#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dcb n GLY 6 N 0.00 2.93 0.14 -1.67 0.00 -0.23 -5.03 105.19 101.33 1dcb n GLY 6 Ca 0.00 -0.31 0.02 0.00 0.00 0.00 0.00 46.02 45.73 1dcb n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dcb n TYR 7 N 0.00 0.00 -2.07 1.61 4.01 -1.26 -4.04 117.16 115.41 1dcb n TYR 7 Ca 0.00 -0.36 -0.19 0.00 -0.16 0.00 0.00 57.90 57.19 1dcb n TYR 7 Cb 0.00 -0.06 0.12 0.00 -0.31 0.00 0.00 39.34 39.08 1dcb n TYR 7 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dcb n GLY 8 N -0.47 -0.38 0.21 2.72 0.00 -1.26 -4.68 105.19 101.33 1dcb n GLY 8 Ca 0.04 -1.85 0.06 0.00 0.00 0.00 0.00 46.02 44.26 1dcb n GLY 8 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1dcb h LYS 9 N 0.00 0.00 0.00 1.61 1.63 -1.98 0.16 116.57 117.99 1dcb h LYS 9 Ca -0.27 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1dcb h LYS 9 Cb 0.85 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.48 1dcb h LYS 9 CO 0.23 0.30 -1.53 0.72 -3.45 0.00 0.00 179.45 175.72 1dcb n HIS 10 N -3.91 0.02 -0.58 1.91 8.25 -1.26 -4.51 115.22 115.15 1dcb n HIS 10 Ca -0.02 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1dcb n HIS 10 Cb 0.37 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 31.19 1dcb n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1dcb n ASN 11 N -1.94 0.84 -3.61 0.41 6.94 -1.21 -4.98 115.26 111.72 1dcb n ASN 11 Ca -0.00 -1.41 -0.30 0.00 -0.02 0.00 0.00 54.58 52.84 1dcb n ASN 11 Cb 0.46 0.00 0.29 0.00 -2.36 0.00 0.00 39.78 38.17 1dcb n ASN 11 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1dcb s GLY 12 N -0.41 1.43 0.55 4.83 0.00 0.55 -1.07 107.32 113.19 1dcb s GLY 12 Ca 0.00 -0.69 0.24 0.00 0.00 0.00 0.00 44.72 44.27 1dcb s GLY 12 CO 0.00 0.28 2.08 -2.55 0.00 0.00 0.00 173.10 172.91 1dcb h PRO 13 N -3.34 0.00 0.00 2.90 0.11 -1.84 -0.83 132.00 129.00 1dcb h PRO 13 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1dcb h PRO 13 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1dcb h PRO 13 CO 0.32 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.26 1dcb n GLU 14 N -4.25 0.41 -0.00 1.05 0.00 -1.26 -2.64 120.64 113.95 1dcb n GLU 14 Ca 0.03 0.06 0.03 0.00 0.00 0.00 0.00 57.16 57.29 1dcb n GLU 14 Cb 0.35 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 30.25 1dcb n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1dcb n HIS 15 N -1.15 0.00 -0.07 -1.84 8.25 -0.32 -4.75 115.22 115.34 1dcb n HIS 15 Ca 0.11 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.71 1dcb n HIS 15 Cb 0.11 -0.06 0.53 0.00 1.12 0.00 0.00 29.99 31.68 1dcb n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1dcb h TRP 16 N 0.00 0.37 -0.04 4.41 6.55 -1.48 -2.20 115.95 123.56 1dcb h TRP 16 Ca 0.00 0.01 0.01 0.00 0.95 0.00 0.00 58.89 59.86 1dcb h TRP 16 Cb 0.23 -0.12 -0.00 0.00 -0.86 0.00 0.00 29.16 28.41 1dcb h TRP 16 CO 0.00 0.17 0.07 1.12 -1.05 0.00 0.00 178.44 178.74 1dcb h HIS 17 N 0.34 0.00 -0.14 0.49 2.07 -1.80 0.29 115.15 116.39 1dcb h HIS 17 Ca 0.28 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.69 1dcb h HIS 17 Cb 0.64 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.61 1dcb h HIS 17 CO -0.00 0.00 -0.38 0.87 -3.07 0.00 0.00 177.93 175.35 1dcb h LYS 18 N 0.00 0.31 0.00 5.12 1.57 -1.76 -2.96 116.57 118.85 1dcb h LYS 18 Ca 0.02 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 1dcb h LYS 18 Cb 0.15 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1dcb h LYS 18 CO -0.00 0.65 -1.84 -0.25 -0.57 0.00 0.00 179.45 177.44 1dcb n ASP 19 N -4.05 1.03 -3.59 0.86 8.00 -0.87 -4.76 116.55 113.18 1dcb n ASP 19 Ca -0.01 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.21 1dcb n ASP 19 Cb 0.47 1.67 -0.11 0.00 -0.02 0.00 0.00 41.12 43.12 1dcb n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1dcb s PHE 20 N -3.09 1.78 0.55 1.24 0.08 0.04 -4.97 117.98 113.59 1dcb s PHE 20 Ca -0.07 -2.46 0.26 0.00 0.12 0.00 0.00 56.93 54.78 1dcb s PHE 20 Cb 0.10 -1.53 1.45 0.00 -0.57 0.00 0.00 43.02 42.47 1dcb s PHE 20 CO 0.71 -0.76 1.99 -1.35 -0.10 0.00 0.00 175.22 175.72 1dcb h PRO 21 N 6.06 0.00 0.00 0.24 0.11 -1.77 -0.34 132.00 136.30 1dcb h PRO 21 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1dcb h PRO 21 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1dcb h PRO 21 CO 0.46 0.00 0.05 0.97 -0.21 0.00 0.00 178.00 179.26 1dcb h ILE 22 N 0.00 0.00 -0.30 4.15 2.10 -1.92 -2.17 117.51 119.37 1dcb h ILE 22 Ca 0.23 0.00 0.09 0.00 1.08 0.00 0.00 64.86 66.26 1dcb h ILE 22 Cb 0.98 0.57 -0.01 0.00 -1.09 0.00 0.00 36.82 37.26 1dcb h ILE 22 CO -0.00 0.00 0.34 0.00 -1.08 0.00 0.00 178.15 177.41 1dcb h ALA 23 N 1.89 1.96 -0.34 0.18 0.00 -1.37 0.14 119.26 121.73 1dcb h ALA 23 Ca 0.00 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1dcb h ALA 23 Cb 0.09 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.80 1dcb h ALA 23 CO 0.00 -0.50 -0.09 0.36 0.00 0.00 0.00 179.25 179.02 1dcb n LYS 24 N -3.72 1.88 -1.23 0.00 2.85 -0.81 -4.96 118.16 112.16 1dcb n LYS 24 Ca 0.05 -3.17 -0.21 0.00 -1.05 0.00 0.00 58.31 53.93 1dcb n LYS 24 Cb 0.49 -1.81 0.15 0.00 -0.65 0.00 0.00 35.03 33.21 1dcb n LYS 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1dcb n GLY 25 N -1.10 -1.61 0.15 2.58 0.00 0.50 -5.02 105.19 100.69 1dcb n GLY 25 Ca 0.32 -1.66 0.01 0.00 0.00 0.00 0.00 46.02 44.69 1dcb n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1dcb h GLU 26 N 0.00 0.00 -2.10 1.61 4.39 -1.96 -3.37 114.58 113.16 1dcb h GLU 26 Ca -0.30 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 58.86 1dcb h GLU 26 Cb 0.84 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 29.08 1dcb h GLU 26 CO 0.21 0.57 -0.88 2.89 -1.16 0.00 0.00 179.01 180.64 1dcb n ARG 27 N -3.66 2.29 -2.75 2.33 1.85 -1.26 -4.80 116.66 110.66 1dcb n ARG 27 Ca -0.01 -4.21 -0.29 0.00 -1.00 0.00 0.00 57.85 52.34 1dcb n ARG 27 Cb 0.61 -2.00 -0.02 0.00 -1.05 0.00 0.00 32.46 30.00 1dcb n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1dcb s GLN 28 N -3.06 3.69 0.06 2.89 -1.52 -1.26 -2.27 119.66 118.19 1dcb s GLN 28 Ca 0.45 0.39 0.04 0.00 -1.95 0.00 0.00 55.36 54.28 1dcb s GLN 28 Cb 0.32 -2.38 -0.03 0.00 -0.22 0.00 0.00 33.01 30.70 1dcb s GLN 28 CO -0.11 -0.11 -0.12 -1.12 -0.25 0.00 0.00 175.29 173.58 1dcb s SER 29 N -3.51 1.36 0.72 5.90 0.01 -1.26 -4.66 113.70 112.26 1dcb s SER 29 Ca 0.50 -0.59 -0.03 0.00 1.31 0.00 0.00 55.95 57.13 1dcb s SER 29 Cb -0.10 -0.02 0.10 0.00 0.21 0.00 0.00 66.02 66.22 1dcb s SER 29 CO 0.37 -0.13 0.68 -0.81 0.41 0.00 0.00 173.24 173.76 1dcb n PRO 30 N 1.34 -0.13 -3.84 12.44 -0.04 -1.26 -4.77 135.00 138.74 1dcb n PRO 30 Ca -0.22 -1.56 -0.09 0.00 -0.04 0.00 0.00 63.50 61.59 1dcb n PRO 30 Cb 0.54 -0.54 -0.06 0.00 -0.04 0.00 0.00 33.50 33.40 1dcb n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1dcb s VAL 31 N -2.11 0.09 0.05 0.52 -7.23 -1.26 -0.48 120.40 109.97 1dcb s VAL 31 Ca 0.43 -1.10 -0.26 0.00 -1.81 0.00 0.00 61.98 59.24 1dcb s VAL 31 Cb -0.02 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.35 1dcb s VAL 31 CO 0.29 -0.41 0.79 -0.62 -0.31 0.00 0.00 175.10 174.84 1dcb s ASP 32 N -2.89 7.24 -0.35 4.85 2.15 -1.26 -3.04 116.67 123.36 1dcb s ASP 32 Ca 0.09 1.48 -0.12 0.00 0.43 0.00 0.00 52.55 54.43 1dcb s ASP 32 Cb 0.03 -2.48 -0.00 0.00 -0.30 0.00 0.00 42.92 40.17 1dcb s ASP 32 CO -0.06 -0.01 0.23 -0.63 -0.17 0.00 0.00 175.17 174.53 1dcb s ILE 33 N 0.02 5.08 -0.57 4.11 1.01 0.73 -4.96 121.20 126.62 1dcb s ILE 33 Ca 0.40 -0.40 -0.20 0.00 0.00 0.00 0.00 60.65 60.44 1dcb s ILE 33 Cb -0.21 -3.67 0.07 0.00 0.01 0.00 0.00 42.46 38.67 1dcb s ILE 33 CO 0.24 -0.07 0.76 -0.62 0.00 0.00 0.00 174.94 175.24 1dcb s ASP 34 N 1.68 6.21 0.64 3.58 -1.08 -1.26 -0.69 116.67 125.75 1dcb s ASP 34 Ca 0.05 -1.04 0.42 0.00 -0.52 0.00 0.00 52.55 51.46 1dcb s ASP 34 Cb -0.18 -2.34 2.17 0.00 -1.46 0.00 0.00 42.92 41.11 1dcb s ASP 34 CO 0.09 -1.12 2.28 0.71 0.52 0.00 0.00 175.17 177.65 1dcb h THR 35 N 5.93 0.00 0.00 1.71 1.35 -1.95 -0.44 112.91 119.50 1dcb h THR 35 Ca -0.28 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 1dcb h THR 35 Cb 1.08 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 1dcb h THR 35 CO 1.07 0.00 -0.64 0.45 -0.25 0.00 0.00 175.52 176.15 1dcb h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.03 -3.34 115.15 118.37 1dcb h HIS 36 Ca -0.00 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.04 1dcb h HIS 36 Cb 0.13 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 1dcb h HIS 36 CO 0.00 0.00 -2.05 2.41 0.86 0.00 0.00 177.93 179.15 1dcb n THR 37 N -2.77 0.74 -1.98 2.45 -1.04 -0.77 -4.95 114.28 105.97 1dcb n THR 37 Ca 0.02 -0.67 -0.41 0.00 -2.04 0.00 0.00 64.05 60.95 1dcb