#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dsb h GLN 2 N 0.00 0.02 -5.07 0.00 1.08 -2.09 -3.44 115.11 105.61 1dsb h GLN 2 Ca 0.00 -0.03 -0.64 0.00 -1.45 0.00 0.00 58.65 56.53 1dsb h GLN 2 Cb 0.00 0.01 -0.34 0.00 -0.05 0.00 0.00 27.48 27.10 1dsb h GLN 2 CO 0.00 0.58 -0.86 0.71 -0.95 0.00 0.00 178.83 178.31 1dsb s TYR 3 N -2.61 2.38 0.01 2.96 2.02 -1.26 -5.02 117.35 115.83 1dsb s TYR 3 Ca -0.05 -1.11 0.05 0.00 -0.37 0.00 0.00 57.07 55.59 1dsb s TYR 3 Cb 0.08 -1.64 -0.02 0.00 -0.40 0.00 0.00 41.96 39.99 1dsb s TYR 3 CO 0.82 -0.51 -0.15 -1.21 -1.57 0.00 0.00 175.55 172.93 1dsb s GLU 4 N 0.74 1.11 0.12 -0.62 2.02 -1.26 -5.04 118.70 115.78 1dsb s GLU 4 Ca -0.10 -0.65 -0.31 0.00 0.02 0.00 0.00 54.97 53.93 1dsb s GLU 4 Cb -0.16 -1.11 -0.10 0.00 0.10 0.00 0.00 34.13 32.87 1dsb s GLU 4 CO 0.01 0.29 1.71 0.34 0.02 0.00 0.00 175.26 177.64 1dsb s ASP 5 N -0.71 6.51 0.00 -0.19 2.15 -1.26 -0.18 116.67 122.99 1dsb s ASP 5 Ca 0.04 2.65 0.00 0.00 0.43 0.00 0.00 52.55 55.68 1dsb s ASP 5 Cb -0.07 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.98 1dsb s ASP 5 CO 0.00 -0.93 0.00 0.61 -0.17 0.00 0.00 175.17 174.68 1dsb n GLY 6 N 4.05 0.61 0.00 2.66 0.00 0.17 -4.93 105.19 107.75 1dsb n GLY 6 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1dsb n GLY 6 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1dsb n LYS 7 N -2.00 0.00 0.00 1.61 3.00 0.75 -4.81 118.16 116.71 1dsb n LYS 7 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.43 1dsb n LYS 7 Cb 0.00 0.00 0.22 0.00 0.00 0.00 0.00 35.03 35.25 1dsb n LYS 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1dsb n GLN 8 N -1.04 1.08 -3.73 1.64 0.00 -1.12 -4.19 117.38 110.02 1dsb n GLN 8 Ca 0.00 -0.77 -0.08 0.00 0.00 0.00 0.00 57.00 56.15 1dsb n GLN 8 Cb 0.00 -1.48 -0.02 0.00 0.00 0.00 0.00 30.24 28.74 1dsb n GLN 8 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.06 178.58 1dsb s TYR 9 N -2.45 -0.28 0.11 2.61 1.13 -1.25 -0.85 117.35 116.35 1dsb s TYR 9 Ca 0.23 -0.10 0.05 0.00 -1.41 0.00 0.00 57.07 55.84 1dsb s TYR 9 Cb 0.19 0.66 -0.04 0.00 -1.10 0.00 0.00 41.96 41.68 1dsb s TYR 9 CO 0.53 -1.11 -0.13 0.95 -2.51 0.00 0.00 175.55 173.28 1dsb s THR 10 N -3.84 1.18 -0.18 -3.49 -4.23 0.18 0.45 115.64 105.71 1dsb s THR 10 Ca 0.08 -1.65 -0.06 0.00 -1.18 0.00 0.00 61.69 58.88 1dsb s THR 10 Cb -0.04 -1.43 -0.04 0.00 1.34 0.00 0.00 72.50 72.33 1dsb s THR 10 CO 0.01 -0.45 0.04 -0.89 -0.54 0.00 0.00 174.62 172.79 1dsb s THR 11 N -2.16 4.51 0.27 3.99 2.01 -1.26 -0.69 115.64 122.30 1dsb s THR 11 Ca 0.07 -0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.63 1dsb s THR 11 Cb -0.05 -3.02 -0.11 0.00 0.01 0.00 0.00 72.50 69.33 1dsb s THR 11 CO 0.02 0.46 1.54 -0.76 -0.69 0.00 0.00 174.62 175.19 1dsb s LEU 12 N 0.47 4.36 0.55 4.42 1.43 0.61 -4.87 118.68 125.65 1dsb s LEU 12 Ca 0.01 2.83 0.33 0.00 -1.03 0.00 0.00 54.13 56.28 1dsb s LEU 12 Cb -0.13 -3.63 1.44 0.00 0.03 0.00 0.00 46.19 43.90 1dsb s LEU 12 CO 0.01 -0.84 2.02 1.05 0.23 0.00 0.00 176.35 178.82 1dsb h GLU 13 N 5.06 0.00 -2.93 1.70 4.11 -1.97 -3.35 114.58 117.21 1dsb h GLU 13 Ca -0.46 0.00 -0.59 0.00 0.07 0.00 0.00 59.36 58.37 1dsb h GLU 13 Cb 1.22 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.07 1dsb h GLU 13 CO 0.80 0.04 -0.78 -1.59 0.07 0.00 0.00 179.01 177.55 1dsb s LYS 14 N -3.77 0.92 0.83 1.06 0.00 -1.26 -5.12 119.74 112.40 1dsb s LYS 14 Ca -0.00 -1.59 -0.14 0.00 0.00 0.00 0.00 55.97 54.24 1dsb s LYS 14 Cb 0.10 -1.90 0.05 0.00 0.00 0.00 0.00 37.83 36.07 1dsb s LYS 14 CO 0.54 -1.15 0.85 -0.35 0.00 0.00 0.00 175.35 175.25 1dsb n PRO 15 N 3.96 0.05 -3.90 1.78 -0.04 -1.26 -4.98 135.00 130.62 1dsb n PRO 15 Ca 0.08 0.08 -0.35 0.00 -0.04 0.00 0.00 63.50 63.26 1dsb n PRO 15 Cb 0.37 -2.15 -0.14 0.00 -0.04 0.00 0.00 33.50 31.54 1dsb n PRO 15 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1dsb s VAL 16 N -2.18 3.11 0.21 0.52 1.01 -0.60 -5.04 120.40 117.43 1dsb s VAL 16 Ca 0.67 -1.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 1dsb s VAL 16 Cb -0.28 -2.71 -0.09 0.00 0.00 0.00 0.00 36.38 33.30 1dsb s VAL 16 CO 0.57 -0.01 1.35 0.00 0.00 0.00 0.00 175.10 177.01 1dsb s ALA 17 N 1.31 3.56 -0.21 5.51 0.00 -1.26 -3.13 121.76 127.54 1dsb s ALA 17 Ca -0.03 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1dsb s ALA 17 Cb -0.19 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1dsb s ALA 17 CO -0.01 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.56 1dsb n GLY 18 N 2.35 0.47 3.78 0.00 0.00 -1.26 -5.00 105.19 105.52 1dsb n GLY 18 Ca 0.06 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1dsb n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dsb s ALA 19 N -1.76 3.02 0.75 4.61 0.00 -1.18 -4.98 121.76 122.22 1dsb s ALA 19 Ca 0.00 0.84 -0.16 0.00 0.00 0.00 0.00 51.96 52.64 1dsb s ALA 19 Cb 0.00 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 1dsb s ALA 19 CO 0.00 -0.48 0.56 -2.30 0.00 0.00 0.00 175.76 173.54 1dsb n PRO 20 N -0.31 0.25 0.28 0.00 -0.02 -1.26 -4.45 135.00 129.49 1dsb n PRO 20 Ca 0.06 0.13 -0.16 0.00 -2.02 0.00 0.00 63.50 61.51 1dsb n PRO 20 Cb 0.49 -1.87 -0.08 0.00 -0.02 0.00 0.00 33.50 32.02 1dsb n PRO 20 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1dsb h GLN 21 N -0.49 -0.71 -4.50 -0.52 4.20 -1.91 -3.34 115.11 107.84 1dsb h GLN 21 Ca -0.45 0.05 -0.61 0.00 0.06 0.00 0.00 58.65 57.69 1dsb h GLN 21 Cb 1.34 0.16 -0.37 0.00 0.30 0.00 0.00 27.48 28.91 1dsb h GLN 21 CO 0.42 -0.47 -0.80 0.08 -0.67 0.00 0.00 178.83 177.38 1dsb s VAL 22 N -6.06 1.60 -0.17 -0.54 1.01 -1.13 0.19 120.40 115.30 1dsb s VAL 22 Ca -0.17 -1.08 0.01 0.00 0.00 0.00 0.00 61.98 60.74 1dsb s VAL 22 Cb 0.05 -1.74 0.01 0.00 0.00 0.00 0.00 36.38 34.70 1dsb s VAL 22 CO 0.63 0.08 -0.19 -0.22 0.00 0.00 0.00 175.10 175.39 1dsb s LEU 23 N 1.39 2.19 -0.04 3.92 0.20 -0.21 -0.77 118.68 125.36 1dsb s LEU 23 Ca -0.03 -0.61 0.03 0.00 0.69 0.00 0.00 54.13 54.21 1dsb s LEU 23 Cb -0.17 -1.49 -0.03 0.00 -0.43 0.00 0.00 46.19 44.07 1dsb s LEU 23 CO -0.07 0.03 -0.12 -0.70 -0.29 0.00 0.00 176.35 175.20 1dsb s GLU 24 N 1.14 2.54 0.01 1.98 2.12 0.66 -0.44 118.70 126.71 1dsb s GLU 24 Ca 0.01 -0.68 0.08 0.00 0.36 0.00 0.00 54.97 54.74 1dsb s GLU 24 Cb -0.14 -2.44 -0.02 0.00 0.26 0.00 0.00 34.13 31.79 1dsb s GLU 24 CO -0.09 0.63 -0.25 -0.06 -0.54 0.00 0.00 175.26 174.95 1dsb s PHE 25 N -0.81 2.23 0.37 5.30 0.08 -0.31 -0.07 117.98 124.77 1dsb s PHE 25 Ca 0.13 -0.42 -0.07 0.00 0.12 0.00 0.00 56.93 56.69 1dsb s PHE 25 