#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dm0 s PRO 2 N 0.00 2.96 0.13 -0.78 0.02 -1.26 -4.91 135.00 131.16 1dm0 s PRO 2 Ca 0.00 -0.47 -0.34 0.00 0.02 0.00 0.00 61.00 60.21 1dm0 s PRO 2 Cb 0.00 -2.79 -0.14 0.00 0.02 0.00 0.00 34.50 31.59 1dm0 s PRO 2 CO 0.00 0.68 1.55 -0.25 -0.33 0.00 0.00 177.00 178.64 1dm0 n ASP 3 N 1.76 2.83 0.00 2.53 9.92 -1.26 -2.53 116.55 129.80 1dm0 n ASP 3 Ca -0.17 1.08 0.00 0.00 -0.53 0.00 0.00 54.79 55.18 1dm0 n ASP 3 Cb 0.53 -1.38 0.00 0.00 -0.64 0.00 0.00 41.12 39.63 1dm0 n ASP 3 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1dm0 s VAL 5 N -0.17 1.92 -0.30 0.00 0.11 -1.19 -4.95 120.40 115.83 1dm0 s VAL 5 Ca 0.00 -1.57 -0.10 0.00 -2.93 0.00 0.00 61.98 57.37 1dm0 s VAL 5 Cb 0.00 -2.50 0.18 0.00 -1.53 0.00 0.00 36.38 32.53 1dm0 s VAL 5 CO 0.00 0.00 0.92 -0.89 -3.33 0.00 0.00 175.10 171.80 1dm0 s THR 6 N -2.69 -0.53 0.00 5.04 2.01 -1.26 -1.96 115.64 116.25 1dm0 s THR 6 Ca 0.35 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.35 1dm0 s THR 6 Cb -0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1dm0 s THR 6 CO 0.21 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.75 1dm0 n GLY 7 N 5.39 0.75 3.92 4.40 0.00 -0.54 -4.81 105.19 114.30 1dm0 n GLY 7 Ca -0.06 -0.64 -0.27 0.00 0.00 0.00 0.00 46.02 45.05 1dm0 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dm0 s LYS 8 N 0.41 3.12 -0.47 1.61 1.02 -1.26 -0.28 119.74 123.89 1dm0 s LYS 8 Ca 0.00 0.02 -0.24 0.00 0.02 0.00 0.00 55.97 55.77 1dm0 s LYS 8 Cb 0.00 -2.33 0.03 0.00 -0.52 0.00 0.00 37.83 35.01 1dm0 s LYS 8 CO 0.00 -0.51 0.86 0.08 -0.92 0.00 0.00 175.35 174.86 1dm0 s VAL 9 N -2.88 4.54 0.07 3.17 1.01 -1.26 -4.27 120.40 120.79 1dm0 s VAL 9 Ca 0.51 0.56 -0.33 0.00 0.00 0.00 0.00 61.98 62.72 1dm0 s VAL 9 Cb -0.10 -4.40 -0.16 0.00 0.00 0.00 0.00 36.38 31.72 1dm0 s VAL 9 CO 0.45 -0.81 1.51 -0.08 0.00 0.00 0.00 175.10 176.17 1dm0 h GLU 10 N 9.06 -0.94 -2.54 2.72 4.81 -0.86 -3.46 114.58 123.36 1dm0 h GLU 10 Ca -0.25 0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.07 1dm0 h GLU 10 Cb 1.08 0.21 -0.15 0.00 0.63 0.00 0.00 28.75 30.53 1dm0 h GLU 10 CO 1.00 -0.63 0.31 1.52 -0.73 0.00 0.00 179.01 180.49 1dm0 s TYR 11 N -5.63 -0.49 0.32 0.92 -0.85 -1.24 -5.04 117.35 105.35 1dm0 s TYR 11 Ca -0.17 0.44 0.10 0.00 -0.52 0.00 0.00 57.07 56.92 1dm0 s TYR 11 Cb 0.04 0.52 -0.06 0.00 0.38 0.00 0.00 41.96 42.84 1dm0 s TYR 11 CO 0.55 -0.69 -0.12 0.95 -1.52 0.00 0.00 175.55 174.72 1dm0 s THR 12 N -3.00 2.29 -0.09 -3.49 -4.23 -1.26 -2.72 115.64 103.14 