#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ka5 s ILE 2 N 0.00 2.80 -0.39 6.31 1.01 -1.26 -5.08 121.20 124.59 3ka5 s ILE 2 Ca 0.00 -1.49 -0.21 0.00 0.00 0.00 0.00 60.65 58.95 3ka5 s ILE 2 Cb 0.00 -2.64 0.01 0.00 0.01 0.00 0.00 42.46 39.84 3ka5 s ILE 2 CO 0.00 -0.13 0.64 -0.69 0.00 0.00 0.00 174.94 174.76 3ka5 s VAL 3 N 1.21 4.86 -0.18 2.92 1.01 -1.26 -5.04 120.40 123.91 3ka5 s VAL 3 Ca -0.05 0.39 -0.23 0.00 0.00 0.00 0.00 61.98 62.10 3ka5 s VAL 3 Cb -0.20 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 3ka5 s VAL 3 CO -0.02 -0.43 0.70 -0.54 0.00 0.00 0.00 175.10 174.81 3ka5 s LYS 4 N 2.77 4.25 0.13 2.72 1.02 -1.26 -5.05 119.74 124.31 3ka5 s LYS 4 Ca 0.24 0.77 0.04 0.00 0.02 0.00 0.00 55.97 57.04 3ka5 s LYS 4 Cb -0.14 -3.57 -0.04 0.00 -0.52 0.00 0.00 37.83 33.56 3ka5 s LYS 4 CO 0.17 -0.25 -0.09 0.95 -0.92 0.00 0.00 175.35 175.20 3ka5 s THR 5 N 1.93 1.00 0.20 2.17 -4.23 -1.26 -5.15 115.64 110.30 3ka5 s THR 5 Ca 0.33 -1.96 -0.11 0.00 -1.18 0.00 0.00 61.69 58.77 3ka5 s THR 5 Cb -0.16 -1.72 -0.07 0.00 1.34 0.00 0.00 72.50 71.88 3ka5 s THR 5 CO 0.11 -0.75 0.54 -0.75 -0.54 0.00 0.00 174.62 173.23 3ka5 s LYS 6 N -3.62 3.85 0.12 3.99 2.20 -1.26 -5.01 119.74 120.01 3ka5 s LYS 6 Ca 0.14 0.33 -0.35 0.00 -0.36 0.00 0.00 55.97 55.72 3ka5 s LYS 6 Cb 0.02 -2.74 -0.15 0.00 -1.51 0.00 0.00 37.83 33.45 3ka5 s LYS 6 CO -0.01 0.37 1.46 -2.13 -0.36 0.00 0.00 175.35 174.68 3ka5 n ARG 7 N 0.17 1.63 -0.04 4.03 0.63 -1.26 -4.89 116.66 116.93 3ka5 n ARG 7 Ca -0.01 0.59 -0.12 0.00 -0.92 0.00 0.00 57.85 57.38 3ka5 n ARG 7 Cb 0.52 -2.29 -0.07 0.00 0.45 0.00 0.00 32.46 31.07 3ka5 n ARG 7 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 3ka5 h PHE 8 N 5.28 0.23 -1.84 -0.14 3.57 -1.95 -3.38 116.94 118.70 3ka5 h PHE 8 Ca -0.46 -0.05 -0.53 0.00 3.53 0.00 0.00 57.97 60.45 3ka5 h PHE 8 Cb 1.30 -0.06 -0.08 0.00 2.79 0.00 0.00 35.95 39.90 3ka5 h PHE 8 CO 0.62 0.50 1.20 0.00 -2.23 0.00 0.00 178.31 178.39 3ka5 s ALA 9 N -4.79 2.59 0.08 2.41 0.00 -1.26 -4.86 121.76 115.93 3ka5 s ALA 9 Ca -0.14 -1.55 -0.15 0.00 0.00 0.00 0.00 51.96 50.12 3ka5 s ALA 9 Cb 0.05 -4.36 -0.12 0.00 0.00 0.00 0.00 23.12 18.68 3ka5 s ALA 9 CO 0.71 -3.57 1.35 0.82 0.00 0.00 0.00 175.76 175.07 3ka5 h ILE 10 N 6.45 1.32 -3.37 0.00 2.04 -1.95 -3.41 117.51 118.58 3ka5 h ILE 10 Ca -0.11 -1.62 -0.55 0.00 1.00 0.00 0.00 64.86 63.58 3ka5 h ILE 10 Cb 1.05 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 38.89 3ka5 h ILE 10 CO 1.31 0.51 -0.04 -0.54 0.00 0.00 0.00 178.15 179.39 3ka5 s LYS 