#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlo s SER 2 N 0.00 4.75 -0.02 1.61 0.01 -1.26 -5.12 113.70 113.68 2dlo s SER 2 Ca 0.00 0.15 -0.29 0.00 1.31 0.00 0.00 55.95 57.12 2dlo s SER 2 Cb 0.00 -0.78 0.09 0.00 0.21 0.00 0.00 66.02 65.54 2dlo s SER 2 CO 0.00 -1.59 0.78 -0.94 0.41 0.00 0.00 173.24 171.90 2dlo s SER 3 N -4.56 -0.51 -0.11 2.44 1.04 -1.26 -5.16 113.70 105.57 2dlo s SER 3 Ca 0.61 0.35 0.00 0.00 0.48 0.00 0.00 55.95 57.39 2dlo s SER 3 Cb -0.09 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.47 2dlo s SER 3 CO 0.43 -0.63 -0.12 -0.83 0.98 0.00 0.00 173.24 173.08 2dlo s GLY 4 N -1.76 1.57 -0.32 7.32 0.00 -1.26 -5.06 107.32 107.82 2dlo s GLY 4 Ca -0.03 -0.89 -0.28 0.00 0.00 0.00 0.00 44.72 43.52 2dlo s GLY 4 CO -0.01 -0.31 2.19 -0.45 0.00 0.00 0.00 173.10 174.53 2dlo s SER 5 N 0.08 5.25 -0.09 1.64 0.15 -1.26 -4.93 113.70 114.55 2dlo s SER 5 Ca -0.05 1.55 -0.07 0.00 0.70 0.00 0.00 55.95 58.09 2dlo s SER 5 Cb -0.14 -2.51 0.03 0.00 -1.71 0.00 0.00 66.02 61.68 2dlo s SER 5 CO 0.04 -2.17 0.22 -0.94 1.20 0.00 0.00 173.24 171.59 2dlo s SER 6 N 8.94 -0.23 -0.36 5.45 1.04 -1.26 -5.12 113.70 122.16 2dlo s SER 6 Ca 0.96 0.46 0.03 0.00 0.48 0.00 0.00 55.95 57.88 2dlo s SER 6 Cb -0.27 0.42 0.19 0.00 0.10 0.00 0.00 66.02 66.46 2dlo s SER 6 CO 0.32 -0.11 0.72 -0.83 0.98 0.00 0.00 173.24 174.32 2dlo s GLY 7 N 0.51 -1.30 -0.08 7.32 0.00 -1.26 -5.15 107.32 107.36 2dlo s GLY 7 Ca -0.03 0.68 -0.08 0.00 0.00 0.00 0.00 44.72 45.29 2dlo s GLY 7 CO -0.03 3.81 0.23 1.85 0.00 0.00 0.00 173.10 178.96 2dlo s GLU 8 N 2.13 0.31 0.00 2.90 2.12 -1.26 -5.10 118.70 119.80 2dlo s GLU 8 Ca 0.15 0.25 0.00 0.00 0.36 0.00 0.00 54.97 55.73 2dlo s GLU 8 Cb -0.04 0.15 0.00 0.00 0.26 0.00 0.00 34.13 34.50 2dlo s GLU 8 CO -0.13 -0.05 0.00 0.41 -0.54 0.00 0.00 175.26 174.95 2dlo n GLY 9 N 2.77 -0.18 3.65 -1.50 0.00 -1.26 -5.07 105.19 103.60 2dlo n GLY 9 Ca -0.14 -1.18 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 2dlo n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dlo s TYR 11 N -0.98 3.08 -0.12 0.00 5.04 -1.26 -5.13 117.35 117.98 2dlo s TYR 11 Ca 0.16 -0.12 -0.28 0.00 -2.44 0.00 0.00 57.07 54.39 2dlo s TYR 11 Cb -0.11 -2.18 0.07 0.00 0.35 0.00 0.00 41.96 40.08 2dlo s TYR 11 CO 0.06 -0.22 0.68 0.54 -1.34 0.00 0.00 175.55 175.27 2dlo s VAL 12 N -2.33 0.00 0.02 3.14 0.11 -1.26 -5.18 120.40 114.90 2dlo s VAL 12 Ca 0.48 -0.01 -0.18 0.00 -2.93 0.00 0.00 