#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmo s SER 2 N 0.00 0.36 -0.07 1.61 0.15 -1.26 -5.15 113.70 109.34 2dmo s SER 2 Ca 0.00 -0.22 0.01 0.00 0.70 0.00 0.00 55.95 56.44 2dmo s SER 2 Cb 0.00 0.01 0.02 0.00 -1.71 0.00 0.00 66.02 64.34 2dmo s SER 2 CO 0.00 -0.08 -0.09 -0.55 1.20 0.00 0.00 173.24 173.73 2dmo s SER 3 N -0.59 1.68 -0.29 5.45 0.15 -1.26 -4.96 113.70 113.87 2dmo s SER 3 Ca -0.04 -0.25 -0.17 0.00 0.70 0.00 0.00 55.95 56.18 2dmo s SER 3 Cb -0.04 -0.73 -0.02 0.00 -1.71 0.00 0.00 66.02 63.52 2dmo s SER 3 CO -0.00 -0.04 0.48 -0.83 1.20 0.00 0.00 173.24 174.06 2dmo s GLY 4 N 1.04 1.84 -0.08 9.45 0.00 -1.26 -4.95 107.32 113.37 2dmo s GLY 4 Ca -0.08 -0.79 -0.08 0.00 0.00 0.00 0.00 44.72 43.77 2dmo s GLY 4 CO -0.01 1.19 -0.15 -1.14 0.00 0.00 0.00 173.10 173.00 2dmo n SER 5 N 5.57 0.88 -3.40 1.64 3.41 -1.26 -5.02 113.62 115.43 2dmo n SER 5 Ca -0.05 0.19 -0.06 0.00 -0.26 0.00 0.00 58.87 58.70 2dmo n SER 5 Cb 0.50 -0.62 -0.07 0.00 -0.26 0.00 0.00 64.21 63.76 2dmo n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dmo s SER 6 N -4.82 -0.32 0.04 4.04 0.01 -1.26 -5.16 113.70 106.23 2dmo s SER 6 Ca -0.12 0.64 0.05 0.00 1.31 0.00 0.00 55.95 57.83 2dmo s SER 6 Cb 0.02 1.48 -0.02 0.00 0.21 0.00 0.00 66.02 67.71 2dmo s SER 6 CO 0.18 -0.27 -0.15 -0.83 0.41 0.00 0.00 173.24 172.58 2dmo s GLY 7 N 2.65 0.83 -0.72 3.44 0.00 -1.26 -4.92 107.32 107.35 2dmo s GLY 7 Ca 0.10 -0.85 -0.26 0.00 0.00 0.00 0.00 44.72 43.71 2dmo s GLY 7 CO -0.16 -0.82 2.08 -0.54 0.00 0.00 0.00 173.10 173.66 2dmo s GLU 8 N -1.13 2.32 0.16 2.90 0.41 -0.38 -4.20 118.70 118.79 2dmo s GLU 8 Ca 0.02 0.42 -0.31 0.00 -0.41 0.00 0.00 54.97 54.69 2dmo s GLU 8 Cb -0.08 -4.72 -0.11 0.00 -1.78 0.00 0.00 34.13 27.44 2dmo s GLU 8 CO 0.01 -3.36 1.80 0.00 -0.49 0.00 0.00 175.26 173.22 2dmo s ALA 9 N 11.01 3.84 0.20 5.21 0.00 -1.26 -1.59 121.76 139.18 2dmo s ALA 9 Ca 0.78 1.52 0.10 0.00 0.00 0.00 0.00 51.96 54.37 2dmo s ALA 9 Cb -0.11 -3.74 -0.04 0.00 0.00 0.00 0.00 23.12 19.22 2dmo s ALA 9 CO 0.12 -1.11 -0.16 -1.01 0.00 0.00 0.00 175.76 173.60 2dmo s HIS 10 N 2.11 2.46 -0.20 0.00 3.76 -0.29 -1.69 115.29 121.43 2dmo s HIS 10 Ca 0.79 -0.29 -0.07 0.00 -0.15 0.00 0.00 55.06 55.34 2dmo s HIS 10 Cb -0.48 -1.