#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 3.37 0.38 1.20 2.96 -1.26 -4.28 118.68 121.04 1bbz s LEU 2 Ca 0.00 0.01 0.08 0.00 -0.22 0.00 0.00 54.13 54.00 1bbz s LEU 2 Cb 0.00 -1.78 -0.07 0.00 0.50 0.00 0.00 46.19 44.85 1bbz s LEU 2 CO 0.00 0.30 0.00 -0.36 -1.32 0.00 0.00 176.35 174.97 1bbz s PHE 3 N -0.40 2.50 -0.00 5.38 0.40 0.57 -0.99 117.98 125.44 1bbz s PHE 3 Ca 0.07 -0.56 0.02 0.00 -0.60 0.00 0.00 56.93 55.86 1bbz s PHE 3 Cb -0.12 -1.62 -0.01 0.00 0.51 0.00 0.00 43.02 41.78 1bbz s PHE 3 CO 0.02 0.46 -0.07 0.54 0.70 0.00 0.00 175.22 176.87 1bbz s VAL 4 N -2.62 0.54 0.06 -0.44 0.11 0.82 -0.84 120.40 118.03 1bbz s VAL 4 Ca 0.35 -0.33 -0.31 0.00 -2.93 0.00 0.00 61.98 58.76 1bbz s VAL 4 Cb 0.05 -0.46 -0.06 0.00 -1.53 0.00 0.00 36.38 34.38 1bbz s VAL 4 CO 0.18 0.12 1.23 0.00 -3.33 0.00 0.00 175.10 173.31 1bbz s ALA 5 N -0.22 3.43 0.10 1.54 0.00 -0.34 -1.79 121.76 124.48 1bbz s ALA 5 Ca 0.02 0.88 0.03 0.00 0.00 0.00 0.00 51.96 52.89 1bbz s ALA 5 Cb -0.03 -3.47 -0.24 0.00 0.00 0.00 0.00 23.12 19.38 1bbz s ALA 5 CO -0.00 -0.49 1.20 -0.07 0.00 0.00 0.00 175.76 176.39 1bbz h LEU 6 N 6.93 0.16 -8.38 0.00 3.38 -0.54 -0.05 115.31 116.81 1bbz h LEU 6 Ca -0.41 -0.17 -0.17 0.00 0.09 0.00 0.00 57.88 57.21 1bbz h LEU 6 Cb 1.21 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.77 1bbz h LEU 6 CO 0.83 1.14 -0.55 -0.31 0.09 0.00 0.00 178.44 179.63 1bbz s TYR 7 N -2.68 0.80 0.34 1.13 2.02 -1.24 -4.79 117.35 112.92 1bbz s TYR 7 Ca -0.01 -1.14 -0.26 0.00 -0.37 0.00 0.00 57.07 55.28 1bbz s TYR 7 Cb 0.09 -0.38 -0.09 0.00 -0.40 0.00 0.00 41.96 41.18 1bbz s TYR 7 CO 0.84 -0.60 1.03 -0.51 -1.57 0.00 0.00 175.55 174.74 1bbz s ASP 8 N -3.05 7.09 -0.08 2.29 1.11 -1.26 -3.95 116.67 118.81 1bbz s ASP 8 Ca 0.25 2.05 -0.03 0.00 0.18 0.00 0.00 52.55 55.00 1bbz s ASP 8 Cb 0.06 -2.60 0.05 0.00 1.07 0.00 0.00 42.92 41.50 1bbz s ASP 8 CO 0.04 -0.26 0.17 0.12 1.18 0.00 0.00 175.17 176.42 1bbz s PHE 9 N -1.48 -0.21 -0.22 4.23 5.36 -0.40 -4.96 117.98 120.31 1bbz s PHE 9 Ca 0.51 0.61 -0.10 0.00 -0.96 0.00 0.00 56.93 56.98 1bbz s PHE 9 Cb -0.24 -0.14 -0.05 0.00 -0.34 0.00 0.00 43.02 42.24 1bbz s PHE 9 CO 0.31 -0.23 0.15 0.08 -1.46 0.00 0.00 175.22 174.06 1bbz s VAL 10 N 1.76 5.38 0.32 3.12 1.01 -1.26 -1.15 120.40 129.58 1bbz s VAL 10 Ca -0.03 0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 1bbz s VAL 10 Cb -0.12 -3.49 -0.12 0.00 0.00 0.00 0.00 36.38 32.65 1bbz s VAL 10 CO -0.06 0.39 1.34 0.00 0.00 0.00 0.00 175.10 176.77 1bbz n ALA 11 N 3.92 1.36 -2.43 5.51 0.00 -1.26 -4.87 120.51 122.74 1bbz n ALA 11 Ca -0.15 0.37 -0.13 0.00 0.00 0.00 0.00 53.44 53.52 1bbz n ALA 11 Cb 0.52 -2.28 0.03 0.00 0.00 0.00 0.00 19.45 17.73 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 1.18 3.31 -0.41 0.00 3.41 -1.26 -4.94 113.62 114.90 1bbz n SER 12 Ca 0.06 -2.97 0.00 0.00 -0.26 0.00 0.00 58.87 55.70 1bbz n SER 12 Cb 0.35 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 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 -0.60 -0.73 2.93 5.00 0.00 -1.26 -4.91 105.19 105.61 1bbz n GLY 13 Ca 0.26 -1.08 -0.22 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.83 -5.90 -0.87 1.61 8.00 -1.26 -2.16 116.55 114.15 1bbz n ASP 14 Ca 0.00 -0.24 -0.10 0.00 0.71 0.00 0.00 54.79 55.15 1bbz n ASP 14 Cb 0.00 -4.80 -0.04 0.00 -0.02 0.00 0.00 41.12 36.26 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 -2.42 -4.12 -4.91 -2.24 5.03 -1.26 -4.90 115.26 100.44 1bbz n ASN 15 Ca -0.13 0.21 -0.27 0.00 0.87 0.00 0.00 54.58 55.26 1bbz n ASN 15 Cb 0.63 -2.68 0.02 0.00 -1.02 0.00 0.00 39.78 36.72 1bbz n ASN 15 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1bbz s THR 16 N -2.41 4.18 -0.04 3.41 -4.23 -0.92 -0.91 115.64 114.73 1bbz s THR 16 Ca 0.00 0.15 0.03 0.00 -1.18 0.00 0.00 61.69 60.69 1bbz s THR 16 Cb 0.00 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.21 1bbz s THR 16 CO 0.00 -0.66 -0.12 -0.22 -0.54 0.00 0.00 174.62 173.08 1bbz s LEU 17 N -4.92 1.81 0.32 4.79 2.96 -0.69 -4.60 118.68 118.34 1bbz s LEU 17 Ca 0.52 -0.25 -0.27 0.00 -0.22 0.00 0.00 54.13 53.91 1bbz s LEU 17 Cb -0.10 -0.71 -0.09 0.00 0.50 0.00 0.00 46.19 45.78 1bbz s LEU 17 CO 0.46 0.09 1.03 -0.44 -1.32 0.00 0.00 176.35 176.17 1bbz s SER 18 N 0.20 7.18 0.01 3.68 0.01 -1.26 -4.44 113.70 119.07 1bbz s SER 18 Ca -0.04 2.07 0.01 0.00 1.31 0.00 0.00 55.95 59.29 1bbz s SER 18 Cb -0.10 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 63.52 1bbz s SER 18 CO 0.01 -0.19 -0.03 0.27 0.41 0.00 0.00 173.24 173.71 1bbz s ILE 19 N -1.40 0.21 -0.07 1.44 -4.36 -0.30 -4.92 121.20 111.80 1bbz s ILE 19 Ca 0.49 -0.32 -0.02 0.00 -0.26 0.00 0.00 60.65 60.54 1bbz s ILE 19 Cb -0.26 -0.22 -0.03 0.00 1.25 0.00 0.00 42.46 43.20 1bbz s ILE 19 CO 0.32 -0.07 0.03 -0.89 0.24 