61.98 59.34 2dlo s VAL 12 Cb -0.10 -0.98 0.06 0.00 -1.53 0.00 0.00 36.38 33.83 2dlo s VAL 12 CO 0.33 -0.01 0.80 0.00 -3.33 0.00 0.00 175.10 172.90 2dlo n ALA 13 N 1.49 -2.23 -0.89 1.54 0.00 -1.26 -5.01 120.51 114.14 2dlo n ALA 13 Ca -0.17 -0.57 -0.10 0.00 0.00 0.00 0.00 53.44 52.60 2dlo n ALA 13 Cb 0.56 0.17 -0.09 0.00 0.00 0.00 0.00 19.45 20.09 2dlo n ALA 13 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2dlo n THR 14 N -0.58 2.72 -4.87 0.00 5.66 -1.26 -4.85 114.28 111.10 2dlo n THR 14 Ca 0.02 -1.37 -0.33 0.00 -3.05 0.00 0.00 64.05 59.33 2dlo n THR 14 Cb 0.38 -1.77 -0.14 0.00 -1.55 0.00 0.00 70.33 67.26 2dlo n THR 14 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 2dlo s LEU 15 N -0.34 2.66 0.45 1.09 0.05 -1.26 -5.12 118.68 116.20 2dlo s LEU 15 Ca 0.44 -0.29 -0.21 0.00 0.05 0.00 0.00 54.13 54.12 2dlo s LEU 15 Cb 0.23 -1.56 -0.10 0.00 -2.05 0.00 0.00 46.19 42.70 2dlo s LEU 15 CO -0.02 0.25 0.98 -1.61 -0.55 0.00 0.00 176.35 175.39 2dlo s GLU 16 N -0.14 4.09 -0.18 1.48 2.02 -1.26 -4.85 118.70 119.86 2dlo s GLU 16 Ca -0.01 1.21 -0.07 0.00 0.02 0.00 0.00 54.97 56.12 2dlo s GLU 16 Cb -0.14 -2.17 -0.04 0.00 0.10 0.00 0.00 34.13 31.89 2dlo s GLU 16 CO 0.03 -0.16 0.04 0.15 0.02 0.00 0.00 175.26 175.34 2dlo s LYS 17 N -3.16 3.91 0.21 1.61 1.02 -1.26 -1.47 119.74 120.58 2dlo s LYS 17 Ca 0.63 -0.38 -0.32 0.00 0.02 0.00 0.00 55.97 55.92 2dlo s LYS 17 Cb -0.12 -3.15 -0.14 0.00 -0.52 0.00 0.00 37.83 33.90 2dlo s LYS 17 CO 0.16 0.26 1.44 0.00 -0.92 0.00 0.00 175.35 176.29 2dlo n ALA 19 N 2.34 3.87 0.00 0.00 0.00 -1.01 -1.94 120.51 123.77 2dlo n ALA 19 Ca 0.14 -1.52 0.00 0.00 0.00 0.00 0.00 53.44 52.05 2dlo n ALA 19 Cb 0.30 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2dlo n ALA 19 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2dlo n THR 20 N 0.03 0.00 0.18 0.00 -1.04 -1.26 -4.83 114.28 107.36 2dlo n THR 20 Ca 0.27 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.30 2dlo n THR 20 Cb 1.04 -0.73 -0.01 0.00 -1.82 0.00 0.00 70.33 68.81 2dlo n THR 20 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2dlo n SER 22 N -0.59 -3.11 -4.12 0.00 7.64 -0.82 -5.04 113.62 107.58 2dlo n SER 22 Ca 0.01 -0.53 -0.19 0.00 1.01 0.00 0.00 58.87 59.18 2dlo n SER 22 Cb 0.08 -4.30 -0.13 0.00 -1.01 0.00 0.00 64.21 58.84 2dlo n SER 22 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2dlo s GLN 23 N -4.83 0.86 -0.08 1.43 -1.52 -1.24 -4.89 119.66 