1dm0 s THR 12 Ca 0.00 -2.26 -0.09 0.00 -1.18 0.00 0.00 61.69 58.16 1dm0 s THR 12 Cb -0.01 -2.54 0.02 0.00 1.34 0.00 0.00 72.50 71.31 1dm0 s THR 12 CO -0.07 -0.26 0.25 -0.75 -0.54 0.00 0.00 174.62 173.25 1dm0 s LYS 13 N -3.58 0.31 -0.35 3.99 2.20 0.34 -5.00 119.74 117.65 1dm0 s LYS 13 Ca 0.32 0.33 -0.10 0.00 -0.36 0.00 0.00 55.97 56.15 1dm0 s LYS 13 Cb 0.00 0.15 0.01 0.00 -1.51 0.00 0.00 37.83 36.49 1dm0 s LYS 13 CO 0.16 -0.04 0.18 -0.47 -0.36 0.00 0.00 175.35 174.82 1dm0 s TYR 14 N 0.07 3.22 0.88 4.03 6.14 -1.26 -0.24 117.35 130.19 1dm0 s TYR 14 Ca -0.01 -0.83 -0.13 0.00 0.64 0.00 0.00 57.07 56.75 1dm0 s TYR 14 Cb -0.02 -2.40 0.12 0.00 0.42 0.00 0.00 41.96 40.09 1dm0 s TYR 14 CO 0.00 -0.58 1.17 -0.80 0.64 0.00 0.00 175.55 175.99 1dm0 s ASN 15 N 1.57 3.79 0.17 4.32 0.01 -0.58 -4.99 114.94 119.23 1dm0 s ASN 15 Ca 0.03 0.82 0.26 0.00 -0.71 0.00 0.00 52.86 53.26 1dm0 s ASN 15 Cb -0.18 -1.30 0.89 0.00 0.41 0.00 0.00 41.25 41.07 1dm0 s ASN 15 CO 0.06 -2.36 1.80 -0.67 -1.51 0.00 0.00 177.10 174.42 1dm0 n ASP 16 N -3.62 0.65 -1.82 -1.22 2.03 -1.26 -2.48 116.55 108.84 1dm0 n ASP 16 Ca 0.08 0.57 -0.05 0.00 0.52 0.00 0.00 54.79 55.90 1dm0 n ASP 16 Cb 0.60 -0.74 0.28 0.00 -0.72 0.00 0.00 41.12 40.54 1dm0 n ASP 16 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1dm0 n ASP 17 N -2.12 4.44 -0.11 1.67 5.75 -1.26 -4.90 116.55 120.03 1dm0 n ASP 17 Ca 0.06 -3.29 -0.01 0.00 -0.01 0.00 0.00 54.79 51.54 1dm0 n ASP 17 Cb 0.40 -0.72 -0.01 0.00 -1.03 0.00 0.00 41.12 39.76 1dm0 n ASP 17 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1dm0 n ASP 18 N -0.36 -5.81 -4.83 -1.12 8.00 -1.03 -4.97 116.55 106.42 1dm0 n ASP 18 Ca 0.39 0.03 -0.32 0.00 0.71 0.00 0.00 54.79 55.61 1dm0 n ASP 18 Cb 1.32 -3.44 -0.02 0.00 -0.02 0.00 0.00 41.12 38.97 1dm0 n ASP 18 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1dm0 s THR 19 N -1.17 4.35 -0.03 -3.53 -4.23 -1.26 -4.86 115.64 104.91 1dm0 s THR 19 Ca 0.00 1.10 0.07 0.00 -1.18 0.00 0.00 61.69 61.68 1dm0 s THR 19 Cb 0.00 -3.64 -0.02 0.00 1.34 0.00 0.00 72.50 70.18 1dm0 s THR 19 CO 0.00 -0.67 -0.25 0.12 -0.54 0.00 0.00 174.62 173.28 1dm0 s PHE 20 N -2.62 2.26 -0.11 3.99 5.36 -1.00 -1.52 117.98 124.35 1dm0 s PHE 20 Ca 0.60 -0.48 0.03 0.00 -0.96 0.00 0.00 56.93 56.12 1dm0 s PHE 20 Cb -0.12 -1.47 -0.00 0.00 -0.34 0.00 0.00 43.02 41.10 1dm0 s PHE 20 CO 0.34 -0.08 -0.22 0.99 -1.46 0.00 0.00 175.22 174.80 1dm0 s THR 21 N -0.49 2.24 0.21 0.12 2.01 0.67 -1.34 115.64 119.07 1dm0 s THR 21 Ca 0.07 -0.95 0.09 0.00 0.31 0.00 0.00 