#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bbz s LEU 2 N 0.00 3.69 0.41 3.41 2.96 -1.26 -1.16 118.68 126.73 1bbz s LEU 2 Ca 0.00 -0.51 0.06 0.00 -0.22 0.00 0.00 54.13 53.47 1bbz s LEU 2 Cb 0.00 -1.90 -0.07 0.00 0.50 0.00 0.00 46.19 44.72 1bbz s LEU 2 CO 0.00 -0.13 0.01 -0.36 -1.32 0.00 0.00 176.35 174.55 1bbz s PHE 3 N 1.55 2.42 0.01 5.38 0.40 0.59 -1.63 117.98 126.70 1bbz s PHE 3 Ca 0.04 -0.72 0.04 0.00 -0.60 0.00 0.00 56.93 55.69 1bbz s PHE 3 Cb -0.16 -1.72 -0.01 0.00 0.51 0.00 0.00 43.02 41.63 1bbz s PHE 3 CO 0.03 0.39 -0.12 0.54 0.70 0.00 0.00 175.22 176.76 1bbz s VAL 4 N -2.78 0.95 0.01 -0.44 0.11 -0.16 -0.53 120.40 117.56 1bbz s VAL 4 Ca 0.33 -0.70 -0.30 0.00 -2.93 0.00 0.00 61.98 58.38 1bbz s VAL 4 Cb 0.09 -0.83 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 1bbz s VAL 4 CO 0.17 0.13 1.09 0.00 -3.33 0.00 0.00 175.10 173.15 1bbz s ALA 5 N -0.53 3.30 0.02 1.54 0.00 0.34 -2.31 121.76 124.12 1bbz s ALA 5 Ca 0.03 0.65 0.10 0.00 0.00 0.00 0.00 51.96 52.74 1bbz s ALA 5 Cb -0.06 -3.41 -0.19 0.00 0.00 0.00 0.00 23.12 19.47 1bbz s ALA 5 CO 0.00 -0.39 1.06 -0.07 0.00 0.00 0.00 175.76 176.36 1bbz h LEU 6 N 7.05 0.00 -8.05 0.00 3.38 -0.79 0.99 115.31 117.88 1bbz h LEU 6 Ca -0.40 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.46 1bbz h LEU 6 Cb 1.21 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.82 1bbz h LEU 6 CO 0.80 0.92 -0.44 -0.31 0.09 0.00 0.00 178.44 179.49 1bbz s TYR 7 N -2.71 0.39 0.28 1.13 2.02 -1.24 -4.80 117.35 112.42 1bbz s TYR 7 Ca -0.01 -0.81 -0.29 0.00 -0.37 0.00 0.00 57.07 55.59 1bbz s TYR 7 Cb 0.09 -0.17 -0.09 0.00 -0.40 0.00 0.00 41.96 41.38 1bbz s TYR 7 CO 0.81 -0.57 1.06 -0.51 -1.57 0.00 0.00 175.55 174.77 1bbz s ASP 8 N -2.93 7.31 -0.04 2.29 1.01 -1.26 -3.98 116.67 119.07 1bbz s ASP 8 Ca 0.12 2.18 -0.01 0.00 0.71 0.00 0.00 52.55 55.55 1bbz s ASP 8 Cb 0.05 -2.62 0.03 0.00 1.01 0.00 0.00 42.92 41.39 1bbz s ASP 8 CO -0.05 -0.10 0.08 0.12 0.21 0.00 0.00 175.17 175.42 1bbz s PHE 9 N -1.21 -0.06 -0.19 4.23 5.36 -0.20 -4.96 117.98 120.95 1bbz s PHE 9 Ca 0.45 0.28 -0.07 0.00 -0.96 0.00 0.00 56.93 56.63 1bbz s PHE 9 Cb -0.30 -0.16 -0.04 0.00 -0.34 0.00 0.00 43.02 42.19 1bbz s PHE 9 CO 0.38 -0.12 0.07 0.08 -1.46 0.00 0.00 175.22 174.17 1bbz s VAL 10 N 1.05 4.73 0.48 3.12 1.01 -1.26 -0.70 120.40 128.83 1bbz s VAL 10 Ca -0.08 -0.05 -0.23 0.00 0.00 0.00 0.00 61.98 61.61 1bbz s VAL 10 Cb -0.12 -3.14 -0.08 0.00 0.00 0.00 0.00 36.38 33.04 1bbz s VAL 10 