0.00 0.00 174.94 174.57 1bbz s THR 20 N -0.39 4.48 0.16 8.37 2.01 -1.26 -1.28 115.64 127.73 1bbz s THR 20 Ca -0.03 -0.25 -0.33 0.00 0.31 0.00 0.00 61.69 61.39 1bbz s THR 20 Cb -0.03 -2.92 -0.15 0.00 0.01 0.00 0.00 72.50 69.41 1bbz s THR 20 CO -0.00 0.56 1.30 1.17 -0.69 0.00 0.00 174.62 176.96 1bbz n LYS 21 N 1.95 1.45 0.00 4.92 4.81 -1.25 -0.48 118.16 129.55 1bbz n LYS 21 Ca -0.18 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 57.78 1bbz n LYS 21 Cb 0.54 -2.11 0.00 0.00 0.02 0.00 0.00 35.03 33.47 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 2.32 2.03 3.75 3.14 0.00 -0.03 -4.96 105.19 111.44 1bbz n GLY 22 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.51 4.59 0.26 1.61 2.12 0.37 -4.73 118.70 122.41 1bbz s GLU 23 Ca 0.00 1.81 -0.12 0.00 0.36 0.00 0.00 54.97 57.02 1bbz s GLU 23 Cb 0.00 -3.22 -0.08 0.00 0.26 0.00 0.00 34.13 31.09 1bbz s GLU 23 CO 0.00 0.10 0.63 0.15 -0.54 0.00 0.00 175.26 175.60 1bbz s LYS 24 N -0.94 3.91 0.13 4.30 1.02 -1.26 -1.20 119.74 125.70 1bbz s LYS 24 Ca 0.48 0.46 -0.19 0.00 0.02 0.00 0.00 55.97 56.74 1bbz s LYS 24 Cb -0.32 -2.59 0.05 0.00 -0.52 0.00 0.00 37.83 34.45 1bbz s LYS 24 CO 0.39 0.27 0.48 -0.48 -0.92 0.00 0.00 175.35 175.09 1bbz s LEU 25 N -2.79 0.02 -0.15 3.17 -0.00 -0.02 -4.74 118.68 114.17 1bbz s LEU 25 Ca 0.49 -0.17 -0.06 0.00 -0.00 0.00 0.00 54.13 54.39 1bbz s LEU 25 Cb -0.11 2.13 -0.04 0.00 -0.00 0.00 0.00 46.19 48.17 1bbz s LEU 25 CO 0.20 -0.88 0.06 -0.13 -0.00 0.00 0.00 176.35 175.59 1bbz s ARG 26 N -3.68 3.67 -0.26 1.48 3.00 -0.12 -0.32 118.95 122.72 1bbz s ARG 26 Ca 0.02 -0.32 -0.14 0.00 0.00 0.00 0.00 55.73 55.29 1bbz s ARG 26 Cb 0.01 -3.12 -0.04 0.00 0.00 0.00 0.00 34.95 31.80 1bbz s ARG 26 CO -0.12 0.45 0.31 0.08 0.00 0.00 0.00 175.30 176.03 1bbz s VAL 27 N -0.15 5.22 -0.83 3.52 1.01 -1.26 -0.99 120.40 126.93 1bbz s VAL 27 Ca 0.07 0.45 0.21 0.00 0.00 0.00 0.00 61.98 62.71 1bbz s VAL 27 Cb -0.12 -3.64 -0.24 0.00 0.00 0.00 0.00 36.38 32.37 1bbz s VAL 27 CO 0.01 0.20 0.82 0.18 0.00 0.00 0.00 175.10 176.31 1bbz n LEU 28 N 5.10 0.83 0.00 3.92 4.77 0.70 -4.82 117.00 127.50 1bbz n LEU 28 Ca -0.10 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 1bbz n LEU 28 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1bbz n LEU 28 CO 0.36 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1bbz n GLY 29 N 1.46 -0.94 3.14 -0.72 0.00 -1.24 -4.93 105.19 101.96 1bbz n GLY 29 Ca 0.03 -1.23 -0.10 0.00 0.00 0.00 0.00 46.02 44.71 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 0.79 0.93 1.61 1.51 -1.26 -0.42 117.35 118.51 1bbz s TYR 30 Ca 0.00 -0.85 -0.12 0.00 -1.01 0.00 0.00 57.07 55.08 1bbz s TYR 30 Cb 0.00 -0.47 0.21 0.00 -0.11 0.00 0.00 41.96 41.58 1bbz s TYR 30 CO 0.00 -0.17 1.27 0.54 -1.11 0.00 0.00 175.55 176.08 1bbz s ASN 31 N -2.73 3.16 0.23 2.29 4.22 -0.77 -4.91 114.94 116.42 1bbz s ASN 31 Ca 0.07 -0.03 -0.11 0.00 -2.14 0.00 0.00 52.86 50.65 1bbz s ASN 31 Cb 0.03 0.00 0.33 0.00 1.28 0.00 0.00 41.25 42.89 1bbz s ASN 31 CO -0.04 -2.68 1.62 1.12 -2.04 0.00 0.00 177.10 175.07 1bbz h HIS 32 N -1.47 -0.28 -0.60 1.54 2.07 -2.02 -1.82 115.15 112.56 1bbz h HIS 32 Ca -0.41 0.06 0.00 0.00 -2.85 0.00 0.00 60.37 57.17 1bbz h HIS 32 Cb 1.22 0.24 0.00 0.00 2.57 0.00 0.00 27.41 31.44 1bbz h HIS 32 CO -1.18 -0.29 0.00 0.27 -3.07 0.00 0.00 177.93 173.66 1bbz n ASN 33 N -5.44 4.30 0.00 3.10 2.04 -1.26 -4.94 115.26 113.06 1bbz n ASN 33 Ca 0.11 -2.36 0.00 0.00 -0.44 0.00 0.00 54.58 51.88 1bbz n ASN 33 Cb 0.40 -0.54 0.00 0.00 -2.53 0.00 0.00 39.78 37.11 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 1.12 0.68 0.22 4.83 0.00 -0.69 -4.84 105.19 106.52 1bbz n GLY 34 Ca 0.23 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.34 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 1.06 0.00 -6.52 1.61 5.08 -1.92 -3.42 114.58 110.47 1bbz h GLU 35 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1bbz h GLU 35 Cb 0.00 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.00 1bbz h GLU 35 CO 0.00 0.26 -0.86 -1.58 -1.00 0.00 0.00 179.01 175.83 1bbz s TRP 36 N -3.88 2.11 0.01 4.33 0.52 -1.26 -1.51 118.94 119.27 1bbz s TRP 36 Ca -0.01 -0.40 0.03 0.00 0.02 0.00 0.00 56.10 55.74 1bbz s TRP 36 Cb 0.12 -1.22 -0.01 0.00 -1.15 0.00 0.00 33.47 31.20 1bbz s TRP 36 CO 0.65 0.17 -0.09 0.00 0.02 0.00 0.00 176.95 177.70 1bbz s GLU 38 N -0.67 3.88 0.16 0.00 2.56 0.44 -1.44 118.70 123.63 1bbz s GLU 38 Ca -0.00 0.79 0.06 0.00 0.00 0.00 0.00 54.97 55.82 1bbz s GLU 38 Cb -0.05 -3.83 -0.04 0.00 2.00 0.00 0.00 34.13 32.21 1bbz s GLU 38 CO 0.00 -1.14 0.07 0.00 -0.56 0.00 0.00 175.26 173.63 1bbz s ALA 39 N 4.04 3.40 -0.06 6.30 0.00 0.06 -0.22 121.76 135.29 1bbz s ALA 39 Ca 0.46 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 51.15 1bbz s ALA 39 