n THR 37 Cb 0.53 -0.30 -0.01 0.00 -1.82 0.00 0.00 70.33 68.73 1dcb n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dcb s ALA 38 N -3.02 3.52 -0.25 2.41 0.00 -0.25 -4.83 121.76 119.34 1dcb s ALA 38 Ca -0.08 1.39 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 1dcb s ALA 38 Cb 0.10 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 1dcb s ALA 38 CO 0.86 -0.83 0.25 0.21 0.00 0.00 0.00 175.76 176.25 1dcb s LYS 39 N -1.95 4.03 -0.06 0.00 2.36 -0.18 -4.83 119.74 119.11 1dcb s LYS 39 Ca 0.51 -0.16 -0.30 0.00 -2.55 0.00 0.00 55.97 53.47 1dcb s LYS 39 Cb -0.43 -3.60 -0.04 0.00 -1.05 0.00 0.00 37.83 32.71 1dcb s LYS 39 CO 0.57 -0.11 1.43 -0.47 1.55 0.00 0.00 175.35 178.33 1dcb s TYR 40 N 1.55 2.60 -0.35 4.03 5.04 -1.26 -0.21 117.35 128.74 1dcb s TYR 40 Ca 0.10 0.69 -0.02 0.00 -2.44 0.00 0.00 57.07 55.41 1dcb s TYR 40 Cb -0.15 -3.69 0.08 0.00 0.35 0.00 0.00 41.96 38.55 1dcb s TYR 40 CO 0.08 -2.64 0.10 0.34 -1.34 0.00 0.00 175.55 172.09 1dcb s ASP 41 N 2.33 5.06 0.33 4.32 2.15 0.07 -4.87 116.67 126.07 1dcb s ASP 41 Ca 0.64 -1.65 0.26 0.00 0.43 0.00 0.00 52.55 52.23 1dcb s ASP 41 Cb -0.29 -1.76 1.15 0.00 -0.30 0.00 0.00 42.92 41.71 1dcb s ASP 41 CO 0.24 -0.39 1.78 1.55 -0.17 0.00 0.00 175.17 178.17 1dcb h PRO 42 N 8.00 0.00 -0.10 4.34 0.13 -1.93 -2.02 132.00 140.43 1dcb h PRO 42 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1dcb h PRO 42 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1dcb h PRO 42 CO 0.61 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.25 1dcb n SER 43 N -2.41 1.17 -4.64 1.44 3.41 -1.26 -4.82 113.62 106.52 1dcb n SER 43 Ca 0.01 -1.58 -0.41 0.00 -0.26 0.00 0.00 58.87 56.63 1dcb n SER 43 Cb 0.20 -0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.03 1dcb n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1dcb s LEU 44 N -1.65 4.08 0.52 1.04 1.02 -0.76 -5.02 118.68 117.91 1dcb s LEU 44 Ca 0.33 0.85 -0.14 0.00 0.02 0.00 0.00 54.13 55.19 1dcb s LEU 44 Cb 0.17 -2.99 -0.07 0.00 0.02 0.00 0.00 46.19 43.33 1dcb s LEU 44 CO 0.27 -0.42 0.95 -0.54 0.02 0.00 0.00 176.35 176.63 1dcb s LYS 45 N 2.57 3.83 0.51 1.70 1.02 -1.25 -5.00 119.74 123.11 1dcb s LYS 45 Ca 0.30 0.80 -0.22 0.00 0.02 0.00 0.00 55.97 56.87 1dcb s LYS 45 Cb -0.15 -2.18 -0.06 0.00 -0.52 0.00 0.00 37.83 34.92 1dcb s LYS 45 CO 0.08 -0.29 1.23 -1.25 -0.92 0.00 0.00 175.35 174.20 1dcb s PRO 46 N -4.30 3.41 0.56 -1.68 0.04 -1.26 -2.98 135.00 128.80 1dcb s PRO 46 Ca 0.56 1.91 -0.19 0.00 0.04 0.00 0.00 61.00 63.32 1dcb s PRO 46 Cb -0.10 -2.25 -0.05 0.00 0.04 0.00 0.00 34.50 32.14 1dcb s PRO 46 CO 0.37 -0.88 1.14 -0.51 0.04 0.00 0.00 177.00 177.16 1dcb s LEU 47 N -3.41 3.69 -0.34 -3.56 1.43 -1.26 -2.20 118.68 113.03 1dcb s LEU 47 Ca 0.69 2.19 0.01 0.00 -1.03 0.00 0.00 54.13 55.99 1dcb s LEU 47 Cb -0.32 -4.58 0.11 0.00 0.03 0.00 0.00 46.19 41.42 1dcb s LEU 47 CO 0.38 -1.33 0.11 -0.55 0.23 0.00 0.00 176.35 175.18 1dcb s SER 48 N -1.83 4.15 -0.45 2.29 0.15 0.28 -4.88 113.70 113.42 1dcb s SER 48 Ca 0.73 -1.91 -0.14 0.00 0.70 0.00 0.00 55.95 55.33 1dcb s SER 48 Cb -0.25 -1.07 0.07 0.00 -1.71 0.00 0.00 66.02 63.06 1dcb s SER 48 CO 0.30 -0.38 0.35 -0.69 1.20 0.00 0.00 173.24 174.01 1dcb s VAL 49 N 1.26 4.97 -0.58 4.45 1.01 -1.26 -1.13 120.40 129.11 1dcb s VAL 49 Ca 0.11 -1.10 -0.03 0.00 0.00 0.00 0.00 61.98 60.96 1dcb s VAL 49 Cb -0.19 -3.96 0.15 0.00 0.00 0.00 0.00 36.38 32.39 1dcb s VAL 49 CO -0.17 -0.52 0.40 -0.44 0.00 0.00 0.00 175.10 174.36 1dcb s SER 50 N 2.37 5.31 -0.05 3.32 0.01 -0.35 -4.88 113.70 119.43 1dcb s SER 50 Ca 0.04 -2.65 0.08 0.00 1.31 0.00 0.00 55.95 54.72 1dcb s SER 50 Cb -0.23 -1.87 0.15 0.00 0.21 0.00 0.00 66.02 64.28 1dcb s SER 50 CO 0.06 -0.42 1.10 -1.22 0.41 0.00 0.00 173.24 173.16 1dcb n TYR 51 N 3.77 0.10 0.26 2.43 4.01 -1.26 -0.56 117.16 125.91 1dcb n TYR 51 Ca 0.05 -0.68 0.11 0.00 -0.16 0.00 0.00 57.90 57.23 1dcb n TYR 51 Cb 0.39 -0.10 0.72 0.00 -0.31 0.00 0.00 39.34 40.04 1dcb n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1dcb h ASP 52 N 0.30 0.00 -0.70 7.72 2.03 -1.90 -2.59 116.42 121.29 1dcb h ASP 52 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1dcb h ASP 52 Cb 0.74 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.24 1dcb h ASP 52 CO 0.01 0.10 0.00 1.67 -1.03 0.00 0.00 179.24 179.99 1dcb n GLN 53 N -3.88 3.36 -1.68 4.15 -0.06 -1.25 -5.02 117.38 113.00 1dcb n GLN 53 Ca -0.02 -2.81 -0.42 0.00 -2.00 0.00 0.00 57.00 51.75 1dcb n GLN 53 Cb 0.19 -1.78 0.00 0.00 -4.06 0.00 0.00 30.24 24.60 1dcb n GLN 53 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1dcb n ALA 54 N 1.37 0.99 -3.83 1.69 0.00 -0.98 -4.62 120.51 115.14 1dcb n ALA 54 Ca 0.26 0.32 -0.30 0.00 0.00 0.00 0.00 53.44 53.71 1dcb n ALA 54 Cb 0.79 -2.21 -0.15 0.00 0.00 0.00 0.00 19.45 17.88 1dcb n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1dcb s THR 55 N -1.15 1.19 0.19 0.00 2.01 -1.26 -4.93 115.64 111.69 1dcb s THR 55 Ca 0.58 -1.39 -0.16 0.00 0.31 0.00 0.00 61.69 61.04 1dcb s THR 55 Cb -0.56 -1.77 -0.07 0.00 0.01 0.00 0.00 72.50 70.11 1dcb s THR 55 CO 0.60 -0.47 0.62 -0.94 -0.69 0.00 0.00 174.62 173.74 1dcb s SER 56 N 1.49 6.88 -0.03 3.53 1.04 -1.26 -1.28 113.70 124.07 1dcb s SER 56 Ca 0.05 1.19 0.00 0.00 0.48 0.00 0.00 55.95 57.67 1dcb s SER 56 Cb -0.18 -2.33 -0.02 0.00 0.10 0.00 0.00 66.02 63.59 1dcb s SER 56 CO -0.16 0.05 -0.03 0.18 0.98 0.00 0.00 173.24 174.26 1dcb n LEU 57 N 0.65 2.99 -3.76 2.42 4.77 -1.06 -3.97 117.00 119.04 1dcb n LEU 57 Ca -0.03 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1dcb n LEU 57 Cb 0.52 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1dcb n LEU 57 CO 0.43 0.56 0.97 0.00 -1.33 0.00 0.00 177.39 178.01 1dcb s ARG 58 N -2.07 0.69 -0.00 3.23 1.04 -1.23 -1.49 118.95 119.12 1dcb s ARG 58 Ca -0.04 -0.41 0.04 0.00 -1.04 0.00 0.00 55.73 54.27 1dcb s ARG 58 Cb 0.01 0.22 -0.01 0.00 -2.04 0.00 0.00 34.95 33.13 1dcb s ARG 58 CO 0.08 -0.32 -0.12 -1.50 -0.04 0.00 0.00 175.30 173.40 1dcb s ILE 59 N -2.46 0.95 -0.02 4.99 2.07 -0.02 -0.89 121.20 125.82 1dcb s ILE 59 Ca 0.18 -0.57 -0.09 0.00 -1.41 0.00 0.00 60.65 58.76 1dcb s ILE 59 Cb 0.01 -0.80 0.01 0.00 0.13 0.00 0.00 42.46 41.81 1dcb s ILE 59 CO -0.01 0.23 0.19 -1.48 -1.91 0.00 0.00 174.94 171.96 1dcb s LEU 60 N -0.39 1.32 -0.40 8.50 2.34 -0.18 -0.52 118.68 129.36 1dcb s LEU 60 Ca 0.04 -0.00 -0.16 0.00 0.06 0.00 0.00 54.13 54.07 1dcb s LEU 60 Cb -0.05 0.82 0.01 0.00 -0.56 0.00 0.00 46.19 46.41 1dcb s LEU 60 CO -0.00 -0.32 0.35 0.21 -1.06 0.00 0.00 176.35 175.53 1dcb s ASN 61 N -1.04 6.14 -0.01 1.48 3.84 -0.33 -0.71 114.94 124.30 1dcb s ASN 61 Ca -0.11 -0.68 0.21 0.00 0.21 0.00 0.00 52.86 52.49 1dcb s ASN 61 Cb -0.06 -2.18 0.61 0.00 -0.55 0.00 0.00 41.25 39.07 1dcb s ASN 61 CO 0.02 -0.46 1.51 -0.46 -2.79 0.00 0.00 177.10 174.93 1dcb n ASN 62 N 5.34 3.91 0.00 -4.21 0.23 -0.87 -0.27 115.26 119.39 1dcb n ASN 62 Ca -0.10 -2.04 0.00 0.00 -0.53 0.00 0.00 54.58 51.91 1dcb n ASN 62 Cb 0.48 -0.47 0.00 0.00 -2.08 0.00 0.00 39.78 37.71 1dcb n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1dcb n GLY 63 N 1.47 1.39 0.00 4.83 0.00 -1.26 -4.80 105.19 106.81 1dcb n GLY 63 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1dcb n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1dcb n HIS 64 N -2.00 0.00 -3.55 1.61 1.44 -1.26 -4.69 115.22 106.77 1dcb n HIS 64 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 1dcb n HIS 64 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 1dcb n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1dcb n ALA 65 N -0.59 -0.77 -2.92 1.59 0.00 -1.26 -4.87 120.51 111.68 1dcb n ALA 65 Ca 0.00 -0.30 -0.28 0.00 0.00 0.00 0.00 53.44 52.86 1dcb n ALA 65 Cb 0.00 0.17 -0.16 0.00 0.00 0.00 0.00 19.45 19.46 1dcb n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1dcb s PHE 66 N -4.95 1.93 -0.07 0.00 -0.12 -1.26 -2.05 117.98 111.46 1dcb s PHE 66 Ca 0.07 -0.59 0.04 0.00 -0.05 0.00 0.00 56.93 56.40 1dcb s PHE 66 Cb -0.01 -1.29 -0.02 0.00 -0.63 0.00 0.00 43.02 41.07 1dcb s PHE 66 CO 0.02 -0.20 -0.19 -0.80 -0.05 0.00 0.00 175.22 174.00 1dcb s ASN 67 N 0.05 3.60 -0.40 1.98 0.02 0.11 -4.25 114.94 116.04 1dcb s ASN 67 Ca -0.05 -0.37 -0.12 0.00 -1.02 0.00 0.00 52.86 51.30 1dcb s ASN 67 Cb -0.13 -1.04 0.04 0.00 0.02 0.00 0.00 41.25 40.14 1dcb s ASN 67 CO 0.03 0.25 0.26 -0.69 0.02 0.00 0.00 177.10 176.97 1dcb s VAL 68 N -0.20 4.72 0.29 1.60 1.01 -0.38 -1.01 120.40 126.43 1dcb s VAL 68 Ca -0.01 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 1dcb s VAL 68 Cb -0.13 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 1dcb s VAL 68 CO 0.03 -0.35 0.56 -1.61 0.00 0.00 0.00 175.10 