11 N -4.10 4.05 1.10 2.37 1.02 -1.26 -4.91 119.74 118.01 3ka5 s LYS 11 Ca -0.12 0.58 -0.12 0.00 0.02 0.00 0.00 55.97 56.33 3ka5 s LYS 11 Cb 0.08 -2.93 0.25 0.00 -0.52 0.00 0.00 37.83 34.70 3ka5 s LYS 11 CO 0.84 0.47 1.04 -2.30 -0.92 0.00 0.00 175.35 174.48 3ka5 n PRO 12 N 0.83 -1.89 -4.00 -1.68 -0.02 -1.26 -4.64 135.00 122.34 3ka5 n PRO 12 Ca -0.05 -0.51 -0.22 0.00 -2.02 0.00 0.00 63.50 60.70 3ka5 n PRO 12 Cb 0.52 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 3ka5 n PRO 12 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3ka5 s SER 14 N -2.46 6.15 0.36 2.55 1.04 -1.26 -4.77 113.70 115.29 3ka5 s SER 14 Ca 0.68 0.03 0.03 0.00 0.48 0.00 0.00 55.95 57.16 3ka5 s SER 14 Cb -0.25 -1.77 0.66 0.00 0.10 0.00 0.00 66.02 64.76 3ka5 s SER 14 CO 0.63 -0.03 2.00 1.05 0.98 0.00 0.00 173.24 177.87 3ka5 h GLU 15 N 1.48 0.77 -0.46 4.02 4.11 -1.99 -0.54 114.58 121.98 3ka5 h GLU 15 Ca -0.50 -0.06 -0.05 0.00 0.07 0.00 0.00 59.36 58.82 3ka5 h GLU 15 Cb 1.22 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 3ka5 h GLU 15 CO 0.63 0.53 0.08 0.93 0.07 0.00 0.00 179.01 181.25 3ka5 h GLU 16 N 0.79 0.75 -0.29 1.06 3.07 -2.05 -1.38 114.58 116.54 3ka5 h GLU 16 Ca 0.21 -0.20 -0.07 0.00 -0.50 0.00 0.00 59.36 58.80 3ka5 h GLU 16 Cb -0.05 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.75 3ka5 h GLU 16 CO -0.04 0.76 -0.12 1.49 -1.40 0.00 0.00 179.01 179.70 3ka5 h GLU 17 N 0.62 0.48 -0.59 2.33 4.81 -1.84 -2.03 114.58 118.36 3ka5 h GLU 17 Ca 0.14 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 3ka5 h GLU 17 Cb 0.37 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 3ka5 h GLU 17 CO 0.01 0.61 0.10 0.00 -0.73 0.00 0.00 179.01 178.99 3ka5 h ALA 18 N 1.42 0.78 -0.64 2.92 0.00 -0.66 0.13 119.26 123.22 3ka5 h ALA 18 Ca 0.08 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 3ka5 h ALA 18 Cb 0.49 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3ka5 h ALA 18 CO 0.03 0.53 0.19 0.28 0.00 0.00 0.00 179.25 180.28 3ka5 h VAL 19 N 0.88 1.25 -0.21 0.00 2.07 -0.95 -2.93 116.25 116.36 3ka5 h VAL 19 Ca 0.18 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 3ka5 h VAL 19 Cb 0.42 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 3ka5 h VAL 19 CO 0.01 0.34 0.10 0.25 0.02 0.00 0.00 177.57 178.28 3ka5 h LEU 20 N 0.94 0.28 -1.92 2.57 5.85 -1.13 -2.23 115.31 119.67 3ka5 h LEU 20 Ca 0.21 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.79 3ka5 h LEU 20 Cb 0.32 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3ka5 h LEU 20 CO -0.00 0.34 0.00 -0.62 -0.34 0.00 0.00 178.44 177.82 3ka5 n GLU 21 N -4.84 0.00 0.00 1.25 -0.58 0.01 -0.80 120.64 115.68 3ka5 n GLU 21 Ca -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 3ka5 n GLU 21 Cb 0.11 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 3ka5 n GLU 21 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3ka5 n GLU 23 N 0.96 0.00 -0.03 3.49 -0.58 -0.84 -1.05 120.64 122.58 3ka5 n GLU 23 Ca 0.00 0.00 0.01 0.00 -0.42 0.00 0.00 57.16 56.75 3ka5 n GLU 23 Cb 0.00 0.00 0.32 0.00 -0.57 0.00 0.00 31.44 31.19 3ka5 n GLU 23 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3ka5 h LEU 24 N 0.00 0.54 0.00 -4.62 3.38 -1.24 -2.37 115.31 111.00 3ka5 h LEU 24 Ca 0.00 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3ka5 h LEU 24 Cb 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.61 3ka5 h LEU 24 CO 0.00 0.52 -0.39 0.18 0.09 0.00 0.00 178.44 178.84 3ka5 n LEU 25 N -4.34 0.51 0.00 1.67 4.77 -0.22 -4.98 117.00 114.41 3ka5 n LEU 25 Ca 0.03 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 3ka5 n LEU 25 Cb 0.18 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3ka5 n LEU 25 CO 0.38 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 3ka5 n GLY 26 N 1.42 0.47 3.97 -0.72 0.00 -0.89 -5.07 105.19 104.37 3ka5 n GLY 26 Ca 0.05 -0.90 -0.20 0.00 0.00 0.00 0.00 46.02 44.97 3ka5 n GLY 26 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3ka5 s HIS 27 N -2.00 3.14 -0.44 1.61 3.76 -1.26 -5.03 115.29 115.07 3ka5 s HIS 27 Ca 0.00 -0.20 0.22 0.00 -0.15 0.00 0.00 55.06 54.94 3ka5 s HIS 27 Cb 0.00 -1.90 -0.09 0.00 1.11 0.00 0.00 32.58 31.70 3ka5 s HIS 27 CO 0.00 0.09 0.87 0.09 -0.85 0.00 0.00 174.74 174.94 3ka5 n ASN 28 N -1.57 0.52 -3.69 1.40 5.03 -1.26 -4.64 115.26 111.05 3ka5 n ASN 28 Ca -0.02 -0.16 -0.11 0.00 0.87 0.00 0.00 54.58 55.17 3ka5 n ASN 28 Cb 0.58 1.09 -0.06 0.00 -1.02 0.00 0.00 39.78 40.37 3ka5 n ASN 28 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 3ka5 s PHE 29 N -3.29 -0.15 -0.15 3.10 -0.12 -1.26 -2.48 117.98 113.63 3ka5 s PHE 29 Ca 0.00 -0.09 -0.06 0.00 -0.05 0.00 0.00 56.93 56.73 3ka5 s PHE 29 Cb 0.14 0.18 0.07 0.00 -0.63 0.00 0.00 43.02 42.78 3ka5 s PHE 29 CO 0.84 -0.62 0.32 0.12 -0.05 0.00 0.00 175.22 175.83 3ka5 s PHE 30 N -3.34 -0.54 -0.08 3.49 5.36 0.41 -4.97 117.98 118.31 3ka5 s PHE 30 Ca 0.00 1.14 -0.17 0.00 -0.96 0.00 0.00 56.93 56.95 3ka5 s PHE 30 Cb 0.01 0.12 -0.05 0.00 -0.34 0.00 0.00 43.02 42.76 3ka5 s PHE 30 CO -0.08 -0.37 0.44 0.08 -1.46 0.00 0.00 175.22 173.83 3ka5 s VAL 31 N 2.14 5.13 0.15 3.12 1.01 -1.26 -1.43 120.40 129.26 3ka5 s VAL 31 Ca -0.03 0.89 -0.16 0.00 0.00 0.00 0.00 61.98 62.69 3ka5 s VAL 31 Cb -0.11 -3.77 0.03 0.00 0.00 0.00 0.00 36.38 32.52 3ka5 s VAL 31 CO -0.10 0.42 0.42 0.72 0.00 0.00 0.00 175.10 176.55 3ka5 s PHE 32 N 0.03 -0.12 -0.39 5.22 -0.12 -0.48 -4.49 117.98 117.63 3ka5 s PHE 32 Ca 0.24 -0.21 -0.21 0.00 -0.05 0.00 0.00 56.93 56.71 3ka5 s PHE 32 Cb -0.16 0.26 0.01 0.00 -0.63 0.00 0.00 43.02 42.51 3ka5 s PHE 32 CO 0.11 -0.76 0.68 -1.14 -0.05 0.00 0.00 175.22 174.06 3ka5 s GLN 33 N -3.84 3.56 -0.15 1.99 2.00 -1.26 -0.46 119.66 121.51 3ka5 s GLN 33 Ca 0.06 -0.03 -0.29 0.00 -2.00 0.00 0.00 55.36 53.10 3ka5 s GLN 33 Cb 0.01 -3.86 -0.03 0.00 0.80 0.00 0.00 33.01 29.94 3ka5 s GLN 33 CO -0.09 -0.86 1.44 1.21 -0.50 0.00 0.00 175.29 176.49 3ka5 s ASN 34 N 1.89 6.75 0.13 6.67 3.84 0.75 -4.25 114.94 130.73 3ka5 s ASN 34 Ca 0.26 1.80 0.20 0.00 0.21 0.00 0.00 52.86 55.32 3ka5 s ASN 34 Cb -0.14 -2.54 0.82 0.00 -0.55 0.00 0.00 41.25 38.85 3ka5 s ASN 34 CO 0.17 -0.92 1.61 0.61 -2.79 0.00 0.00 177.10 175.78 3ka5 n GLY 35 N 4.00 -1.18 0.13 1.21 0.00 -1.26 -0.03 105.19 108.06 3ka5 n GLY 35 Ca 0.16 0.02 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 3ka5 n GLY 35 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3ka5 h ASP 36 N 0.00 0.54 -0.01 1.61 1.82 -1.95 -3.38 116.42 115.06 3ka5 h ASP 36 Ca 0.00 -0.68 0.00 0.00 -0.39 0.00 0.00 57.03 55.96 3ka5 h ASP 36 Cb 0.33 -0.18 0.00 0.00 0.68 0.00 0.00 39.33 40.17 3ka5 h ASP 36 CO 0.00 1.56 -0.03 -1.54 -1.61 0.00 0.00 179.24 177.62 3ka5 n SER 37 N -3.55 1.27 -1.78 2.28 3.41 -1.16 -4.99 113.62 109.10 3ka5 n SER 37 Ca -0.17 -1.14 -0.20 0.00 -0.26 0.00 0.00 58.87 57.10 3ka5 n SER 37 Cb 1.06 0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 65.08 3ka5 n SER 37 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3ka5 n ASN 38 N 0.11 -5.52 -4.39 4.04 5.03 0.96 -4.97 115.26 110.51 3ka5 n ASN 38 Ca 0.03 0.34 -0.24 0.00 0.87 0.00 0.00 54.58 55.57 3ka5 n ASN 38 Cb 0.12 -4.71 -0.11 0.00 -1.02 0.00 0.00 39.78 34.06 3ka5 n ASN 38 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 3ka5 s GLU 39 N -4.11 1.45 0.14 3.52 2.02 -1.20 -4.87 118.70 115.65 3ka5 s GLU 39 Ca 0.00 -1.54 -0.30 0.00 0.02 0.00 0.00 54.97 53.15 3ka5 s GLU 39 Cb 0.00 -1.59 -0.07 0.00 0.10 0.00 0.00 34.13 32.56 3ka5 s GLU 39 CO 0.00 0.32 1.15 0.08 0.02 0.00 0.00 175.26 176.84 3ka5 s VAL 40 N -2.06 3.84 0.27 2.63 1.01 -1.26 -0.17 120.40 124.65 3ka5 s VAL 40 Ca 0.21 1.49 0.03 0.00 0.00 0.00 0.00 61.98 63.71 3ka5 s