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.99 2dmo s HIS 10 CO 0.35 0.54 0.05 0.50 -0.85 0.00 0.00 174.74 175.33 2dmo s ARG 11 N -2.90 3.84 0.46 1.40 6.06 0.43 -2.53 118.95 125.71 2dmo s ARG 11 Ca 0.24 -0.41 -0.24 0.00 -2.50 0.00 0.00 55.73 52.82 2dmo s ARG 11 Cb -0.08 -3.21 -0.07 0.00 0.06 0.00 0.00 34.95 31.65 2dmo s ARG 11 CO 0.13 0.13 1.28 0.08 -2.50 0.00 0.00 175.30 174.42 2dmo s VAL 12 N 0.75 2.61 0.11 7.11 1.01 -1.15 -1.72 120.40 129.12 2dmo s VAL 12 Ca 0.03 0.49 0.04 0.00 0.00 0.00 0.00 61.98 62.55 2dmo s VAL 12 Cb -0.14 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 2dmo s VAL 12 CO 0.02 0.03 -0.11 -0.76 0.00 0.00 0.00 175.10 174.28 2dmo s LEU 13 N -2.89 2.41 -2.08 3.92 1.43 -1.17 -4.27 118.68 116.04 2dmo s LEU 13 Ca 0.63 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 2dmo s LEU 13 Cb -0.36 -0.38 0.00 0.00 0.03 0.00 0.00 46.19 45.48 2dmo s LEU 13 CO 0.45 -0.23 0.00 0.49 0.23 0.00 0.00 176.35 177.29 2dmo n PHE 14 N 0.53 -0.18 -3.65 0.29 3.01 -1.26 -2.71 117.46 113.49 2dmo n PHE 14 Ca -0.16 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.03 2dmo n PHE 14 Cb 0.58 -3.46 0.04 0.00 -0.01 0.00 0.00 39.48 36.63 2dmo n PHE 14 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dmo n GLY 15 N -0.46 -0.84 3.64 1.37 0.00 -1.26 -4.89 105.19 102.75 2dmo n GLY 15 Ca -0.21 0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2dmo n GLY 15 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2dmo s PHE 16 N -3.53 2.89 -0.71 1.61 5.36 -1.10 -4.92 117.98 117.58 2dmo s PHE 16 Ca 0.36 1.03 -0.03 0.00 -0.96 0.00 0.00 56.93 57.32 2dmo s PHE 16 Cb -0.11 -3.72 0.18 0.00 -0.34 0.00 0.00 43.02 39.02 2dmo s PHE 16 CO 0.84 -1.37 0.55 0.08 -1.46 0.00 0.00 175.22 173.86 2dmo s VAL 17 N 3.92 4.01 -0.88 3.12 1.01 -1.26 -4.76 120.40 125.55 2dmo s VAL 17 Ca 0.52 -3.18 -0.25 0.00 0.00 0.00 0.00 61.98 59.08 2dmo s VAL 17 Cb -0.16 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2dmo s VAL 17 CO 0.18 -0.94 1.94 -2.16 0.00 0.00 0.00 175.10 174.12 2dmo s PRO 18 N -0.40 2.56 -0.70 2.72 0.04 -1.26 -4.91 135.00 133.05 2dmo s PRO 18 Ca 0.20 -0.22 -0.12 0.00 0.04 0.00 0.00 61.00 60.90 2dmo s PRO 18 Cb -0.16 -5.01 0.18 0.00 0.04 0.00 0.00 34.50 29.55 2dmo s PRO 18 CO -0.06 -3.33 0.61 -2.00 0.04 0.00 0.00 177.00 172.26 2dmo s GLU 19 N 7.02 3.17 -0.06 4.56 2.12 -1.26 -2.89 118.70 131.36 2dmo s GLU 19 Ca 0.70 -2.25 -0.30 0.00 0.36 0.00 0.00 54.97 53.48 2dmo s GLU 19 Cb -0.07 -4.22 0.09 0.00 0.26 0.00 0.00 34.13 30.18 2dmo s GLU 19 CO 0.01 -1.27 0.76 0.95 -0.54 0.00 0.00 175.26 175.18 2dmo s THR 20 N 0.54 0.00 0.55 -1.70 -4.23 -1.25 -5.02 115.64 104.53 2dmo s THR 20 Ca 0.13 0.00 0.30 0.00 -1.18 0.00 0.00 61.69 60.94 2dmo s THR 20 Cb -0.18 -1.00 0.45 0.00 