173.73 1dcb s GLU 69 N 1.56 3.65 0.06 2.72 2.02 -0.07 -1.31 118.70 127.33 1dcb s GLU 69 Ca 0.03 0.03 0.02 0.00 0.02 0.00 0.00 54.97 55.07 1dcb s GLU 69 Cb -0.21 -2.64 -0.03 0.00 0.10 0.00 0.00 34.13 31.35 1dcb s GLU 69 CO 0.06 0.22 -0.06 -0.06 0.02 0.00 0.00 175.26 175.44 1dcb s PHE 70 N -2.07 0.68 -0.52 1.61 0.40 0.01 -2.57 117.98 115.52 1dcb s PHE 70 Ca 0.44 -0.68 -0.29 0.00 -0.60 0.00 0.00 56.93 55.81 1dcb s PHE 70 Cb -0.11 -0.41 0.03 0.00 0.51 0.00 0.00 43.02 43.04 1dcb s PHE 70 CO 0.29 -0.14 1.21 0.34 0.70 0.00 0.00 175.22 177.62 1dcb s ASP 71 N -2.13 6.49 -0.40 1.36 2.15 -0.40 -4.77 116.67 118.97 1dcb s ASP 71 Ca -0.03 0.33 0.05 0.00 0.43 0.00 0.00 52.55 53.34 1dcb s ASP 71 Cb -0.04 -2.55 0.58 0.00 -0.30 0.00 0.00 42.92 40.61 1dcb s ASP 71 CO -0.02 -1.40 1.73 -0.90 -0.17 0.00 0.00 175.17 174.41 1dcb n ASP 72 N 8.31 3.63 -0.04 -0.34 5.75 -1.26 -4.58 116.55 128.02 1dcb n ASP 72 Ca 0.11 -3.71 0.12 0.00 -0.01 0.00 0.00 54.79 51.31 1dcb n ASP 72 Cb 0.49 -0.76 0.33 0.00 -1.03 0.00 0.00 41.12 40.15 1dcb n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1dcb n SER 73 N -1.11 0.52 -3.85 -1.12 3.41 -1.26 -4.85 113.62 105.36 1dcb n SER 73 Ca 0.50 -0.28 -0.10 0.00 -0.26 0.00 0.00 58.87 58.72 1dcb n SER 73 Cb 1.32 0.13 -0.08 0.00 -0.26 0.00 0.00 64.21 65.32 1dcb n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1dcb s GLN 74 N -2.89 0.73 -0.26 4.33 -0.21 -1.26 -5.04 119.66 115.05 1dcb s GLN 74 Ca 0.14 -0.71 -0.27 0.00 0.02 0.00 0.00 55.36 54.54 1dcb s GLN 74 Cb 0.18 0.30 -0.30 0.00 1.00 0.00 0.00 33.01 34.19 1dcb s GLN 74 CO 0.64 -0.22 1.70 -0.25 -2.12 0.00 0.00 175.29 175.04 1dcb n ASP 75 N 0.49 1.51 -0.11 5.90 9.92 -1.26 -4.54 116.55 128.46 1dcb n ASP 75 Ca -0.18 -2.55 -0.23 0.00 -0.53 0.00 0.00 54.79 51.30 1dcb n ASP 75 Cb 0.60 -0.71 -0.10 0.00 -0.64 0.00 0.00 41.12 40.27 1dcb n ASP 75 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1dcb n LYS 76 N 7.60 0.56 -3.87 -1.24 5.02 -1.26 -4.79 118.16 120.19 1dcb n LYS 76 Ca 0.47 0.48 -0.36 0.00 -2.02 0.00 0.00 58.31 56.88 1dcb n LYS 76 Cb 0.41 -1.66 -0.13 0.00 -0.02 0.00 0.00 35.03 33.62 1dcb n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dcb s ALA 77 N -2.44 2.87 0.10 7.82 0.00 -1.26 -3.90 121.76 124.94 1dcb s ALA 77 Ca -0.31 -1.69 0.05 0.00 0.00 0.00 0.00 51.96 50.00 1dcb s ALA 77 Cb 0.08 -2.00 -0.03 0.00 0.00 0.00 0.00 23.12 21.17 1dcb s ALA 77 CO 0.53 -1.20 -0.12 0.14 0.00 0.00 0.00 175.76 175.11 1dcb s VAL 78 N 1.32 1.10 -0.04 0.00 -7.23 0.27 -0.97 120.40 114.85 1dcb s VAL 78 Ca -0.03 -1.59 0.06 0.00 -1.81 0.00 0.00 61.98 58.62 1dcb s VAL 78 Cb -0.19 -1.34 -0.01 0.00 0.56 0.00 0.00 36.38 35.39 1dcb s VAL 78 CO -0.00 -0.44 -0.23 -0.22 -0.31 0.00 0.00 175.10 173.89 1dcb s LEU 79 N -2.29 2.04 0.36 1.32 0.20 -0.16 -1.21 118.68 118.94 1dcb s LEU 79 Ca 0.05 -0.45 -0.11 0.00 0.69 0.00 0.00 54.13 54.30 1dcb s LEU 79 Cb -0.05 -1.25 0.03 0.00 -0.43 0.00 0.00 46.19 44.49 1dcb s LEU 79 CO 0.02 0.26 0.66 -1.59 -0.29 0.00 0.00 176.35 175.40 1dcb s LYS 80 N -0.32 2.07 2.07 1.98 -2.85 -0.28 -1.93 119.74 120.48 1dcb s LYS 80 Ca 0.02 -1.53 0.00 0.00 -1.00 0.00 0.00 55.97 53.47 1dcb s LYS 80 Cb -0.11 0.55 0.00 0.00 -2.06 0.00 0.00 37.83 36.21 1dcb s LYS 80 CO 0.01 -0.93 0.00 0.41 0.10 0.00 0.00 175.35 174.94 1dcb n GLY 81 N -0.54 -1.21 7.00 0.59 0.00 -1.26 -0.55 105.19 109.22 1dcb n GLY 81 Ca -0.05 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1dcb n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dcb n GLY 82 N 0.00 2.26 0.05 -0.02 0.00 -0.94 -1.79 105.19 104.75 1dcb n GLY 82 Ca 0.00 -0.49 0.15 0.00 0.00 0.00 0.00 46.02 45.68 1dcb n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dcb n PRO 83 N 13.38 0.93 -2.94 1.61 -0.04 -1.26 -3.89 135.00 142.78 1dcb n PRO 83 Ca 0.00 -0.10 -0.30 0.00 -0.04 0.00 0.00 63.50 63.06 1dcb n PRO 83 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.93 1dcb n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1dcb s LEU 84 N -2.14 3.88 -0.15 1.53 1.43 -0.74 -5.09 118.68 117.41 1dcb s LEU 84 Ca 0.42 1.11 0.00 0.00 -1.03 0.00 0.00 54.13 54.63 1dcb s LEU 84 Cb 0.21 -3.97 0.03 0.00 0.03 0.00 0.00 46.19 42.49 1dcb s LEU 84 CO 0.39 -0.35 -0.11 -1.81 0.23 0.00 0.00 176.35 174.70 1dcb s ASP 85 N -3.04 2.69 0.00 2.29 1.01 -1.26 -4.31 116.67 114.05 1dcb s ASP 85 Ca 0.51 -0.52 0.00 0.00 0.71 0.00 0.00 52.55 53.24 1dcb s ASP 85 Cb -0.10 -1.07 0.00 0.00 1.01 0.00 0.00 42.92 42.75 1dcb s ASP 85 CO 0.29 -0.10 0.00 0.61 0.21 0.00 0.00 175.17 176.18 1dcb n GLY 86 N 4.81 -2.49 3.60 0.21 0.00 -1.26 -4.97 105.19 105.09 1dcb n GLY 86 Ca -0.15 -2.00 -0.34 0.00 0.00 0.00 0.00 46.02 43.53 1dcb n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dcb s THR 87 N -0.32 4.45 -0.14 2.61 2.01 -1.26 -4.53 115.64 118.46 1dcb s THR 87 Ca 0.00 -0.16 0.02 0.00 0.31 0.00 0.00 61.69 61.86 1dcb s THR 87 Cb 0.00 -2.97 0.00 0.00 0.01 0.00 0.00 72.50 69.54 1dcb s THR 87 CO 0.00 0.49 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.92 1dcb s TYR 88 N 0.22 2.70 -0.07 4.92 1.51 -0.81 -1.04 117.35 124.77 1dcb s TYR 88 Ca 0.02 -1.10 -0.13 0.00 -1.01 0.00 0.00 57.07 54.84 1dcb s TYR 88 Cb -0.13 -1.82 -0.05 0.00 -0.11 0.00 0.00 41.96 39.85 1dcb s TYR 88 CO 0.01 -0.48 0.33 1.03 -1.11 0.00 0.00 175.55 175.33 1dcb s ARG 89 N 0.66 3.93 0.10 -0.62 0.52 -0.23 -0.99 118.95 122.33 1dcb s ARG 89 Ca -0.09 0.22 -0.31 0.00 -0.52 0.00 0.00 55.73 55.02 1dcb s ARG 89 Cb -0.16 -3.28 -0.08 0.00 0.52 0.00 0.00 34.95 31.95 1dcb s ARG 89 CO 0.02 0.56 1.49 -1.17 0.02 0.00 0.00 175.30 176.22 1dcb s LEU 90 N -0.56 4.36 -0.08 2.53 2.96 -0.14 -1.62 118.68 126.12 1dcb s LEU 90 Ca 0.20 2.41 0.02 0.00 -0.22 0.00 0.00 54.13 56.54 1dcb s LEU 90 Cb -0.15 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 42.90 1dcb s LEU 90 CO 0.09 -0.75 -0.05 0.00 -1.32 0.00 0.00 176.35 174.31 1dcb n ILE 91 N 4.20 0.50 -3.77 6.68 3.06 -0.69 -4.50 119.36 124.84 1dcb n ILE 91 Ca 0.13 -0.22 -0.04 0.00 -2.50 0.00 0.00 62.75 60.13 1dcb n ILE 91 Cb 0.41 -0.81 -0.01 0.00 0.54 0.00 0.00 39.64 39.77 1dcb n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1dcb s GLN 92 N -2.17 1.24 0.02 9.51 1.03 -1.23 -0.81 119.66 127.25 1dcb s GLN 92 Ca -0.10 -0.70 -0.01 0.00 0.04 0.00 0.00 55.36 54.60 1dcb s GLN 92 Cb 0.03 0.42 -0.02 0.00 0.03 0.00 0.00 33.01 33.47 1dcb s GLN 92 CO 0.22 -0.57 -0.01 -0.59 -2.54 0.00 0.00 175.29 171.80 1dcb s PHE 93 N -3.25 0.25 0.26 9.60 -0.12 -0.43 -0.28 117.98 124.02 1dcb s PHE 93 Ca 0.13 -0.52 -0.19 0.00 -0.05 0.00 0.00 56.93 56.30 1dcb s PHE 93 Cb -0.02 -0.19 0.01 0.00 -0.63 0.00 0.00 43.02 42.20 1dcb s PHE 93 CO 0.03 -0.21 0.64 -3.38 -0.05 0.00 0.00 175.22 172.24 1dcb s HIS 94 N -1.62 -0.03 0.22 3.49 -3.43 -0.76 -1.25 115.29 111.90 1dcb s HIS 94 Ca -0.14 -0.39 0.09 0.00 -0.80 0.00 0.00 55.06 53.82 1dcb s HIS 94 Cb -0.09 0.54 -0.05 0.00 -1.43 0.00 0.00 32.58 31.56 1dcb s HIS 94 CO -0.01 -1.15 -0.16 -0.06 -2.00 0.00 0.00 174.74 171.36 1dcb s PHE 95 N -3.94 1.87 -0.02 0.38 0.40 -1.26 -0.97 117.98 114.43 1dcb s PHE 95 Ca 0.14 -0.50 0.06 0.00 -0.60 0.00 0.00 56.93 56.02 1dcb s PHE 95 Cb -0.04 -0.85 -0.01 0.00 0.51 0.00 0.00 43.02 42.62 1dcb s PHE 95 CO 0.07 0.45 -0.19 -1.01 0.70 0.00 0.00 175.22 175.24 1dcb s HIS 96 N -2.78 1.76 0.22 0.36 3.76 -0.45 -4.73 115.29 113.44 1dcb s HIS 96 Ca 0.24 -0.39 -0.14 0.00 -0.15 0.00 0.00 55.06 54.62 1dcb s HIS 96 Cb -0.02 -1.15 0.00 0.00 1.11 0.00 0.00 32.58 32.53 1dcb s HIS 96 CO 0.09 -0.07 0.48 1.67 -0.85 0.00 0.00 174.74 176.05 1dcb s TRP 97 N -0.32 0.21 0.39 1.40 -2.14 -1.19 -1.52 118.94 115.78 1dcb s TRP 97 Ca 0.04 -0.58 0.03 0.00 2.66 0.00 0.00 56.10 58.25 1dcb s TRP 97 Cb -0.09 0.24 0.03 0.00 -3.10 0.00 0.00 33.47 30.55 1dcb s TRP 97 CO 0.00 -0.95 0.22 0.41 -2.66 0.00 0.00 176.95 173.97 1dcb n GLY 98 N -0.35 3.07 0.12 3.67 0.00 -1.18 -1.20 105.19 109.32 1dcb n GLY 98 Ca -0.05 -2.28 0.06 0.00 0.00 0.00 0.00 46.02 43.75 1dcb n GLY 98 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1dcb h SER 99 N 0.59 0.00 -4.08 1.61 4.64 -1.90 -3.39 113.55 111.01 1dcb h SER 99 Ca -0.27 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.70 1dcb h SER 99 Cb 0.93 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.88 1dcb h SER 99 CO 0.43 0.29 -0.66 -0.76 -0.87 0.00 0.00 176.83 175.26 1dcb s LEU 100 N -5.77 2.16 0.55 5.97 2.01 -1.26 -5.06 118.68 117.29 1dcb s LEU 100 Ca 0.00 -1.20 0.33 0.00 0.01 0.00 0.00 54.13 53.26 1dcb s LEU 100 Cb 0.08 -0.20 1.58 0.00 0.01 0.00 0.00 46.19 47.67 1dcb s LEU 100 CO 0.78 -0.53 2.09 0.44 1.01 0.00 0.00 176.35 180.14 1dcb h ASP 101 N 2.55 0.00 0.62 2.29 3.32 -1.92 -2.93 116.42 120.34 1dcb h ASP 