00 144.05 1zzv n PRO 63 Ca -0.26 0.75 0.01 0.00 -2.02 0.00 0.00 63.50 61.99 1zzv n PRO 63 Cb 0.51 -2.50 0.32 0.00 -0.02 0.00 0.00 33.50 31.81 1zzv n PRO 63 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1zzv h LEU 64 N 5.63 0.53 0.00 2.45 7.12 -1.26 -3.44 115.31 126.34 1zzv h LEU 64 Ca -0.45 -0.07 0.00 0.00 0.13 0.00 0.00 57.88 57.49 1zzv h LEU 64 Cb 1.26 -0.14 0.00 0.00 -0.53 0.00 0.00 40.66 41.25 1zzv h LEU 64 CO 0.87 0.52 0.00 0.61 -0.13 0.00 0.00 178.44 180.31 1zzv n GLY 65 N -1.07 -1.45 2.75 3.75 0.00 -1.26 -5.03 105.19 102.88 1zzv n GLY 65 Ca 0.02 0.50 -0.17 0.00 0.00 0.00 0.00 46.02 46.38 1zzv n GLY 65 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1zzv s ASN 66 N 0.00 0.41 0.00 1.61 0.01 -1.26 -4.92 114.94 110.79 1zzv s ASN 66 Ca 0.00 0.07 0.00 0.00 -0.71 0.00 0.00 52.86 52.22 1zzv s ASN 66 Cb 0.00 -0.08 0.00 0.00 0.41 0.00 0.00 41.25 41.58 1zzv s ASN 66 CO 0.00 -0.17 0.00 -3.20 -1.51 0.00 0.00 177.10 172.22 1zzv n ASN 67 N 4.55 0.00 -4.84 -1.22 5.15 -1.26 -4.87 115.26 112.76 1zzv n ASN 67 Ca -0.20 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.49 1zzv n ASN 67 Cb 0.50 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.71 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 0.00 4.42 0.18 1.20 0.01 -1.26 -4.68 113.70 113.56 1zzv s SER 68 Ca 0.00 -1.43 -0.01 0.00 1.31 0.00 0.00 55.95 55.83 1zzv s SER 68 Cb 0.00 0.48 -0.04 0.00 0.21 0.00 0.00 66.02 66.67 1zzv s SER 68 CO 0.00 -1.00 0.09 0.26 0.41 0.00 0.00 173.24 173.00 1zzv s TRP 69 N -2.82 1.08 -0.01 2.43 0.51 -0.67 -0.95 118.94 118.52 1zzv s TRP 69 Ca 0.21 -1.28 -0.15 0.00 -2.12 0.00 0.00 56.10 52.76 1zzv s TRP 69 Cb -0.01 -0.57 0.02 0.00 -0.81 0.00 0.00 33.47 32.11 1zzv s TRP 69 CO 0.13 -0.54 0.32 -0.08 -0.51 0.00 0.00 176.95 176.28 1zzv s THR 70 N -4.05 0.06 -0.56 2.01 -1.32 0.14 -1.02 115.64 110.90 1zzv s THR 70 Ca 0.32 -0.48 -0.20 0.00 -1.21 0.00 0.00 61.69 60.12 1zzv s THR 70 Cb 0.07 -0.66 0.07 0.00 -1.51 0.00 0.00 72.50 70.47 1zzv s THR 70 CO 0.08 -0.27 0.73 -0.76 -2.21 0.00 0.00 174.62 172.19 1zzv s LEU 71 N -1.41 4.95 -0.26 9.08 1.43 -0.39 -1.19 118.68 130.89 1zzv s LEU 71 Ca -0.13 -1.05 -0.22 0.00 -1.03 0.00 0.00 54.13 51.70 1zzv s LEU 71 Cb -0.05 -2.43 -0.01 0.00 0.03 0.00 0.00 46.19 43.73 1zzv s LEU 71 CO 0.04 -1.08 0.73 -0.70 0.23 0.00 0.00 176.35 175.57 1zzv s GLU 72 N 2.98 4.11 -0.32 1.70 2.12 0.19 -4.86 118.70 124.62 1zzv s GLU 72 Ca 0.16 0.70 -0.29 0.00 0.36 0.00 0.00 54.97 55.91 1zzv s GLU 72 Cb -0.20 -3.66 0.00 0.00 0.26 0.00 0.00 34.13 30.53 1zzv s GLU 72 CO 0.10 -0.50 1.34 -2.14 -0.54 0.00 0.00 175.26 173.53 1zzv s PRO 73 N 2.71 3.84 -0.48 4.30 0.02 -1.26 -1.03 135.00 143.11 1zzv s PRO 73 Ca 0.30 1.22 0.04 0.00 0.02 0.00 0.00 61.00 62.58 1zzv s PRO 73 Cb -0.15 -3.92 0.21 0.00 0.02 0.00 0.00 34.50 30.66 1zzv s PRO 73 CO 0.09 -1.22 0.85 0.00 -0.33 0.00 0.00 177.00 176.39 1zzv n ALA 74 N 7.91 -2.12 -1.22 -1.55 0.00 -1.24 -4.98 120.51 117.31 1zzv n ALA 74 Ca 0.15 -0.93 -0.26 0.00 0.00 0.00 0.00 53.44 52.40 1zzv n ALA 74 Cb 0.47 -1.80 -0.09 0.00 0.00 0.00 0.00 19.45 18.02 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 2.48 2.89 -3.38 0.00 -0.04 -0.79 -4.58 135.00 131.58 1zzv n PRO 75 Ca 0.14 -1.74 -0.13 0.00 -0.04 0.00 0.00 63.50 61.74 1zzv n PRO 75 Cb 0.60 -2.38 0.01 0.00 -0.04 0.00 0.00 33.50 31.69 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 2.79 -2.60 -2.44 0.55 0.00 -1.26 -4.97 120.51 112.58 1zzv n ALA 76 Ca 0.59 -0.11 -0.34 0.00 0.00 0.00 0.00 53.44 53.58 1zzv n ALA 76 Cb 0.57 -1.83 -0.06 0.00 0.00 0.00 0.00 19.45 18.14 1zzv n ALA 76 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1zzv s PRO 77 N -4.07 3.87 0.08 0.00 0.04 -1.26 -5.01 135.00 128.65 1zzv s PRO 77 Ca 0.09 0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.47 1zzv s PRO 77 Cb -0.03 -2.88 0.00 0.00 0.04 0.00 0.00 34.50 31.63 1zzv s PRO 77 CO 0.81 0.46 0.00 1.63 0.04 0.00 0.00 177.00 179.94 1zzv n LYS 78 N 0.59 0.00 -0.88 4.56 5.02 -1.26 -4.93 118.16 121.26 1zzv n LYS 78 Ca -0.05 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.21 1zzv n LYS 78 Cb 0.52 -0.33 -0.04 0.00 -0.02 0.00 0.00 35.03 35.16 1zzv n LYS 78 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1zzv n GLU 79 N -3.14 0.00 0.00 1.97 0.28 -1.26 -5.31 120.64 113.19 1zzv n GLU 79 Ca 0.00 -0.82 0.00 0.00 -0.16 0.00 0.00 57.16 56.18 1zzv n GLU 79 Cb 0.18 0.25 0.00 0.00 1.43 0.00 0.00 31.44 33.30 1zzv n GLU 79 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57