CO -0.04 0.44 1.24 0.00 0.00 0.00 0.00 175.10 176.73 1bbz n ALA 11 N 3.75 1.15 -1.42 5.51 0.00 -1.26 -4.87 120.51 123.37 1bbz n ALA 11 Ca -0.16 0.19 0.05 0.00 0.00 0.00 0.00 53.44 53.51 1bbz n ALA 11 Cb 0.52 -2.26 0.07 0.00 0.00 0.00 0.00 19.45 17.78 1bbz n ALA 11 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bbz n SER 12 N -0.24 1.21 0.00 0.00 3.41 -1.26 -4.95 113.62 111.79 1bbz n SER 12 Ca 0.09 -2.47 0.00 0.00 -0.26 0.00 0.00 58.87 56.23 1bbz n SER 12 Cb 0.42 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 1bbz n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bbz n GLY 13 N -0.70 -1.80 2.72 5.00 0.00 -1.26 -4.98 105.19 104.16 1bbz n GLY 13 Ca 0.08 -1.82 -0.21 0.00 0.00 0.00 0.00 46.02 44.07 1bbz n GLY 13 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bbz n ASP 14 N 0.22 -5.59 -1.27 1.61 8.00 -1.26 -1.73 116.55 116.53 1bbz n ASP 14 Ca 0.00 -0.12 -0.14 0.00 0.71 0.00 0.00 54.79 55.24 1bbz n ASP 14 Cb 0.00 -4.60 -0.03 0.00 -0.02 0.00 0.00 41.12 36.47 1bbz n ASP 14 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1bbz n ASN 15 N -2.21 -4.44 -4.88 -2.24 4.13 -1.26 -4.88 115.26 99.48 1bbz n ASN 15 Ca -0.17 0.18 -0.30 0.00 1.68 0.00 0.00 54.58 55.97 1bbz n ASN 15 Cb 0.64 -3.36 -0.00 0.00 -1.54 0.00 0.00 39.78 35.52 1bbz n ASN 15 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1bbz s THR 16 N -2.58 4.77 -0.06 3.41 -4.23 -0.70 -0.93 115.64 115.31 1bbz s THR 16 Ca 0.00 0.64 0.05 0.00 -1.18 0.00 0.00 61.69 61.20 1bbz s THR 16 Cb 0.00 -3.84 -0.01 0.00 1.34 0.00 0.00 72.50 70.00 1bbz s THR 16 CO 0.00 -0.92 -0.22 -0.22 -0.54 0.00 0.00 174.62 172.72 1bbz s LEU 17 N -4.75 2.01 0.21 4.79 2.96 -0.24 -4.62 118.68 119.04 1bbz s LEU 17 Ca 0.52 -0.47 -0.30 0.00 -0.22 0.00 0.00 54.13 53.67 1bbz s LEU 17 Cb -0.11 -1.24 -0.08 0.00 0.50 0.00 0.00 46.19 45.26 1bbz s LEU 17 CO 0.46 0.19 1.14 -0.44 -1.32 0.00 0.00 176.35 176.38 1bbz s SER 18 N 0.04 7.19 0.03 3.68 0.01 -1.26 -4.41 113.70 118.98 1bbz s SER 18 Ca -0.07 2.21 0.04 0.00 1.31 0.00 0.00 55.95 59.43 1bbz s SER 18 Cb -0.14 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.46 1bbz s SER 18 CO 0.04 -0.26 -0.12 0.27 0.41 0.00 0.00 173.24 173.59 1bbz s ILE 19 N -0.47 0.94 -0.07 1.44 -4.36 0.12 -4.92 121.20 113.87 1bbz s ILE 19 Ca 0.49 -0.92 0.00 0.00 -0.26 0.00 0.00 60.65 59.97 1bbz s ILE 19 Cb -0.32 -0.86 -0.03 0.00 1.25 0.00 0.00 42.46 42.50 1bbz s ILE 19 CO 0.38 -0.04 -0.06 -0.89 0.24 0.00 0.00 174.94 174.56 1bbz s THR 