101 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1dcb h ASP 101 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1dcb h ASP 101 CO 0.64 0.07 0.00 0.61 -1.72 0.00 0.00 179.24 178.84 1dcb n GLY 102 N -0.47 -1.15 3.36 2.75 0.00 -1.26 -3.50 105.19 104.92 1dcb n GLY 102 Ca -0.01 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 1dcb n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1dcb s GLN 103 N -2.85 1.16 0.00 1.61 -2.07 -1.11 -4.67 119.66 111.73 1dcb s GLN 103 Ca 0.14 -1.03 0.00 0.00 -1.82 0.00 0.00 55.36 52.65 1dcb s GLN 103 Cb 0.14 0.41 0.00 0.00 -1.09 0.00 0.00 33.01 32.48 1dcb s GLN 103 CO 0.37 -0.44 0.00 0.41 -1.32 0.00 0.00 175.29 174.31 1dcb n GLY 104 N -0.22 2.11 3.84 2.60 0.00 -1.14 -3.12 105.19 109.25 1dcb n GLY 104 Ca -0.10 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1dcb n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dcb s SER 105 N 0.00 5.72 -0.14 1.61 1.04 -0.72 -3.16 113.70 118.05 1dcb s SER 105 Ca 0.00 1.56 -0.10 0.00 0.48 0.00 0.00 55.95 57.90 1dcb s SER 105 Cb 0.00 -2.49 -0.03 0.00 0.10 0.00 0.00 66.02 63.60 1dcb s SER 105 CO 0.00 -1.21 -0.19 -0.62 0.98 0.00 0.00 173.24 172.20 1dcb n GLU 106 N -2.89 0.45 -1.78 4.02 1.02 -1.26 -4.82 120.64 115.38 1dcb n GLU 106 Ca 0.07 0.51 -0.32 0.00 -0.02 0.00 0.00 57.16 57.40 1dcb n GLU 106 Cb 0.54 -1.67 0.03 0.00 -0.02 0.00 0.00 31.44 30.32 1dcb n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1dcb s HIS 107 N -2.28 3.05 0.07 -0.32 3.76 -1.26 -4.53 115.29 113.78 1dcb s HIS 107 Ca -0.16 1.46 0.03 0.00 -0.15 0.00 0.00 55.06 56.25 1dcb s HIS 107 Cb 0.02 -2.94 -0.03 0.00 1.11 0.00 0.00 32.58 30.74 1dcb s HIS 107 CO 0.23 -1.18 -0.10 0.95 -0.85 0.00 0.00 174.74 173.79 1dcb s THR 108 N -2.78 0.82 -0.24 1.30 -4.23 -1.17 -4.73 115.64 104.62 1dcb s THR 108 Ca 0.60 -1.32 0.02 0.00 -1.18 0.00 0.00 61.69 59.82 1dcb s THR 108 Cb -0.15 -0.98 0.05 0.00 1.34 0.00 0.00 72.50 72.76 1dcb s THR 108 CO 0.47 -0.40 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.33 1dcb s VAL 109 N -1.70 2.16 -1.48 2.29 1.01 -0.93 -0.19 120.40 121.56 1dcb s VAL 109 Ca -0.03 -1.47 -0.08 0.00 0.00 0.00 0.00 61.98 60.40 1dcb s VAL 109 Cb -0.08 -2.19 0.06 0.00 0.00 0.00 0.00 36.38 34.17 1dcb s VAL 109 CO 0.01 0.10 0.78 0.47 0.00 0.00 0.00 175.10 176.46 1dcb n ASP 110 N 4.48 -2.81 0.00 3.32 8.00 0.13 -0.55 116.55 129.13 1dcb n ASP 110 Ca -0.16 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1dcb n ASP 110 Cb 0.44 -3.60 0.00 0.00 -0.02 0.00 0.00 41.12 37.94 1dcb n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1dcb n LYS 111 N -4.48 -0.22 -2.78 -1.24 4.76 -1.26 -4.98 118.16 107.96 1dcb n LYS 111 Ca -0.11 0.05 -0.41 0.00 -2.87 0.00 0.00 58.31 54.98 1dcb n LYS 111 Cb 0.59 -3.73 -0.05 0.00 -1.84 0.00 0.00 35.03 30.00 1dcb n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1dcb s LYS 112 N -0.67 4.70 -0.13 1.97 2.20 0.29 -5.05 119.74 123.05 1dcb s LYS 112 Ca 0.00 1.40 -0.05 0.00 -0.36 0.00 0.00 55.97 56.96 1dcb s LYS 112 Cb 0.00 -3.35 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 1dcb s LYS 112 CO 0.00 0.30 0.06 0.15 -0.36 0.00 0.00 175.35 175.50 1dcb s LYS 113 N -0.28 3.46 0.46 4.03 1.02 -1.26 -2.19 119.74 124.99 1dcb s LYS 113 Ca 0.44 -0.31 0.03 0.00 0.02 0.00 0.00 55.97 56.15 1dcb s LYS 113 Cb -0.23 -3.05 0.01 0.00 -0.52 0.00 0.00 37.83 34.04 1dcb s LYS 113 CO 0.29 0.57 0.66 0.71 -0.92 0.00 0.00 175.35 176.66 1dcb s TYR 114 N -0.47 3.00 0.20 3.18 2.02 -1.26 -4.74 117.35 119.28 1dcb s TYR 114 Ca 0.10 -0.04 0.20 0.00 -0.37 0.00 0.00 57.07 56.97 1dcb s TYR 114 Cb -0.12 -2.44 0.81 0.00 -0.40 0.00 0.00 41.96 39.81 1dcb s TYR 114 CO 0.02 -0.51 1.79 0.00 -1.57 0.00 0.00 175.55 175.28 1dcb h ALA 115 N 0.39 1.05 -2.74 3.71 0.00 -1.51 -1.88 119.26 118.28 1dcb h ALA 115 Ca -0.43 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 54.28 1dcb h ALA 115 Cb 1.27 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.97 1dcb h ALA 115 CO 0.53 0.39 0.36 0.00 0.00 0.00 0.00 179.25 180.53 1dcb s ALA 116 N -3.71 -1.30 -0.11 0.00 0.00 -1.19 -3.37 121.76 112.09 1dcb s ALA 116 Ca -0.00 -0.28 -0.07 0.00 0.00 0.00 0.00 51.96 51.61 1dcb s ALA 116 Cb 0.11 0.74 0.04 0.00 0.00 0.00 0.00 23.12 24.01 1dcb s ALA 116 CO 0.67 -1.03 0.27 -2.00 0.00 0.00 0.00 175.76 173.66 1dcb s GLU 117 N -3.16 0.26 -0.15 0.00 2.12 -0.58 -1.08 118.70 116.12 1dcb s GLU 117 Ca 0.14 0.49 -0.14 0.00 0.36 0.00 0.00 54.97 55.81 1dcb s GLU 117 Cb -0.04 -0.00 -0.05 0.00 0.26 0.00 0.00 34.13 34.30 1dcb s GLU 117 CO 0.06 -0.11 0.32 -1.17 -0.54 0.00 0.00 175.26 173.82 1dcb s LEU 118 N 0.83 4.25 -0.16 2.70 2.96 0.19 -1.34 118.68 128.12 1dcb s LEU 118 Ca -0.06 0.56 0.01 0.00 -0.22 0.00 0.00 54.13 54.42 1dcb s LEU 118 Cb -0.07 -2.42 0.02 0.00 0.50 0.00 0.00 46.19 44.23 1dcb s LEU 118 CO -0.05 0.09 -0.18 -1.00 -1.32 0.00 0.00 176.35 173.89 1dcb s HIS 119 N 0.44 2.50 -0.36 5.38 3.76 -0.15 0.09 115.29 126.96 1dcb s HIS 119 Ca 0.18 -1.42 -0.12 0.00 -0.15 0.00 0.00 55.06 53.55 1dcb s HIS 119 Cb -0.13 -1.76 0.01 0.00 1.11 0.00 0.00 32.58 31.81 1dcb s HIS 119 CO 0.05 -0.72 0.22 -0.51 -0.85 0.00 0.00 174.74 172.93 1dcb s LEU 120 N 1.28 4.63 -0.18 0.89 1.02 0.54 -1.83 118.68 125.02 1dcb s LEU 120 Ca 0.03 -0.79 -0.18 0.00 0.02 0.00 0.00 54.13 53.21 1dcb s LEU 120 Cb -0.13 -2.06 -0.03 0.00 0.02 0.00 0.00 46.19 43.98 1dcb s LEU 120 CO -0.10 -0.33 0.50 -0.69 0.02 0.00 0.00 176.35 175.75 1dcb s VAL 121 N 1.61 5.13 0.02 -1.59 1.01 0.61 -1.01 120.40 126.18 1dcb s VAL 121 Ca 0.04 0.94 0.04 0.00 0.00 0.00 0.00 61.98 63.00 1dcb s VAL 121 Cb -0.18 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 1dcb s VAL 121 CO 0.08 0.22 -0.12 -1.00 0.00 0.00 0.00 175.10 174.27 1dcb s HIS 122 N 1.38 1.06 0.03 5.22 3.76 -0.29 -1.70 115.29 124.75 1dcb s HIS 122 Ca 0.24 -0.29 0.08 0.00 -0.15 0.00 0.00 55.06 54.94 1dcb s HIS 122 Cb -0.15 -0.65 -0.02 0.00 1.11 0.00 0.00 32.58 32.86 1dcb s HIS 122 CO 0.10 0.00 -0.24 1.67 -0.85 0.00 0.00 174.74 175.42 1dcb s TRP 123 N -0.65 2.15 0.01 1.40 1.48 -0.64 -1.26 118.94 121.42 1dcb s TRP 123 Ca 0.02 -0.40 -0.30 0.00 -1.06 0.00 0.00 56.10 54.35 1dcb s TRP 123 Cb -0.06 -1.31 -0.07 0.00 -1.16 0.00 0.00 33.47 30.86 1dcb s TRP 123 CO 0.01 0.07 1.69 1.21 -4.06 0.00 0.00 176.95 175.87 1dcb s ASN 124 N -1.04 6.62 0.08 -2.66 3.84 -0.40 -1.07 114.94 120.32 1dcb s ASN 124 Ca 0.10 2.39 0.18 0.00 0.21 0.00 0.00 52.86 55.75 1dcb s ASN 124 Cb -0.09 -2.55 0.77 0.00 -0.55 0.00 0.00 41.25 38.83 1dcb s ASN 124 CO 0.01 -0.92 1.57 0.35 -2.79 0.00 0.00 177.10 175.32 1dcb n THR 125 N 5.15 0.88 0.20 -5.21 -2.24 -0.21 -2.11 114.28 110.75 1dcb n THR 125 Ca 0.17 0.22 0.07 0.00 -2.27 0.00 0.00 64.05 62.23 1dcb n THR 125 Cb 0.42 -1.01 0.41 0.00 -2.10 0.00 0.00 70.33 68.05 1dcb n THR 125 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1dcb h LYS 127 N 0.00 0.00 -0.07 -0.78 2.10 -1.91 -2.95 116.57 112.96 1dcb h LYS 127 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1dcb h LYS 127 Cb 0.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 1dcb h LYS 127 CO 0.00 0.32 0.00 0.66 -2.00 0.00 0.00 179.45 178.43 1dcb n TYR 128 N -3.58 0.08 0.00 0.07 4.01 -0.90 -4.96 117.16 111.88 1dcb n TYR 128 Ca -0.01 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1dcb n TYR 128 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 1dcb n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dcb n GLY 129 N 1.08 1.18 3.58 2.72 0.00 -1.12 -4.58 105.19 108.06 1dcb n GLY 129 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1dcb n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1dcb s ASP 130 N -0.32 -0.33 0.17 1.61 1.47 -1.26 -5.06 116.67 112.95 1dcb s ASP 130 Ca 0.00 -0.41 -0.14 0.00 1.18 0.00 0.00 52.55 53.18 1dcb s ASP 130 Cb 0.00 0.62 0.08 0.00 -0.34 0.00 0.00 42.92 43.28 1dcb s ASP 130 CO 0.00 -1.11 1.81 0.15 0.68 0.00 0.00 175.17 176.70 1dcb h PHE 131 N 2.10 0.55 0.00 2.11 3.57 -1.94 -2.55 116.94 120.78 1dcb h PHE 131 Ca -0.27 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.24 1dcb h PHE 131 Cb 1.27 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.83 1dcb h PHE 131 CO 0.34 0.32 -0.02 0.78 -2.23 0.00 0.00 178.31 177.50 1dcb h GLY 132 N 0.59 0.00 1.11 2.40 0.00 -1.98 -1.97 103.07 103.21 1dcb h GLY 132 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.21 1dcb h GLY 132 CO -0.08 0.00 -1.63 0.50 0.00 0.00 0.00 176.54 175.33 1dcb h LYS 133 N 0.00 0.17 -0.60 4.80 1.79 -1.78 -3.37 116.57 117.58 1dcb h LYS 133 Ca -0.00 -0.29 -0.08 0.00 -2.18 0.00 0.00 60.65 58.09 1dcb h LYS 133 Cb 0.06 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.79 1dcb h LYS 133 CO 0.00 0.96 0.05 0.00 -1.08 