61.69 61.21 1dm0 s THR 21 Cb -0.10 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 1dm0 s THR 21 CO 0.00 0.55 -0.07 0.54 -0.69 0.00 0.00 174.62 174.95 1dm0 s VAL 22 N 0.36 3.24 -0.32 3.82 0.11 -0.05 -0.50 120.40 127.05 1dm0 s VAL 22 Ca -0.17 -1.76 -0.01 0.00 -2.93 0.00 0.00 61.98 57.12 1dm0 s VAL 22 Cb -0.18 -2.64 0.11 0.00 -1.53 0.00 0.00 36.38 32.14 1dm0 s VAL 22 CO 0.08 -0.19 0.12 -0.75 -3.33 0.00 0.00 175.10 171.03 1dm0 s LYS 23 N -3.08 0.73 -0.11 1.54 2.47 -1.10 -1.93 119.74 118.25 1dm0 s LYS 23 Ca 0.27 -1.14 0.01 0.00 -1.56 0.00 0.00 55.97 53.55 1dm0 s LYS 23 Cb -0.08 -1.94 -0.01 0.00 -1.46 0.00 0.00 37.83 34.34 1dm0 s LYS 23 CO 0.16 -1.02 -0.16 0.08 0.16 0.00 0.00 175.35 174.58 1dm0 s VAL 24 N 1.50 2.80 0.00 4.02 1.01 -1.24 -0.06 120.40 128.43 1dm0 s VAL 24 Ca 0.11 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1dm0 s VAL 24 Cb -0.18 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.06 1dm0 s VAL 24 CO -0.22 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.02 1dm0 n GLY 25 N 3.39 2.40 0.00 4.51 0.00 -1.26 -3.54 105.19 110.70 1dm0 n GLY 25 Ca -0.18 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1dm0 n GLY 25 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dm0 n ASP 26 N 9.61 0.66 -4.86 1.61 5.75 -1.26 -5.03 116.55 123.02 1dm0 n ASP 26 Ca 0.00 -0.94 -0.21 0.00 -0.01 0.00 0.00 54.79 53.63 1dm0 n ASP 26 Cb 0.00 0.07 -0.04 0.00 -1.03 0.00 0.00 41.12 40.13 1dm0 n ASP 26 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1dm0 s LYS 27 N -0.07 2.96 -0.36 0.11 -0.14 -1.23 -4.93 119.74 116.07 1dm0 s LYS 27 Ca 0.00 -1.07 -0.00 0.00 -1.36 0.00 0.00 55.97 53.54 1dm0 s LYS 27 Cb 0.00 -2.60 0.13 0.00 -1.68 0.00 0.00 37.83 33.68 1dm0 s LYS 27 CO 0.00 0.32 0.19 -2.00 -0.76 0.00 0.00 175.35 173.11 1dm0 s GLU 28 N -3.91 0.72 0.34 1.68 2.12 -1.26 -3.60 118.70 114.79 1dm0 s GLU 28 Ca 0.35 -1.38 0.08 0.00 0.36 0.00 0.00 54.97 54.38 1dm0 s GLU 28 Cb -0.08 -1.65 -0.03 0.00 0.26 0.00 0.00 34.13 32.64 1dm0 s GLU 28 CO 0.26 -1.15 0.25 -0.51 -0.54 0.00 0.00 175.26 173.57 1dm0 s LEU 29 N 1.07 3.50 0.34 2.70 1.43 -0.81 0.70 118.68 127.61 1dm0 s LEU 29 Ca 0.16 -0.57 0.03 0.00 -1.03 0.00 0.00 54.13 52.72 1dm0 s LEU 29 Cb -0.22 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 1dm0 s LEU 29 CO -0.07 -0.33 0.12 0.72 0.23 0.00 0.00 176.35 177.02 1dm0 s PHE 30 N -2.34 1.73 0.04 0.29 -0.12 -0.28 -0.87 117.98 116.43 1dm0 s PHE 30 Ca 0.40 -1.23 -0.04 0.00 -0.05 0.00 0.00 56.93 56.01 1dm0 s PHE 30 Cb -0.05 -1.06 -0.02 0.00 -0.63 0.00 