20 N -0.85 3.77 0.13 8.37 2.01 -1.26 -1.03 115.64 126.77 1bbz s THR 20 Ca -0.00 -0.45 -0.35 0.00 0.31 0.00 0.00 61.69 61.19 1bbz s THR 20 Cb -0.07 -2.55 -0.15 0.00 0.01 0.00 0.00 72.50 69.74 1bbz s THR 20 CO 0.01 0.60 1.50 1.17 -0.69 0.00 0.00 174.62 177.21 1bbz n LYS 21 N 2.23 1.79 0.00 4.92 4.81 -1.26 -0.87 118.16 129.79 1bbz n LYS 21 Ca -0.18 0.65 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 1bbz n LYS 21 Cb 0.53 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 33.21 1bbz n LYS 21 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bbz n GLY 22 N 3.13 2.13 3.76 3.14 0.00 0.34 -4.95 105.19 112.73 1bbz n GLY 22 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1bbz n GLY 22 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bbz s GLU 23 N -0.72 4.54 0.25 1.61 2.12 -0.05 -4.68 118.70 121.77 1bbz s GLU 23 Ca 0.00 1.94 -0.15 0.00 0.36 0.00 0.00 54.97 57.11 1bbz s GLU 23 Cb 0.00 -3.16 -0.08 0.00 0.26 0.00 0.00 34.13 31.15 1bbz s GLU 23 CO 0.00 0.07 0.67 0.15 -0.54 0.00 0.00 175.26 175.61 1bbz s LYS 24 N -1.48 4.04 -0.02 4.30 -0.14 -1.26 -0.51 119.74 124.67 1bbz s LYS 24 Ca 0.46 0.63 -0.16 0.00 -1.36 0.00 0.00 55.97 55.54 1bbz s LYS 24 Cb -0.34 -2.69 0.03 0.00 -1.68 0.00 0.00 37.83 33.15 1bbz s LYS 24 CO 0.44 0.31 0.35 -0.48 -0.76 0.00 0.00 175.35 175.21 1bbz s LEU 25 N -2.48 0.71 -0.19 3.17 -0.00 0.31 -4.61 118.68 115.59 1bbz s LEU 25 Ca 0.47 0.18 -0.08 0.00 -0.00 0.00 0.00 54.13 54.69 1bbz s LEU 25 Cb -0.13 1.38 -0.04 0.00 -0.00 0.00 0.00 46.19 47.39 1bbz s LEU 25 CO 0.19 -0.44 0.09 -0.13 -0.00 0.00 0.00 176.35 176.06 1bbz s ARG 26 N -1.22 4.02 -0.30 1.48 3.00 -0.51 -0.30 118.95 125.12 1bbz s ARG 26 Ca -0.13 -0.31 -0.20 0.00 0.00 0.00 0.00 55.73 55.09 1bbz s ARG 26 Cb -0.05 -3.30 -0.01 0.00 0.00 0.00 0.00 34.95 31.59 1bbz s ARG 26 CO 0.05 0.24 0.61 0.08 0.00 0.00 0.00 175.30 176.27 1bbz s VAL 27 N 0.49 4.96 -0.42 3.52 1.01 -0.31 -0.72 120.40 128.93 1bbz s VAL 27 Ca 0.05 0.83 0.23 0.00 0.00 0.00 0.00 61.98 63.08 1bbz s VAL 27 Cb -0.12 -3.98 -0.11 0.00 0.00 0.00 0.00 36.38 32.17 1bbz s VAL 27 CO 0.00 -0.12 0.96 0.18 0.00 0.00 0.00 175.10 176.13 1bbz n LEU 28 N 5.83 0.59 0.00 3.92 4.32 0.51 -2.50 117.00 129.66 1bbz n LEU 28 Ca -0.02 0.09 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 1bbz n LEU 28 Cb 0.49 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 1bbz n LEU 28 CO 0.45 -0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.20 1bbz n GLY 29 N 1.30 -0.81 