Cb -0.11 -1.40 0.03 0.00 -0.57 0.00 0.00 43.02 40.97 1dsb s PHE 25 CO 0.02 0.03 0.61 -0.59 -0.10 0.00 0.00 175.22 175.18 1dsb s PHE 26 N -0.68 0.74 -0.07 0.36 -0.71 -0.42 -2.38 117.98 114.82 1dsb s PHE 26 Ca 0.10 -1.14 -0.10 0.00 -1.04 0.00 0.00 56.93 54.75 1dsb s PHE 26 Cb -0.10 0.27 0.02 0.00 -1.21 0.00 0.00 43.02 42.01 1dsb s PHE 26 CO 0.00 -1.33 0.26 0.45 -1.34 0.00 0.00 175.22 173.26 1dsb s SER 27 N -3.19 -0.23 0.00 1.98 0.15 -1.26 -1.85 113.70 109.30 1dsb s SER 27 Ca 0.25 0.38 0.15 0.00 0.70 0.00 0.00 55.95 57.43 1dsb s SER 27 Cb -0.02 0.47 0.66 0.00 -1.71 0.00 0.00 66.02 65.41 1dsb s SER 27 CO 0.18 -0.18 1.45 0.49 1.20 0.00 0.00 173.24 176.38 1dsb n PHE 28 N 2.52 0.00 0.84 3.44 3.72 -1.26 -1.85 117.46 124.86 1dsb n PHE 28 Ca -0.15 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.36 1dsb n PHE 28 Cb 0.58 -0.44 0.03 0.00 -0.94 0.00 0.00 39.48 38.70 1dsb n PHE 28 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1dsb n PHE 29 N -1.44 0.07 -2.84 1.38 3.72 -1.26 -4.58 117.46 112.52 1dsb n PHE 29 Ca 0.05 0.02 -0.42 0.00 -0.05 0.00 0.00 57.45 57.04 1dsb n PHE 29 Cb 0.15 -0.21 -0.04 0.00 -0.94 0.00 0.00 39.48 38.44 1dsb n PHE 29 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1dsb h PRO 31 N 7.99 0.24 0.00 0.00 0.11 -1.90 -2.31 132.00 136.13 1dsb h PRO 31 Ca -0.23 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 1dsb h PRO 31 Cb 1.08 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1dsb h PRO 31 CO 0.93 0.18 -0.05 0.45 -0.21 0.00 0.00 178.00 179.30 1dsb h HIS 32 N 0.23 0.00 -0.11 0.65 3.86 -1.93 -1.84 115.15 116.01 1dsb h HIS 32 Ca 0.07 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.11 1dsb h HIS 32 Cb -0.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1dsb h HIS 32 CO -0.06 0.05 -0.64 0.00 0.86 0.00 0.00 177.93 178.14 1dsb h TYR 34 N 0.30 0.45 0.43 0.00 5.03 -0.85 -1.68 116.97 120.65 1dsb h TYR 34 Ca -0.01 -0.10 -0.02 0.00 2.58 0.00 0.00 58.73 61.18 1dsb h TYR 34 Cb 1.19 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 39.37 1dsb h TYR 34 CO 0.04 0.66 -0.21 1.96 -1.32 0.00 0.00 178.16 179.29 1dsb h GLN 35 N 0.11 -0.56 -0.96 1.82 1.08 -1.20 0.10 115.11 115.50 1dsb h GLN 35 Ca 0.05 0.04 0.19 0.00 -1.45 0.00 0.00 58.65 57.48 1dsb h GLN 35 Cb 0.52 0.13 -0.11 0.00 -0.05 0.00 0.00 27.48 27.97 1dsb h GLN 35 CO 0.02 -0.38 0.54 0.74 -0.95 0.00 0.00 178.83 178.81 1dsb h PHE 36 N -0.58 0.94 0.00 2.96 -1.00 -0.19 -0.43 116.94 118.64 1dsb h PHE 36 Ca -0.06 0.04 -0.05 0.00 2.81 0.00 0.00 57.97 60.71 1dsb h PHE 36 Cb 0.45 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.73 1dsb h PHE 36 CO -0.05 0.16 -0.43 1.49 -1.61 0.00 0.00 178.31 177.87 1dsb h GLU 37 N 0.66 0.00 0.00 1.51 4.22 -1.05 -0.16 114.58 119.76 1dsb h GLU 37 Ca 0.56 0.00 -0.10 0.00 0.08 0.00 0.00 59.36 59.90 1dsb h GLU 37 Cb 0.92 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 1dsb h GLU 37 CO -0.41 0.34 -0.73 0.93 -2.18 0.00 0.00 179.01 176.96 1dsb h GLU 38 N -1.00 0.00 0.00 1.92 3.07 -0.86 -3.19 114.58 114.52 1dsb h GLU 38 Ca -0.07 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.58 1dsb h GLU 38 Cb 0.59 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.46 1dsb h GLU 38 CO -0.04 0.37 -1.75 0.28 -1.40 0.00 0.00 179.01 176.47 1dsb n VAL 39 N -3.09 0.75 0.04 3.13 0.31 -0.90 -4.74 118.33 113.83 1dsb n VAL 39 Ca -0.01 -0.25 0.01 0.00 -0.01 0.00 0.00 64.34 64.08 1dsb n VAL 39 Cb 0.73 -1.22 -0.07 0.00 -0.91 0.00 0.00 33.84 32.38 1dsb n VAL 39 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1dsb h LEU 40 N -0.18 0.00 -1.48 7.52 4.07 -1.20 -3.49 115.31 120.56 1dsb h LEU 40 Ca -0.31 0.00 -0.48 0.00 0.08 0.00 0.00 57.88 57.16 1dsb h LEU 40 Cb 1.40 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 43.09 1dsb h LEU 40 CO -0.10 0.53 -0.83 1.41 -1.08 0.00 0.00 178.44 178.37 1dsb n HIS 41 N -2.89 -1.91 -0.11 1.13 8.25 -0.23 -4.90 115.22 114.57 1dsb n HIS 41 Ca -0.08 0.82 -0.06 0.00 -0.26 0.00 0.00 57.72 58.14 1dsb n HIS 41 Cb 0.81 -3.81 0.00 0.00 1.12 0.00 0.00 29.99 28.12 1dsb n HIS 41 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1dsb h ILE 42 N -1.85 0.42 -0.38 1.59 1.08 -1.40 -2.03 117.51 114.95 1dsb h ILE 42 Ca -0.61 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 63.91 1dsb h ILE 42 Cb 1.37 0.42 -0.04 0.00 -3.07 0.00 0.00 36.82 35.51 1dsb h ILE 42 CO 0.65 0.00 0.13 0.28 -0.69 0.00 0.00 178.15 178.52 1dsb h SER 43 N -0.14 0.13 -0.61 1.72 0.02 -1.91 0.11 113.55 112.86 1dsb h SER 43 Ca 0.18 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1dsb h SER 43 Cb 0.42 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.97 1dsb h SER 43 CO -0.46 0.11 0.38 0.44 -1.14 0.00 0.00 176.83 176.16 1dsb h ASP 44 N 0.28 0.73 -0.44 3.07 3.32 -1.90 0.11 116.42 121.59 1dsb h ASP 44 Ca 0.17 -0.05 -0.14 0.00 0.02 0.00 0.00 57.03 57.03 1dsb h ASP 44 Cb 0.16 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1dsb h ASP 44 CO -0.18 0.57 -0.28 0.78 -1.72 0.00 0.00 179.24 178.41 1dsb h ASN 45 N 0.83 1.01 -0.58 6.45 2.35 -0.88 -1.24 115.58 123.51 1dsb h ASN 45 Ca 0.22 -0.41 -0.06 0.00 -0.55 0.00 0.00 56.30 55.50 1dsb h ASN 45 Cb -0.03 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.03 1dsb h ASN 45 CO -0.04 1.21 0.13 0.58 -1.65 0.00 0.00 177.43 177.65 1dsb h VAL 46 N 0.82 1.25 -0.75 2.81 2.07 -0.57 -2.63 116.25 119.25 1dsb h VAL 46 Ca 0.09 -0.92 0.01 0.00 0.82 0.00 0.00 66.70 66.71 1dsb h VAL 46 Cb 0.86 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 1dsb h VAL 46 CO 0.08 0.34 0.49 0.50 0.02 0.00 0.00 177.57 179.00 1dsb h LYS 47 N 0.84 0.97 0.00 1.57 3.64 -0.56 -1.84 116.57 121.17 1dsb h LYS 47 Ca 0.18 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1dsb h LYS 47 Cb 0.37 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1dsb h LYS 47 CO 0.00 0.64 0.00 0.87 -2.27 0.00 0.00 179.45 178.69 1dsb h LYS 48 N 0.99 0.00 -0.01 1.90 1.57 -0.85 -2.82 116.57 117.35 1dsb h LYS 48 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1dsb h LYS 48 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1dsb h LYS 48 CO -0.08 0.00 -0.12 1.63 -0.57 0.00 0.00 179.45 180.32 1dsb n LYS 49 N -2.37 1.36 -2.47 3.15 5.02 -0.71 -5.02 118.16 117.11 1dsb n LYS 49 Ca -0.01 -0.88 -0.33 0.00 -2.02 0.00 0.00 58.31 55.07 1dsb n LYS 49 Cb 0.10 -1.16 -0.03 0.00 -0.02 0.00 0.00 35.03 33.92 1dsb n LYS 49 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1dsb s LEU 50 N -1.33 3.74 1.35 -0.35 1.43 -1.07 -4.82 118.68 117.63 