109.38 2dlo s GLN 23 Ca 0.11 -0.73 -0.30 0.00 -1.95 0.00 0.00 55.36 52.50 2dlo s GLN 23 Cb -0.01 -0.84 -0.04 0.00 -0.22 0.00 0.00 33.01 31.89 2dlo s GLN 23 CO 0.60 0.20 1.51 -1.25 -0.25 0.00 0.00 175.29 176.10 2dlo s PRO 24 N -1.13 4.21 0.11 2.91 0.04 -1.26 -0.05 135.00 139.82 2dlo s PRO 24 Ca 0.00 2.01 -0.30 0.00 0.04 0.00 0.00 61.00 62.75 2dlo s PRO 24 Cb -0.08 -3.88 -0.06 0.00 0.04 0.00 0.00 34.50 30.52 2dlo s PRO 24 CO 0.01 -0.78 1.14 0.42 0.04 0.00 0.00 177.00 177.84 2dlo s ILE 25 N 3.72 4.01 0.00 0.56 1.01 -0.55 -4.89 121.20 125.06 2dlo s ILE 25 Ca 0.67 1.55 0.00 0.00 0.00 0.00 0.00 60.65 62.87 2dlo s ILE 25 Cb -0.30 -3.99 0.00 0.00 0.01 0.00 0.00 42.46 38.18 2dlo s ILE 25 CO 0.25 0.18 0.00 0.18 0.00 0.00 0.00 174.94 175.55 2dlo n LEU 26 N 3.26 1.40 0.00 2.97 4.77 -1.26 -4.61 117.00 123.52 2dlo n LEU 26 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2dlo n LEU 26 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2dlo n LEU 26 CO 0.55 0.23 0.24 0.47 -1.33 0.00 0.00 177.39 177.55 2dlo n ASP 27 N -1.94 0.00 -3.93 -1.43 8.00 -1.26 -4.94 116.55 111.05 2dlo n ASP 27 Ca 0.00 0.64 -0.11 0.00 0.71 0.00 0.00 54.79 56.03 2dlo n ASP 27 Cb 0.27 -0.37 -0.13 0.00 -0.02 0.00 0.00 41.12 40.87 2dlo n ASP 27 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2dlo s ARG 28 N -1.69 0.17 -0.29 -1.24 3.52 -1.26 -5.14 118.95 113.02 2dlo s ARG 28 Ca 0.00 -0.27 -0.07 0.00 -0.13 0.00 0.00 55.73 55.26 2dlo s ARG 28 Cb 0.00 -0.00 0.01 0.00 -1.56 0.00 0.00 34.95 33.39 2dlo s ARG 28 CO 0.00 -0.01 0.07 0.42 -0.81 0.00 0.00 175.30 174.97 2dlo s ILE 29 N -0.61 3.93 -0.40 4.11 1.01 -1.26 -4.50 121.20 123.49 2dlo s ILE 29 Ca -0.06 -0.66 -0.13 0.00 0.00 0.00 0.00 60.65 59.80 2dlo s ILE 29 Cb -0.04 -3.01 0.03 0.00 0.01 0.00 0.00 42.46 39.45 2dlo s ILE 29 CO -0.00 0.11 0.26 -0.22 0.00 0.00 0.00 174.94 175.09 2dlo s LEU 30 N 1.50 4.95 -0.11 2.97 0.20 -0.42 -4.97 118.68 122.80 2dlo s LEU 30 Ca 0.03 -1.01 -0.30 0.00 0.69 0.00 0.00 54.13 53.55 2dlo s LEU 30 Cb -0.17 -2.09 -0.01 0.00 -0.43 0.00 0.00 46.19 43.49 2dlo s LEU 30 CO 0.02 -0.44 1.04 -0.13 -0.29 0.00 0.00 176.35 176.56 2dlo s ARG 31 N 1.60 4.40 -0.18 1.98 0.52 -1.26 -0.71 118.95 125.29 2dlo s ARG 31 Ca 0.03 1.44 -0.12 0.00 -0.52 0.00 0.00 55.73 56.56 2dlo s ARG 31 Cb -0.20 -3.56 0.06 0.00 0.52 0.00 0.00 34.95 31.78 2dlo s ARG 31 CO 0.08 -0.37 0.46 0.00 0.02 0.00 0.00 175.30 175.49 2dlo s ALA 32 N 2.16 -1.18 -1.64 2.13 0.00 -0.25 -4.89 121.76 118.09 2dlo s ALA 32 Ca 0.49 1.59 0.00 0.00 0.00 0.00 0.00 51.96 54.04 2dlo s ALA 32 Cb -0.19 -0.95 0.00 0.00 0.00 0.00 0.00 23.12 21.98 2dlo s ALA 32 CO 0.18 -0.27 0.00 -1.33 0.00 0.00 0.00 175.76 174.34 2dlo n MET 33 N 3.89 -1.42 0.00 0.00 2.81 -1.26 -2.18 117.12 118.96 2dlo n MET 33 Ca -0.20 0.94 0.00 0.00 -1.81 0.00 0.00 57.70 56.63 2dlo n MET 33 Cb 0.56 -5.40 0.00 0.00 -0.71 0.00 0.00 33.22 27.67 2dlo n MET 33 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dlo n GLY 34 N -0.96 2.18 3.97 3.03 0.00 -1.26 -4.98 105.19 107.17 2dlo n GLY 34 Ca -0.21 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 2dlo n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dlo s LYS 35 N 0.00 1.08 -0.12 1.61 1.02 -0.93 -5.07 119.74 117.34 2dlo s LYS 35 Ca 0.00 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.15 2dlo s LYS 35 Cb 0.00 -2.10 -0.02 0.00 -0.52 0.00 0.00 37.83 35.20 2dlo s LYS 35 CO 0.00 -1.98 -0.13 0.00 -0.92 0.00 0.00 175.35 172.32 2dlo s ALA 36 N -3.52 2.64 0.17 5.17 0.00 -1.26 -1.09 121.76 123.87 2dlo s ALA 36 Ca 0.71 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.78 2dlo s ALA 36 Cb -0.04 -1.19 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 2dlo s ALA 36 CO 0.49 0.30 0.04 0.71 0.00 0.00 0.00 175.76 177.30 2dlo s TYR 37 N 0.18 1.13 0.54 0.00 1.51 0.12 -2.39 117.35 118.43 2dlo s TYR 37 Ca -0.07 -1.15 -0.18 0.00 -1.01 0.00 0.00 57.07 54.65 2dlo s TYR 37 Cb -0.15 -0.63 -0.06 0.00 -0.11 0.00 0.00 41.96 41.00 2dlo s TYR 37 CO 0.05 -0.37 1.07 -1.01 -1.11 0.00 0.00 175.55 174.17 2dlo s HIS 38 N -3.85 2.91 -2.00 2.71 3.76 -1.26 -1.30 115.29 116.26 2dlo s HIS 38 Ca 0.27 1.55 0.10 0.00 -0.15 0.00 0.00 55.06 56.83 2dlo s HIS 38 Cb 0.07 -3.10 0.59 0.00 1.11 0.00 0.00 32.58 31.25 2dlo s HIS 38 CO 0.05 -1.10 1.03 -0.35 -0.85 0.00 0.00 174.74 173.52 2dlo n PRO 39 N -1.42 0.49 0.00 8.40 -0.04 -1.26 -2.93 135.00 138.24 2dlo n PRO 39 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2dlo n PRO 39 Cb 0.52 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 2dlo n PRO 39 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dlo n GLY 40 N -0.02 0.00 0.12 0.55 0.00 -1.26 -4.82 105.19 99.76 2dlo n GLY 40 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 2dlo n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dlo n PHE 42 N -4.66 1.39 -3.98 0.00 7.35 -1.18 -4.88 117.46 111.49 2dlo n PHE 42 Ca -0.06 0.21 -0.10 0.00 -0.76 0.00 0.00 57.45 56.75 2dlo n PHE 42 Cb 0.28 -2.55 -0.07 0.00 0.35 0.00 0.00 39.48 37.49 2dlo n PHE 42 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2dlo s THR 43 N 9.24 0.05 0.93 -2.13 -4.23 -1.26 -2.82 115.64 115.41 2dlo s THR 43 Ca 1.10 -1.43 -0.12 0.00 -1.18 0.00 0.00 61.69 60.07 2dlo s THR 43 Cb -0.67 -1.94 0.15 0.00 1.34 0.00 0.00 72.50 71.38 2dlo s THR 43 CO 0.41 -0.23 1.09 0.00 -0.54 0.00 0.00 174.62 175.35 2dlo n VAL 45 N -4.02 0.25 0.00 0.00 0.24 -1.21 -3.45 118.33 110.14 2dlo n VAL 45 Ca 0.07 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 2dlo n VAL 45 Cb 0.55 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.79 2dlo n VAL 45 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2dlo n VAL 46 N -2.41 0.00 0.20 3.34 0.31 -1.26 -4.64 118.33 113.87 2dlo n VAL 46 Ca -0.04 0.28 0.09 0.00 -0.01 0.00 0.00 64.34 64.67 2dlo n VAL 46 Cb 0.58 -1.18 0.30 0.00 -0.91 0.00 0.00 33.84 32.64 2dlo n VAL 46 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dlo n HIS 48 N -3.27 -1.68 -4.02 0.00 -0.00 -1.22 -4.96 115.22 100.06 2dlo n HIS 48 Ca 0.01 0.69 -0.25 0.00 -0.00 0.00 0.00 57.72 58.17 2dlo n HIS 48 Cb 0.52 -4.17 -0.04 0.00 -0.00 0.00 0.00 29.99 26.30 2dlo n HIS 48 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.34 175.36 2dlo s ARG 49 N -4.80 3.16 -0.50 -0.41 1.70 -1.26 -4.64 118.95 112.20 2dlo s ARG 49 Ca 0.07 -0.78 -0.28 0.00 -0.47 0.00 0.00 55.73 54.28 2dlo s ARG 49 Cb -0.01 -2.78 0.00 0.00 -0.57 0.00 0.00 34.95 31.59 2dlo s ARG 49 CO 0.55 0.48 1.55 0.20 -1.08 0.00 0.00 175.30 177.00 2dlo s GLY 50 N -3.33 0.80 -0.24 3.88 0.00 -1.26 -1.32 107.32 105.85 2dlo s GLY 50 Ca 0.33 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.63 2dlo s GLY 50 CO 0.26 2.97 1.72 1.04 0.00 0.00 0.00 173.10 179.09 2dlo n LEU 51 N 10.06 5.54 -4.42 0.66 4.77 -1.13 -4.81 117.00 127.68 2dlo n LEU 51 Ca 0.16 -2.83 -0.44 0.00 -0.03 0.00 0.00 56.01 52.86 2dlo n LEU 51 Cb 0.49 -0.87 -0.03 0.00 -2.33 0.00 0.00 43.42 40.69 2dlo n LEU 51 CO 0.70 0.98 0.78 1.51 -1.33 0.00 0.00 177.39 180.04 2dlo s ASP 52 N 0.19 6.56 0.00 -1.43 -4.77 -1.26 -3.81 116.67 112.14 2dlo s ASP 52 Ca 0.26 -2.00 0.00 0.00 -3.30 0.00 0.00 52.55 47.51 2dlo s ASP 52 Cb 0.21 -2.35 0.00 0.00 -1.09 0.00 0.00 42.92 39.69 2dlo s ASP 52 CO 0.02 -1.01 0.00 0.61 0.70 0.00 0.00 175.17 175.49 2dlo n GLY 53 N 5.16 1.44 3.09 2.12 0.00 -1.26 -5.12 105.19 110.62 2dlo