0.00 43.02 41.27 1dm0 s PHE 30 CO 0.25 -0.31 0.06 -0.08 -0.05 0.00 0.00 175.22 175.09 1dm0 s THR 31 N -3.43 0.14 -0.55 -4.49 -1.32 -0.45 0.66 115.64 106.21 1dm0 s THR 31 Ca 0.32 -1.16 0.06 0.00 -1.21 0.00 0.00 61.69 59.70 1dm0 s THR 31 Cb 0.05 -0.86 0.15 0.00 -1.51 0.00 0.00 72.50 70.34 1dm0 s THR 31 CO 0.16 -0.64 1.08 -0.46 -2.21 0.00 0.00 174.62 172.55 1dm0 n ASN 32 N 0.84 2.39 -4.51 8.08 2.04 -1.26 -2.36 115.26 120.47 1dm0 n ASN 32 Ca -0.19 -1.91 -0.42 0.00 -0.44 0.00 0.00 54.58 51.62 1dm0 n ASN 32 Cb 0.58 -0.11 -0.03 0.00 -2.53 0.00 0.00 39.78 37.69 1dm0 n ASN 32 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1dm0 s ARG 33 N -0.94 3.22 0.42 -3.83 1.81 -1.26 -4.92 118.95 113.45 1dm0 s ARG 33 Ca 0.12 -0.62 0.34 0.00 -1.72 0.00 0.00 55.73 53.85 1dm0 s ARG 33 Cb 0.07 -4.35 1.38 0.00 -0.45 0.00 0.00 34.95 31.59 1dm0 s ARG 33 CO 0.09 -2.02 1.37 0.91 -0.68 0.00 0.00 175.30 174.96 1dm0 n TRP 34 N 8.60 0.41 0.42 -0.53 7.02 -1.26 -2.15 117.44 129.95 1dm0 n TRP 34 Ca 0.05 0.41 0.13 0.00 -1.02 0.00 0.00 57.50 57.07 1dm0 n TRP 34 Cb 0.48 -0.84 0.30 0.00 -2.42 0.00 0.00 31.31 28.83 1dm0 n TRP 34 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1dm0 h ASN 35 N 0.00 0.00 -0.04 -0.99 2.35 -2.01 -3.26 115.58 111.62 1dm0 h ASN 35 Ca 0.79 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 56.36 1dm0 h ASN 35 Cb 2.77 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 41.14 1dm0 h ASN 35 CO -0.27 0.00 -0.62 -0.07 -1.65 0.00 0.00 177.43 174.81 1dm0 h LEU 36 N 0.00 0.75 -1.61 1.61 3.38 -1.86 -3.32 115.31 114.25 1dm0 h LEU 36 Ca 0.00 -0.43 0.39 0.00 0.09 0.00 0.00 57.88 57.93 1dm0 h LEU 36 Cb 0.85 -0.22 -0.09 0.00 0.09 0.00 0.00 40.66 41.29 1dm0 h LEU 36 CO 0.00 1.19 0.88 1.56 0.09 0.00 0.00 178.44 182.16 1dm0 h GLN 37 N 0.48 0.13 0.00 1.13 4.20 -1.74 1.39 115.11 120.71 1dm0 h GLN 37 Ca -0.01 -0.01 -0.32 0.00 0.06 0.00 0.00 58.65 58.37 1dm0 h GLN 37 Cb 1.20 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.90 1dm0 h GLN 37 CO 0.12 0.09 -1.99 0.43 -0.67 0.00 0.00 178.83 176.81 1dm0 n SER 38 N -4.46 0.49 -0.10 1.46 7.64 -1.25 -2.74 113.62 114.66 1dm0 n SER 38 Ca 0.32 0.23 -0.10 0.00 1.01 0.00 0.00 58.87 60.34 1dm0 n SER 38 Cb 1.32 0.41 -0.02 0.00 -1.01 0.00 0.00 64.21 64.91 1dm0 n SER 38 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1dm0 h LEU 39 N 0.00 0.44 0.81 -3.43 3.38 0.05 -2.93 115.31 113.62 1dm0 h LEU 39 Ca -0.39 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.38 1dm0 h LEU 39 Cb 2.10 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.73 