1dsb s LEU 50 Ca 0.11 1.74 -0.23 0.00 -1.03 0.00 0.00 54.13 54.73 1dsb s LEU 50 Cb 0.09 -4.54 0.34 0.00 0.03 0.00 0.00 46.19 42.12 1dsb s LEU 50 CO 0.21 -0.69 1.02 -2.84 0.23 0.00 0.00 176.35 174.28 1dsb s PRO 51 N -3.62 -2.40 0.30 1.29 0.02 -1.26 -4.96 135.00 124.36 1dsb s PRO 51 Ca 0.63 -0.10 -0.17 0.00 0.02 0.00 0.00 61.00 61.38 1dsb s PRO 51 Cb -0.13 -1.46 -0.09 0.00 0.02 0.00 0.00 34.50 32.84 1dsb s PRO 51 CO 0.25 -4.48 0.74 -2.00 -0.33 0.00 0.00 177.00 171.18 1dsb s GLU 52 N -5.36 4.09 0.00 5.54 2.56 -1.26 -3.60 118.70 120.67 1dsb s GLU 52 Ca 0.71 0.76 0.00 0.00 0.00 0.00 0.00 54.97 56.43 1dsb s GLU 52 Cb -0.09 -2.56 0.00 0.00 2.00 0.00 0.00 34.13 33.48 1dsb s GLU 52 CO 0.56 0.22 0.00 0.41 -0.56 0.00 0.00 175.26 175.89 1dsb n GLY 53 N -0.04 0.66 3.50 -1.50 0.00 -1.26 -4.98 105.19 101.58 1dsb n GLY 53 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1dsb n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dsb s VAL 54 N -2.74 5.23 0.00 1.61 1.01 -1.24 -5.07 120.40 119.21 1dsb s VAL 54 Ca 0.00 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1dsb s VAL 54 Cb 0.00 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1dsb s VAL 54 CO 0.00 -0.10 0.21 -0.75 0.00 0.00 0.00 175.10 174.45 1dsb s LYS 55 N 1.70 3.47 -0.09 2.72 2.20 -1.26 -4.86 119.74 123.62 1dsb s LYS 55 Ca 0.06 -0.28 -0.00 0.00 -0.36 0.00 0.00 55.97 55.39 1dsb s LYS 55 Cb -0.18 -3.08 -0.03 0.00 -1.51 0.00 0.00 37.83 33.03 1dsb s LYS 55 CO 0.10 0.66 -0.06 -1.64 -0.36 0.00 0.00 175.35 174.05 1dsb s MET 56 N -1.97 2.99 -0.08 4.03 -1.94 -1.26 -2.83 119.30 118.25 1dsb s MET 56 Ca 0.28 -0.53 0.03 0.00 -1.71 0.00 0.00 55.69 53.76 1dsb s MET 56 Cb -0.13 -2.68 0.01 0.00 2.01 0.00 0.00 34.83 34.04 1dsb s MET 56 CO 0.19 0.56 -0.18 0.99 -0.01 0.00 0.00 175.02 176.57 1dsb s THR 57 N -0.52 1.59 -0.15 2.05 2.01 0.05 -5.02 115.64 115.65 1dsb s THR 57 Ca 0.08 -0.75 0.01 0.00 0.31 0.00 0.00 61.69 61.33 1dsb s THR 57 Cb -0.12 -1.40 0.00 0.00 0.01 0.00 0.00 72.50 71.00 1dsb s THR 57 CO 0.02 0.45 -0.16 -0.75 -0.69 0.00 0.00 174.62 173.49 1dsb s LYS 58 N 0.43 3.18 0.08 4.92 2.20 -1.26 -0.24 119.74 129.05 1dsb s LYS 58 Ca -0.15 -0.77 0.09 0.00 -0.36 0.00 0.00 55.97 54.78 1dsb s LYS 58 Cb -0.16 -2.59 -0.03 0.00 -1.51 0.00 0.00 37.83 33.53 1dsb s LYS 58 CO 0.06 0.01 -0.24 0.71 -0.36 0.00 0.00 175.35 175.53 1dsb s TYR 59 N 0.82 2.09 0.32 4.03 2.02 0.90 -4.97 117.35 122.57 1dsb s TYR 59 Ca -0.05 -0.40 -0.08 0.00 -0.37 0.00 0.00 57.07 56.17 1dsb s TYR 59 Cb -0.15 -1.20 -0.06 0.00 -0.40 0.00 0.00 41.96 40.15 1dsb s TYR 59 CO -0.01 0.19 0.64 -1.58 -1.57 0.00 0.00 175.55 173.22 1dsb s HIS 60 N -0.93 3.46 0.26 2.71 2.46 -1.26 -1.30 115.29 120.69 1dsb s HIS 60 Ca 0.10 0.83 0.10 0.00 0.47 0.00 0.00 55.06 56.57 1dsb s HIS 60 Cb -0.10 -2.26 -0.04 0.00 -0.13 0.00 0.00 32.58 30.05 1dsb s HIS 60 CO 0.03 0.08 -0.07 0.14 -2.47 0.00 0.00 174.74 172.45 1dsb s VAL 61 N -2.15 3.14 -0.10 0.89 -7.23 -0.77 -4.83 120.40 109.35 1dsb s VAL 61 Ca 0.47 -2.01 0.15 0.00 -1.81 0.00 0.00 61.98 58.78 1dsb s VAL 61 Cb -0.11 -2.65 -0.20 0.00 0.56 0.00 0.00 36.38 33.99 1dsb s VAL 61 CO 0.29 -0.34 0.65 0.59 -0.31 0.00 0.00 175.10 175.98 1dsb n ASN 62 N -0.67 0.73 -0.13 4.85 3.02 -1.26 -4.57 115.26 117.22 1dsb n ASN 62 Ca -0.07 0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 1dsb n ASN 62 Cb 0.59 0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.98 1dsb n ASN 62 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1dsb n PHE 63 N -2.92 0.00 -3.99 3.10 1.16 -1.26 -4.48 117.46 109.07 1dsb n PHE 63 Ca -0.15 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.30 1dsb n PHE 63 Cb 0.96 -0.01 -0.13 0.00 -1.61 0.00 0.00 39.48 38.69 1dsb n PHE 63 CO 0.00 0.00 0.00 -1.64 -1.87 0.00 0.00 176.76 173.25 1dsb s MET 64 N -1.74 0.23 0.00 3.97 -1.94 -1.26 -4.82 119.30 113.74 1dsb s MET 64 Ca 0.00 -0.25 0.00 0.00 -1.71 0.00 0.00 55.69 53.73 1dsb s MET 64 Cb 0.00 -0.13 0.00 0.00 2.01 0.00 0.00 34.83 36.71 1dsb s MET 64 CO 0.00 0.03 0.00 0.41 -0.01 0.00 0.00 175.02 175.45 1dsb n GLY 65 N 2.60 0.71 7.00 -0.03 0.00 -1.26 -3.98 105.19 110.23 1dsb n GLY 65 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1dsb n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dsb n GLY 66 N -2.55 3.00 0.32 -0.02 0.00 -1.26 -2.24 105.19 102.45 1dsb n GLY 66 Ca 0.00 0.29 -0.17 0.00 0.00 0.00 0.00 46.02 46.14 1dsb n GLY 66 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1dsb h ASP 67 N 0.00 -0.65 -0.91 1.61 3.32 -1.93 -2.68 116.42 115.18 1dsb h ASP 67 Ca 0.00 0.02 0.12 0.00 0.02 0.00 0.00 57.03 57.19 1dsb h ASP 67 Cb 0.00 0.17 -0.07 0.00 0.22 0.00 0.00 39.33 39.65 1dsb h ASP 67 CO 0.00 -0.45 0.58 -0.07 -1.72 0.00 0.00 179.24 177.58 1dsb h LEU 68 N -0.79 0.75 -0.51 1.55 3.38 -1.87 -1.89 115.31 115.94 1dsb h LEU 68 Ca -0.08 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.02 1dsb h LEU 68 Cb 0.60 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 1dsb h LEU 68 CO 0.13 0.41 0.08 1.23 0.09 0.00 0.00 178.44 180.38 1dsb h GLY 69 N 0.81 0.61 1.31 0.83 0.00 -1.13 0.93 103.07 106.43 1dsb h GLY 69 Ca 0.44 -0.01 -0.15 0.00 0.00 0.00 0.00 47.33 47.62 1dsb h GLY 69 CO -0.20 -0.09 -0.39 0.50 0.00 0.00 0.00 176.54 176.35 1dsb h LYS 70 N 0.21 0.76 -0.89 4.80 1.57 -1.09 -2.35 116.57 119.58 1dsb h LYS 70 Ca 0.26 -0.40 0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1dsb h LYS 70 Cb 0.36 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.63 1dsb h LYS 70 CO -0.36 1.02 0.56 -0.44 -0.57 0.00 0.00 179.45 179.66 1dsb h ASP 71 N 0.62 0.90 0.10 0.86 3.32 -0.55 -1.98 116.42 119.69 1dsb h ASP 71 Ca 0.05 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 1dsb h ASP 71 Cb 0.95 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 1dsb h ASP 71 CO 0.09 0.59 -0.34 -0.07 -1.72 0.00 0.00 179.24 177.79 1dsb h LEU 72 N 1.05 0.35 -0.86 1.55 3.38 -0.72 0.56 115.31 120.62 1dsb h LEU 72 Ca 0.37 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 1dsb h LEU 72 Cb 0.11 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1dsb h LEU 72 CO -0.15 0.68 -0.12 0.74 0.09 0.00 0.00 178.44 179.67 1dsb h THR 73 N 0.30 1.25 -0.23 0.22 2.02 -0.98 0.80 112.91 116.29 1dsb h THR 73 Ca 0.04 -1.15 -0.11 0.00 0.77 0.00 0.00 66.41 65.95 1dsb h THR 73 Cb 0.75 1.08 -0.00 0.00 -1.74 0.00 0.00 68.15 68.23 1dsb h THR 73 CO 0.06 0.39 -0.30 -0.61 0.37 0.00 0.00 175.52 175.42 1dsb h GLN 74 N 0.65 0.60 -0.78 6.66 4.15 -0.97 -2.12 115.11 123.30 1dsb h GLN 