1.34 0.00 0.00 72.50 73.11 2dmo s THR 20 CO -0.05 0.00 1.91 0.07 -0.54 0.00 0.00 174.62 176.02 2dmo h LYS 21 N 2.78 0.00 0.00 3.99 -0.00 -2.03 -3.15 116.57 118.16 2dmo h LYS 21 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.40 2dmo h LYS 21 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.39 2dmo h LYS 21 CO 0.37 0.00 0.00 0.39 -0.00 0.00 0.00 179.45 180.21 2dmo n GLU 22 N -4.19 0.00 -1.72 0.07 1.02 -1.26 -4.90 120.64 109.66 2dmo n GLU 22 Ca 0.15 0.25 -0.43 0.00 -0.02 0.00 0.00 57.16 57.11 2dmo n GLU 22 Cb 0.83 -0.70 -0.02 0.00 -0.02 0.00 0.00 31.44 31.53 2dmo n GLU 22 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dmo n GLU 23 N -1.77 2.42 -2.65 3.49 4.71 -1.19 -4.03 120.64 121.61 2dmo n GLU 23 Ca 0.00 0.86 -0.43 0.00 -0.01 0.00 0.00 57.16 57.58 2dmo n GLU 23 Cb 0.00 -2.57 -0.02 0.00 -1.01 0.00 0.00 31.44 27.83 2dmo n GLU 23 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 2dmo s LEU 24 N -0.47 4.20 0.49 -4.62 2.96 -1.25 -3.78 118.68 116.21 2dmo s LEU 24 Ca 0.64 1.51 -0.24 0.00 -0.22 0.00 0.00 54.13 55.82 2dmo s LEU 24 Cb -0.55 -3.55 -0.07 0.00 0.50 0.00 0.00 46.19 42.52 2dmo s LEU 24 CO 0.52 -0.54 1.41 -1.10 -1.32 0.00 0.00 176.35 175.32 2dmo s GLN 25 N 2.44 3.45 0.36 1.98 -0.21 -1.14 -4.67 119.66 121.87 2dmo s GLN 25 Ca 0.48 2.38 0.01 0.00 0.02 0.00 0.00 55.36 58.25 2dmo s GLN 25 Cb -0.18 -2.50 -0.00 0.00 1.00 0.00 0.00 33.01 31.33 2dmo s GLN 25 CO 0.14 -0.99 0.44 1.33 -2.12 0.00 0.00 175.29 174.10 2dmo n VAL 26 N -0.53 0.00 -4.19 1.09 0.24 -1.26 -5.00 118.33 108.68 2dmo n VAL 26 Ca 0.07 -2.04 -0.23 0.00 -2.04 0.00 0.00 64.34 60.10 2dmo n VAL 26 Cb 0.43 1.17 -0.06 0.00 -1.47 0.00 0.00 33.84 33.91 2dmo n VAL 26 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2dmo s MET 27 N -2.99 2.63 -0.28 7.34 -1.94 -1.26 -4.77 119.30 118.02 2dmo s MET 27 Ca 0.33 -1.17 -0.29 0.00 -1.71 0.00 0.00 55.69 52.85 2dmo s MET 27 Cb -0.00 -2.40 -0.02 0.00 2.01 0.00 0.00 34.83 34.42 2dmo s MET 27 CO 0.24 0.40 1.65 -1.25 -0.01 0.00 0.00 175.02 176.05 2dmo s PRO 28 N -3.59 3.62 0.00 2.03 0.04 -1.26 -2.97 135.00 132.87 2dmo s PRO 28 Ca 0.31 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.86 2dmo s PRO 28 Cb -0.08 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.38 2dmo s PRO 28 CO 0.22 -1.51 0.00 0.41 0.04 0.00 0.00 177.00 176.16 2dmo n GLY 29 N 4.96 0.96 3.90 0.56 0.00 -1.26 -5.02 105.19 109.29 2dmo n GLY 29 Ca 0.20 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 2dmo n GLY 29 