1dm0 h LEU 39 CO 0.06 0.48 -0.47 -0.07 0.09 0.00 0.00 178.44 178.53 1dm0 h LEU 40 N 0.37 -1.18 0.00 1.67 3.38 0.15 -1.33 115.31 118.36 1dm0 h LEU 40 Ca 0.11 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1dm0 h LEU 40 Cb 0.18 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1dm0 h LEU 40 CO -0.01 -0.74 0.00 -0.11 0.09 0.00 0.00 178.44 177.67 1dm0 n LEU 41 N -5.46 0.00 -0.11 1.67 0.00 -1.11 0.25 117.00 112.24 1dm0 n LEU 41 Ca -0.15 0.11 -0.14 0.00 0.00 0.00 0.00 56.01 55.84 1dm0 n LEU 41 Cb 0.49 -0.11 -0.12 0.00 0.00 0.00 0.00 43.42 43.68 1dm0 n LEU 41 CO 0.34 -0.11 -1.19 -1.20 0.00 0.00 0.00 177.39 175.24 1dm0 n SER 42 N -1.11 1.71 -0.07 1.96 7.64 -0.88 -3.12 113.62 119.75 1dm0 n SER 42 Ca 0.01 -0.08 -0.11 0.00 1.01 0.00 0.00 58.87 59.70 1dm0 n SER 42 Cb 0.01 0.06 0.03 0.00 -1.01 0.00 0.00 64.21 63.29 1dm0 n SER 42 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dm0 h ALA 43 N 0.28 0.68 -0.73 -0.43 0.00 0.45 -2.58 119.26 116.93 1dm0 h ALA 43 Ca -0.50 -0.46 0.05 0.00 0.00 0.00 0.00 54.91 54.01 1dm0 h ALA 43 Cb 1.89 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 19.51 1dm0 h ALA 43 CO -0.05 0.67 0.43 0.37 0.00 0.00 0.00 179.25 180.67 1dm0 h GLN 44 N 0.64 0.78 0.00 0.00 4.15 -0.36 0.20 115.11 120.52 1dm0 h GLN 44 Ca 0.05 -0.05 -0.05 0.00 0.77 0.00 0.00 58.65 59.37 1dm0 h GLN 44 Cb 0.97 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.48 1dm0 h GLN 44 CO 0.09 0.51 -0.24 0.82 -1.93 0.00 0.00 178.83 178.08 1dm0 h ILE 45 N 0.80 0.52 -0.01 2.39 2.04 -1.47 -3.20 117.51 118.58 1dm0 h ILE 45 Ca 0.32 -1.31 0.00 0.00 1.00 0.00 0.00 64.86 64.86 1dm0 h ILE 45 Cb 0.15 1.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.15 1dm0 h ILE 45 CO -0.16 0.24 -0.01 0.35 0.00 0.00 0.00 178.15 178.57 1dm0 n THR 46 N -3.30 0.00 -2.98 -0.27 -2.24 -0.90 -4.99 114.28 99.60 1dm0 n THR 46 Ca 0.01 -0.50 -0.12 0.00 -2.27 0.00 0.00 64.05 61.17 1dm0 n THR 46 Cb 0.50 1.17 0.06 0.00 -2.10 0.00 0.00 70.33 69.96 1dm0 n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dm0 n GLY 47 N 0.48 -0.26 3.87 3.38 0.00 0.61 -4.99 105.19 108.28 1dm0 n GLY 47 Ca 0.05 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1dm0 n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dm0 s MET 48 N -4.76 3.81 -0.18 1.61 -1.94 -0.53 -4.99 119.30 112.32 1dm0 s MET 48 Ca 0.08 0.42 -0.09 0.00 -1.71 0.00 0.00 55.69 54.39 1dm0 s MET 48 Cb -0.01 -2.47 -0.05 0.00 2.01 0.00 0.00 34.83 34.31 1dm0 s MET 48 CO 0.54 0.09 0.12 0.99 -0.01 0.00 0.00 175.02 