74 Ca 0.11 -0.35 0.04 0.00 0.77 0.00 0.00 58.65 59.23 1dsb h GLN 74 Cb 0.58 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 28.24 1dsb h GLN 74 CO 0.04 0.95 0.48 0.00 -1.93 0.00 0.00 178.83 178.37 1dsb h ALA 75 N 0.64 1.04 -0.63 3.38 0.00 -0.64 -0.77 119.26 122.28 1dsb h ALA 75 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1dsb h ALA 75 Cb 0.88 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1dsb h ALA 75 CO 0.07 0.25 0.34 2.35 0.00 0.00 0.00 179.25 182.27 1dsb h TRP 76 N 0.92 0.87 -0.85 0.00 2.91 -0.79 0.65 115.95 119.66 1dsb h TRP 76 Ca 0.32 -0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.34 1dsb h TRP 76 Cb 0.08 -0.28 -0.04 0.00 -0.51 0.00 0.00 29.16 28.41 1dsb h TRP 76 CO -0.04 0.63 0.56 0.00 -1.03 0.00 0.00 178.44 178.56 1dsb h ALA 77 N 1.16 1.42 -0.53 2.65 0.00 -0.65 0.15 119.26 123.48 1dsb h ALA 77 Ca 0.22 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1dsb h ALA 77 Cb 0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1dsb h ALA 77 CO -0.04 0.52 0.06 0.28 0.00 0.00 0.00 179.25 180.07 1dsb h VAL 78 N 1.12 1.26 -0.65 0.00 2.07 -0.37 0.03 116.25 119.70 1dsb h VAL 78 Ca 0.32 -0.99 -0.05 0.00 0.82 0.00 0.00 66.70 66.80 1dsb h VAL 78 Cb -0.07 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1dsb h VAL 78 CO -0.08 0.36 0.21 0.00 0.02 0.00 0.00 177.57 178.07 1dsb h ALA 79 N 0.97 0.85 -0.34 1.67 0.00 0.23 -0.72 119.26 121.92 1dsb h ALA 79 Ca 0.16 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1dsb h ALA 79 Cb 0.44 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1dsb h ALA 79 CO 0.02 0.52 0.00 0.52 0.00 0.00 0.00 179.25 180.31 1dsb h MET 80 N 0.94 0.60 -0.40 0.00 2.86 -0.55 0.43 114.93 118.81 1dsb h MET 80 Ca 0.21 -0.19 -0.07 0.00 -2.06 0.00 0.00 59.70 57.59 1dsb h MET 80 Cb 0.29 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1dsb h MET 80 CO -0.01 0.72 -0.03 0.00 1.06 0.00 0.00 176.91 178.65 1dsb h ALA 81 N 0.86 1.20 0.00 6.32 0.00 -0.72 -2.58 119.26 124.34 1dsb h ALA 81 Ca 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1dsb h ALA 81 Cb 0.45 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1dsb h ALA 81 CO 0.02 0.52 -0.48 1.28 0.00 0.00 0.00 179.25 180.59 1dsb n LEU 82 N -4.23 0.72 -1.53 0.00 4.77 -0.30 -4.96 117.00 111.48 1dsb n LEU 82 Ca 0.02 0.30 -0.11 0.00 -0.03 0.00 0.00 56.01 56.20 1dsb n LEU 82 Cb 0.29 -0.21 0.02 0.00 -2.33 0.00 0.00 43.42 41.18 1dsb n LEU 82 CO 0.41 -0.08 -0.01 0.61 -1.33 0.00 0.00 177.39 176.99 1dsb n GLY 83 N 1.33 0.10 1.00 -0.72 0.00 0.14 -4.95 105.19 102.09 1dsb n GLY 83 Ca 0.04 -0.36 0.04 0.00 0.00 0.00 0.00 46.02 45.74 1dsb n GLY 83 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1dsb n VAL 84 N -3.85 2.38 -0.23 1.61 0.24 -0.43 -4.79 118.33 113.26 1dsb n VAL 84 Ca -0.06 -2.10 0.03 0.00 -2.04 0.00 0.00 64.34 60.17 1dsb n VAL 84 Cb 0.56 -0.28 0.13 0.00 -1.47 0.00 0.00 33.84 32.78 1dsb n VAL 84 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1dsb h GLU 85 N 1.56 0.11 0.00 7.34 3.07 -1.93 0.12 114.58 124.85 1dsb h GLU 85 Ca 0.08 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1dsb h GLU 85 Cb 1.54 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.43 1dsb h GLU 85 CO 0.29 0.08 0.00 -0.44 -1.40 0.00 0.00 179.01 177.54 1dsb h ASP 86 N 0.12 0.00 0.64 1.42 3.32 -1.96 -1.87 116.42 118.09 1dsb h ASP 86 Ca 0.37 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.16 1dsb h ASP 86 Cb 0.64 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.16 1dsb h ASP 86 CO -0.60 0.00 -1.43 0.11 -1.72 0.00 0.00 179.24 175.60 1dsb h LYS 87 N 0.00 0.07 0.00 3.56 1.57 -1.14 -3.41 116.57 117.22 1dsb h LYS 87 Ca 0.00 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1dsb h LYS 87 Cb 0.37 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1dsb h LYS 87 CO 0.00 0.85 -0.98 1.33 -0.57 0.00 0.00 179.45 180.08 1dsb n VAL 88 N -3.27 0.00 0.04 0.50 0.24 -1.03 -4.62 118.33 110.19 1dsb n VAL 88 Ca -0.11 -0.24 -0.11 0.00 -2.04 0.00 0.00 64.34 61.85 1dsb n VAL 88 Cb 1.01 0.71 -0.04 0.00 -1.47 0.00 0.00 33.84 34.05 1dsb n VAL 88 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1dsb h THR 89 N 0.00 0.55 0.16 3.34 2.02 -1.58 -0.93 112.91 116.47 1dsb h THR 89 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1dsb h THR 89 Cb 0.42 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 1dsb h THR 89 CO 0.00 0.00 -0.08 0.58 0.37 0.00 0.00 175.52 176.39 1dsb h VAL 90 N -0.28 0.89 0.00 3.16 2.07 -1.86 -1.52 116.25 118.71 1dsb h VAL 90 Ca 0.07 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 1dsb h VAL 90 Cb 0.38 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1dsb h VAL 90 CO -0.20 0.06 -0.12 1.55 0.02 0.00 0.00 177.57 178.87 1dsb h PRO 91 N -0.33 0.00 -0.11 1.57 0.13 -1.79 -0.79 132.00 130.68 1dsb h PRO 91 Ca -0.02 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.03 1dsb h PRO 91 Cb 0.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.39 1dsb h PRO 91 CO 0.04 0.12 -0.22 -0.07 -0.23 0.00 0.00 178.00 177.64 1dsb h LEU 92 N 0.00 0.38 -0.73 1.56 3.38 -0.89 0.31 115.31 119.33 1dsb h LEU 92 Ca -0.00 -0.56 0.02 0.00 0.09 0.00 0.00 57.88 57.43 1dsb h LEU 92 Cb 0.33 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 1dsb h LEU 92 CO 0.02 0.87 0.47 -0.26 0.09 0.00 0.00 178.44 179.63 1dsb h PHE 93 N -0.09 0.89 -0.28 1.13 0.04 -0.98 -0.23 116.94 117.42 1dsb h PHE 93 Ca 0.00 0.02 -0.17 0.00 2.80 0.00 0.00 57.97 60.62 1dsb h PHE 93 Cb 0.80 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.66 1dsb h PHE 93 CO 0.11 0.54 -0.50 0.93 -0.60 0.00 0.00 178.31 178.78 1dsb h GLU 94 N 0.95 0.84 -0.25 1.51 5.08 -1.12 0.22 114.58 121.81 1dsb h GLU 94 Ca 0.28 -0.53 0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1dsb h GLU 94 Cb -0.07 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1dsb h GLU 94 CO -0.08 1.16 0.12 0.78 -1.00 0.00 0.00 179.01 179.99 1dsb h GLY 95 N 0.61 0.33 0.53 -3.84 0.00 -0.02 0.33 103.07 101.01 1dsb h GLY 95 Ca 0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 1dsb h GLY 95 CO 0.11 0.07 -0.14 -2.08 0.00 0.00 0.00 176.54 174.50 1dsb h VAL 96 N 0.26 1.46 0.00 4.60 2.07 -1.04 -0.21 116.25 123.39 1dsb h VAL 96 Ca 0.10 -1.58 -0.37 0.00 0.82 0.00 0.00 66.70 65.68 1dsb h VAL 96 Cb 0.03 2.39 -0.07 0.00 -1.52 0.00 0.00 31.29 32.12 1dsb h VAL 96 CO -0.07 0.43 -2.34 0.00 0.02 0.00 0.00 177.57 175.61 1dsb n GLN 97 N -4.62 0.68 -0.07 1.57 6.02 0.76 -4.07 117.38 117.65 1dsb n GLN 97 Ca -0.08 0.02 -0.05 0.00 -0.01 0.00 0.00 57.00 56.88 1dsb n GLN 97 Cb 0.40 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 30.10 1dsb n GLN 97 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1dsb n LYS 98 N -2.81 0.44 0.04 -1.09 4.81 -0.21 -4.62 118.16 114.73 1dsb n LYS 98 Ca -0.32 0.42 -0.08 0.00 -0.87 0.00 0.00 58.31 57.45 1dsb n LYS 98 Cb 1.14 -1.55 -0.13 0.00 0.02 0.00 0.00 35.03 34.51 1dsb n LYS 98 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1dsb h THR 99 N -0.93 1.44 -5.80 3.15 1.35 -1.20 -3.48 112.91 107.43 1dsb h THR 99 Ca 0.00 -3.19 -0.38 0.00 -0.55 0.00 0.00 66.41 62.30 1dsb h THR 99 Cb 0.61 2.72 0.14 0.00 -1.73 0.00 0.00 68.15 69.89 1dsb h THR 99 CO 0.00 0.82 -0.72 0.00 -0.25 0.00 0.00 175.52 175.37 1dsb n GLN 100 N -3.26 -7.29 0.00 4.72 6.02 -0.19 -4.91 117.38 112.47 1dsb n GLN 100 Ca -0.06 0.82 0.11 0.00 -0.01 0.00 0.00 57.00 57.86 1dsb n GLN 100 Cb 0.98 -5.85 0.07 0.00 1.02 0.00 0.00 30.24 26.46 1dsb n GLN 100 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1dsb n THR 101 N -4.65 0.00 -3.29 5.09 -2.24 -0.61 -4.81 114.28 103.77 1dsb n THR 101 Ca -0.11 -0.44 -0.44 0.00 -2.27 0.00 0.00 64.05 60.79 1dsb n THR 101 Cb 0.60 1.40 -0.07 0.00 -2.10 0.00 0.00 70.33 70.16 1dsb n THR 101 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1dsb s ILE 102 N -1.94 5.08 0.00 2.28 1.01 -1.16 -4.84 121.20 121.64 1dsb s ILE 102 Ca 0.23 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.13 1dsb s ILE 102 Cb 0.18 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.47 1dsb s ILE 102 CO 0.34 -0.64 0.00 0.54 0.00 0.00 0.00 174.94 175.18 1dsb n ARG 103 N 5.62 3.07 -4.08 2.79 1.74 -1.26 -4.81 116.66 119.73 1dsb n ARG 103 Ca -0.10 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.86 1dsb n ARG 103 Cb 0.45 -0.70 -0.05 0.00 -1.02 0.00 0.00 32.46 31.13 1dsb n ARG 103 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1dsb s SER 104 N -1.31 0.48 0.54 0.55 1.04 -1.26 -4.98 113.70 108.77 1dsb s SER 104 Ca 0.00 -1.29 0.27 0.00 0.48 0.00 0.00 55.95 55.41 1dsb s SER 104 Cb 0.00 0.60 1.56 0.00 0.10 0.00 0.00 66.02 68.28 1dsb s SER 104 CO 0.00 -1.18 2.14 0.00 0.98 0.00 0.00 173.24 175.18 1dsb h ALA 105 N 2.23 1.44 -0.01 5.32 0.00 -1.98 -1.30 119.26 124.95 1dsb h ALA 105 Ca -0.29 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 1dsb h ALA 105 Cb 1.24 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1dsb h ALA 105 CO 0.40 0.09 -0.74 0.66 0.00 0.00 0.00 179.25 179.66 1dsb h SER 106 N 0.00 0.11 -0.53 0.00 4.64 -1.99 -1.98 113.55 113.81 1dsb h SER 106 Ca -0.00 -0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.15 1dsb h SER 106 Cb 0.18 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1dsb h SER 106 CO 0.01 0.81 0.01 0.44 -0.87 0.00 0.00 176.83 177.23 1dsb h ASP 107 N 0.06 0.94 -0.49 4.97 3.32 -1.60 -0.43 116.42 123.20 1dsb h ASP 107 Ca -0.02 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 56.72 1dsb h ASP 107 Cb 1.31 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.59 1dsb h ASP 107 CO 0.10 0.99 0.06 0.40 -1.72 0.00 0.00 179.24 179.08 1dsb h ILE 108 N 0.89 1.25 -0.85 0.35 2.04 -1.31 -2.82 117.51 117.07 1dsb h ILE 108 Ca 0.16 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 1dsb h ILE 108 Cb 0.51 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.48 1dsb h ILE 108 CO 0.03 0.34 0.48 -0.09 0.00 0.00 0.00 178.15 178.91 1dsb h ARG 109 N 0.69 1.17 -0.87 2.37 2.43 -1.01 -2.38 114.38 116.78 1dsb h ARG 109 Ca 0.15 -0.12 0.09 0.00 -0.81 0.00 0.00 59.98 59.28 1dsb h ARG 109 Cb 0.42 -0.23 -0.06 0.00 -0.42 0.00 0.00 29.97 29.68 1dsb h ARG 109 CO 0.01 0.84 0.56 -0.44 -1.51 0.00 0.00 179.97 179.44 1dsb h ASP 110 N 1.17 0.77 -0.56 -3.80 3.32 -0.84 -1.87 116.42 114.62 1dsb h ASP 110 Ca 0.30 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.33 1dsb h ASP 110 Cb -0.00 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1dsb h ASP 110 CO -0.05 0.46 0.18 0.58 -1.72 0.00 0.00 179.24 178.69 1dsb h VAL 111 N 0.86 1.24 -0.17 -1.35 2.07 -1.25 -0.50 116.25 117.15 1dsb h VAL 111 Ca 0.40 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 1dsb h VAL 111 Cb 0.40 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1dsb h VAL 111 CO -0.16 0.30 -0.00 -0.26 0.02 0.00 0.00 177.57 177.46 1dsb h PHE 112 N 0.78 0.34 -0.70 1.57 -1.00 -1.25 -0.89 116.94 115.80 1dsb h PHE 112 Ca 0.18 -0.06 -0.03 0.00 2.81 0.00 0.00 57.97 60.87 1dsb h PHE 112 Cb 0.28 -0.09 -0.03 0.00 3.61 0.00 0.00 35.95 39.72 1dsb h PHE 112 CO 0.02 0.53 0.33 0.82 -1.61 0.00 0.00 178.31 178.40 1dsb h ILE 113 N 0.06 1.23 -0.07 -0.55 2.04 -1.31 -0.99 117.51 117.91 1dsb h ILE 113 Ca 0.05 -0.64 -0.09 0.00 1.00 0.00 0.00 64.86 65.18 1dsb h ILE 113 Cb 0.39 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1dsb h ILE 113 CO 0.01 0.27 -0.36 -1.13 0.00 0.00 0.00 178.15 176.94 1dsb h ASN 114 N 1.00 0.14 0.14 1.72 -0.73 -0.94 -2.22 115.58 114.68 1dsb h ASN 114 Ca 0.24 -0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.36 1dsb h ASN 114 Cb 0.11 -0.04 0.00 0.00 0.27 0.00 0.00 38.32 38.66 1dsb h ASN 114 CO -0.03 0.49 0.00 0.00 -0.37 0.00 0.00 177.43 177.52 1dsb n ALA 115 N -2.47 2.56 0.00 1.57 0.00 -0.35 -4.89 120.51 116.93 1dsb n ALA 115 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1dsb n ALA 115 Cb 0.42 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1dsb n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dsb n GLY 116 N 0.93 0.57 3.72 0.00 0.00 -0.83 -5.04 105.19 104.53 1dsb n GLY 116 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1dsb n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dsb s ILE 117 N -2.00 4.75 0.26 -0.61 1.09 -0.65 -4.99 121.20 119.05 1dsb s ILE 117 Ca 0.00 1.95 -0.29 0.00 -1.10 0.00 0.00 60.65 61.21 1dsb s ILE 117 Cb 0.00 -4.27 -0.09 0.00 -1.06 0.00 0.00 42.46 37.04 1dsb s ILE 117 CO 0.00 0.25 1.23 -0.54 -0.10 0.00 0.00 174.94 175.78 1dsb s LYS 118 N 0.52 4.47 0.21 2.79 1.02 -1.26 -3.83 119.74 123.65 1dsb s LYS 118 Ca 0.47 2.00 -0.12 0.00 0.02 0.00 0.00 55.97 58.34 1dsb s LYS 118 Cb -0.21 -3.16 0.25 0.00 -0.52 0.00 0.00 37.83 34.19 1dsb s LYS 118 CO 0.27 -0.07 1.66 0.78 -0.92 0.00 0.00 175.35 177.07 1dsb h GLY 119 N 4.29 0.57 1.23 -3.33 0.00 -1.95 0.96 103.07 104.85 1dsb h GLY 119 Ca -0.47 0.11 0.02 0.00 0.00 0.00 0.00 47.33 46.99 1dsb h GLY 119 CO 0.70 -0.19 0.48 1.05 0.00 0.00 0.00 176.54 178.58 1dsb h GLU 120 N 0.09 0.91 -0.25 4.80 4.11 -1.99 0.10 114.58 122.35 1dsb h GLU 120 Ca 0.30 -0.05 -0.17 0.00 0.07 