#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 3.81 -0.32 3.84 1.01 -1.26 -5.07 121.20 123.21 3ka5 s ILE 2 Ca 0.00 -0.86 -0.26 0.00 0.00 0.00 0.00 60.65 59.53 3ka5 s ILE 2 Cb 0.00 -3.02 0.01 0.00 0.01 0.00 0.00 42.46 39.46 3ka5 s ILE 2 CO 0.00 0.01 0.90 -0.69 0.00 0.00 0.00 174.94 175.16 3ka5 s VAL 3 N 1.45 4.67 -0.08 2.92 1.01 -1.26 -5.03 120.40 124.08 3ka5 s VAL 3 Ca 0.01 1.34 -0.23 0.00 0.00 0.00 0.00 61.98 63.10 3ka5 s VAL 3 Cb -0.18 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 3ka5 s VAL 3 CO 0.02 -0.38 0.67 -0.54 0.00 0.00 0.00 175.10 174.87 3ka5 s LYS 4 N 3.27 4.42 0.05 2.72 1.02 -1.26 -5.07 119.74 124.89 3ka5 s LYS 4 Ca 0.37 0.83 -0.00 0.00 0.02 0.00 0.00 55.97 57.19 3ka5 s LYS 4 Cb -0.13 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.69 3ka5 s LYS 4 CO 0.15 0.07 -0.04 0.95 -0.92 0.00 0.00 175.35 175.55 3ka5 s THR 5 N 0.81 0.28 0.18 2.17 -4.23 -1.26 -5.15 115.64 108.44 3ka5 s THR 5 Ca 0.36 -1.60 -0.11 0.00 -1.18 0.00 0.00 61.69 59.16 3ka5 s THR 5 Cb -0.17 -1.23 -0.07 0.00 1.34 0.00 0.00 72.50 72.37 3ka5 s THR 5 CO 0.17 -0.84 0.52 -0.75 -0.54 0.00 0.00 174.62 173.18 3ka5 s LYS 6 N -3.26 3.85 0.06 3.99 2.20 -1.26 -5.00 119.74 120.32 3ka5 s LYS 6 Ca 0.02 0.32 -0.36 0.00 -0.36 0.00 0.00 55.97 55.58 3ka5 s LYS 6 Cb 0.03 -2.80 -0.16 0.00 -1.51 0.00 0.00 37.83 33.39 3ka5 s LYS 6 CO -0.07 0.41 1.46 -2.13 -0.36 0.00 0.00 175.35 174.66 3ka5 n ARG 7 N 0.33 1.43 -0.08 4.03 0.63 -1.26 -4.89 116.66 116.85 3ka5 n ARG 7 Ca -0.03 0.52 -0.11 0.00 -0.92 0.00 0.00 57.85 57.31 3ka5 n ARG 7 Cb 0.52 -2.20 -0.04 0.00 0.45 0.00 0.00 32.46 31.19 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 5.31 0.47 -1.54 -0.14 3.57 -1.95 -3.37 116.94 119.29 3ka5 h PHE 8 Ca -0.47 -0.08 -0.51 0.00 3.53 0.00 0.00 57.97 60.44 3ka5 h PHE 8 Cb 1.31 -0.12 -0.08 0.00 2.79 0.00 0.00 35.95 39.85 3ka5 h PHE 8 CO 0.63 0.60 1.21 0.00 -2.23 0.00 0.00 178.31 178.52 3ka5 s ALA 9 N -4.99 2.46 0.03 2.41 0.00 -1.26 -4.84 121.76 115.57 3ka5 s ALA 9 Ca -0.14 -1.63 -0.20 0.00 0.00 0.00 0.00 51.96 49.99 3ka5 s ALA 9 Cb 0.07 -4.42 -0.16 0.00 0.00 0.00 0.00 23.12 18.61 3ka5 s ALA 9 CO 0.75 -3.77 1.28 0.82 0.00 0.00 0.00 175.76 174.84 3ka5 h ILE 10 N 6.66 1.38 -3.59 0.00 2.04 -1.95 -3.41 117.51 118.64 3ka5 h ILE 10 Ca -0.03 -1.50 -0.52 0.00 1.00 0.00 0.00 64.86 63.81 3ka5 h ILE 10 Cb 1.04 2.05 -0.03 0.00 -0.74 0.00 0.00 36.82 39.14 3ka5 h ILE 10 CO 1.32 0.44 0.16 -0.54 0.00 0.00 0.00 178.15 179.53 3ka5 s LYS 11 N -4.02 4.41 1.10 2.37 1.02 -1.26 -4.88 119.74 118.48 3ka5 s LYS 11 Ca -0.14 1.03 -0.12 0.00 0.02 0.00 0.00 55.97 56.76 3ka5 s LYS 11 Cb 0.05 -3.01 0.25 0.00 -0.52 0.00 0.00 37.83 34.60 3ka5 s LYS 11 CO 0.77 0.45 1.06 -2.14 -0.92 0.00 0.00 175.35 174.56 3ka5 s PRO 12 N -1.68 -0.46 0.30 -1.68 0.02 -1.26 -4.64 135.00 125.60 3ka5 s PRO 12 Ca 0.41 1.05 0.06 0.00 0.02 0.00 0.00 61.00 62.54 3ka5 s PRO 12 Cb -0.19 -1.59 -0.02 0.00 0.02 0.00 0.00 34.50 32.72 3ka5 s PRO 12 CO 0.23 -3.48 0.38 -1.54 -0.33 0.00 0.00 177.00 172.27 3ka5 s SER 14 N -2.53 5.91 0.25 2.53 1.04 -1.26 -4.75 113.70 114.89 3ka5 s SER 14 Ca 0.68 -0.17 -0.06 0.00 0.48 0.00 0.00 55.95 56.88 3ka5 s SER 14 Cb -0.25 -1.38 0.27 0.00 0.10 0.00 0.00 66.02 64.76 3ka5 s SER 14 CO 0.63 -0.28 1.89 -0.33 0.98 0.00 0.00 173.24 176.13 3ka5 h GLU 15 N 1.09 1.24 -0.40 4.02 5.08 -1.99 0.09 114.58 123.71 3ka5 h GLU 15 Ca -0.48 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 57.76 3ka5 h GLU 15 Cb 1.25 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 3ka5 h GLU 15 CO 0.57 0.87 0.24 0.93 -1.00 0.00 0.00 179.01 180.62 3ka5 h GLU 16 N 1.25 0.54 -0.51 2.33 3.07 -2.05 -1.35 114.58 117.86 3ka5 h GLU 16 Ca 0.32 -0.05 -0.10 0.00 -0.50 0.00 0.00 59.36 59.04 3ka5 h GLU 16 Cb -0.03 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.75 3ka5 h GLU 16 CO -0.06 0.41 -0.06 1.49 -1.40 0.00 0.00 179.01 179.39 3ka5 h GLU 17 N 0.52 0.91 -0.55 2.33 4.81 -1.86 -2.67 114.58 118.07 3ka5 h GLU 17 Ca 0.14 -0.30 0.01 0.00 -0.13 0.00 0.00 59.36 59.09 3ka5 h GLU 17 Cb 0.01 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 3ka5 h GLU 17 CO -0.03 0.94 0.35 0.00 -0.73 0.00 0.00 179.01 179.55 3ka5 h ALA 18 N 1.10 0.70 -0.36 2.92 0.00 -0.56 0.78 119.26 123.83 3ka5 h ALA 18 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3ka5 h ALA 18 Cb 0.58 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3ka5 h ALA 18 CO 0.03 0.11 0.14 0.28 0.00 0.00 0.00 179.25 179.81 3ka5 h VAL 19 N 0.71 1.19 -0.60 0.00 2.07 -1.11 -2.94 116.25 115.57 3ka5 h VAL 19 Ca 0.21 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 3ka5 h VAL 19 Cb -0.05 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 3ka5 h VAL 19 CO -0.06 0.21 0.27 0.25 0.02 0.00 0.00 177.57 178.27 