176.75 1dm0 s THR 49 N -2.18 5.36 0.01 2.05 2.01 -1.24 -4.05 115.64 117.60 1dm0 s THR 49 Ca 0.50 0.17 0.03 0.00 0.31 0.00 0.00 61.69 62.70 1dm0 s THR 49 Cb -0.10 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 68.98 1dm0 s THR 49 CO 0.27 0.49 -0.09 0.68 -0.69 0.00 0.00 174.62 175.28 1dm0 s VAL 50 N 0.02 0.66 -0.17 3.82 -7.23 0.61 -2.58 120.40 115.54 1dm0 s VAL 50 Ca 0.09 -0.55 -0.05 0.00 -1.81 0.00 0.00 61.98 59.66 1dm0 s VAL 50 Cb -0.11 -0.60 -0.03 0.00 0.56 0.00 0.00 36.38 36.20 1dm0 s VAL 50 CO -0.00 0.05 -0.00 -0.89 -0.31 0.00 0.00 175.10 173.94 1dm0 s THR 51 N -0.48 4.13 -0.12 5.32 2.01 -0.80 -1.46 115.64 124.23 1dm0 s THR 51 Ca 0.01 -0.27 -0.02 0.00 0.31 0.00 0.00 61.69 61.72 1dm0 s THR 51 Cb -0.05 -2.84 -0.03 0.00 0.01 0.00 0.00 72.50 69.59 1dm0 s THR 51 CO 0.00 0.47 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.73 1dm0 s ILE 52 N 0.54 3.91 -0.19 1.82 1.01 -0.83 -1.62 121.20 125.85 1dm0 s ILE 52 Ca -0.01 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.28 1dm0 s ILE 52 Cb -0.14 -2.68 0.03 0.00 0.01 0.00 0.00 42.46 39.69 1dm0 s ILE 52 CO 0.02 0.54 -0.14 -0.54 0.00 0.00 0.00 174.94 174.82 1dm0 s LYS 53 N -0.11 2.39 0.01 2.79 1.02 -1.18 -0.08 119.74 124.57 1dm0 s LYS 53 Ca 0.02 -0.83 -0.14 0.00 0.02 0.00 0.00 55.97 55.05 1dm0 s LYS 53 Cb -0.13 -2.43 0.02 0.00 -0.52 0.00 0.00 37.83 34.77 1dm0 s LYS 53 CO 0.02 -0.33 0.30 -0.08 -0.92 0.00 0.00 175.35 174.34 1dm0 s THR 54 N 1.36 0.07 -1.54 2.17 -1.32 -1.05 -4.37 115.64 110.95 1dm0 s THR 54 Ca 0.01 -0.56 0.10 0.00 -1.21 0.00 0.00 61.69 60.04 1dm0 s THR 54 Cb -0.15 -0.71 0.37 0.00 -1.51 0.00 0.00 72.50 70.50 1dm0 s THR 54 CO -0.10 -0.31 1.24 0.59 -2.21 0.00 0.00 174.62 173.84 1dm0 n ASN 55 N 1.05 2.54 -2.65 8.08 4.13 -1.26 -4.02 115.26 123.13 1dm0 n ASN 55 Ca -0.21 -2.16 -0.19 0.00 1.68 0.00 0.00 54.58 53.70 1dm0 n ASN 55 Cb 0.57 -0.37 0.01 0.00 -1.54 0.00 0.00 39.78 38.45 1dm0 n ASN 55 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1dm0 n ALA 56 N 0.53 4.10 -0.53 5.41 0.00 -1.26 -4.96 120.51 123.80 1dm0 n ALA 56 Ca 0.13 -3.79 -0.05 0.00 0.00 0.00 0.00 53.44 49.73 1dm0 n ALA 56 Cb 0.47 -0.75 -0.07 0.00 0.00 0.00 0.00 19.45 19.09 1dm0 n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dm0 s HIS 58 N 1.40 2.05 0.37 0.00 -3.43 -1.26 -5.03 115.29 109.39 1dm0 s HIS 58 Ca 0.28 -0.40 -0.25 0.00 -0.80 0.00 0.00 55.06 53.89 1dm0 s HIS 58 Cb 0.13 -1.11 -0.12 0.00 -1.43 0.00 0.00 32.58 30.06 1dm0 s HIS 58 CO 0.00 0.28 0.92 0.09 -2.00 0.00 0.00 174.74 174.04 1dm0 n ASN 