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dmo s ASN 30 N -2.70 4.65 -0.05 1.61 0.02 -1.16 -4.88 114.94 112.44 2dmo s ASN 30 Ca 0.00 -1.21 0.03 0.00 -1.02 0.00 0.00 52.86 50.66 2dmo s ASN 30 Cb 0.00 0.34 -0.03 0.00 0.02 0.00 0.00 41.25 41.58 2dmo s ASN 30 CO 0.00 -1.07 -0.13 -0.63 0.02 0.00 0.00 177.10 175.29 2dmo s ILE 31 N -2.75 3.19 -0.08 0.60 -1.09 -1.26 -2.92 121.20 116.89 2dmo s ILE 31 Ca 0.35 -0.70 -0.03 0.00 -2.23 0.00 0.00 60.65 58.04 2dmo s ILE 31 Cb -0.02 -2.27 0.05 0.00 -1.58 0.00 0.00 42.46 38.64 2dmo s ILE 31 CO 0.22 0.57 0.16 0.68 -1.23 0.00 0.00 174.94 175.34 2dmo s VAL 32 N -0.77 -0.21 -0.09 2.92 -7.23 -1.05 -4.95 120.40 109.02 2dmo s VAL 32 Ca 0.12 0.32 -0.30 0.00 -1.81 0.00 0.00 61.98 60.31 2dmo s VAL 32 Cb -0.11 -0.28 -0.03 0.00 0.56 0.00 0.00 36.38 36.52 2dmo s VAL 32 CO 0.01 0.13 1.33 -0.36 -0.31 0.00 0.00 175.10 175.91 2dmo s PHE 33 N 2.04 2.80 0.01 2.82 0.08 -1.19 -1.13 117.98 123.41 2dmo s PHE 33 Ca 0.00 0.90 -0.21 0.00 0.12 0.00 0.00 56.93 57.74 2dmo s PHE 33 Cb -0.12 -3.58 -0.06 0.00 -0.57 0.00 0.00 43.02 38.70 2dmo s PHE 33 CO -0.06 -2.08 0.63 0.08 -0.10 0.00 0.00 175.22 173.70 2dmo s VAL 34 N 3.07 4.85 -0.08 -0.44 1.01 -0.62 -0.15 120.40 128.03 2dmo s VAL 34 Ca 0.59 1.33 -0.08 0.00 0.00 0.00 0.00 61.98 63.83 2dmo s VAL 34 Cb -0.26 -3.97 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 2dmo s VAL 34 CO 0.21 0.42 -0.15 0.18 0.00 0.00 0.00 175.10 175.75 2dmo n LEU 35 N 2.66 0.95 -4.40 3.92 4.77 0.82 -1.25 117.00 124.47 2dmo n LEU 35 Ca -0.06 0.23 -0.30 0.00 -0.03 0.00 0.00 56.01 55.85 2dmo n LEU 35 Cb 0.51 -0.63 -0.13 0.00 -2.33 0.00 0.00 43.42 40.83 2dmo n LEU 35 CO 0.44 -0.41 -0.55 -0.75 -1.33 0.00 0.00 177.39 174.79 2dmo s LYS 36 N -1.87 1.70 -0.61 3.23 2.20 -1.25 -4.92 119.74 118.24 2dmo s LYS 36 Ca -0.13 -1.18 -0.13 0.00 -0.36 0.00 0.00 55.97 54.17 2dmo s LYS 36 Cb 0.02 -2.00 0.15 0.00 -1.51 0.00 0.00 37.83 34.49 2dmo s LYS 36 CO 0.19 0.49 0.54 0.15 -0.36 0.00 0.00 175.35 176.36 2dmo s LYS 37 N -1.66 3.02 1.00 4.03 1.02 -1.26 -1.14 119.74 124.75 2dmo s LYS 37 Ca 0.14 -1.97 -0.16 0.00 0.02 0.00 0.00 55.97 54.00 2dmo s LYS 37 Cb -0.10 -4.22 0.25 0.00 -0.52 0.00 0.00 37.83 33.23 2dmo s LYS 37 CO 0.05 -1.28 0.56 0.41 -0.92 0.00 0.00 175.35 174.16 2dmo n GLY 38 N 4.74 -3.36 0.02 -3.33 0.00 -1.09 -4.97 105.19 97.19 2dmo n GLY 38 Ca -0.04 -1.09 -0.01 0.00 0.00 0.00 0.00 46.02 44.88 2dmo n GLY 38 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2dmo n ASN 39 N -4.10 3.26 -2.37 1.61 6.94 -1.26 -4.64 115.26 114.70 2dmo n ASN 39 Ca 0.09 0.00 -0.26 0.00 -0.02 0.00 0.00 54.58 54.39 2dmo n ASN 39 Cb 0.39 0.92 -0.01 0.00 -2.36 0.00 0.00 39.78 38.71 2dmo n ASN 39 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2dmo n ASP 40 N -2.08 6.68 -3.20 0.53 8.00 -1.26 -4.77 116.55 120.45 2dmo n ASP 40 Ca -0.08 -3.28 -0.22 0.00 0.71 0.00 0.00 54.79 51.92 2dmo n ASP 40 Cb 0.54 -1.15 0.01 0.00 -0.02 0.00 0.00 41.12 40.49 2dmo n ASP 40 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2dmo n ASN 41 N 0.46 -4.29 -3.71 -2.24 2.85 -1.26 -4.93 115.26 102.14 2dmo n ASN 41 Ca 0.46 -0.31 -0.30 0.00 -0.11 0.00 0.00 54.58 54.32 2dmo n ASN 41 Cb 0.53 -3.53 -0.14 0.00 1.24 0.00 0.00 39.78 37.88 2dmo n ASN 41 CO 0.00 0.00 0.00 0.26 -2.11 0.00 0.00 177.26 175.41 2dmo s TRP 42 N -2.96 1.75 -0.05 1.20 0.23 -1.26 -3.76 118.94 114.09 2dmo s TRP 42 Ca 0.34 -2.00 -0.08 0.00 -2.03 0.00 0.00 56.10 52.33 2dmo s TRP 42 Cb -0.17 -1.73 -0.05 0.00 0.03 0.00 0.00 33.47 31.56 2dmo s TRP 42 CO 0.42 -0.84 0.24 0.00 0.96 0.00 0.00 176.95 177.72 2dmo s ALA 43 N 1.09 3.83 0.06 0.98 0.00 0.84 -2.67 121.76 125.89 2dmo s ALA 43 Ca 0.13 -0.54 -0.27 0.00 0.00 0.00 0.00 51.96 51.29 2dmo s ALA 43 Cb -0.20 -2.08 -0.05 0.00 0.00 0.00 0.00 23.12 20.78 2dmo s ALA 43 CO -0.13 0.60 0.84 0.99 0.00 0.00 0.00 175.76 178.06 2dmo s THR 44 N -1.13 4.68 0.45 0.00 2.01 -0.29 -0.57 115.64 120.79 2dmo s THR 44 Ca 0.21 1.79 0.03 0.00 0.31 0.00 0.00 61.69 64.02 2dmo s THR 44 Cb -0.13 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.17 2dmo s THR 44 CO 0.10 0.33 0.08 0.68 -0.69 0.00 0.00 174.62 175.13 2dmo s VAL 45 N 0.05 0.79 -0.01 3.82 -7.23 -0.20 -0.13 120.40 117.50 2dmo s VAL 45 Ca 0.42 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.58 2dmo s VAL 45 Cb -0.21 -2.27 0.01 0.00 0.56 0.00 0.00 36.38 34.47 2dmo s VAL 45 CO 0.25 0.00 0.03 -0.04 -0.31 0.00 0.00 175.10 175.04 2dmo s MET 46 N -3.76 0.02 -0.22 4.82 -1.94 0.78 -3.05 119.30 115.95 2dmo s MET 46 Ca 0.17 0.08 -0.04 0.00 -1.71 0.00 0.00 55.69 54.19 2dmo s MET 46 Cb 0.02 -0.04 0.11 0.00 2.01 0.00 0.00 34.83 36.93 2dmo s MET 46 CO 0.10 -0.04 0.37 0.12 -0.01 0.00 0.00 175.02 175.56 2dmo s PHE 47 N 0.27 -0.76 -1.35 -0.03 5.36 -0.91 -3.16 117.98 117.40 2dmo s PHE 47 Ca -0.02 1.02 -0.04 0.00 -0.96 0.00 0.00 56.93 56.93 2dmo s PHE 47 Cb -0.03 0.08 0.02 0.00 -0.34 0.00 0.00 43.02 42.75 2dmo s PHE 47 CO -0.01 -0.62 0.29 -1.71 -1.46 0.00 0.00 175.22 171.72 2dmo n ASN 48 N 5.37 -4.72 -1.20 6.13 5.15 -1.26 -2.12 115.26 122.61 2dmo n ASN 48 Ca -0.05 -0.12 -0.02 0.00 -0.60 0.00 0.00 54.58 53.79 2dmo n ASN 48 Cb 0.50 -3.91 0.01 0.00 -0.53 0.00 0.00 39.78 35.85 2dmo n ASN 48 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2dmo n GLY 49 N -1.13 0.41 2.97 8.20 0.00 -1.26 -5.07 105.19 109.30 2dmo n GLY 49 Ca -0.12 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 2dmo n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dmo s GLN 50 N -4.25 0.13 0.17 1.61 -0.21 -0.90 -4.90 119.66 111.30 2dmo s GLN 50 Ca 0.01 0.58 -0.15 0.00 0.02 0.00 0.00 55.36 55.81 2dmo s GLN 50 Cb -0.00 -0.14 -0.07 0.00 1.00 0.00 0.00 33.01 33.79 2dmo s GLN 50 CO 0.08 -0.23 0.59 0.21 -2.12 0.00 0.00 175.29 173.82 2dmo s LYS 51 N 1.84 4.04 -0.17 2.91 2.20 -1.26 -2.13 119.74 127.16 2dmo s LYS 51 Ca -0.03 0.58 -0.30 0.00 -0.36 0.00 0.00 55.97 55.85 2dmo s LYS 51 Cb -0.11 -2.90 0.13 0.00 -1.51 0.00 0.00 37.83 33.44 2dmo s LYS 51 CO -0.07 0.44 1.04 0.20 -0.36 0.00 0.00 175.35 176.60 2dmo s GLY 52 N -1.74 -0.23 0.40 5.54 0.00 -1.17 -4.50 107.32 105.62 2dmo s GLY 52 Ca 0.40 2.10 -0.15 0.00 0.00 0.00 0.00 44.72 47.08 2dmo s GLY 52 CO 0.20 1.03 0.82 1.08 0.00 0.00 0.00 173.10 176.22 2dmo s LEU 53 N -1.12 3.89 0.07 0.66 2.01 -1.26 -1.03 118.68 121.90 2dmo s LEU 53 Ca -0.00 1.34 -0.19 0.00 0.01 0.00 0.00 54.13 55.29 2dmo s LEU 53 Cb -0.01 -4.20 0.04 0.00 0.01 0.00 0.00 46.19 42.04 2dmo s LEU 53 CO 0.00 -0.36 0.43 0.68 1.01 0.00 0.00 176.35 178.12 2dmo s VAL 54 N -2.25 0.05 0.30 -1.59 -7.23 0.26 -3.93 120.40 106.00 2dmo s VAL 54 Ca 0.55 -0.43 -0.29 0.00 -1.81 0.00 0.00 61.98 60.00 2dmo s VAL 54 Cb -0.10 -1.01 -0.10 0.00 0.56 0.00 0.00 36.38 35.73 2dmo s VAL 54 CO 0.24 -0.24 1.24 -2.16 -0.31 0.00 0.00 175.10 173.87 2dmo s PRO 55 N -2.82 4.45 0.03 4.82 0.04 -1.26 -0.11 135.00 140.15 2dmo s PRO 55 Ca -0.03 2.06 0.06 0.00 0.04 0.00 0.00 61.00 63.13 2dmo s PRO 55 Cb -0.00 -3.12 -0.24 0.00 0.04 0.00 0.00 34.50 31.18 2dmo s PRO 55 CO -0.05 -0.06 0.94 0.00 0.04 0.00 0.00 177.00 177.87 2dmo h ASN 57 N 0.02 0.00 -0.80 0.00 -0.73 -1.92 -2.94 115.58 109.21 2dmo h ASN 57 Ca -0.18 0.00 -0.32 0.00 1.87 0.00 0.00 56.30 57.68 2dmo h ASN 57 Cb 1.93 0.00 -0.19 0.00 0.27 0.00 0.00 38.32 40.33 2dmo h ASN 57 CO 0.12 0.39 0.40 -1.22 -0.37 0.00 0.00 177.43 176.75 2dmo n TYR 58 N -3.51 2.58 -4.21 0.67 4.02 -1.25 -4.90 117.16 110.57 2dmo n TYR 58 Ca -0.00 -1.39 -0.16 0.00 -0.01 0.00 0.00 57.90 56.34 2dmo n TYR 58 Cb 0.53 -0.76 -0.14 0.00 -0.02 0.00 0.00 