0.00 0.00 179.45 179.38 1dcb h ALA 134 N 0.58 0.80 0.00 3.86 0.00 -0.97 -2.65 119.26 120.87 1dcb h ALA 134 Ca -0.27 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1dcb h ALA 134 Cb 2.00 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1dcb h ALA 134 CO 0.13 0.60 0.01 -0.39 0.00 0.00 0.00 179.25 179.60 1dcb h VAL 135 N 0.92 0.00 -0.00 0.00 -1.51 -1.54 -1.47 116.25 112.64 1dcb h VAL 135 Ca 0.18 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.65 1dcb h VAL 135 Cb 0.49 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.41 1dcb h VAL 135 CO 0.02 0.00 -0.28 0.00 -1.23 0.00 0.00 177.57 176.08 1dcb n GLN 136 N -2.71 0.41 -4.15 5.19 6.02 -1.00 -4.65 117.38 116.48 1dcb n GLN 136 Ca -0.02 -0.20 -0.31 0.00 -0.01 0.00 0.00 57.00 56.46 1dcb n GLN 136 Cb 0.07 -1.50 -0.08 0.00 1.02 0.00 0.00 30.24 29.75 1dcb n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1dcb s GLN 137 N -2.73 2.62 0.41 -1.09 -1.52 -0.55 -5.04 119.66 111.75 1dcb s GLN 137 Ca 0.19 -0.79 0.19 0.00 -1.95 0.00 0.00 55.36 53.01 1dcb s GLN 137 Cb 0.19 -2.58 0.89 0.00 -0.22 0.00 0.00 33.01 31.29 1dcb s GLN 137 CO 0.58 0.56 1.85 -1.35 -0.25 0.00 0.00 175.29 176.67 1dcb h PRO 138 N 3.57 0.00 -0.17 2.91 0.11 -1.84 -2.55 132.00 134.03 1dcb h PRO 138 Ca -0.48 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 1dcb h PRO 138 Cb 1.17 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 1dcb h PRO 138 CO 0.60 0.31 -0.14 -0.40 -0.21 0.00 0.00 178.00 178.15 1dcb n ASP 139 N -3.74 2.55 -0.13 -2.05 5.75 -1.26 -4.28 116.55 113.39 1dcb n ASP 139 Ca -0.01 -3.50 -0.12 0.00 -0.01 0.00 0.00 54.79 51.14 1dcb n ASP 139 Cb 0.41 -0.55 -0.01 0.00 -1.03 0.00 0.00 41.12 39.94 1dcb n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1dcb h GLY 140 N 0.94 1.03 -3.62 6.12 0.00 -1.35 -3.43 103.07 102.76 1dcb h GLY 140 Ca 0.08 -1.00 -0.46 0.00 0.00 0.00 0.00 47.33 45.95 1dcb h GLY 140 CO 0.18 0.91 -0.77 1.08 0.00 0.00 0.00 176.54 177.93 1dcb s LEU 141 N -8.94 2.40 -0.12 3.11 1.43 0.12 -1.27 118.68 115.41 1dcb s LEU 141 Ca -0.11 -0.80 0.01 0.00 -1.03 0.00 0.00 54.13 52.20 1dcb s LEU 141 Cb 0.12 -0.66 0.02 0.00 0.03 0.00 0.00 46.19 45.70 1dcb s LEU 141 CO 0.88 -0.09 -0.13 0.00 0.23 0.00 0.00 176.35 177.24 1dcb s ALA 142 N -1.98 1.61 -0.12 4.21 0.00 -0.39 -0.10 121.76 124.99 1dcb s ALA 142 Ca 0.10 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.38 1dcb s ALA 142 Cb -0.06 -0.88 -0.00 0.00 0.00 0.00 0.00 23.12 22.18 1dcb s ALA 142 CO 0.04 -0.21 -0.21 0.08 0.00 0.00 0.00 175.76 175.46 1dcb s VAL 143 N 1.25 2.29 -0.29 0.00 1.01 -0.84 -1.14 120.40 122.67 1dcb s VAL 143 Ca -0.02 -0.92 -0.16 0.00 0.00 0.00 0.00 61.98 60.87 1dcb s VAL 143 Cb -0.14 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 1dcb s VAL 143 CO -0.05 0.55 0.44 -0.76 0.00 0.00 0.00 175.10 175.28 1dcb s LEU 144 N 0.51 4.14 -0.18 3.92 1.43 -0.18 -0.83 118.68 127.48 1dcb s LEU 144 Ca -0.13 0.25 -0.10 0.00 -1.03 0.00 0.00 54.13 53.12 1dcb s LEU 144 Cb -0.17 -2.52 -0.05 0.00 0.03 0.00 0.00 46.19 43.48 1dcb s LEU 144 CO 0.05 -0.29 0.14 -0.83 0.23 0.00 0.00 176.35 175.65 1dcb s GLY 145 N 1.65 2.07 -0.09 -3.19 0.00 0.88 -0.34 107.32 108.30 1dcb s GLY 145 Ca 0.17 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.23 1dcb s GLY 145 CO 0.11 0.07 -0.08 -0.42 0.00 0.00 0.00 173.10 172.78 1dcb s ILE 146 N 0.14 0.93 0.34 0.90 1.01 0.11 -1.91 121.20 122.73 1dcb s ILE 146 Ca 0.10 -0.28 -0.22 0.00 0.00 0.00 0.00 60.65 60.25 1dcb s ILE 146 Cb -0.11 -0.93 -0.10 0.00 0.01 0.00 0.00 42.46 41.33 1dcb s ILE 146 CO -0.01 0.34 0.89 -0.36 0.00 0.00 0.00 174.94 175.80 1dcb s PHE 147 N 1.35 3.52 -0.13 3.97 0.08 -1.26 0.56 117.98 126.07 1dcb s PHE 147 Ca -0.02 1.60 0.03 0.00 0.12 0.00 0.00 56.93 58.66 1dcb s PHE 147 Cb -0.14 -2.81 0.01 0.00 -0.57 0.00 0.00 43.02 39.51 1dcb s PHE 147 CO -0.04 0.11 -0.22 -0.51 -0.10 0.00 0.00 175.22 174.46 1dcb s LEU 148 N -2.53 2.15 0.16 -0.37 1.02 -0.24 -1.96 118.68 116.91 1dcb s LEU 148 Ca 0.54 -0.57 0.08 0.00 0.02 0.00 0.00 54.13 54.20 1dcb s LEU 148 Cb -0.14 -1.45 -0.04 0.00 0.02 0.00 0.00 46.19 44.58 1dcb s LEU 148 CO 0.19 0.11 -0.10 -1.59 0.02 0.00 0.00 176.35 174.98 1dcb s LYS 149 N 0.65 2.07 -0.21 1.70 -2.85 -0.11 -2.38 119.74 118.62 1dcb s LYS 149 Ca -0.11 -1.20 -0.20 0.00 -1.00 0.00 0.00 55.97 53.46 1dcb s LYS 149 Cb -0.16 -2.20 -0.03 0.00 -2.06 0.00 0.00 37.83 33.38 1dcb s LYS 149 CO 0.02 0.45 0.61 0.08 0.10 0.00 0.00 175.35 176.61 1dcb s VAL 150 N -1.56 5.03 0.00 1.79 1.01 -1.26 -0.73 120.40 124.69 1dcb s VAL 150 Ca 0.24 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.35 1dcb s VAL 150 Cb -0.09 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.36 1dcb s VAL 150 CO 0.15 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1dcb n GLY 151 N 3.88 0.98 3.81 4.51 0.00 0.11 -4.90 105.19 113.59 1dcb n GLY 151 Ca -0.02 0.40 -0.33 0.00 0.00 0.00 0.00 46.02 46.07 1dcb n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dcb s SER 152 N 2.00 6.76 0.66 1.61 0.01 -1.26 -3.98 113.70 119.50 1dcb s SER 152 Ca 0.00 1.78 -0.17 0.00 1.31 0.00 0.00 55.95 58.86 1dcb s SER 152 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1dcb s SER 152 CO 0.00 -0.49 1.24 0.00 0.41 0.00 0.00 173.24 174.40 1dcb s ALA 153 N -2.09 2.33 -0.36 1.44 0.00 -1.26 -2.25 121.76 119.56 1dcb s ALA 153 Ca 0.63 1.04 -0.05 0.00 0.00 0.00 0.00 51.96 53.58 1dcb s ALA 153 Cb -0.12 -3.50 0.07 0.00 0.00 0.00 0.00 23.12 19.58 1dcb s ALA 153 CO 0.16 -1.58 0.14 0.21 0.00 0.00 0.00 175.76 174.68 1dcb s LYS 154 N -3.56 2.40 0.23 0.00 2.47 -1.25 -4.81 119.74 115.23 1dcb s LYS 154 Ca 0.78 -1.43 -0.06 0.00 -1.56 0.00 0.00 55.97 53.70 1dcb s LYS 154 Cb -0.33 -3.49 0.39 0.00 -1.46 0.00 0.00 37.83 32.94 1dcb s LYS 154 CO 0.40 -0.82 1.75 -1.00 0.16 0.00 0.00 175.35 175.84 1dcb h PRO 155 N 8.16 0.49 0.00 4.03 0.13 -1.92 -0.88 132.00 142.01 1dcb h PRO 155 Ca -0.20 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1dcb h PRO 155 Cb 1.07 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1dcb h PRO 155 CO 0.64 0.32 0.00 0.41 -0.23 0.00 0.00 178.00 179.15 1dcb n GLY 156 N -1.31 -0.81 0.05 1.56 0.00 -1.26 -2.08 105.19 101.34 1dcb n GLY 156 Ca 0.12 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.21 1dcb n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1dcb n LEU 157 N -1.41 0.54 -0.23 0.99 7.94 -0.34 -4.56 117.00 119.93 1dcb n LEU 157 Ca 0.04 0.05 0.05 0.00 -1.11 0.00 0.00 56.01 55.04 1dcb n LEU 157 Cb 0.12 -0.06 0.30 0.00 0.53 0.00 0.00 43.42 44.31 1dcb n LEU 157 CO 0.10 -0.02 1.23 -0.61 -1.11 0.00 0.00 177.39 176.99 1dcb h GLN 158 N 0.00 0.86 -0.35 1.96 5.75 -1.43 -0.15 115.11 121.76 1dcb h GLN 158 Ca 0.00 -0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.49 1dcb h GLN 158 Cb 0.85 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.19 1dcb h GLN 158 CO 0.00 0.57 0.24 0.87 -2.65 0.00 0.00 178.83 177.86 1dcb h LYS 159 N 0.89 0.30 -0.10 1.69 1.57 -1.80 -0.60 116.57 118.52 1dcb h LYS 159 Ca 0.34 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.92 1dcb h LYS 159 Cb 0.19 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.44 1dcb h LYS 159 CO -0.11 0.20 -0.64 0.28 -0.57 0.00 0.00 179.45 178.61 1dcb h VAL 160 N 0.31 1.34 -0.07 0.50 2.07 -1.32 -3.29 116.25 115.79 1dcb h VAL 160 Ca 0.15 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.73 1dcb h VAL 160 Cb 0.20 2.18 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1dcb h VAL 160 CO -0.03 0.59 0.02 0.58 0.02 0.00 0.00 177.57 178.74 1dcb h VAL 161 N 0.25 1.19 -0.09 2.57 2.07 -1.11 -2.92 116.25 118.21 1dcb h VAL 161 Ca -0.05 -0.59 0.03 0.00 0.82 0.00 0.00 66.70 66.90 1dcb h VAL 161 Cb 1.29 1.45 -0.00 0.00 -1.52 0.00 0.00 31.29 32.51 1dcb h VAL 161 CO 0.13 0.17 0.06 0.44 0.02 0.00 0.00 177.57 178.39 1dcb h ASP 162 N -0.10 0.00 0.72 0.57 3.32 -1.24 -2.51 116.42 117.18 1dcb h ASP 162 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1dcb h ASP 162 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1dcb h ASP 162 CO 0.00 0.00 -0.26 0.55 -1.72 0.00 0.00 179.24 177.81 1dcb n VAL 163 N -4.48 0.00 -0.09 -1.35 3.14 -1.11 -4.26 118.33 110.18 1dcb n VAL 163 Ca -0.01 -0.00 0.16 0.00 -2.96 0.00 0.00 64.34 61.52 1dcb n VAL 163 Cb 0.18 -0.10 0.56 0.00 -1.06 0.00 0.00 33.84 33.41 1dcb n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1dcb h LEU 164 N 0.02 0.27 -1.04 6.55 3.38 -1.41 -1.84 115.31 121.24 1dcb h LEU 164 Ca 0.00 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.04 1dcb h LEU 164 Cb 0.50 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 1dcb h LEU 164 CO 0.00 0.15 0.64 0.44 0.09 0.00 0.00 178.44 179.76 1dcb h ASP 