3.48 -0.72 0.00 -1.17 -4.96 105.19 102.32 1bbz n GLY 29 Ca 0.01 -1.30 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 1bbz n GLY 29 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bbz s TYR 30 N -2.00 1.86 0.48 1.61 2.02 -1.26 0.91 117.35 120.97 1bbz s TYR 30 Ca 0.00 -1.11 0.07 0.00 -0.37 0.00 0.00 57.07 55.66 1bbz s TYR 30 Cb 0.00 -1.22 0.03 0.00 -0.40 0.00 0.00 41.96 40.38 1bbz s TYR 30 CO 0.00 -0.14 0.66 0.54 -1.57 0.00 0.00 175.55 175.05 1bbz s ASN 31 N -3.54 5.44 0.25 2.29 4.22 -0.74 -4.87 114.94 117.98 1bbz s ASN 31 Ca 0.30 -0.46 -0.10 0.00 -2.14 0.00 0.00 52.86 50.46 1bbz s ASN 31 Cb 0.06 -0.45 0.37 0.00 1.28 0.00 0.00 41.25 42.51 1bbz s ASN 31 CO 0.15 -0.98 1.48 0.00 -2.04 0.00 0.00 177.10 175.70 1bbz n HIS 32 N -2.04 0.24 0.79 1.54 1.44 -1.26 -0.95 115.22 114.98 1bbz n HIS 32 Ca 0.10 1.16 0.12 0.00 -2.01 0.00 0.00 57.72 57.09 1bbz n HIS 32 Cb 0.60 -0.99 0.25 0.00 0.12 0.00 0.00 29.99 29.97 1bbz n HIS 32 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 1bbz n ASN 33 N -5.50 2.78 0.00 4.39 2.04 -1.26 -4.97 115.26 112.74 1bbz n ASN 33 Ca 0.13 -1.89 0.00 0.00 -0.44 0.00 0.00 54.58 52.39 1bbz n ASN 33 Cb 0.45 -0.14 0.00 0.00 -2.53 0.00 0.00 39.78 37.56 1bbz n ASN 33 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1bbz n GLY 34 N 1.36 2.12 0.23 4.83 0.00 -0.13 -4.87 105.19 108.72 1bbz n GLY 34 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.25 1bbz n GLY 34 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1bbz h GLU 35 N 2.10 0.03 -6.66 1.61 5.08 -1.93 -3.42 114.58 111.39 1bbz h GLU 35 Ca 0.00 -0.01 -0.69 0.00 -1.00 0.00 0.00 59.36 57.67 1bbz h GLU 35 Cb 0.00 -0.01 -0.22 0.00 0.50 0.00 0.00 28.75 29.02 1bbz h GLU 35 CO 0.00 0.18 -0.82 -1.58 -1.00 0.00 0.00 179.01 175.79 1bbz s TRP 36 N -4.71 2.50 -0.04 4.33 0.52 -1.26 -1.73 118.94 118.54 1bbz s TRP 36 Ca -0.04 -0.29 0.03 0.00 0.02 0.00 0.00 56.10 55.82 1bbz s TRP 36 Cb 0.16 -1.41 0.00 0.00 -1.15 0.00 0.00 33.47 31.07 1bbz s TRP 36 CO 0.70 0.27 -0.13 0.00 0.02 0.00 0.00 176.95 177.80 1bbz s GLU 38 N 0.27 4.22 0.25 0.00 2.56 0.26 -0.39 118.70 125.86 1bbz s GLU 38 Ca -0.07 0.94 0.05 0.00 0.00 0.00 0.00 54.97 55.89 1bbz s GLU 38 Cb -0.12 -3.62 -0.05 0.00 2.00 0.00 0.00 34.13 32.34 1bbz s GLU 38 CO 0.02 -0.44 -0.04 0.00 -0.56 0.00 0.00 175.26 174.24 1bbz s ALA 39 N 2.58 2.05 -0.04 6.30 0.00 0.41 -0.36 121.76 132.69 1bbz s ALA 39 Ca 0.35 -1.82 0.01 0.00 0.00 0.00 0.00 51.96 50.51 1bbz s ALA 39 Cb -0.16 