0.00 0.00 59.36 59.50 1dsb h GLU 120 Cb 0.47 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1dsb h GLU 120 CO -0.52 0.60 -0.54 1.49 0.07 0.00 0.00 179.01 180.11 1dsb h GLU 121 N 0.94 0.73 -0.07 1.06 4.81 -1.30 -2.07 114.58 118.67 1dsb h GLU 121 Ca 0.28 -0.45 -0.04 0.00 -0.13 0.00 0.00 59.36 59.01 1dsb h GLU 121 Cb -0.04 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1dsb h GLU 121 CO -0.07 1.08 -0.13 -0.92 -0.73 0.00 0.00 179.01 178.24 1dsb h TYR 122 N 0.56 0.26 -0.81 0.92 3.20 -0.08 -2.62 116.97 118.40 1dsb h TYR 122 Ca 0.01 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.78 1dsb h TYR 122 Cb 1.12 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 39.30 1dsb h TYR 122 CO 0.06 0.72 0.45 -0.44 -1.64 0.00 0.00 178.16 177.31 1dsb h ASP 123 N -0.27 1.00 -0.20 -2.11 3.32 -0.85 0.19 116.42 117.51 1dsb h ASP 123 Ca 0.00 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1dsb h ASP 123 Cb 0.70 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1dsb h ASP 123 CO 0.03 0.80 0.09 0.00 -1.72 0.00 0.00 179.24 178.44 1dsb h ALA 124 N 1.37 0.26 -0.42 3.45 0.00 -1.39 -2.38 119.26 120.14 1dsb h ALA 124 Ca 0.29 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1dsb h ALA 124 Cb 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1dsb h ALA 124 CO -0.05 -0.16 0.03 0.00 0.00 0.00 0.00 179.25 179.07 1dsb h ALA 125 N 0.95 0.57 -0.91 0.00 0.00 -1.13 -1.98 119.26 116.75 1dsb h ALA 125 Ca 0.07 -0.25 0.14 0.00 0.00 0.00 0.00 54.91 54.88 1dsb h ALA 125 Cb 0.14 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 1dsb h ALA 125 CO -0.01 0.32 0.58 2.35 0.00 0.00 0.00 179.25 182.50 1dsb h TRP 126 N 0.57 0.87 0.00 0.00 2.91 -0.41 -1.73 115.95 118.16 1dsb h TRP 126 Ca 0.12 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.17 1dsb h TRP 126 Cb 0.44 -0.27 0.00 0.00 -0.51 0.00 0.00 29.16 28.81 1dsb h TRP 126 CO 0.03 0.32 -0.76 0.09 -1.03 0.00 0.00 178.44 177.09 1dsb n ASN 127 N -4.57 0.66 -4.71 2.65 3.02 -0.92 -4.91 115.26 106.48 1dsb n ASN 127 Ca 0.18 -0.41 -0.33 0.00 -0.03 0.00 0.00 54.58 53.99 1dsb n ASN 127 Cb 0.46 0.57 0.12 0.00 -0.61 0.00 0.00 39.78 40.32 1dsb n ASN 127 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1dsb s SER 128 N -3.28 3.71 0.28 6.41 1.04 -0.65 -4.93 113.70 116.28 1dsb s SER 128 Ca 0.08 2.28 0.15 0.00 0.48 0.00 0.00 55.95 58.94 1dsb s SER 128 Cb 0.16 -2.58 0.06 0.00 0.10 0.00 0.00 66.02 63.77 1dsb s SER 128 CO 0.77 -2.58 1.43 -0.26 0.98 0.00 0.00 173.24 173.58 1dsb h PHE 129 N -0.94 0.00 -0.28 5.02 0.04 -1.91 -2.45 116.94 116.43 1dsb h PHE 129 Ca -0.46 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.31 1dsb h PHE 129 Cb 1.28 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.42 1dsb h PHE 129 CO 0.49 0.50 0.15 0.28 -0.60 0.00 0.00 178.31 179.12 1dsb h VAL 130 N 0.00 1.13 -0.27 -0.55 2.07 -1.92 0.15 116.25 116.86 1dsb h VAL 130 Ca -0.01 -0.35 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 1dsb h VAL 130 Cb 1.39 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 1dsb h VAL 130 CO 0.06 0.13 -0.12 0.58 0.02 0.00 0.00 177.57 178.24 1dsb h VAL 131 N 0.33 1.22 -0.68 2.57 2.07 -1.77 -1.16 116.25 118.83 1dsb h VAL 131 Ca 0.10 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 1dsb h VAL 131 Cb 0.08 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1dsb h VAL 131 CO -0.01 0.32 0.34 0.11 0.02 0.00 0.00 177.57 178.34 1dsb h LYS 132 N 0.42 0.97 -0.19 1.57 1.57 -0.83 -0.12 116.57 119.96 1dsb h LYS 132 Ca 0.08 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 1dsb h LYS 132 Cb 0.47 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1dsb h LYS 132 CO 0.03 0.76 -0.40 0.66 -0.57 0.00 0.00 179.45 179.93 1dsb h SER 133 N 0.94 0.45 -0.43 0.86 4.64 -0.22 -1.66 113.55 118.13 1dsb h SER 133 Ca 0.23 -0.19 -0.08 0.00 -0.47 0.00 0.00 61.79 61.28 1dsb h SER 133 Cb 0.10 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1dsb h SER 133 CO -0.03 0.80 -0.02 -0.07 -0.87 0.00 0.00 176.83 176.64 1dsb h LEU 134 N 0.36 0.82 -0.33 5.97 4.07 -0.80 -0.79 115.31 124.60 1dsb h LEU 134 Ca 0.03 -0.21 -0.07 0.00 0.08 0.00 0.00 57.88 57.71 1dsb h LEU 134 Cb 0.85 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.37 1dsb h LEU 134 CO 0.07 0.89 -0.08 0.58 -1.08 0.00 0.00 178.44 178.82 1dsb h VAL 135 N 0.78 1.28 -0.76 1.22 2.07 -0.74 -2.43 116.25 117.66 1dsb h VAL 135 Ca 0.15 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 1dsb h VAL 135 Cb 0.49 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 1dsb h VAL 135 CO 0.02 0.37 0.45 0.00 0.02 0.00 0.00 177.57 178.43 1dsb h ALA 136 N 0.81 0.98 -0.52 1.67 0.00 -1.05 -2.06 119.26 119.08 1dsb h ALA 136 Ca 0.08 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1dsb h ALA 136 Cb 0.58 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1dsb h ALA 136 CO 0.03 0.46 0.31 0.37 0.00 0.00 0.00 179.25 180.42 1dsb h GLN 137 N 1.05 0.61 -0.61 0.00 4.15 -1.11 0.15 115.11 119.35 1dsb h GLN 137 Ca 0.27 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.61 1dsb h GLN 137 Cb -0.02 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 1dsb h GLN 137 CO -0.05 0.40 0.18 1.96 -1.93 0.00 0.00 178.83 179.40 1dsb h GLN 138 N 0.62 0.94 -0.49 1.69 4.20 -1.15 -1.80 115.11 119.13 1dsb h GLN 138 Ca 0.21 -0.21 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1dsb h GLN 138 Cb 0.01 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1dsb h GLN 138 CO -0.09 0.84 0.08 0.93 -0.67 0.00 0.00 178.83 179.92 1dsb h GLU 139 N 0.87 0.81 -0.55 1.46 5.08 -1.00 -2.61 114.58 118.64 1dsb h GLU 139 Ca 0.19 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1dsb h GLU 139 Cb 0.30 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1dsb h GLU 139 CO -0.01 0.81 0.28 -0.22 -1.00 0.00 0.00 179.01 178.87 1dsb h LYS 140 N 0.68 0.78 -0.55 2.33 3.64 -0.59 -2.04 116.57 120.81 1dsb h LYS 140 Ca 0.15 -0.10 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1dsb h LYS 140 Cb 0.39 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1dsb h LYS 140 CO 0.01 0.62 0.34 0.00 -2.27 0.00 0.00 179.45 178.15 1dsb h ALA 141 N 1.12 0.71 -0.42 5.00 0.00 -1.29 0.51 119.26 124.88 1dsb h ALA 141 Ca 0.19 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1dsb h ALA 141 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1dsb h ALA 141 CO -0.03 0.07 0.07 0.00 0.00 0.00 0.00 179.25 179.37 1dsb h ALA 142 N 1.23 1.34 -0.24 0.00 0.00 -1.22 -3.02 119.26 117.35 1dsb h ALA 142 Ca 0.22 