39.34 38.95 2dmo n TYR 58 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2dmo s LEU 59 N -2.94 2.02 -0.08 7.72 1.43 -1.11 -3.03 118.68 122.69 2dmo s LEU 59 Ca 0.53 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.53 2dmo s LEU 59 Cb 0.43 -0.31 -0.02 0.00 0.03 0.00 0.00 46.19 46.31 2dmo s LEU 59 CO 0.12 0.07 -0.12 -0.70 0.23 0.00 0.00 176.35 175.95 2dmo s GLU 60 N -0.18 2.81 -0.43 1.70 2.12 -0.70 -4.90 118.70 119.11 2dmo s GLU 60 Ca 0.02 -0.65 -0.28 0.00 0.36 0.00 0.00 54.97 54.42 2dmo s GLU 60 Cb -0.03 -2.51 -0.01 0.00 0.26 0.00 0.00 34.13 31.84 2dmo s GLU 60 CO -0.00 0.53 1.75 -1.25 -0.54 0.00 0.00 175.26 175.75 2dmo s PRO 61 N -0.47 3.15 -0.63 4.30 0.04 -1.26 -0.43 135.00 139.70 2dmo s PRO 61 Ca 0.06 1.08 -0.24 0.00 0.04 0.00 0.00 61.00 61.95 2dmo s PRO 61 Cb -0.12 -4.23 0.06 0.00 0.04 0.00 0.00 34.50 30.25 2dmo s PRO 61 CO 0.02 -2.09 0.99 0.08 0.04 0.00 0.00 177.00 176.04 2dmo s VAL 62 N 7.34 4.28 0.00 -0.36 1.01 -0.68 -4.70 120.40 127.28 2dmo s VAL 62 Ca 0.73 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.64 2dmo s VAL 62 Cb -0.18 -4.66 0.00 0.00 0.00 0.00 0.00 36.38 31.54 2dmo s VAL 62 CO 0.29 -1.39 0.00 -0.24 0.00 0.00 0.00 175.10 173.77 2dmo n SER 63 N 7.81 2.31 0.00 3.32 2.88 -1.26 -4.60 113.62 124.08 2dmo n SER 63 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 2dmo n SER 63 Cb 0.46 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 2dmo n SER 63 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dmo n GLY 64 N 2.64 -1.52 3.57 0.46 0.00 -1.26 -5.08 105.19 103.99 2dmo n GLY 64 Ca 0.00 0.38 -0.40 0.00 0.00 0.00 0.00 46.02 46.00 2dmo n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dmo s PRO 65 N -0.81 2.91 0.43 1.61 0.04 -1.26 -4.98 135.00 132.92 2dmo s PRO 65 Ca 0.00 0.86 0.08 0.00 0.04 0.00 0.00 61.00 61.98 2dmo s PRO 65 Cb 0.00 -4.30 0.01 0.00 0.04 0.00 0.00 34.50 30.25 2dmo s PRO 65 CO 0.00 -2.38 0.58 -1.12 0.04 0.00 0.00 177.00 174.11 2dmo s SER 66 N 7.15 5.64 -0.42 6.66 0.01 -1.26 -4.99 113.70 126.49 2dmo s SER 66 Ca 0.70 -0.44 -0.10 0.00 1.31 0.00 0.00 55.95 57.42 2dmo s SER 66 Cb -0.15 -0.63 0.07 0.00 0.21 0.00 0.00 66.02 65.52 2dmo s SER 66 CO 0.25 -0.78 0.28 -0.44 0.41 0.00 0.00 173.24 172.96 2dmo s SER 67 N -4.36 5.74 0.00 2.44 0.01 -1.26 -5.21 113.70 111.05 2dmo s SER 67 Ca 0.55 -1.41 0.00 0.00 1.31 0.00 0.00 55.95 56.40 2dmo s SER 67 Cb -0.10 -2.02 0.00 0.00 0.21 0.00 0.00 66.02 64.11 2dmo s SER 67 CO 0.33 -0.54 0.00 0.61 0.41 0.00 0.00 173.24 174.05