Cb -0.10 -1.20 0.02 0.00 0.00 0.00 0.00 23.12 21.84 1bbz s ALA 39 CO 0.24 0.51 -0.04 -1.14 0.00 0.00 0.00 175.76 175.33 1bbz s GLN 40 N -2.99 0.85 0.00 0.00 0.74 -0.16 -2.03 119.66 116.07 1bbz s GLN 40 Ca 0.29 -0.07 0.00 0.00 0.05 0.00 0.00 55.36 55.63 1bbz s GLN 40 Cb -0.10 -0.95 -0.00 0.00 1.10 0.00 0.00 33.01 33.06 1bbz s GLN 40 CO 0.21 -0.15 0.00 0.25 -0.55 0.00 0.00 175.29 175.05 1bbz n THR 41 N 4.40 0.00 1.00 -0.34 -2.24 0.23 -0.94 114.28 116.39 1bbz n THR 41 Ca -0.19 -0.02 0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1bbz n THR 41 Cb 0.51 0.01 0.54 0.00 -2.10 0.00 0.00 70.33 69.28 1bbz n THR 41 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1bbz n LYS 42 N -0.01 0.30 0.00 -0.78 4.01 -1.26 -2.38 118.16 118.04 1bbz n LYS 42 Ca -0.00 0.09 0.10 0.00 -0.51 0.00 0.00 58.31 57.98 1bbz n LYS 42 Cb 0.00 -1.50 -0.10 0.00 -0.51 0.00 0.00 35.03 32.93 1bbz n LYS 42 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1bbz n ASN 43 N -1.29 1.07 0.00 4.39 4.13 -1.26 -5.09 115.26 117.20 1bbz n ASN 43 Ca 0.10 -1.03 0.00 0.00 1.68 0.00 0.00 54.58 55.33 1bbz n ASN 43 Cb 0.17 0.93 0.00 0.00 -1.54 0.00 0.00 39.78 39.34 1bbz n ASN 43 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1bbz n GLY 44 N 1.46 0.58 3.37 7.41 0.00 -1.00 -5.09 105.19 111.92 1bbz n GLY 44 Ca 0.04 -2.00 -0.23 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.80 1.39 0.00 1.61 -0.21 -1.26 -0.60 119.66 119.79 1bbz s GLN 45 Ca 0.00 -1.50 0.00 0.00 0.02 0.00 0.00 55.36 53.88 1bbz s GLN 45 Cb 0.00 -1.48 0.00 0.00 1.00 0.00 0.00 33.01 32.53 1bbz s GLN 45 CO 0.00 0.30 0.00 0.41 -2.12 0.00 0.00 175.29 173.88 1bbz n GLY 46 N 0.10 1.72 3.77 3.09 0.00 -0.86 -4.72 105.19 108.29 1bbz n GLY 46 Ca -0.11 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.00 3.92 0.05 1.61 0.52 -0.09 -0.76 118.94 122.19 1bbz s TRP 47 Ca 0.00 1.78 0.01 0.00 0.02 0.00 0.00 56.10 57.91 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 0.45 -0.05 0.14 0.02 0.00 0.00 176.95 177.52 1bbz s VAL 48 N -1.22 0.37 0.27 4.03 -7.23 -0.52 -1.71 120.40 114.40 1bbz s VAL 48 Ca 0.40 -1.42 -0.30 0.00 -1.81 0.00 0.00 61.98 58.85 1bbz s VAL 48 Cb -0.24 -1.00 -0.11 0.00 0.56 0.00 0.00 36.38 35.60 1bbz s VAL 48 CO 0.29 -0.69 1.54 -2.84 -0.31 0.00 0.00 175.10 173.09 1bbz s PRO 49 N -2.68 4.17 0.28 4.82 0.02 -1.26 -0.84 135.00 139.52 1bbz s PRO 49 Ca -0.02 2.48 -0.00 0.00 0.02 0.00 0.00 61.00 63.47 1bbz s PRO 49 Cb -0.02 -3.06 0.41 0.00 0.02 0.00 0.00 34.50 31.86 1bbz s PRO 49 CO -0.04 -0.56 1.81 0.77 -0.33 0.00 0.00 177.00 178.65 1bbz h SER 50 N 5.00 0.72 0.00 2.53 0.02 -1.52 -2.32 113.55 117.97 1bbz h SER 50 Ca -0.46 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 1bbz h SER 50 Cb 1.22 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.57 1bbz h SER 50 CO 0.79 0.75 0.00 -0.46 -1.14 0.00 0.00 176.83 176.77 1bbz n ASN 51 N -4.25 0.00 -0.46 3.07 0.23 -1.26 -2.61 115.26 109.97 1bbz n ASN 51 Ca 0.03 -1.38 0.12 0.00 -0.53 0.00 0.00 54.58 52.82 1bbz n ASN 51 Cb 0.26 0.00 0.17 0.00 -2.08 0.00 0.00 39.78 38.12 1bbz n ASN 51 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1bbz n TYR 52 N -0.75 0.00 -4.34 -2.53 4.02 -0.87 -4.96 117.16 107.73 1bbz n TYR 52 Ca 0.11 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.80 1bbz n TYR 52 Cb 0.05 -0.04 -0.10 0.00 -0.02 0.00 0.00 39.34 39.23 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 -2.40 1.76 0.07 -0.72 -4.36 -1.07 0.25 121.20 114.72 1bbz s ILE 53 Ca 0.23 -2.09 -0.13 0.00 -0.26 0.00 0.00 60.65 58.39 1bbz s ILE 53 Cb 0.19 -1.95 0.02 0.00 1.25 0.00 0.00 42.46 41.97 1bbz s ILE 53 CO 0.51 -0.49 0.30 0.28 0.24 0.00 0.00 174.94 175.79 1bbz s THR 54 N -2.61 0.09 0.28 8.37 -1.32 -0.74 -4.88 115.64 114.83 1bbz s THR 54 Ca 0.20 -0.74 -0.30 0.00 -1.21 0.00 0.00 61.69 59.63 1bbz s THR 54 Cb -0.03 -1.05 -0.11 0.00 -1.51 0.00 0.00 72.50 69.80 1bbz s THR 54 CO 0.07 -0.41 1.58 -2.84 -2.21 0.00 0.00 174.62 170.80 1bbz s PRO 55 N -3.01 4.14 0.12 7.08 0.02 -1.26 -0.12 135.00 141.97 1bbz s PRO 55 Ca -0.02 2.54 -0.32 0.00 0.02 0.00 0.00 61.00 63.22 1bbz s PRO 55 Cb 0.01 -3.04 -0.12 0.00 0.02 0.00 0.00 34.50 31.37 1bbz s PRO 55 CO -0.06 -0.61 1.78 1.55 -0.33 0.00 0.00 177.00 179.33 1bbz n VAL 56 N 2.29 0.27 -2.30 3.83 3.14 -0.16 -2.30 118.33 123.10 1bbz n VAL 56 Ca 0.08 -0.05 -0.03 0.00 -2.96 0.00 0.00 64.34 61.39 1bbz n VAL 56 Cb 0.38 -1.96 0.00 0.00 -1.06 0.00 0.00 33.84 31.20 1bbz n VAL 56 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 1bbz n ASN 57 N 5.09 -1.98 0.00 6.55 2.04 -1.26 -4.95 115.26 120.74 1bbz n ASN 57 Ca 0.18 -0.03 0.00 0.00 -0.44 0.00 0.00 54.58 54.29 1bbz n ASN 57 Cb 0.34 -1.02 0.00 0.00 -2.53 0.00 0.00 39.78 36.57 1bbz n ASN 57 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62