3ka5 h LEU 20 N 0.43 0.81 -1.77 2.57 5.85 -1.16 -2.07 115.31 119.96 3ka5 h LEU 20 Ca 0.12 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3ka5 h LEU 20 Cb 0.20 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.02 3ka5 h LEU 20 CO -0.01 0.73 0.00 -0.62 -0.34 0.00 0.00 178.44 178.20 3ka5 n GLU 21 N -4.50 0.05 0.00 1.25 -0.58 0.24 -0.61 120.64 116.50 3ka5 n GLU 21 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 3ka5 n GLU 21 Cb 0.14 -1.37 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 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 0.86 0.00 0.05 3.49 -0.58 -0.78 -1.05 120.64 122.63 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 0.02 0.00 0.33 0.00 -0.57 0.00 0.00 31.44 31.22 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 0.38 0.00 -4.62 3.38 -1.13 -2.49 115.31 110.82 3ka5 h LEU 24 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3ka5 h LEU 24 Cb 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3ka5 h LEU 24 CO 0.00 0.50 -0.23 0.18 0.09 0.00 0.00 178.44 178.99 3ka5 n LEU 25 N -4.26 0.29 0.00 1.67 4.77 -0.22 -4.95 117.00 114.29 3ka5 n LEU 25 Ca 0.00 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 3ka5 n LEU 25 Cb 0.27 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 3ka5 n LEU 25 CO 0.39 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3ka5 n GLY 26 N 1.48 0.52 3.98 -0.72 0.00 -0.94 -5.07 105.19 104.44 3ka5 n GLY 26 Ca 0.06 -0.87 -0.20 0.00 0.00 0.00 0.00 46.02 45.01 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 3.18 -0.16 1.61 3.76 -1.26 -5.03 115.29 115.38 3ka5 s HIS 27 Ca 0.00 -0.09 0.22 0.00 -0.15 0.00 0.00 55.06 55.04 3ka5 s HIS 27 Cb 0.00 -2.02 -0.32 0.00 1.11 0.00 0.00 32.58 31.35 3ka5 s HIS 27 CO 0.00 -0.04 0.54 0.09 -0.85 0.00 0.00 174.74 174.48 3ka5 n ASN 28 N -1.72 0.14 -3.81 1.40 5.03 -1.26 -4.62 115.26 110.43 3ka5 n ASN 28 Ca -0.01 -0.13 -0.10 0.00 0.87 0.00 0.00 54.58 55.21 3ka5 n ASN 28 Cb 0.58 1.85 -0.08 0.00 -1.02 0.00 0.00 39.78 41.11 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 -3.45 0.02 -0.16 3.10 -0.12 -1.26 -1.68 117.98 114.43 3ka5 s PHE 29 Ca -0.06 -0.27 -0.06 0.00 -0.05 0.00 0.00 56.93 56.49 3ka5 s PHE 29 Cb 0.14 0.01 0.07 0.00 -0.63 0.00 0.00 43.02 42.62 3ka5 s PHE 29 CO 0.90 -0.49 0.34 0.12 -0.05 0.00 0.00 175.22 176.04 3ka5 s PHE 30 N -2.94 -0.58 -0.08 3.49 5.36 0.63 -4.97 117.98 118.88 3ka5 s PHE 30 Ca -0.02 1.20 -0.17 0.00 -0.96 0.00 0.00 56.93 56.97 3ka5 s PHE 30 Cb 0.01 0.14 -0.05 0.00 -0.34 0.00 0.00 43.02 42.78 3ka5 s PHE 30 CO -0.06 -0.39 0.46 0.08 -1.46 0.00 0.00 175.22 173.85 3ka5 s VAL 31 N 2.24 5.13 0.12 3.12 1.01 -1.26 -1.50 120.40 129.26 3ka5 s VAL 31 Ca -0.02 0.93 -0.15 0.00 0.00 0.00 0.00 61.98 62.73 3ka5 s VAL 31 Cb -0.11 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.51 3ka5 s VAL 31 CO -0.11 0.40 0.38 0.72 0.00 0.00 0.00 175.10 176.49 3ka5 s PHE 32 N 0.15 -0.16 -0.38 5.22 -0.12 -0.55 -4.44 117.98 117.70 3ka5 s PHE 32 Ca 0.25 -0.16 -0.21 0.00 -0.05 0.00 0.00 56.93 56.75 3ka5 s PHE 32 Cb -0.16 0.23 0.01 0.00 -0.63 0.00 0.00 43.02 42.47 3ka5 s PHE 32 CO 0.11 -0.69 0.69 -1.14 -0.05 0.00 0.00 175.22 174.14 3ka5 s GLN 33 N -3.81 3.61 -0.24 1.99 2.00 -1.26 -0.59 119.66 121.35 3ka5 s GLN 33 Ca 0.03 0.05 -0.29 0.00 -2.00 0.00 0.00 55.36 53.15 3ka5 s GLN 33 Cb 0.02 -3.84 -0.02 0.00 0.80 0.00 0.00 33.01 29.97 3ka5 s GLN 33 CO -0.12 -0.85 1.50 1.21 -0.50 0.00 0.00 175.29 176.54 3ka5 s ASN 34 N 1.87 6.49 0.34 6.67 3.84 0.52 -4.28 114.94 130.39 3ka5 s ASN 34 Ca 0.27 1.49 0.26 0.00 0.21 0.00 0.00 52.86 55.09 3ka5 s ASN 34 Cb -0.14 -2.53 1.10 0.00 -0.55 0.00 0.00 41.25 39.13 3ka5 s ASN 34 CO 0.17 -1.18 1.79 1.23 -2.79 0.00 0.00 177.10 176.31 3ka5 h GLY 35 N 11.36 0.00 0.87 1.21 0.00 -1.86 0.30 103.07 114.95 3ka5 h GLY 35 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3ka5 h GLY 35 CO 1.01 0.00 -1.12 1.22 0.00 0.00 0.00 176.54 177.65 3ka5 n ASP 36 N -2.46 0.75 0.00 0.19 8.00 -1.26 -4.30 116.55 117.46 3ka5 n ASP 36 Ca 0.02 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.80 3ka5 n ASP 36 Cb 0.24 0.63 0.00 0.00 -0.02 0.00 0.00 41.12 41.98 3ka5 n ASP 36 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3ka5 n SER 37 N -2.61 0.43 -1.84 -2.24 3.41 -1.13 -5.00 113.62 104.64 3ka5 n SER 37 Ca -0.00 -0.71 -0.21 0.00 -0.26 0.00 0.00 58.87 57.69 3ka5 n SER 37 Cb 0.55 0.49 -0.06 0.00 -0.26 0.00 0.00 64.21 64.92 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 -0.49 -5.63 -4.30 4.04 5.03 0.10 -4.97 115.26 109.04 3ka5 n ASN 38 Ca 0.00 0.35 -0.23 0.00 0.87 0.00 0.00 54.58 55.57 3ka5 n ASN 38 Cb 0.01 -4.87 -0.12 0.00 -1.02 0.00 0.00 39.78 33.78 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 -4.16 1.17 0.07 3.52 0.41 -1.20 -4.90 118.70 113.61 3ka5 s GLU 39 Ca 0.00 -1.24 -0.30 0.00 -0.41 0.00 0.00 54.97 53.02 3ka5 s GLU 39 Cb 0.00 -1.37 -0.05 0.00 -1.78 0.00 0.00 34.13 30.93 3ka5 s GLU 39 CO 0.00 0.31 1.13 0.08 -0.49 0.00 0.00 175.26 176.29 3ka5 s VAL 40 N -1.44 4.18 0.33 2.63 1.01 -1.26 -0.35 120.40 125.50 3ka5 s VAL 40 Ca 0.09 1.62 0.04 0.00 0.00 0.00 0.00 61.98 63.72 3ka5 s VAL 40 Cb -0.09 -4.03 -0.06 0.00 0.00 0.00 0.00 36.38 32.20 3ka5 s VAL 40 CO 0.05 0.16 0.06 0.20 0.00 0.00 0.00 175.10 175.57 3ka5 s ASN 41 N 0.82 2.40 -0.05 3.32 0.01 0.24 -4.55 114.94 117.13 3ka5 s ASN 41 Ca 0.55 -1.40 -0.01 0.00 -0.71 0.00 0.00 52.86 51.30 3ka5 s ASN 41 Cb -0.28 -0.04 0.03 0.00 0.41 0.00 0.00 41.25 41.37 3ka5 s ASN 41 CO 0.30 -0.63 0.02 -0.69 -1.51 0.00 0.00 177.10 174.59 3ka5 s VAL 42 N -3.29 0.17 0.06 1.60 1.01 -0.76 -1.48 120.40 117.71 3ka5 s VAL 42 Ca 0.36 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.57 3ka5 s VAL 42 Cb 0.08 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 3ka5 s VAL 42 CO 0.15 0.21 0.18 0.68 0.00 0.00 0.00 175.10 176.32 3ka5 s VAL 43 N 1.88 5.19 0.14 2.92 -7.23 -0.56 -0.40 120.40 122.34 3ka5 s VAL 43 Ca 0.03 -0.45 -0.13 0.00 -1.81 0.00 0.00 61.98 59.61 3ka5 s VAL 43 Cb -0.12 -3.51 0.02 0.00 0.56 0.00 0.00 36.38 33.32 3ka5 s VAL 43 CO -0.04 0.16 0.36 -0.72 -0.31 0.00 0.00 175.10 174.56 3ka5 s TYR 44 N -1.45 0.02 -0.17 2.82 -0.85 -0.30 -0.27 117.35 117.15 3ka5 s TYR 44 Ca 0.33 -0.38 -0.20 0.00 -0.52 0.00 0.00 57.07 56.30 3ka5 s TYR 44 Cb -0.13 0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.34 3ka5 s TYR 44 CO 0.25 -0.73 0.57 0.15 -1.52 0.00 0.00 175.55 174.28 3ka5 s LYS 45 N -3.87 4.26 0.20 -3.49 1.02 -0.68 -0.30 119.74 116.88 3ka5 s LYS 45 Ca 0.08 0.55 -0.10 0.00 0.02 0.00 0.00 55.97 56.52 3ka5 s LYS 45 Cb 0.02 -3.53 -0.07 0.00 -0.52 0.00 0.00 37.83 33.74 3ka5 s LYS 45 CO -0.07 -0.09 0.52 1.03 -0.92 0.00 0.00 175.35 175.82 3ka5 s ARG 46 N 1.42 3.80 0.00 1.68 0.52 -0.17 -4.92 118.95 121.29 3ka5 s ARG 46 Ca 0.28 0.26 0.00 0.00 -0.52 0.00 0.00 55.73 55.74 3ka5 s ARG 46 Cb -0.16 -2.73 0.00 0.00 0.52 0.00 0.00 34.95 32.58 3ka5 s ARG 46 CO 0.11 0.37 0.23 1.63 0.02 0.00 0.00 175.30 177.66 3ka5 n LYS 47 N 0.09 0.36 -0.07 3.54 5.02 -1.26 -1.59 118.16 124.25 3ka5 n LYS 47 Ca -0.01 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.31 3ka5 n LYS 47 Cb 0.52 -1.13 0.05 0.00 -0.02 0.00 0.00 35.03 34.45 3ka5 n LYS 47 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3ka5 n ASP 48 N 0.11 1.67 0.00 4.39 5.75 -1.26 -4.97 116.55 122.24 3ka5 n ASP 48 Ca 0.00 -2.24 0.00 0.00 -0.01 0.00 0.00 54.79 52.54 3ka5 n ASP 48 Cb 0.07 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 3ka5 n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ka5 n GLY 49 N -0.71 3.05 3.81 6.12 0.00 -0.62 -5.01 105.19 111.83 3ka5 n GLY 49 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.63 3.01 0.03 1.61 0.02 -1.26 -4.81 114.94 112.90 3ka5 s ASN 50 Ca 0.00 0.66 0.06 0.00 -1.02 0.00 0.00 52.86 52.56 3ka5 s ASN 50 Cb 0.00 -0.99 -0.03 0.00 0.02 0.00 0.00 41.25 40.25 3ka5 s ASN 50 CO 0.00 -2.83 -0.17 -0.31 0.02 0.00 0.00 177.10 173.81 3ka5 s TYR 51 N -3.46 2.59 0.14 2.20 2.02 -1.26 -1.00 117.35 118.59 3ka5 s TYR 51 Ca 0.68 -0.23 0.07 0.00 -0.37 0.00 0.00 57.07 57.22 3ka5 s TYR 51 Cb -0.10 -1.49 -0.04 0.00 -0.40 0.00 0.00 41.96 39.93 3ka5 s TYR 51 CO 0.53 0.25 -0.05 0.20 -1.57 0.00 0.00 175.55 174.91 3ka5 s GLY 52 N -1.35 1.77 -0.14 0.71 0.00 0.59 -4.89 107.32 104.02 3ka5 s GLY 52 Ca 0.14 -1.32 -0.01 0.00 0.00 0.00 0.00 44.72 43.53 3ka5 s GLY 52 CO 0.05 -1.32 -0.01 -2.27 0.00 0.00 0.00 173.10 169.54 3ka5 s LEU 53 N -2.61 1.13 -0.23 0.66 2.96 -1.26 -1.15 118.68 118.18 3ka5 s LEU 53 Ca 0.25 -0.48 -0.11 0.00 -0.22 0.00 0.00 54.13 53.56 3ka5 s LEU 53 Cb -0.10 -0.67 -0.05 0.00 0.50 0.00 0.00 46.19 45.87 3ka5 s LEU 53 CO 0.16 -0.21 0.19 -0.63 -1.32 0.00 0.00 176.35 174.54 3ka5 s ILE 54 N 1.81 5.34 0.13 6.68 1.01 0.46 -4.96 121.20 131.68 3ka5 s ILE 54 Ca 0.02 0.24 0.05 0.00 0.00 0.00 0.00 60.65 60.96 3ka5 s ILE 54 Cb -0.14 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 3ka5 s ILE 54 CO -0.07 0.34 -0.11 -1.83 0.00 0.00 0.00 174.94 173.26 3ka5 s GLU 55 N 1.07 1.03 0.31 2.79 -1.05 -1.26 -1.83 118.70 119.75 3ka5 s GLU 55 Ca 0.09 -1.35 0.26 0.00 -0.15 0.00 0.00 54.97 53.82 3ka5 s GLU 55 Cb -0.14 -0.71 0.96 0.00 -0.44 0.00 0.00 34.13 33.80 3ka5 s GLU 55 CO 0.05 0.11 1.77 -1.00 0.95 0.00 0.00 175.26 177.13 3ka5 h PRO 56 N 3.12 0.00 0.00 -4.83 0.13 -1.99 -3.51 132.00 124.92 3ka5 h PRO 56 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 3ka5 h PRO 56 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3ka5 h PRO 56 CO 0.58 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.44