165 N 0.29 1.02 0.76 -0.43 3.32 -1.80 -1.11 116.42 118.48 1dcb h ASP 165 Ca 0.30 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1dcb h ASP 165 Cb 0.78 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1dcb h ASP 165 CO -0.07 0.66 0.00 0.28 -1.72 0.00 0.00 179.24 178.39 1dcb h SER 166 N 1.16 0.00 -0.67 6.45 0.02 -1.63 -3.28 113.55 115.61 1dcb h SER 166 Ca 0.42 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 61.01 1dcb h SER 166 Cb 0.15 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.28 1dcb h SER 166 CO -0.16 0.00 -1.03 2.30 -1.14 0.00 0.00 176.83 176.81 1dcb n ILE 167 N -2.48 1.64 -0.27 3.27 -5.35 -0.45 -4.70 119.36 111.02 1dcb n ILE 167 Ca 0.01 -3.42 0.04 0.00 -0.27 0.00 0.00 62.75 59.12 1dcb n ILE 167 Cb 0.24 0.40 0.18 0.00 -1.74 0.00 0.00 39.64 38.72 1dcb n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1dcb h LYS 168 N 2.55 0.57 -6.06 6.28 3.64 -1.56 -3.42 116.57 118.57 1dcb h LYS 168 Ca 0.03 -0.03 -0.55 0.00 -1.27 0.00 0.00 60.65 58.82 1dcb h LYS 168 Cb 1.31 -0.13 -0.08 0.00 -0.41 0.00 0.00 32.23 32.91 1dcb h LYS 168 CO 0.42 0.38 -0.54 0.95 -2.27 0.00 0.00 179.45 178.39 1dcb s THR 169 N -6.02 2.86 0.18 1.00 -4.23 -1.26 -0.69 115.64 107.48 1dcb s THR 169 Ca -0.12 -1.74 -0.32 0.00 -1.18 0.00 0.00 61.69 58.33 1dcb s THR 169 Cb 0.20 -2.95 -0.11 0.00 1.34 0.00 0.00 72.50 70.98 1dcb s THR 169 CO 0.77 -0.16 1.65 -0.75 -0.54 0.00 0.00 174.62 175.59 1dcb s LYS 170 N -3.83 4.17 0.00 3.99 2.20 -0.14 -2.59 119.74 123.55 1dcb s LYS 170 Ca 0.38 2.47 0.00 0.00 -0.36 0.00 0.00 55.97 58.46 1dcb s LYS 170 Cb -0.01 -3.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1dcb s LYS 170 CO 0.22 -0.68 0.00 0.41 -0.36 0.00 0.00 175.35 174.94 1dcb n GLY 171 N 3.88 1.12 3.78 5.54 0.00 0.63 -4.52 105.19 115.61 1dcb n GLY 171 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1dcb n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dcb s LYS 172 N -0.96 4.47 0.04 1.61 -0.14 -1.07 -4.89 119.74 118.81 1dcb s LYS 172 Ca 0.00 1.39 -0.09 0.00 -1.36 0.00 0.00 55.97 55.91 1dcb s LYS 172 Cb 0.00 -2.73 0.00 0.00 -1.68 0.00 0.00 37.83 33.42 1dcb s LYS 172 CO 0.00 0.16 0.20 -1.54 -0.76 0.00 0.00 175.35 173.40 1dcb s SER 173 N -1.59 0.04 -0.09 2.83 1.04 -1.26 -1.19 113.70 113.48 1dcb s SER 173 Ca 0.52 -0.38 -0.08 0.00 0.48 0.00 0.00 55.95 56.49 1dcb s SER 173 Cb -0.20 0.29 0.03 0.00 0.10 0.00 0.00 66.02 66.24 1dcb s SER 173 CO 0.25 -0.56 0.25 0.00 0.98 0.00 0.00 173.24 174.16 1dcb s ALA 174 N -2.62 -0.61 0.26 5.32 0.00 0.32 -4.97 121.76 119.46 1dcb s ALA 174 Ca -0.05 0.72 -0.30 0.00 0.00 0.00 0.00 51.96 52.33 1dcb s ALA 174 Cb -0.01 -0.42 -0.14 0.00 0.00 0.00 0.00 23.12 22.55 1dcb s ALA 174 CO -0.04 -0.12 1.21 -0.25 0.00 0.00 0.00 175.76 176.55 1dcb n ASP 175 N 3.01 1.99 -2.97 0.00 8.00 -1.26 -0.84 116.55 124.48 1dcb n ASP 175 Ca -0.13 1.17 -0.15 0.00 0.71 0.00 0.00 54.79 56.38 1dcb n ASP 175 Cb 0.58 -1.35 -0.01 0.00 -0.02 0.00 0.00 41.12 40.32 1dcb n ASP 175 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1dcb n PHE 176 N 0.99 -2.09 -3.28 1.24 7.35 -0.56 -4.73 117.46 116.39 1dcb n PHE 176 Ca 0.10 -2.52 -0.22 0.00 -0.76 0.00 0.00 57.45 54.05 1dcb n PHE 176 Cb 0.31 0.74 -0.00 0.00 0.35 0.00 0.00 39.48 40.88 1dcb n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1dcb s THR 177 N -0.04 4.50 -1.61 -2.13 -4.23 -1.26 -3.19 115.64 107.68 1dcb s THR 177 Ca 0.33 -0.60 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 1dcb s THR 177 Cb 0.17 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.38 1dcb s THR 177 CO -0.17 -0.39 0.00 0.59 -0.54 0.00 0.00 174.62 174.11 1dcb n ASN 178 N -1.85 -5.20 -4.67 3.99 4.13 -1.26 -4.99 115.26 105.41 1dcb n ASN 178 Ca -0.02 0.08 -0.39 0.00 1.68 0.00 0.00 54.58 55.93 1dcb n ASN 178 Cb 0.57 -4.27 -0.06 0.00 -1.54 0.00 0.00 39.78 34.47 1dcb n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1dcb s PHE 179 N -2.84 3.39 -0.37 3.10 5.36 -1.26 -5.04 117.98 120.31 1dcb s PHE 179 Ca 0.00 0.84 -0.13 0.00 -0.96 0.00 0.00 56.93 56.69 1dcb s PHE 179 Cb 0.00 -2.70 0.01 0.00 -0.34 0.00 0.00 43.02 39.99 1dcb s PHE 179 CO 0.00 -0.09 0.24 0.34 -1.46 0.00 0.00 175.22 174.25 1dcb s ASP 180 N 1.11 5.93 0.62 6.13 -1.08 -1.26 -4.53 116.67 123.58 1dcb s ASP 180 Ca 0.26 -0.75 0.36 0.00 -0.52 0.00 0.00 52.55 51.90 1dcb s ASP 180 Cb -0.16 -2.10 2.07 0.00 -1.46 0.00 0.00 42.92 41.27 1dcb s ASP 180 CO 0.10 -0.34 2.30 1.55 0.52 0.00 0.00 175.17 179.30 1dcb h PRO 181 N 8.51 0.00 -0.17 4.34 0.13 -1.97 -2.77 132.00 140.06 1dcb h PRO 181 Ca -0.28 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.90 1dcb h PRO 181 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1dcb h PRO 181 CO 0.67 0.00 0.19 0.00 -0.23 0.00 0.00 178.00 178.64 1dcb h ARG 182 N 0.00 0.00 0.00 0.86 3.08 -1.93 -1.04 114.38 115.35 1dcb h ARG 182 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1dcb h ARG 182 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1dcb h ARG 182 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1dcb n GLY 183 N -1.40 -0.93 0.25 0.04 0.00 -1.05 -3.09 105.19 99.01 1dcb n GLY 183 Ca 0.01 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.03 1dcb n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dcb n LEU 184 N -1.27 1.40 -4.79 0.99 4.77 -0.39 -4.29 117.00 113.41 1dcb n LEU 184 Ca 0.10 -0.65 -0.38 0.00 -0.03 0.00 0.00 56.01 55.04 1dcb n LEU 184 Cb 0.15 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.18 1dcb n LEU 184 CO 0.15 0.29 0.43 -0.76 -1.33 0.00 0.00 177.39 176.17 1dcb s LEU 185 N -2.49 4.49 0.83 2.23 1.43 -1.18 -4.93 118.68 119.06 1dcb s LEU 185 Ca 0.12 1.52 -0.12 0.00 -1.03 0.00 0.00 54.13 54.62 1dcb s LEU 185 Cb 0.14 -3.35 0.09 0.00 0.03 0.00 0.00 46.19 43.10 1dcb s LEU 185 CO 0.59 0.15 1.10 -2.16 0.23 0.00 0.00 176.35 176.26 1dcb s PRO 186 N -1.45 1.86 0.27 1.29 0.04 -1.26 -4.98 135.00 130.77 1dcb s PRO 186 Ca 0.38 0.61 -0.02 0.00 0.04 0.00 0.00 61.00 62.01 1dcb s PRO 186 Cb -0.20 -1.89 0.36 0.00 0.04 0.00 0.00 34.50 32.80 1dcb s PRO 186 CO 0.23 -1.77 1.78 1.49 0.04 0.00 0.00 177.00 178.77 1dcb h GLU 187 N -1.20 0.81 -5.89 4.56 4.81 -1.92 -3.44 114.58 112.31 1dcb h GLU 187 Ca -0.48 -0.20 -0.62 0.00 -0.13 0.00 0.00 59.36 57.93 1dcb h GLU 187 Cb 1.28 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.51 1dcb h GLU 187 CO 0.59 0.78 -0.50 0.45 -0.73 0.00 0.00 179.01 179.61 1dcb s SER 188 N -6.62 6.36 0.00 1.04 0.15 -1.26 -5.00 113.70 108.37 1dcb s SER 188 Ca -0.10 0.29 0.15 0.00 0.70 0.00 0.00 55.95 57.00 1dcb s SER 188 Cb 0.15 -1.97 0.42 0.00 -1.71 0.00 0.00 66.02 62.91 1dcb s SER 188 CO 0.81 0.19 1.34 0.18 1.20 0.00 0.00 173.24 176.96 1dcb n LEU 189 N 0.44 3.26 -4.75 3.45 4.77 -1.26 -4.77 117.00 118.14 1dcb n LEU 189 Ca -0.06 -1.93 -0.41 0.00 -0.03 0.00 0.00 56.01 53.58 1dcb n LEU 189 Cb 0.51 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 41.28 1dcb n LEU 189 CO 0.50 0.80 1.14 -1.81 -1.33 0.00 0.00 177.39 176.69 1dcb s ASP 190 N -1.02 6.54 0.25 -1.43 1.01 -1.26 -4.74 116.67 116.02 1dcb s ASP 190 Ca 0.32 2.80 -0.09 0.00 0.71 0.00 0.00 52.55 56.30 1dcb s ASP 190 Cb 0.17 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.45 1dcb s ASP 190 CO 0.22 -0.77 0.39 -0.72 0.21 0.00 0.00 175.17 174.51 1dcb s TYR 191 N -0.25 0.63 0.14 4.23 1.13 -1.26 -1.09 117.35 120.88 1dcb s TYR 191 Ca 0.59 -0.95 0.07 0.00 -1.41 0.00 0.00 57.07 55.37 1dcb s TYR 191 Cb -0.44 -0.02 -0.04 0.00 -1.10 0.00 0.00 41.96 40.36 1dcb s TYR 191 CO 0.48 -0.92 -0.06 -1.58 -2.51 0.00 0.00 175.55 170.96 1dcb s TRP 192 N -3.94 2.79 0.01 -3.49 0.51 -0.08 -0.76 118.94 113.98 1dcb s TRP 192 Ca 0.27 -0.14 -0.07 0.00 -2.12 0.00 0.00 56.10 54.04 1dcb s TRP 192 Cb 0.01 -1.41 -0.00 0.00 -0.81 0.00 0.00 33.47 31.26 1dcb s TRP 192 CO 0.11 0.48 0.14 -0.08 -0.51 0.00 0.00 176.95 177.08 1dcb s THR 193 N -1.46 0.10 -0.14 2.01 -1.32 0.56 -1.18 115.64 114.21 1dcb s THR 193 Ca 0.24 -0.80 -0.30 0.00 -1.21 0.00 0.00 61.69 59.62 1dcb s THR 193 Cb -0.10 -0.59 0.11 0.00 -1.51 0.00 0.00 72.50 70.42 1dcb s THR 193 CO 0.16 -0.44 0.93 -0.72 -2.21 0.00 0.00 174.62 172.34 1dcb s TYR 194 N -1.78 -0.43 0.12 9.09 1.13 -1.04 -1.45 117.35 122.99 1dcb s TYR 194 Ca -0.12 0.76 -0.30 0.00 -1.41 0.00 0.00 57.07 56.00 1dcb s TYR 194 Cb -0.06 0.44 -0.06 0.00 -1.10 0.00 0.00 41.96 41.18 1dcb s TYR 194 CO -0.00 -0.40 1.10 -1.25 -2.51 0.00 0.00 175.55 172.49 1dcb s PRO 195 N -1.08 4.56 0.00 -3.49 0.04 -1.26 -1.43 135.00 132.34 1dcb s PRO 195 Ca -0.04 1.68 0.00 0.00 0.04 0.00 0.00 61.00 62.68 1dcb s PRO 195 Cb -0.00 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1dcb s PRO 195 CO 0.03 -0.01 0.00 0.41 0.04 0.00 0.00 