59 N 0.94 0.86 0.00 7.38 3.02 -1.26 0.32 115.26 126.52 1dm0 n ASN 59 Ca -0.18 1.06 0.00 0.00 -0.03 0.00 0.00 54.58 55.43 1dm0 n ASN 59 Cb 0.54 -1.28 0.00 0.00 -0.61 0.00 0.00 39.78 38.42 1dm0 n ASN 59 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dm0 n GLY 60 N 1.31 0.36 3.80 7.41 0.00 0.22 -4.91 105.19 113.38 1dm0 n GLY 60 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1dm0 n GLY 60 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dm0 s GLY 61 N -2.00 2.66 0.09 -0.02 0.00 0.15 -4.76 107.32 103.45 1dm0 s GLY 61 Ca 0.00 0.38 -0.19 0.00 0.00 0.00 0.00 44.72 44.91 1dm0 s GLY 61 CO 0.00 0.76 0.58 -0.32 0.00 0.00 0.00 173.10 174.12 1dm0 s GLY 62 N -1.74 2.65 0.31 0.20 0.00 -1.26 -1.13 107.32 106.35 1dm0 s GLY 62 Ca 0.50 0.03 0.07 0.00 0.00 0.00 0.00 44.72 45.32 1dm0 s GLY 62 CO 0.21 0.43 -0.05 -0.11 0.00 0.00 0.00 173.10 173.58 1dm0 s PHE 63 N -1.18 2.12 0.00 1.90 -0.71 0.21 -4.64 117.98 115.68 1dm0 s PHE 63 Ca 0.31 -0.66 0.00 0.00 -1.04 0.00 0.00 56.93 55.53 1dm0 s PHE 63 Cb -0.19 -1.25 0.00 0.00 -1.21 0.00 0.00 43.02 40.37 1dm0 s PHE 63 CO 0.19 0.35 0.00 0.45 -1.34 0.00 0.00 175.22 174.87 1dm0 n SER 64 N -0.68 0.00 -4.66 1.98 2.88 -1.26 -4.35 113.62 107.54 1dm0 n SER 64 Ca -0.05 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.17 1dm0 n SER 64 Cb 0.64 0.01 -0.09 0.00 -0.75 0.00 0.00 64.21 64.02 1dm0 n SER 64 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1dm0 s GLU 65 N -1.45 2.64 0.05 -1.46 -1.05 -1.26 -5.02 118.70 111.14 1dm0 s GLU 65 Ca 0.00 -0.71 -0.07 0.00 -0.15 0.00 0.00 54.97 54.04 1dm0 s GLU 65 Cb 0.00 -2.58 -0.01 0.00 -0.44 0.00 0.00 34.13 31.11 1dm0 s GLU 65 CO 0.00 0.59 0.14 0.08 0.95 0.00 0.00 175.26 177.03 1dm0 s VAL 66 N -1.12 0.13 -0.18 1.83 1.01 -1.26 -3.11 120.40 117.71 1dm0 s VAL 66 Ca 0.20 -1.07 -0.00 0.00 0.00 0.00 0.00 61.98 61.11 1dm0 s VAL 66 Cb -0.11 -1.01 0.04 0.00 0.00 0.00 0.00 36.38 35.30 1dm0 s VAL 66 CO 0.11 -0.59 -0.05 -0.63 0.00 0.00 0.00 175.10 173.94 1dm0 s ILE 67 N -2.88 1.14 -0.48 2.22 1.01 -0.64 -4.99 121.20 116.59 1dm0 s ILE 67 Ca -0.03 -0.71 -0.21 0.00 0.00 0.00 0.00 60.65 59.70 1dm0 s ILE 67 Cb 0.00 -1.35 0.04 0.00 0.01 0.00 0.00 42.46 41.16 1dm0 s ILE 67 CO -0.06 0.08 0.70 -0.36 0.00 0.00 0.00 174.94 175.30 1dm0 s PHE 68 N 1.61 3.01 -2.43 3.97 0.40 -1.26 -1.91 117.98 121.37 1dm0 s PHE 68 Ca -0.00 -0.17 0.19 0.00 -0.60 0.00 0.00 56.93 56.35 1dm0 s PHE 68 Cb -0.16 -3.54 0.15 0.00 0.51 0.00 0.00 43.02 39.98 1dm0 s PHE 68 CO -0.08 -1.00 1.12 0.54 0.70 0.00 0.00 175.22 176.50