VAL 40 Cb -0.06 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 3ka5 s VAL 40 CO 0.09 0.21 0.06 0.20 0.00 0.00 0.00 175.10 175.66 3ka5 s ASN 41 N 0.30 1.67 -0.05 3.32 -0.87 0.40 -4.53 114.94 115.18 3ka5 s ASN 41 Ca 0.53 -1.33 -0.01 0.00 -1.57 0.00 0.00 52.86 50.48 3ka5 s ASN 41 Cb -0.30 0.06 0.03 0.00 -0.02 0.00 0.00 41.25 41.01 3ka5 s ASN 41 CO 0.34 -0.64 0.01 -0.69 -2.57 0.00 0.00 177.10 173.55 3ka5 s VAL 42 N -3.54 0.20 0.12 1.60 1.01 -0.85 -1.38 120.40 117.56 3ka5 s VAL 42 Ca 0.35 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.53 3ka5 s VAL 42 Cb 0.08 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 3ka5 s VAL 42 CO 0.13 0.20 0.16 0.68 0.00 0.00 0.00 175.10 176.26 3ka5 s VAL 43 N 1.63 4.78 0.17 2.92 -7.23 -0.51 0.03 120.40 122.19 3ka5 s VAL 43 Ca -0.01 -0.82 -0.18 0.00 -1.81 0.00 0.00 61.98 59.16 3ka5 s VAL 43 Cb -0.13 -3.39 0.03 0.00 0.56 0.00 0.00 36.38 33.46 3ka5 s VAL 43 CO -0.03 -0.00 0.49 -0.72 -0.31 0.00 0.00 175.10 174.52 3ka5 s TYR 44 N -1.61 -0.19 -0.21 2.82 -0.85 -0.32 -0.44 117.35 116.56 3ka5 s TYR 44 Ca 0.32 -0.13 -0.11 0.00 -0.52 0.00 0.00 57.07 56.62 3ka5 s TYR 44 Cb -0.11 0.36 -0.05 0.00 0.38 0.00 0.00 41.96 42.54 3ka5 s TYR 44 CO 0.25 -0.84 0.17 0.21 -1.52 0.00 0.00 175.55 173.81 3ka5 s LYS 45 N -3.84 4.16 -0.07 -3.49 2.20 -1.03 -0.61 119.74 117.05 3ka5 s LYS 45 Ca 0.06 -0.19 0.01 0.00 -0.36 0.00 0.00 55.97 55.49 3ka5 s LYS 45 Cb -0.00 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 3ka5 s LYS 45 CO -0.07 0.21 -0.06 -0.98 -0.36 0.00 0.00 175.35 174.09 3ka5 s ARG 46 N 0.62 2.78 -1.11 4.03 1.70 -1.12 -4.95 118.95 120.91 3ka5 s ARG 46 Ca 0.09 -0.53 -0.26 0.00 -0.47 0.00 0.00 55.73 54.56 3ka5 s ARG 46 Cb -0.12 -2.61 -0.20 0.00 -0.57 0.00 0.00 34.95 31.45 3ka5 s ARG 46 CO 0.01 0.66 2.08 0.15 -1.08 0.00 0.00 175.30 177.12 3ka5 s LYS 47 N -0.80 1.43 0.00 3.89 -0.14 -1.26 -2.12 119.74 120.74 3ka5 s LYS 47 Ca 0.12 -0.59 0.00 0.00 -1.36 0.00 0.00 55.97 54.14 3ka5 s LYS 47 Cb -0.11 -5.03 0.00 0.00 -1.68 0.00 0.00 37.83 31.00 3ka5 s LYS 47 CO 0.02 -5.23 0.00 -3.47 -0.76 0.00 0.00 175.35 165.91 3ka5 n ASP 48 N 18.68 0.00 0.00 2.83 2.03 -1.26 -5.01 116.55 133.82 3ka5 n ASP 48 Ca 0.42 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.71 3ka5 n ASP 48 Cb 0.47 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.87 3ka5 n ASP 48 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3ka5 n GLY 49 N 0.00 3.04 3.94 0.27 0.00 -0.90 -5.04 105.19 106.50 3ka5 n GLY 49 Ca 0.00 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 