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1dsb h ALA 142 Cb -0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1dsb h ALA 142 CO -0.08 0.46 -0.37 0.00 0.00 0.00 0.00 179.25 179.26 1dsb h ALA 143 N 1.47 0.37 -0.83 0.00 0.00 -0.64 -1.46 119.26 118.17 1dsb h ALA 143 Ca 0.14 -0.44 0.13 0.00 0.00 0.00 0.00 54.91 54.74 1dsb h ALA 143 Cb 0.28 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 1dsb h ALA 143 CO 0.00 0.45 0.54 -0.44 0.00 0.00 0.00 179.25 179.81 1dsb h ASP 144 N 0.40 0.60 -0.24 0.00 3.32 -0.80 -2.00 116.42 117.69 1dsb h ASP 144 Ca 0.02 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1dsb h ASP 144 Cb 0.97 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1dsb h ASP 144 CO 0.09 0.32 0.00 1.33 -1.72 0.00 0.00 179.24 179.25 1dsb n VAL 145 N -4.53 0.30 -3.76 -1.35 0.24 -1.17 -4.94 118.33 103.12 1dsb n VAL 145 Ca 0.15 -0.61 -0.25 0.00 -2.04 0.00 0.00 64.34 61.60 1dsb n VAL 145 Cb 0.44 1.03 0.04 0.00 -1.47 0.00 0.00 33.84 33.88 1dsb n VAL 145 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1dsb n GLN 146 N 1.25 -5.74 -1.85 7.34 6.02 -0.75 -4.87 117.38 118.77 1dsb n GLN 146 Ca 0.18 0.66 -0.42 0.00 -0.01 0.00 0.00 57.00 57.40 1dsb n GLN 146 Cb 0.56 -5.46 -0.03 0.00 1.02 0.00 0.00 30.24 26.33 1dsb n GLN 146 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1dsb s LEU 147 N -7.00 4.38 0.00 1.08 2.96 -0.60 -4.88 118.68 114.62 1dsb s LEU 147 Ca 0.36 2.55 0.01 0.00 -0.22 0.00 0.00 54.13 56.82 1dsb s LEU 147 Cb -0.18 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 42.95 1dsb s LEU 147 CO 0.80 -0.94 0.10 0.54 -1.32 0.00 0.00 176.35 175.53 1dsb n ARG 148 N 6.07 5.66 -3.50 1.98 5.12 -1.26 -4.97 116.66 125.76 1dsb n ARG 148 Ca 0.17 -0.08 -0.12 0.00 -1.93 0.00 0.00 57.85 55.89 1dsb n ARG 148 Cb 0.40 -0.60 -0.03 0.00 -1.16 0.00 0.00 32.46 31.07 1dsb n ARG 148 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1dsb s GLY 149 N -0.91 -0.50 0.10 -0.13 0.00 -1.26 -5.14 107.32 99.49 1dsb s GLY 149 Ca 0.00 0.41 0.03 0.00 0.00 0.00 0.00 44.72 45.16 1dsb s GLY 149 CO 0.02 0.10 -0.08 -1.34 0.00 0.00 0.00 173.10 171.80 1dsb s VAL 150 N -3.45 0.84 0.59 1.40 -7.23 -1.26 -4.43 120.40 106.86 1dsb s VAL 150 Ca -0.00 -1.81 -0.16 0.00 -1.81 0.00 0.00 61.98 58.20 1dsb s VAL 150 Cb -0.00 -1.54 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 1dsb s VAL 150 CO -0.10 -0.72 1.06 -2.16 -0.31 0.00 0.00 175.10 172.87 1dsb s PRO 151 N -3.35 3.32 -0.02 4.82 0.04 -1.26 -4.90 135.00 133.64 1dsb s PRO 151 Ca 0.09 1.22 -0.10 0.00 0.04 0.00 0.00 61.00 62.26 1dsb s PRO 151 Cb 0.01 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.53 1dsb s PRO 151 CO -0.02 -0.81 0.22 0.00 0.04 0.00 0.00 177.00 176.43 1dsb s ALA 152 N -2.42 -0.54 -0.02 8.56 0.00 -1.00 -5.01 121.76 121.33 1dsb s ALA 152 Ca 0.64 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.80 1dsb s ALA 152 Cb -0.16 -0.01 0.02 0.00 0.00 0.00 0.00 23.12 22.97 1dsb s ALA 152 CO 0.36 -0.21 -0.00 1.41 0.00 0.00 0.00 175.76 177.32 1dsb s MET 153 N -1.05 0.22 0.02 0.00 1.75 -1.26 -1.17 119.30 117.81 1dsb s MET 153 Ca -0.11 0.04 0.08 0.00 -1.25 0.00 0.00 55.69 54.45 1dsb s MET 153 Cb -0.06 -0.35 -0.02 0.00 2.84 0.00 0.00 34.83 37.24 1dsb s MET 153 CO 0.02 -0.08 -0.23 -0.06 -0.65 0.00 0.00 175.02 174.02 1dsb s PHE 154 N 0.69 2.05 -0.11 4.11 0.40 0.42 -1.70 117.98 123.83 1dsb s PHE 154 Ca -0.07 -0.39 0.03 0.00 -0.60 0.00 0.00 56.93 55.91 1dsb s PHE 154 Cb -0.10 -1.26 0.00 0.00 0.51 0.00 0.00 43.02 42.17 1dsb s PHE 154 CO -0.01 0.06 -0.22 0.08 0.70 0.00 0.00 175.22 175.82 1dsb s VAL 155 N -0.70 2.17 -1.32 -0.44 1.01 0.11 -1.04 120.40 120.18 1dsb s VAL 155 Ca 0.09 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.04 1dsb s VAL 155 Cb -0.09 -1.85 0.04 0.00 0.00 0.00 0.00 36.38 34.48 1dsb s VAL 155 CO 0.01 0.55 0.41 0.59 0.00 0.00 0.00 175.10 176.66 1dsb n ASN 156 N 3.65 -4.44 -0.19 3.32 3.02 0.13 -0.66 115.26 120.09 1dsb n ASN 156 Ca -0.19 -0.24 -0.02 0.00 -0.03 0.00 0.00 54.58 54.11 1dsb n ASN 156 Cb 0.53 -3.67 -0.01 0.00 -0.61 0.00 0.00 39.78 36.02 1dsb n ASN 156 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dsb n GLY 157 N -1.19 0.17 0.02 7.41 0.00 -1.25 -4.69 105.19 105.66 1dsb n GLY 157 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 1dsb n GLY 157 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dsb n LYS 158 N 0.31 2.96 -4.29 1.61 5.02 0.17 -1.55 118.16 122.39 1dsb n LYS 158 Ca -0.02 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.04 1dsb n LYS 158 Cb 0.34 -1.09 -0.12 0.00 -0.02 0.00 0.00 35.03 34.14 1dsb n LYS 158 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1dsb s TYR 159 N -2.08 1.77 -0.12 2.13 2.02 -0.84 -0.28 117.35 119.95 1dsb s TYR 159 Ca -0.02 -0.43 0.03 0.00 -0.37 0.00 0.00 57.07 56.27 1dsb s TYR 159 Cb 0.01 -0.95 0.01 0.00 -0.40 0.00 0.00 41.96 40.63 1dsb s TYR 159 CO 0.14 0.22 -0.20 -1.14 -1.57 0.00 0.00 175.55 173.00 1dsb s GLN 160 N -2.10 2.78 0.54 -0.62 0.74 0.13 0.05 119.66 121.18 1dsb s GLN 160 Ca 0.08 -0.77 -0.22 0.00 0.05 0.00 0.00 55.36 54.50 1dsb s GLN 160 Cb -0.09 -2.23 -0.05 0.00 1.10 0.00 0.00 33.01 31.74 1dsb s GLN 160 CO 0.05 0.02 1.35 -0.51 -0.55 0.00 0.00 175.29 175.64 1dsb s LEU 161 N 0.75 3.85 -0.48 3.68 2.01 -0.69 -0.65 118.68 127.16 1dsb s LEU 161 Ca -0.10 2.74 0.03 0.00 0.01 0.00 0.00 54.13 56.81 1dsb s LEU 161 Cb -0.16 -4.28 0.15 0.00 0.01 0.00 0.00 46.19 41.91 1dsb s LEU 161 CO 0.01 -1.55 0.30 0.21 1.01 0.00 0.00 176.35 176.33 1dsb s ASN 162 N -0.98 3.44 0.00 2.29 2.47 -0.03 -4.77 114.94 117.36 1dsb s ASN 162 Ca 0.71 -2.92 0.09 0.00 0.42 0.00 0.00 52.86 51.16 1dsb s ASN 162 Cb -0.40 -1.02 0.48 0.00 -1.45 0.00 0.00 41.25 38.86 1dsb s ASN 162 CO 0.47 -0.22 1.04 -0.81 -3.72 0.00 0.00 177.10 173.86 1dsb n PRO 163 N 3.14 0.21 0.19 0.43 -0.04 -1.26 -2.56 135.00 135.11 1dsb n PRO 163 Ca 0.15 0.08 0.04 0.00 -0.04 0.00 0.00 63.50 63.73 1dsb n PRO 163 Cb 0.37 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.68 1dsb n PRO 163 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1dsb h GLN 164 N 0.00 0.00 -2.32 0.54 4.20 -1.93 -3.26 115.11 112.34 1dsb h GLN 164 Ca 0.00 0.00 -0.69 0.00 0.06 0.00 0.00 58.65 58.02 1dsb h GLN 164 Cb 0.03 0.00 -0.18 0.00 0.30 0.00 0.00 27.48 27.63 1dsb h GLN 164 CO 0.00 0.39 1.49 0.41 -0.67 0.00 0.00 178.83 180.45 1dsb n GLY 165 N -0.09 5.19 3.60 3.46 0.00 -1.06 -4.88 105.19 111.41 1dsb n GLY 165 Ca -0.01 -2.15 -0.14 0.00 0.00 0.00 0.00 46.02 43.72 1dsb n GLY 165 