177.00 177.47 1dcb n GLY 196 N 2.44 3.66 3.40 0.56 0.00 0.12 -4.86 105.19 110.50 1dcb n GLY 196 Ca 0.05 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.22 1dcb n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dcb s SER 197 N 1.83 1.96 0.43 1.61 1.04 -0.96 -2.20 113.70 117.41 1dcb s SER 197 Ca 0.00 -1.55 -0.26 0.00 0.48 0.00 0.00 55.95 54.62 1dcb s SER 197 Cb 0.00 0.34 -0.09 0.00 0.10 0.00 0.00 66.02 66.37 1dcb s SER 197 CO 0.00 -0.85 1.39 0.18 0.98 0.00 0.00 173.24 174.94 1dcb n LEU 198 N -0.68 4.76 -0.04 2.42 4.77 -0.35 -4.59 117.00 123.30 1dcb n LEU 198 Ca -0.01 1.13 0.15 0.00 -0.03 0.00 0.00 56.01 57.25 1dcb n LEU 198 Cb 0.65 -1.57 0.80 0.00 -2.33 0.00 0.00 43.42 40.97 1dcb n LEU 198 CO 0.36 -0.28 1.03 0.00 -1.33 0.00 0.00 177.39 177.17 1dcb s THR 200 N -2.30 0.29 0.49 0.00 -4.23 -1.26 -4.79 115.64 103.84 1dcb s THR 200 Ca 0.37 -1.93 -0.21 0.00 -1.18 0.00 0.00 61.69 58.74 1dcb s THR 200 Cb 0.21 -2.07 -0.10 0.00 1.34 0.00 0.00 72.50 71.88 1dcb s THR 200 CO 0.42 -0.47 0.62 -2.65 -0.54 0.00 0.00 174.62 172.00 1dcb n PRO 201 N -0.14 0.67 0.00 3.99 -0.02 -1.26 -0.84 135.00 137.40 1dcb n PRO 201 Ca -0.06 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1dcb n PRO 201 Cb 0.64 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 1dcb n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1dcb n PRO 202 N 0.23 0.19 -3.18 0.52 -0.04 -1.26 -4.99 135.00 126.47 1dcb n PRO 202 Ca 0.11 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.40 1dcb n PRO 202 Cb 0.43 -1.00 -0.02 0.00 -0.04 0.00 0.00 33.50 32.87 1dcb n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1dcb n LEU 203 N -0.50 -0.77 -4.77 1.53 4.77 -0.02 -4.92 117.00 112.31 1dcb n LEU 203 Ca 0.00 -0.17 -0.41 0.00 -0.03 0.00 0.00 56.01 55.40 1dcb n LEU 203 Cb 0.00 -1.59 -0.00 0.00 -2.33 0.00 0.00 43.42 39.49 1dcb n LEU 203 CO 0.00 0.05 1.17 -0.76 -1.33 0.00 0.00 177.39 176.52 1dcb s LEU 204 N -5.98 4.32 -1.22 2.23 1.43 -1.26 -4.46 118.68 113.74 1dcb s LEU 204 Ca 0.29 3.04 -0.06 0.00 -1.03 0.00 0.00 54.13 56.37 1dcb s LEU 204 Cb -0.16 -3.66 0.20 0.00 0.03 0.00 0.00 46.19 42.60 1dcb s LEU 204 CO 0.36 -0.89 1.90 -0.62 0.23 0.00 0.00 176.35 177.33 1dcb n GLU 205 N 0.85 4.21 0.00 1.70 1.02 -1.26 -1.21 120.64 125.94 1dcb n GLU 205 Ca 0.03 -3.85 0.00 0.00 -0.02 0.00 0.00 57.16 53.32 1dcb n GLU 205 Cb 0.39 -2.72 0.00 0.00 -0.02 0.00 0.00 31.44 29.08 1dcb n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dcb s VAL 207 N -0.90 3.89 -0.42 0.00 1.01 -0.94 -0.70 120.40 122.35 1dcb s VAL 207 Ca 0.00 -0.59 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 1dcb s VAL 207 Cb 0.00 -2.68 0.07 0.00 0.00 0.00 0.00 36.38 33.78 1dcb s VAL 207 CO 0.00 0.47 0.28 -0.89 0.00 0.00 0.00 175.10 174.95 1dcb s THR 208 N -0.96 4.45 0.05 3.92 2.01 0.85 0.12 115.64 126.08 1dcb s THR 208 Ca 0.16 -1.27 -0.25 0.00 0.31 0.00 0.00 61.69 60.65 1dcb s THR 208 Cb -0.11 -3.68 -0.06 0.00 0.01 0.00 0.00 72.50 68.66 1dcb s THR 208 CO 0.06 -0.48 0.76 0.26 -0.69 0.00 0.00 174.62 174.53 1dcb s TRP 209 N 1.48 3.75 -0.28 4.92 0.52 -0.51 -1.99 118.94 126.83 1dcb s TRP 209 Ca 0.03 1.47 -0.00 0.00 0.02 0.00 0.00 56.10 57.62 1dcb s TRP 209 Cb -0.23 -2.81 0.08 0.00 -1.15 0.00 0.00 33.47 29.37 1dcb s TRP 209 CO 0.03 0.29 0.04 0.42 0.02 0.00 0.00 176.95 177.76 1dcb s ILE 210 N -0.14 1.19 -0.25 2.03 1.01 -0.01 -2.49 121.20 122.53 1dcb s ILE 210 Ca 0.38 -1.35 -0.08 0.00 0.00 0.00 0.00 60.65 59.60 1dcb s ILE 210 Cb -0.21 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 1dcb s ILE 210 CO 0.23 -0.44 0.10 -0.69 0.00 0.00 0.00 174.94 174.14 1dcb s VAL 211 N 1.50 4.62 0.18 2.92 1.01 -0.32 -0.08 120.40 130.22 1dcb s VAL 211 Ca 0.04 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 1dcb s VAL 211 Cb -0.18 -3.17 -0.08 0.00 0.00 0.00 0.00 36.38 32.96 1dcb s VAL 211 CO -0.15 0.32 0.92 -0.76 0.00 0.00 0.00 175.10 175.43 1dcb s LEU 212 N 1.57 4.58 0.20 3.92 2.01 -0.80 -0.90 118.68 129.26 1dcb s LEU 212 Ca 0.06 1.83 -0.07 0.00 0.01 0.00 0.00 54.13 55.97 1dcb s LEU 212 Cb -0.15 -3.54 0.13 0.00 0.01 0.00 0.00 46.19 42.64 1dcb s LEU 212 CO 0.06 0.08 1.66 0.50 1.01 0.00 0.00 176.35 179.65 1dcb h LYS 213 N 4.74 0.98 -5.57 1.70 3.64 -1.46 -3.44 116.57 117.16 1dcb h LYS 213 Ca -0.44 -0.32 -0.60 0.00 -1.27 0.00 0.00 60.65 58.01 1dcb h LYS 213 Cb 1.20 -0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 32.83 1dcb h LYS 213 CO 0.69 0.99 0.19 -2.00 -2.27 0.00 0.00 179.45 177.06 1dcb s GLU 214 N -4.93 4.14 0.49 1.90 2.12 -1.26 -5.04 118.70 116.11 1dcb s GLU 214 Ca -0.11 0.61 -0.18 0.00 0.36 0.00 0.00 54.97 55.65 1dcb s GLU 214 Cb 0.14 -3.64 -0.09 0.00 0.26 0.00 0.00 34.13 30.80 1dcb s GLU 214 CO 0.85 -0.40 0.99 -1.25 -0.54 0.00 0.00 175.26 174.91 1dcb s PRO 215 N 2.45 3.97 0.07 4.30 0.05 -1.26 -4.72 135.00 139.86 1dcb s PRO 215 Ca 0.28 1.08 0.01 0.00 0.05 0.00 0.00 61.00 62.41 1dcb s PRO 215 Cb -0.16 -2.14 -0.04 0.00 0.05 0.00 0.00 34.50 32.22 1dcb s PRO 215 CO 0.09 -0.26 0.17 0.96 0.05 0.00 0.00 177.00 178.01 1dcb s ILE 216 N -2.39 5.11 0.05 0.56 -4.36 -0.83 -4.93 121.20 114.41 1dcb s ILE 216 Ca 0.61 -0.53 0.03 0.00 -0.26 0.00 0.00 60.65 60.51 1dcb s ILE 216 Cb -0.11 -3.49 -0.04 0.00 1.25 0.00 0.00 42.46 40.07 1dcb s ILE 216 CO 0.25 0.12 0.01 -0.94 0.24 0.00 0.00 174.94 174.62 1dcb s SER 217 N -2.51 5.14 0.14 4.36 1.04 -1.26 -0.94 113.70 119.67 1dcb s SER 217 Ca 0.33 -0.09 0.04 0.00 0.48 0.00 0.00 55.95 56.71 1dcb s SER 217 Cb -0.13 -1.30 -0.04 0.00 0.10 0.00 0.00 66.02 64.65 1dcb s SER 217 CO 0.26 0.22 -0.09 0.68 0.98 0.00 0.00 173.24 175.29 1dcb s VAL 218 N -1.24 1.06 0.41 5.02 -7.23 0.10 -3.81 120.40 114.71 1dcb s VAL 218 Ca 0.24 -2.03 -0.10 0.00 -1.81 0.00 0.00 61.98 58.28 1dcb s VAL 218 Cb -0.12 -1.82 -0.06 0.00 0.56 0.00 0.00 36.38 34.94 1dcb s VAL 218 CO 0.16 -0.76 0.76 -0.94 -0.31 0.00 0.00 175.10 174.00 1dcb s SER 219 N -3.14 6.49 0.31 4.85 1.04 -1.17 0.06 113.70 122.14 1dcb s SER 219 Ca 0.16 1.09 0.06 0.00 0.48 0.00 0.00 55.95 57.74 1dcb s SER 219 Cb 0.03 -2.31 0.73 0.00 0.10 0.00 0.00 66.02 64.57 1dcb s SER 219 CO -0.00 -0.41 1.80 -1.28 0.98 0.00 0.00 173.24 174.32 1dcb h SER 220 N 1.17 0.79 -0.47 7.02 0.87 -1.93 0.10 113.55 121.10 1dcb h SER 220 Ca -0.47 0.08 -0.10 0.00 -1.23 0.00 0.00 61.79 60.07 1dcb h SER 220 Cb 1.19 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 63.07 1dcb h SER 220 CO 0.64 0.32 -0.08 1.05 -0.53 0.00 0.00 176.83 178.23 1dcb h GLU 221 N 0.79 0.93 -0.27 2.24 9.09 -1.95 -0.18 114.58 125.23 1dcb h GLU 221 Ca 0.55 -0.31 -0.07 0.00 0.05 0.00 0.00 59.36 59.58 1dcb h GLU 221 Cb 0.83 -0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 27.85 1dcb h GLU 221 CO -0.34 0.97 -0.10 1.96 0.05 0.00 0.00 179.01 181.55 1dcb h GLN 222 N 0.84 0.54 -0.04 1.06 4.20 -1.20 -3.01 115.11 117.49 1dcb h GLN 222 Ca 0.14 -0.22 -0.13 0.00 0.06 0.00 0.00 58.65 58.50 1dcb h GLN 222 Cb 0.60 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 1dcb h GLN 222 CO 0.04 0.77 -0.57 -0.24 -0.67 0.00 0.00 178.83 178.16 1dcb h VAL 223 N 0.28 1.39 -0.69 -0.54 3.04 -1.26 -2.87 116.25 115.61 1dcb h VAL 223 Ca 0.06 -1.93 0.14 0.00 -1.01 0.00 0.00 66.70 63.97 1dcb h VAL 223 Cb 0.59 1.99 -0.10 0.00 -2.01 0.00 0.00 31.29 31.77 1dcb h VAL 223 CO 0.03 0.56 0.16 -0.07 -1.01 0.00 0.00 177.57 177.25 1dcb h LEU 224 N 0.10 0.02 -2.17 3.16 3.38 -0.93 -0.12 115.31 118.76 1dcb h LEU 224 Ca -0.00 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1dcb h LEU 224 Cb 1.04 0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1dcb h LEU 224 CO 0.08 -0.01 -0.03 0.11 0.09 0.00 0.00 178.44 178.68 1dcb h LYS 225 N 0.28 0.00 -0.26 1.13 1.57 -1.38 -2.01 116.57 115.90 1dcb h LYS 225 Ca 0.38 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.08 1dcb h LYS 225 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1dcb h LYS 225 CO -0.47 0.03 -0.14 0.74 -0.57 0.00 0.00 179.45 179.05 1dcb h PHE 226 N 0.00 0.63 0.00 -1.35 -1.00 -1.05 -3.09 116.94 111.09 1dcb h PHE 226 Ca -0.00 -0.16 0.00 0.00 2.81 0.00 0.00 57.97 60.62 1dcb h PHE 226 Cb 0.07 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.49 1dcb h PHE 226 CO 0.00 0.81 0.00 0.54 -1.61 0.00 0.00 178.31 178.05 1dcb n ARG 227 N -4.46 0.11 0.00 1.51 1.74 -0.76 -1.95 116.66 112.85 1dcb n ARG 227 Ca -0.04 0.21 0.12 0.00 -0.77 0.00 0.00 57.85 57.38 1dcb n ARG 227 Cb 0.36 -1.50 0.23 0.00 -1.02 0.00 0.00 32.46 30.53 1dcb n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1dcb n LYS 228 N -1.28 1.14 -1.53 5.56 5.02 -1.17 -4.45 118.16 121.45 1dcb n LYS 228 Ca 0.04 -0.81 -0.30 0.00 -2.02 0.00 0.00 58.31 55.21 1dcb n LYS 228 Cb 0.06 -1.48 0.08 0.00 -0.02 0.00 