n GLY 53 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.07 2dlo n GLY 53 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dlo s ILE 54 N -2.00 0.47 0.44 -0.61 -4.36 -1.25 -5.15 121.20 108.75 2dlo s ILE 54 Ca 0.00 -1.47 -0.24 0.00 -0.26 0.00 0.00 60.65 58.69 2dlo s ILE 54 Cb 0.00 -1.07 -0.08 0.00 1.25 0.00 0.00 42.46 42.56 2dlo s ILE 54 CO 0.00 -0.67 1.17 -2.16 0.24 0.00 0.00 174.94 173.52 2dlo s PRO 55 N -2.72 3.84 0.37 0.37 0.04 -1.26 -4.96 135.00 130.67 2dlo s PRO 55 Ca -0.01 1.81 -0.07 0.00 0.04 0.00 0.00 61.00 62.77 2dlo s PRO 55 Cb -0.02 -2.49 0.02 0.00 0.04 0.00 0.00 34.50 32.06 2dlo s PRO 55 CO -0.03 -0.49 0.60 -0.59 0.04 0.00 0.00 177.00 176.52 2dlo s PHE 56 N -1.50 0.76 -0.14 0.56 -0.12 -1.26 -3.99 117.98 112.29 2dlo s PHE 56 Ca 0.62 -1.15 -0.16 0.00 -0.05 0.00 0.00 56.93 56.19 2dlo s PHE 56 Cb -0.29 0.25 0.04 0.00 -0.63 0.00 0.00 43.02 42.39 2dlo s PHE 56 CO 0.36 -1.32 0.43 -0.08 -0.05 0.00 0.00 175.22 174.57 2dlo s THR 57 N -2.69 0.01 0.36 -4.49 -1.32 -1.21 -4.90 115.64 101.40 2dlo s THR 57 Ca 0.25 -0.07 0.07 0.00 -1.21 0.00 0.00 61.69 60.73 2dlo s THR 57 Cb -0.02 -0.63 -0.00 0.00 -1.51 0.00 0.00 72.50 70.33 2dlo s THR 57 CO 0.18 -0.04 0.50 0.68 -2.21 0.00 0.00 174.62 173.72 2dlo s VAL 58 N -0.08 3.74 0.38 5.08 -7.23 -1.26 -0.07 120.40 120.95 2dlo s VAL 58 Ca -0.03 -1.01 0.06 0.00 -1.81 0.00 0.00 61.98 59.19 2dlo s VAL 58 Cb -0.03 -3.28 -0.07 0.00 0.56 0.00 0.00 36.38 33.55 2dlo s VAL 58 CO 0.02 -0.11 0.03 -0.62 -0.31 0.00 0.00 175.10 174.10 2dlo s ASP 59 N -4.22 3.34 0.33 4.85 2.15 -1.14 -4.87 116.67 117.11 2dlo s ASP 59 Ca 0.48 -1.38 0.19 0.00 0.43 0.00 0.00 52.55 52.27 2dlo s ASP 59 Cb -0.10 -0.27 1.19 0.00 -0.30 0.00 0.00 42.92 43.45 2dlo s ASP 59 CO 0.32 -0.52 1.39 0.00 -0.17 0.00 0.00 175.17 176.19 2dlo n ALA 60 N -0.87 0.92 -0.66 3.66 0.00 -1.26 0.23 120.51 122.53 2dlo n ALA 60 Ca -0.04 0.89 -0.15 0.00 0.00 0.00 0.00 53.44 54.14 2dlo n ALA 60 Cb 0.67 -0.90 0.05 0.00 0.00 0.00 0.00 19.45 19.27 2dlo n ALA 60 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2dlo n THR 61 N -4.96 2.56 -3.72 0.00 -2.24 -1.26 -4.84 114.28 99.82 2dlo n THR 61 Ca 0.34 -1.42 -0.28 0.00 -2.27 0.00 0.00 64.05 60.41 2dlo n THR 61 Cb 1.15 -1.19 -0.06 0.00 -2.10 0.00 0.00 70.33 68.12 2dlo n THR 61 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2dlo n SER 62 N 0.23 -0.73 -4.32 3.42 2.88 0.61 -4.83 113.62 110.88 2dlo n SER 62 Ca 0.28 -0.90 -0.44 0.00 -1.33 0.00 0.00 58.87 56.48 2dlo n SER 62 Cb 0.69 -1.15 -0.07 0.00 -0.75 0.00 0.00 64.21 62.94 2dlo n SER 62 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2dlo s GLN 63 N -5.68 2.88 -0.40 -1.46 -0.21 -1.22 -4.79 119.66 108.78 2dlo s GLN 63 Ca 0.43 -1.57 -0.27 0.00 0.02 0.00 0.00 55.36 53.96 2dlo s GLN 63 Cb -0.25 -4.14 -0.05 0.00 1.00 0.00 0.00 33.01 29.57 2dlo s GLN 63 CO 0.73 -1.17 2.20 0.42 -2.12 0.00 0.00 175.29 175.35 2dlo s ILE 64 N 1.56 3.11 -0.37 1.08 1.01 -1.26 -2.88 121.20 123.45 2dlo s ILE 64 Ca 0.04 0.09 -0.09 0.00 0.00 0.00 0.00 60.65 60.68 2dlo s ILE 64 Cb -0.27 -3.21 0.04 0.00 0.01 0.00 0.00 42.46 39.03 2dlo s ILE 64 CO 0.04 -0.17 0.19 -1.00 0.00 0.00 0.00 174.94 173.99 2dlo s HIS 65 N 9.88 3.27 0.16 3.97 3.76 0.90 -3.28 115.29 133.94 2dlo s HIS 65 Ca 0.93 -1.21 -0.33 0.00 -0.15 0.00 0.00 55.06 54.30 2dlo s HIS 65 Cb -0.22 -2.49 -0.16 0.00 1.11 0.00 0.00 32.58 30.81 2dlo s HIS 65 CO 0.29 -0.71 1.08 0.00 -0.85 0.00 0.00 174.74 174.55 2dlo n ILE 67 N 1.29 -0.55 -0.33 0.00 2.08 -1.26 0.11 119.36 120.70 2dlo n ILE 67 Ca 0.16 2.06 0.19 0.00 0.56 0.00 0.00 62.75 65.72 2dlo n ILE 67 Cb 0.23 -2.59 0.37 0.00 -0.75 0.00 0.00 39.64 36.90 2dlo n ILE 67 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2dlo h GLU 68 N 0.00 0.07 0.04 0.38 4.39 -1.90 0.19 114.58 117.74 2dlo h GLU 68 Ca 0.17 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.87 2dlo h GLU 68 Cb 0.39 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2dlo h GLU 68 CO -0.82 0.04 -0.02 -0.44 -1.16 0.00 0.00 179.01 176.62 2dlo h ASP 69 N 0.07 -0.04 -0.84 1.42 5.19 0.46 -3.32 116.42 119.36 2dlo h ASP 69 Ca 0.65 0.00 0.12 0.00 -0.62 0.00 0.00 57.03 57.18 2dlo h ASP 69 Cb 1.46 0.01 -0.13 0.00 0.18 0.00 0.00 39.33 40.85 2dlo h ASP 69 CO -0.81 0.17 -0.36 0.33 -3.12 0.00 0.00 179.24 175.45 2dlo n PHE 70 N -3.26 -0.06 -0.32 4.55 7.35 0.72 0.17 117.46 126.60 2dlo n PHE 70 Ca -0.01 1.04 0.22 0.00 -0.76 0.00 0.00 57.45 57.95 2dlo n PHE 70 Cb 0.02 -0.76 0.44 0.00 0.35 0.00 0.00 39.48 39.53 2dlo n PHE 70 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2dlo h HIS 71 N 0.00 0.74 0.00 -5.13 3.86 -0.79 0.12 115.15 113.95 2dlo h HIS 71 Ca 0.26 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.51 2dlo h HIS 71 Cb 0.47 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.78 2dlo h HIS 71 CO -0.77 -0.24 -0.28 -0.09 0.86 0.00 0.00 177.93 177.42 2dlo h ARG 72 N 