3ka5 n GLY 49 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ka5 s ASN 50 N 0.60 3.20 0.15 1.61 0.01 -1.26 -4.92 114.94 114.33 3ka5 s ASN 50 Ca 0.00 0.22 0.10 0.00 -0.71 0.00 0.00 52.86 52.47 3ka5 s ASN 50 Cb 0.00 -0.29 -0.04 0.00 0.41 0.00 0.00 41.25 41.33 3ka5 s ASN 50 CO 0.00 -2.67 -0.22 -0.31 -1.51 0.00 0.00 177.10 172.39 3ka5 s TYR 51 N -3.84 2.41 0.14 2.20 2.02 -1.26 -2.79 117.35 116.23 3ka5 s TYR 51 Ca 0.73 -0.32 0.09 0.00 -0.37 0.00 0.00 57.07 57.20 3ka5 s TYR 51 Cb -0.04 -1.25 -0.04 0.00 -0.40 0.00 0.00 41.96 40.23 3ka5 s TYR 51 CO 0.52 0.42 -0.13 0.20 -1.57 0.00 0.00 175.55 174.99 3ka5 s GLY 52 N -2.35 1.73 -0.12 0.71 0.00 0.22 -4.93 107.32 102.58 3ka5 s GLY 52 Ca 0.18 -1.39 -0.00 0.00 0.00 0.00 0.00 44.72 43.51 3ka5 s GLY 52 CO 0.09 -1.39 -0.08 -2.27 0.00 0.00 0.00 173.10 169.45 3ka5 s LEU 53 N -2.46 1.27 -0.23 0.66 2.96 -1.26 -1.17 118.68 118.46 3ka5 s LEU 53 Ca 0.22 -0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 53.67 3ka5 s LEU 53 Cb -0.10 -0.89 -0.05 0.00 0.50 0.00 0.00 46.19 45.65 3ka5 s LEU 53 CO 0.13 -0.11 0.16 -0.63 -1.32 0.00 0.00 176.35 174.58 3ka5 s ILE 54 N 1.68 5.37 0.16 6.68 1.01 0.11 -4.95 121.20 131.24 3ka5 s ILE 54 Ca 0.05 0.21 0.10 0.00 0.00 0.00 0.00 60.65 61.01 3ka5 s ILE 54 Cb -0.13 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 3ka5 s ILE 54 CO -0.09 0.37 -0.22 -1.61 0.00 0.00 0.00 174.94 173.39 3ka5 s GLU 55 N 0.86 1.36 0.33 2.79 2.02 -1.26 -2.01 118.70 122.78 3ka5 s GLU 55 Ca 0.08 -1.40 0.12 0.00 0.02 0.00 0.00 54.97 53.79 3ka5 s GLU 55 Cb -0.13 -1.63 0.56 0.00 0.10 0.00 0.00 34.13 33.03 3ka5 s GLU 55 CO 0.03 0.36 1.73 -1.00 0.02 0.00 0.00 175.26 176.40 3ka5 h PRO 56 N 3.49 0.00 -3.23 0.39 0.13 -1.99 -3.46 132.00 127.33 3ka5 h PRO 56 Ca -0.46 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 3ka5 h PRO 56 Cb 1.20 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.22 3ka5 h PRO 56 CO 0.46 0.48 0.07 -1.21 -0.23 0.00 0.00 178.00 177.56 3ka5 s GLU 57 N -3.93 1.35 -0.05 0.86 2.02 -1.26 -5.15 118.70 112.54 3ka5 s GLU 57 Ca -0.02 -0.77 -0.19 0.00 0.02 0.00 0.00 54.97 54.01 3ka5 s GLU 57 Cb 0.14 0.53 -0.05 0.00 0.10 0.00 0.00 34.13 34.85 3ka5 s GLU 57 CO 0.74 -0.58 0.52 -0.51 0.02 0.00 0.00 175.26 175.46 3ka5 s LEU 58 N -2.84 4.37 0.00 1.80 1.43 -1.26 -5.19 118.68 116.99 3ka5 s LEU 58 Ca 0.07 1.00 0.28 0.00 -1.03 0.00 0.00 54.13 54.45 3ka5 s LEU 58 Cb -0.01 -2.79 1.10 0.00 0.03 0.00 0.00 46.19 44.52 3ka5 s LEU 58 CO -0.05 0.10 1.77 -0.62 0.23 0.00 0.00 176.35 177.78