0.00 35.03 33.67 1dcb n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1dcb s LEU 229 N -2.42 2.74 0.00 -0.35 1.02 -0.82 -4.86 118.68 113.99 1dcb s LEU 229 Ca 0.23 1.42 0.07 0.00 0.02 0.00 0.00 54.13 55.87 1dcb s LEU 229 Cb 0.19 -4.09 -0.02 0.00 0.02 0.00 0.00 46.19 42.29 1dcb s LEU 229 CO 0.51 -1.87 -0.21 0.20 0.02 0.00 0.00 176.35 175.01 1dcb s ASN 230 N -3.83 2.43 0.10 2.29 0.02 0.13 0.86 114.94 116.93 1dcb s ASN 230 Ca 0.60 -0.41 -0.07 0.00 -1.02 0.00 0.00 52.86 51.96 1dcb s ASN 230 Cb -0.15 -0.25 -0.19 0.00 0.02 0.00 0.00 41.25 40.68 1dcb s ASN 230 CO 0.55 0.23 1.21 -0.26 0.02 0.00 0.00 177.10 178.85 1dcb h PHE 231 N 5.42 0.69 -4.14 2.20 0.04 -1.00 -3.36 116.94 116.79 1dcb h PHE 231 Ca -0.40 -0.42 -0.49 0.00 2.80 0.00 0.00 57.97 59.46 1dcb h PHE 231 Cb 1.14 -0.06 0.14 0.00 2.20 0.00 0.00 35.95 39.37 1dcb h PHE 231 CO 0.42 1.27 0.27 0.54 -0.60 0.00 0.00 178.31 180.21 1dcb s ASN 232 N -7.19 3.76 0.45 2.17 4.22 -1.26 -4.41 114.94 112.68 1dcb s ASN 232 Ca -0.06 1.51 -0.09 0.00 -2.14 0.00 0.00 52.86 52.08 1dcb s ASN 232 Cb 0.08 -2.20 -0.05 0.00 1.28 0.00 0.00 41.25 40.35 1dcb s ASN 232 CO 0.89 -2.46 0.79 -0.83 -2.04 0.00 0.00 177.10 173.45 1dcb s GLY 233 N -3.48 1.76 0.05 0.45 0.00 -1.26 -0.96 107.32 103.87 1dcb s GLY 233 Ca 0.63 -0.31 -0.31 0.00 0.00 0.00 0.00 44.72 44.73 1dcb s GLY 233 CO 0.56 -0.12 1.91 -2.21 0.00 0.00 0.00 173.10 173.24 1dcb n GLU 234 N -1.76 2.73 -0.07 2.90 2.13 -1.26 -1.97 120.64 123.34 1dcb n GLU 234 Ca 0.02 1.00 0.00 0.00 0.66 0.00 0.00 57.16 58.84 1dcb n GLU 234 Cb 0.54 -2.91 0.00 0.00 0.27 0.00 0.00 31.44 29.34 1dcb n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1dcb n GLY 235 N 4.39 0.96 3.49 8.31 0.00 -1.26 -5.09 105.19 116.00 1dcb n GLY 235 Ca 0.20 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1dcb n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dcb s GLU 236 N -0.67 1.77 0.41 1.61 2.02 -0.83 -5.09 118.70 117.92 1dcb s GLU 236 Ca 0.00 -1.61 -0.23 0.00 0.02 0.00 0.00 54.97 53.15 1dcb s GLU 236 Cb 0.00 -1.89 -0.12 0.00 0.10 0.00 0.00 34.13 32.22 1dcb s GLU 236 CO 0.00 0.36 0.70 -2.30 0.02 0.00 0.00 175.26 174.04 1dcb n PRO 237 N -0.37 0.79 -2.74 0.39 -0.02 -1.26 -4.87 135.00 126.91 1dcb n PRO 237 Ca -0.08 0.29 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 1dcb n PRO 237 Cb 0.58 -1.65 -0.03 0.00 -0.02 0.00 0.00 33.50 32.38 1dcb n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1dcb s GLU 238 N -1.70 4.33 -0.29 -0.52 2.12 -1.26 -4.78 118.70 116.60 1dcb s GLU 238 Ca 0.63 1.26 0.02 0.00 0.36 0.00 0.00 54.97 57.24 1dcb s GLU 238 Cb -0.60 -3.59 0.08 0.00 0.26 0.00 0.00 34.13 30.28 1dcb s GLU 238 CO 0.57 -0.42 -0.00 -2.00 -0.54 0.00 0.00 175.26 172.87 1dcb s GLU 239 N 2.45 1.58 0.46 4.30 2.12 -1.26 -5.07 118.70 123.29 1dcb s GLU 239 Ca 0.44 -1.45 -0.25 0.00 0.36 0.00 0.00 54.97 54.07 1dcb s GLU 239 Cb -0.17 -2.84 -0.08 0.00 0.26 0.00 0.00 34.13 31.31 1dcb s GLU 239 CO 0.12 -0.78 1.36 -0.51 -0.54 0.00 0.00 175.26 174.91 1dcb s LEU 240 N 1.15 4.09 -0.74 2.70 1.43 -1.26 -0.44 118.68 125.61 1dcb s LEU 240 Ca 0.02 2.77 -0.21 0.00 -1.03 0.00 0.00 54.13 55.69 1dcb s LEU 240 Cb -0.19 -4.01 0.09 0.00 0.03 0.00 0.00 46.19 42.11 1dcb s LEU 240 CO -0.09 -1.14 0.98 -0.32 0.23 0.00 0.00 176.35 176.01 1dcb s MET 241 N -2.49 3.26 0.01 1.70 -2.45 0.25 -4.60 119.30 114.98 1dcb s MET 241 Ca 0.62 -1.21 -0.14 0.00 -1.25 0.00 0.00 55.69 53.71 1dcb s MET 241 Cb -0.40 -4.46 0.02 0.00 1.25 0.00 0.00 34.83 31.23 1dcb s MET 241 CO 0.51 -1.77 0.30 0.14 1.05 0.00 0.00 175.02 175.26 1dcb s VAL 242 N 3.43 0.07 -1.33 10.11 -7.23 -1.26 -4.41 120.40 119.78 1dcb s VAL 242 Ca 0.24 -0.57 -0.03 0.00 -1.81 0.00 0.00 61.98 59.81 1dcb s VAL 242 Cb -0.14 -0.76 0.02 0.00 0.56 0.00 0.00 36.38 36.06 1dcb s VAL 242 CO 0.03 -0.32 0.85 0.47 -0.31 0.00 0.00 175.10 175.83 1dcb n ASP 243 N 0.96 -2.41 -2.36 4.85 8.00 -0.34 -4.88 116.55 120.38 1dcb n ASP 243 Ca -0.20 -0.75 -0.25 0.00 0.71 0.00 0.00 54.79 54.30 1dcb n ASP 243 Cb 0.57 -4.34 -0.04 0.00 -0.02 0.00 0.00 41.12 37.29 1dcb n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1dcb n ASN 244 N -3.03 6.48 -4.31 -2.24 6.94 -1.10 -4.92 115.26 113.08 1dcb n ASN 244 Ca -0.21 -3.18 -0.26 0.00 -0.02 0.00 0.00 54.58 50.91 1dcb n ASN 244 Cb 0.64 -1.20 -0.13 0.00 -2.36 0.00 0.00 39.78 36.73 1dcb n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1dcb s TRP 245 N -1.73 1.96 -0.11 -2.53 1.48 -1.26 -4.61 118.94 112.14 1dcb s TRP 245 Ca 0.54 -0.40 -0.10 0.00 -1.06 0.00 0.00 56.10 55.08 1dcb s TRP 245 Cb 0.36 -1.10 -0.05 0.00 -1.16 0.00 0.00 33.47 31.52 1dcb s TRP 245 CO -0.17 0.21 0.22 0.50 -4.06 0.00 0.00 176.95 173.64 1dcb s ARG 246 N -1.72 3.78 0.68 3.25 3.52 -1.26 -4.98 118.95 122.22 1dcb s ARG 246 Ca 0.09 0.01 -0.16 0.00 -0.13 0.00 0.00 55.73 55.53 1dcb s ARG 246 Cb -0.10 -3.27 0.01 0.00 -1.56 0.00 0.00 34.95 30.04 1dcb s ARG 246 CO 0.04 0.61 1.21 -1.25 -0.81 0.00 0.00 175.30 175.09 1dcb s PRO 247 N -0.60 2.45 0.40 5.12 0.04 -1.26 -4.69 135.00 136.46 1dcb s PRO 247 Ca 0.16 1.77 -0.27 0.00 0.04 0.00 0.00 61.00 62.70 1dcb s PRO 247 Cb -0.13 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 1dcb s PRO 247 CO 0.05 -1.60 1.46 0.00 0.04 0.00 0.00 177.00 176.95 1dcb s ALA 248 N -1.86 3.46 0.33 8.56 0.00 -1.26 -4.46 121.76 126.53 1dcb s ALA 248 Ca 0.75 1.53 0.08 0.00 0.00 0.00 0.00 51.96 54.32 1dcb s ALA 248 Cb -0.29 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.19 1dcb s ALA 248 CO 0.41 -1.10 0.20 -0.65 0.00 0.00 0.00 175.76 174.62 1dcb s GLN 249 N -2.21 2.53 0.28 0.00 -1.52 0.37 -4.94 119.66 114.17 1dcb s GLN 249 Ca 0.55 -1.42 -0.30 0.00 -1.95 0.00 0.00 55.36 52.25 1dcb s GLN 249 Cb -0.45 -2.31 -0.11 0.00 -0.22 0.00 0.00 33.01 29.91 1dcb s GLN 249 CO 0.61 0.13 1.57 -2.14 -0.25 0.00 0.00 175.29 175.21 1dcb s PRO 250 N -3.90 4.15 0.27 2.91 0.02 -1.26 -4.53 135.00 132.66 1dcb s PRO 250 Ca 0.38 2.53 0.12 0.00 0.02 0.00 0.00 61.00 64.05 1dcb s PRO 250 Cb -0.04 -3.04 0.32 0.00 0.02 0.00 0.00 34.50 31.76 1dcb s PRO 250 CO 0.24 -0.60 1.58 1.25 -0.33 0.00 0.00 177.00 179.14 1dcb h LEU 251 N 4.99 0.00 -3.66 -5.54 5.85 -1.94 -3.43 115.31 111.57 1dcb h LEU 251 Ca -0.47 0.00 -0.51 0.00 0.84 0.00 0.00 57.88 57.74 1dcb h LEU 251 Cb 1.22 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.26 1dcb h LEU 251 CO 0.80 0.63 -0.97 0.29 -0.34 0.00 0.00 178.44 178.84 1dcb n LYS 252 N -3.68 -0.81 0.00 1.25 5.02 -1.26 -2.69 118.16 115.98 1dcb n LYS 252 Ca -0.01 0.38 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 1dcb n LYS 252 Cb 0.65 -2.97 0.00 0.00 -0.02 0.00 0.00 35.03 32.68 1dcb n LYS 252 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1dcb n ASN 253 N -2.37 0.00 -4.40 4.39 2.04 -1.26 -5.01 115.26 108.65 1dcb n ASN 253 Ca -0.15 0.00 -0.37 0.00 -0.44 0.00 0.00 54.58 53.62 1dcb n ASN 253 Cb 0.60 0.00 0.05 0.00 -2.53 0.00 0.00 39.78 37.90 1dcb n ASN 253 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1dcb n ARG 254 N 0.00 0.30 -5.20 -3.83 1.74 -1.10 -5.00 116.66 103.56 1dcb n ARG 254 Ca 0.00 0.13 -0.31 0.00 -0.77 0.00 0.00 57.85 56.89 1dcb n ARG 254 Cb 0.00 -1.62 -0.15 0.00 -1.02 0.00 0.00 32.46 29.67 1dcb n ARG 254 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1dcb s GLN 255 N -2.27 2.29 -0.26 5.56 0.74 -1.26 -5.00 119.66 119.46 1dcb s GLN 255 Ca 0.64 -0.87 -0.13 0.00 0.05 0.00 0.00 55.36 55.04 1dcb s GLN 255 Cb -0.39 -2.15 -0.04 0.00 1.10 0.00 0.00 33.01 31.53 1dcb s GLN 255 CO 0.60 0.54 0.29 0.42 -0.55 0.00 0.00 175.29 176.58 1dcb s ILE 256 N -0.54 5.25 0.15 -2.34 1.01 -1.26 -4.72 121.20 118.74 1dcb s ILE 256 Ca 0.08 0.40 0.02 0.00 0.00 0.00 0.00 60.65 61.14 1dcb s ILE 256 Cb -0.11 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 1dcb s ILE 256 CO 0.00 0.22 0.29 -0.54 0.00 0.00 0.00 174.94 174.91 1dcb s LYS 257 N 1.77 3.45 0.09 2.79 1.02 -0.53 -1.01 119.74 127.32 1dcb s LYS 257 Ca 0.12 -0.57 0.10 0.00 0.02 0.00 0.00 55.97 55.64 1dcb s LYS 257 Cb -0.15 -2.96 -0.03 0.00 -0.52 0.00 0.00 37.83 34.16 1dcb s LYS 257 CO 0.09 0.51 -0.26 0.00 -0.92 0.00 0.00 175.35 174.78 1dcb s ALA 258 N -1.74 2.28 -2.49 5.17 0.00 0.71 -0.32 121.76 125.37 1dcb s ALA 258 Ca 0.35 -1.36 0.24 0.00 0.00 0.00 0.00 51.96 51.19 1dcb s ALA 258 Cb -0.11 -0.41 0.76 0.00 0.00 0.00 0.00 23.12 23.36 1dcb s ALA 258 CO 0.29 0.52 1.58 -1.13 0.00 0.00 0.00 175.76 177.01 1dcb n SER 259 N 1.31 1.96 0.00 0.00 3.41 0.06 -0.75 113.62 119.62 1dcb n SER 259 Ca -0.18 -1.69 0.00 0.00 -0.26 0.00 0.00 58.87 56.74 1dcb n SER 259 Cb 0.53 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1dcb n SER 259 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10