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dsb s MET 166 N -2.18 0.82 0.26 1.61 -1.94 -1.23 -4.72 119.30 111.91 1dsb s MET 166 Ca 0.52 0.94 -0.30 0.00 -1.71 0.00 0.00 55.69 55.15 1dsb s MET 166 Cb 0.26 0.40 -0.09 0.00 2.01 0.00 0.00 34.83 37.41 1dsb s MET 166 CO -0.17 -0.10 1.21 0.34 -0.01 0.00 0.00 175.02 176.29 1dsb s ASP 167 N 0.32 7.03 -0.17 3.03 2.15 -1.26 -4.97 116.67 122.80 1dsb s ASP 167 Ca -0.00 2.39 0.16 0.00 0.43 0.00 0.00 52.55 55.53 1dsb s ASP 167 Cb -0.05 -2.62 0.43 0.00 -0.30 0.00 0.00 42.92 40.37 1dsb s ASP 167 CO 0.01 -0.36 1.31 0.35 -0.17 0.00 0.00 175.17 176.31 1dsb n THR 168 N 1.65 2.16 0.11 1.71 -2.24 -1.26 -4.28 114.28 112.13 1dsb n THR 168 Ca 0.02 -2.23 -0.04 0.00 -2.27 0.00 0.00 64.05 59.53 1dsb n THR 168 Cb 0.44 -0.26 0.07 0.00 -2.10 0.00 0.00 70.33 68.48 1dsb n THR 168 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1dsb h SER 169 N 0.94 0.07 -3.24 3.42 4.64 -2.03 -3.41 113.55 113.94 1dsb h SER 169 Ca 0.03 -0.05 -0.56 0.00 -0.47 0.00 0.00 61.79 60.73 1dsb h SER 169 Cb 1.27 -0.02 -0.35 0.00 -0.31 0.00 0.00 62.40 62.98 1dsb h SER 169 CO 0.14 0.79 -0.82 0.21 -0.87 0.00 0.00 176.83 176.27 1dsb s ASN 170 N -6.84 2.29 0.13 4.97 3.84 -1.26 -5.03 114.94 113.04 1dsb s ASN 170 Ca -0.01 -0.38 -0.13 0.00 0.21 0.00 0.00 52.86 52.55 1dsb s ASN 170 Cb 0.12 -0.99 -0.04 0.00 -0.55 0.00 0.00 41.25 39.79 1dsb s ASN 170 CO 0.79 -0.03 1.49 0.24 -2.79 0.00 0.00 177.10 176.80 1dsb h MET 171 N 7.67 0.82 -0.56 0.43 2.86 -1.91 -2.37 114.93 121.86 1dsb h MET 171 Ca -0.32 -0.38 -0.01 0.00 -2.06 0.00 0.00 59.70 56.93 1dsb h MET 171 Cb 1.16 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.78 1dsb h MET 171 CO 0.47 1.01 0.31 -0.44 1.06 0.00 0.00 176.91 179.32 1dsb h ASP 172 N 0.62 0.70 -0.50 1.22 3.32 -1.97 -0.22 116.42 119.59 1dsb h ASP 172 Ca 0.08 -0.09 -0.10 0.00 0.02 0.00 0.00 57.03 56.94 1dsb h ASP 172 Cb 0.78 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1dsb h ASP 172 CO 0.06 0.59 -0.08 0.58 -1.72 0.00 0.00 179.24 178.67 1dsb h VAL 173 N 0.75 1.26 -0.06 -1.35 2.07 -1.93 -2.11 116.25 114.88 1dsb h VAL 173 Ca 0.20 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.51 1dsb h VAL 173 Cb 0.04 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1dsb h VAL 173 CO -0.03 0.43 0.02 0.15 0.02 0.00 0.00 177.57 178.16 1dsb h PHE 174 N 0.87 0.04 -0.84 1.57 3.57 -1.03 -0.07 116.94 121.05 1dsb h PHE 174 Ca 0.14 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.70 1dsb h PHE 174 Cb 0.62 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.29 1dsb h PHE 174 CO 0.04 0.02 0.52 0.28 -2.23 0.00 0.00 178.31 176.95 1dsb h VAL 175 N 0.05 1.06 -0.03 1.41 2.07 -0.96 -0.27 116.25 119.59 1dsb h VAL 175 Ca 0.02 -0.33 -0.16 0.00 0.82 0.00 0.00 66.70 67.05 1dsb h VAL 175 Cb 0.01 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.77 1dsb h VAL 175 CO -0.02 0.18 -0.70 1.56 0.02 0.00 0.00 177.57 178.61 1dsb h GLN 176 N 0.97 0.18 -0.39 1.57 1.08 -1.13 -0.90 115.11 116.49 1dsb h GLN 176 Ca 0.36 -0.14 -0.06 0.00 -1.45 0.00 0.00 58.65 57.35 1dsb h GLN 176 Cb 0.13 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 1dsb h GLN 176 CO -0.16 0.80 0.01 0.37 -0.95 0.00 0.00 178.83 178.91 1dsb h GLN 177 N 0.12 0.69 0.10 1.46 4.15 -0.38 0.47 115.11 121.72 1dsb h GLN 177 Ca -0.02 -0.21 -0.01 0.00 0.77 0.00 0.00 58.65 59.18 1dsb h GLN 177 Cb 1.24 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.87 1dsb h GLN 177 CO 0.10 0.77 -0.05 -0.92 -1.93 0.00 0.00 178.83 176.81 1dsb h TYR 178 N 0.52 -0.13 -0.93 3.99 5.03 -0.93 -1.82 116.97 122.71 1dsb h TYR 178 Ca 0.11 -0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.43 1dsb h TYR 178 Cb 0.46 0.04 -0.05 0.00 1.55 0.00 0.00 36.73 38.73 1dsb h TYR 178 CO 0.04 -0.04 0.61 0.00 -1.32 0.00 0.00 178.16 177.45 1dsb h ALA 179 N 0.71 1.34 -0.39 1.82 0.00 -1.03 -2.33 119.26 119.37 1dsb h ALA 179 Ca -0.01 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1dsb h ALA 179 Cb 0.15 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1dsb h ALA 179 CO 0.02 0.62 -0.21 -0.44 0.00 0.00 0.00 179.25 179.24 1dsb h ASP 180 N 1.26 0.78 -0.51 0.00 3.32 -0.66 -2.29 116.42 118.31 1dsb h ASP 180 Ca 0.34 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 1dsb h ASP 180 Cb -0.14 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.17 1dsb h ASP 180 CO -0.07 0.97 0.13 0.74 -1.72 0.00 0.00 179.24 179.29 1dsb h THR 181 N 0.67 1.24 -0.19 0.35 2.02 -1.01 -0.81 112.91 115.19 1dsb h THR 181 Ca 0.10 -0.84 0.01 0.00 0.77 0.00 0.00 66.41 66.45 1dsb h THR 181 Cb 0.71 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 1dsb h THR 181 CO 0.05 0.30 0.08 0.58 0.37 0.00 0.00 175.52 176.91 1dsb h VAL 182 N 0.71 0.98 -0.16 3.16 2.07 -1.29 0.90 116.25 122.60 1dsb h VAL 182 Ca 0.16 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.65 1dsb h VAL 182 Cb 0.32 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 1dsb h VAL 182 CO 0.00 0.03 -0.04 0.50 0.02 0.00 0.00 177.57 178.08 1dsb h LYS 183 N 0.17 -0.01 -0.21 1.57 3.64 -1.22 0.50 116.57 121.01 1dsb h LYS 183 Ca 0.08 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1dsb h LYS 183 Cb 0.03 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.80 1dsb h LYS 183 CO -0.07 -0.00 -0.17 -0.92 -2.27 0.00 0.00 179.45 176.02 1dsb h TYR 184 N -0.01 -0.44 -0.39 1.91 3.20 -0.73 -2.36 116.97 118.15 1dsb h TYR 184 Ca 0.08 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 1dsb h TYR 184 Cb 0.12 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.60 1dsb h TYR 184 CO -0.19 -0.25 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.01 1dsb h LEU 185 N -0.18 0.59 -1.39 2.82 3.38 -0.42 -0.64 115.31 119.48 1dsb h LEU 185 Ca 0.12 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1dsb h LEU 185 Cb 0.37 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1dsb h LEU 185 CO -0.32 0.66 -0.31 0.77 0.09 0.00 0.00 178.44 179.34 1dsb h SER 186 N 0.59 0.00 -0.02 -0.43 4.64 -0.42 -2.42 113.55 115.49 1dsb h SER 186 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1dsb h SER 186 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1dsb h SER 186 CO 0.01 0.31 -0.29 -1.84 -0.87 0.00 0.00 176.83 174.15 1dsb n GLU 187 N -4.03 1.59 0.00 4.77 0.28 -0.93 -5.02 120.64 117.30 1dsb n GLU 187 Ca -0.02 -1.26 0.08 0.00 -0.16 0.00 0.00 57.16 55.80 1dsb n GLU 187 Cb 0.36 -1.43 0.48 0.00 1.43 0.00 0.00 31.44 32.28 1dsb n GLU 187 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14