0.32 0.02 0.00 0.00 0.00 0.00 23.12 23.30 1bbz s ALA 39 CO 0.09 -0.15 -0.03 -1.14 0.00 0.00 0.00 175.76 174.53 1bbz s GLN 40 N -3.79 0.65 0.23 0.00 0.74 0.11 -1.20 119.66 116.39 1bbz s GLN 40 Ca 0.28 -0.04 0.01 0.00 0.05 0.00 0.00 55.36 55.66 1bbz s GLN 40 Cb 0.05 -0.73 -0.00 0.00 1.10 0.00 0.00 33.01 33.43 1bbz s GLN 40 CO 0.10 -0.10 0.04 0.25 -0.55 0.00 0.00 175.29 175.03 1bbz n THR 41 N 4.10 0.00 0.29 -0.34 -2.24 0.73 -1.42 114.28 115.40 1bbz n THR 41 Ca -0.25 -1.20 0.14 0.00 -2.27 0.00 0.00 64.05 60.47 1bbz n THR 41 Cb 0.51 0.35 0.85 0.00 -2.10 0.00 0.00 70.33 69.93 1bbz n THR 41 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1bbz h LYS 42 N 0.00 0.00 -1.82 -0.78 2.10 -2.00 -3.06 116.57 111.01 1bbz h LYS 42 Ca -0.18 0.00 -0.54 0.00 -2.00 0.00 0.00 60.65 57.93 1bbz h LYS 42 Cb 0.62 0.00 -0.41 0.00 -0.90 0.00 0.00 32.23 31.54 1bbz h LYS 42 CO 0.29 0.03 -0.83 0.27 -2.00 0.00 0.00 179.45 177.21 1bbz n ASN 43 N -3.88 3.58 0.00 7.07 0.23 -1.26 -5.11 115.26 115.89 1bbz n ASN 43 Ca -0.03 -3.46 0.00 0.00 -0.53 0.00 0.00 54.58 50.56 1bbz n ASN 43 Cb 0.12 -0.53 0.00 0.00 -2.08 0.00 0.00 39.78 37.28 1bbz n ASN 43 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bbz n GLY 44 N -0.22 0.13 3.15 4.83 0.00 -1.16 -4.95 105.19 106.98 1bbz n GLY 44 Ca 0.30 -2.29 -0.10 0.00 0.00 0.00 0.00 46.02 43.92 1bbz n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bbz s GLN 45 N -0.23 0.79 0.00 1.61 -0.21 -1.26 -0.19 119.66 120.17 1bbz s GLN 45 Ca 0.00 -1.29 0.00 0.00 0.02 0.00 0.00 55.36 54.09 1bbz s GLN 45 Cb 0.00 -0.16 0.00 0.00 1.00 0.00 0.00 33.01 33.85 1bbz s GLN 45 CO 0.00 -0.03 0.00 0.41 -2.12 0.00 0.00 175.29 173.55 1bbz n GLY 46 N 0.05 0.54 3.77 3.09 0.00 -0.34 -4.59 105.19 107.70 1bbz n GLY 46 Ca -0.13 -1.44 -0.39 0.00 0.00 0.00 0.00 46.02 44.06 1bbz n GLY 46 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1bbz s TRP 47 N -1.80 3.85 0.04 1.61 0.52 -0.11 -0.45 118.94 122.61 1bbz s TRP 47 Ca 0.00 1.77 -0.01 0.00 0.02 0.00 0.00 56.10 57.88 1bbz s TRP 47 Cb 0.00 -2.88 -0.03 0.00 -1.15 0.00 0.00 33.47 29.41 1bbz s TRP 47 CO 0.00 0.39 -0.02 0.14 0.02 0.00 0.00 176.95 177.48 1bbz s VAL 48 N -1.33 0.18 0.16 4.03 -7.23 0.47 -1.08 120.40 115.60 1bbz s VAL 48 Ca 0.43 -1.46 -0.32 0.00 -1.81 0.00 0.00 61.98 58.82 1bbz s VAL 48 Cb -0.22 -1.05 -0.10 0.00 0.56 0.00 0.00 36.38 35.56 1bbz s VAL 48 CO 0.27 -0.81 1.59 -2.84 -0.31 0.00 0.00 175.10 173.01 1bbz s PRO 49 N -3.01 4.21 0.39 4.82 0.02 -1.26 -0.69 135.00 139.48 1bbz s PRO 49 Ca -0.02 2.38 0.06 0.00 0.02 0.00 0.00 61.00 63.44 1bbz s PRO 49 Cb 0.01 -3.19 0.79 0.00 0.02 0.00 0.00 34.50 32.14 1bbz s PRO 49 CO -0.07 -0.63 2.03 0.77 -0.33 0.00 0.00 177.00 178.78 1bbz h SER 50 N 6.93 0.53 0.00 2.53 0.02 -1.58 -2.25 113.55 119.73 1bbz h SER 50 Ca -0.43 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1bbz h SER 50 Cb 1.20 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.61 1bbz h SER 50 CO 0.92 0.40 0.00 -3.20 -1.14 0.00 0.00 176.83 173.81 1bbz n ASN 51 N -4.45 0.00 -0.89 3.07 5.15 -1.26 -2.76 115.26 114.11 1bbz n ASN 51 Ca 0.04 -1.08 0.11 0.00 -0.60 0.00 0.00 54.58 53.05 1bbz n ASN 51 Cb 0.07 0.00 0.09 0.00 -0.53 0.00 0.00 39.78 39.42 1bbz n ASN 51 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1bbz n TYR 52 N -0.91 0.01 -4.21 1.20 4.02 -0.85 -5.00 117.16 111.43 1bbz n TYR 52 Ca 0.18 -0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.94 1bbz n TYR 52 Cb 0.08 -0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.30 1bbz n TYR 52 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 1bbz s ILE 53 N -1.84 0.94 -0.11 -0.72 -4.36 -1.11 -0.04 121.20 113.96 1bbz s ILE 53 Ca 0.26 -1.97 -0.18 0.00 -0.26 0.00 0.00 60.65 58.50 1bbz s ILE 53 Cb 0.19 -1.73 0.04 0.00 1.25 0.00 0.00 42.46 42.21 1bbz s ILE 53 CO 0.28 -0.79 0.46 0.28 0.24 0.00 0.00 174.94 175.41 1bbz s THR 54 N -3.38 0.02 0.57 8.37 -1.32 -0.98 -4.92 115.64 114.00 1bbz s THR 54 Ca 0.14 -0.14 -0.21 0.00 -1.21 0.00 0.00 61.69 60.27 1bbz s THR 54 Cb 0.03 -0.71 -0.05 0.00 -1.51 0.00 0.00 72.50 70.27 1bbz s THR 54 CO -0.02 -0.08 1.25 -2.65 -2.21 0.00 0.00 174.62 170.91 1bbz n PRO 55 N 2.04 1.41 -1.76 7.08 -0.02 -1.26 -0.99 135.00 141.49 1bbz n PRO 55 Ca -0.17 0.53 -0.31 0.00 -2.02 0.00 0.00 63.50 61.53 1bbz n PRO 55 Cb 0.57 -2.45 0.03 0.00 -0.02 0.00 0.00 33.50 31.62 1bbz n PRO 55 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1bbz s VAL 56 N -1.35 4.45 -1.53 -1.45 -7.23 -0.65 -4.16 120.40 108.49 1bbz s VAL 56 Ca 0.74 0.80 -0.05 0.00 -1.81 0.00 0.00 61.98 61.66 1bbz s VAL 56 Cb -0.42 -3.70 0.01 0.00 0.56 0.00 0.00 36.38 32.84 1bbz s VAL 56 CO 0.48 -1.04 0.57 0.59 -0.31 0.00 0.00 175.10 175.39 1bbz n ASN 57 N -2.89 -5.82 -0.21 4.85 4.13 -1.26 -5.01 115.26 109.05 1bbz n ASN 57 Ca 0.07 -0.29 0.03 0.00 1.68 0.00 0.00 54.58 56.06 1bbz n ASN 57 Cb 0.54 -4.71 0.02 0.00 -1.54 0.00 0.00 39.78 34.09 1bbz n ASN 57 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30