0.24 0.00 -0.91 2.45 2.43 0.16 -2.02 114.38 116.73 2dlo h ARG 72 Ca 0.70 0.00 0.37 0.00 -0.81 0.00 0.00 59.98 60.24 2dlo h ARG 72 Cb 1.60 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 30.99 2dlo h ARG 72 CO -0.66 0.00 0.44 1.17 -1.51 0.00 0.00 179.97 179.41 2dlo n LYS 73 N -4.65 -0.06 0.06 0.20 4.81 0.16 0.65 118.16 119.33 2dlo n LYS 73 Ca -0.04 1.27 -0.23 0.00 -0.87 0.00 0.00 58.31 58.45 2dlo n LYS 73 Cb 0.15 -2.25 -0.15 0.00 0.02 0.00 0.00 35.03 32.80 2dlo n LYS 73 CO 0.00 0.00 0.00 0.74 1.17 0.00 0.00 177.40 179.31 2dlo h PHE 74 N 0.00 0.66 -3.19 5.64 -1.00 -0.92 -3.41 116.94 114.71 2dlo h PHE 74 Ca 0.75 -0.48 -0.64 0.00 2.81 0.00 0.00 57.97 60.41 2dlo h PHE 74 Cb 1.95 -0.03 -0.41 0.00 3.61 0.00 0.00 35.95 41.07 2dlo h PHE 74 CO -0.06 1.66 -0.53 0.00 -1.61 0.00 0.00 178.31 177.76 2dlo s ALA 75 N -2.56 3.73 0.15 2.45 0.00 0.21 -5.07 121.76 120.68 2dlo s ALA 75 Ca -0.17 -3.69 0.06 0.00 0.00 0.00 0.00 51.96 48.16 2dlo s ALA 75 Cb 0.05 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.89 2dlo s ALA 75 CO 0.83 -2.08 -0.13 -1.54 0.00 0.00 0.00 175.76 172.84 2dlo s SER 76 N -0.99 2.04 0.00 0.00 1.04 -0.42 -4.26 113.70 111.10 2dlo s SER 76 Ca 0.23 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.73 2dlo s SER 76 Cb -0.10 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2dlo s SER 76 CO -0.12 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.49 2dlo n GLY 77 N 0.08 6.23 3.60 7.32 0.00 -1.26 -5.08 105.19 116.08 2dlo n GLY 77 Ca -0.12 -1.67 -0.43 0.00 0.00 0.00 0.00 46.02 43.80 2dlo n GLY 77 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlo s PRO 78 N 1.26 3.37 0.19 1.61 0.04 -1.26 -4.99 135.00 135.22 2dlo s PRO 78 Ca 0.00 1.27 0.10 0.00 0.04 0.00 0.00 61.00 62.41 2dlo s PRO 78 Cb 0.00 -4.16 -0.04 0.00 0.04 0.00 0.00 34.50 30.33 2dlo s PRO 78 CO 0.00 -1.82 -0.20 -1.54 0.04 0.00 0.00 177.00 173.48 2dlo s SER 79 N 5.63 2.99 -0.04 6.66 1.04 -1.26 -5.15 113.70 123.57 2dlo s SER 79 Ca 0.75 -0.89 0.05 0.00 0.48 0.00 0.00 55.95 56.34 2dlo s SER 79 Cb -0.20 -0.20 -0.01 0.00 0.10 0.00 0.00 66.02 65.71 2dlo s SER 79 CO 0.33 0.01 -0.21 -0.94 0.98 0.00 0.00 173.24 173.41 2dlo s SER 80 N -2.81 2.52 0.00 7.02 1.04 -1.26 -5.32 113.70 114.88 2dlo s SER 80 Ca 0.19 -0.41 0.29 0.00 0.48 0.00 0.00 55.95 56.50 2dlo s SER 80 Cb -0.06 -0.57 1.19 0.00 0.10 0.00 0.00 66.02 66.68 2dlo s SER 80 CO 0.08 0.21 1.82 0.61 0.98 0.00 0.00 173.24 176.95