#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 -0.92 0.28 1.61 1.04 -1.26 -5.15 113.70 109.30 2dlo s SER 2 Ca 0.00 1.27 -0.29 0.00 0.48 0.00 0.00 55.95 57.41 2dlo s SER 2 Cb 0.00 2.04 -0.10 0.00 0.10 0.00 0.00 66.02 68.06 2dlo s SER 2 CO 0.00 -0.18 1.10 -0.55 0.98 0.00 0.00 173.24 174.60 2dlo s SER 3 N 2.69 7.25 0.00 7.02 0.15 -1.26 -5.02 113.70 124.53 2dlo s SER 3 Ca -0.05 2.28 0.00 0.00 0.70 0.00 0.00 55.95 58.88 2dlo s SER 3 Cb -0.10 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 2dlo s SER 3 CO -0.18 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.71 2dlo n GLY 4 N 1.17 1.02 3.01 9.45 0.00 -1.26 -5.17 105.19 113.40 2dlo n GLY 4 Ca -0.01 -0.28 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 2dlo n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlo s SER 5 N 0.00 1.39 -0.30 1.61 0.15 -1.26 -5.12 113.70 110.17 2dlo s SER 5 Ca 0.00 -0.22 -0.11 0.00 0.70 0.00 0.00 55.95 56.32 2dlo s SER 5 Cb 0.00 -0.47 0.16 0.00 -1.71 0.00 0.00 66.02 64.00 2dlo s SER 5 CO 0.00 0.05 0.84 -0.94 1.20 0.00 0.00 173.24 174.39 2dlo s SER 6 N 0.37 -0.86 -0.32 5.45 1.04 -1.26 -5.13 113.70 112.99 2dlo s SER 6 Ca -0.07 0.93 -0.01 0.00 0.48 0.00 0.00 55.95 57.27 2dlo s SER 6 Cb -0.11 1.88 0.11 0.00 0.10 0.00 0.00 66.02 67.99 2dlo s SER 6 CO 0.01 -0.16 0.12 -0.83 0.98 0.00 0.00 173.24 173.36 2dlo s GLY 7 N 2.73 0.93 -1.12 7.32 0.00 -1.26 -5.06 107.32 110.86 2dlo s GLY 7 Ca 0.02 -1.58 -0.21 0.00 0.00 0.00 0.00 44.72 42.94 2dlo s GLY 7 CO -0.18 1.77 1.54 1.85 0.00 0.00 0.00 173.10 178.08 2dlo s GLU 8 N 1.63 3.73 0.31 2.90 2.12 -1.26 -4.97 118.70 123.16 2dlo s GLU 8 Ca 0.11 -1.47 -0.26 0.00 0.36 0.00 0.00 54.97 53.71 2dlo s GLU 8 Cb -0.18 -5.40 -0.15 0.00 0.26 0.00 0.00 34.13 28.67 2dlo s GLU 8 CO -0.25 -2.20 0.70 0.41 -0.54 0.00 0.00 175.26 173.37 2dlo n GLY 9 N 6.29 -1.14 3.16 -1.50 0.00 -1.26 -4.99 105.19 105.74 2dlo n GLY 9 Ca 0.38 0.24 -0.09 0.00 0.00 0.00 0.00 46.02 46.55 2dlo n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dlo n TYR 11 N -0.06 -1.69 -3.98 0.00 0.18 -1.26 -5.04 117.16 105.30 2dlo n TYR 11 Ca -0.08 -0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.59 2dlo n TYR 11 Cb 0.63 -1.54 -0.12 0.00 -0.38 0.00 0.00 39.34 37.93 2dlo n TYR 11 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 2dlo s VAL 12 N -2.23 0.18 0.22 -3.48 -7.23 -1.26 -5.14 120.40 101.46 2dlo s VAL 12 Ca 0.56 -0.65 -0.14 0.00 -1.81 0.00 0.00 61.98 59.94 2dlo s VAL 12 Cb -0.13 -0.26 0.05 0.00 0.56 0.00 0.00 36.38 36.60 2dlo s VAL 12 CO 0.61 -0.31 0.68 0.00 -0.31 0.00 0.00 175.10 175.78 2dlo n ALA 13 N 2.06 -1.67 -1.97 1.32 0.00 -1.26 -5.06 120.51 113.92 2dlo n ALA 13 Ca -0.20 -0.86 -0.28 0.00 0.00 0.00 0.00 53.44 52.11 2dlo n ALA 13 Cb 0.56 0.59 -0.07 0.00 0.00 0.00 0.00 19.45 20.54 2dlo n ALA 13 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2dlo n THR 14 N -0.47 1.72 -3.78 0.00 -2.24 -1.26 -4.84 114.28 103.41 2dlo n THR 14 Ca -0.04 -1.78 -0.13 0.00 -2.27 0.00 0.00 64.05 59.83 2dlo n THR 14 Cb 0.44 -2.16 -0.11 0.00 -2.10 0.00 0.00 70.33 66.41 2dlo n THR 14 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 2dlo s LEU 15 N 11.15 0.97 0.29 3.22 0.05 -1.26 -5.15 118.68 127.95 2dlo s LEU 15 Ca 0.69 0.40 -0.26 0.00 0.05 0.00 0.00 54.13 55.02 2dlo s LEU 15 Cb -0.00 1.00 -0.09 0.00 -2.05 0.00 0.00 46.19 45.04 2dlo s LEU 15 CO 0.14 -0.19 0.91 -1.61 -0.55 0.00 0.00 176.35 175.05 2dlo s GLU 16 N -0.28 4.58 -0.24 1.48 2.02 -1.26 -4.87 118.70 120.12 2dlo s GLU 16 Ca -0.04 1.29 -0.09 0.00 0.02 0.00 0.00 54.97 56.14 2dlo s GLU 16 Cb -0.03 -2.89 -0.04 0.00 0.10 0.00 0.00 34.13 31.27 2dlo s GLU 16 CO 0.01 0.34 0.13 0.15 0.02 0.00 0.00 175.26 175.91 2dlo s LYS 17 N -1.90 3.94 0.13 1.61 1.02 -1.26 -1.24 119.74 122.04 2dlo s LYS 17 Ca 0.48 -0.34 -0.35 0.00 0.02 0.00 0.00 55.97 55.78 2dlo s LYS 17 Cb -0.19 -3.46 -0.16 0.00 -0.52 0.00 0.00 37.83 33.50 2dlo s LYS 17 CO 0.25 0.00 1.30 0.00 -0.92 0.00 0.00 175.35 175.98 2dlo n ALA 19 N 2.22 3.18 -0.03 0.00 0.00 -1.08 -1.58 120.51 123.21 2dlo n ALA 19 Ca 0.17 -1.10 -0.04 0.00 0.00 0.00 0.00 53.44 52.47 2dlo n ALA 19 Cb 0.22 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 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 0.46 0.32 0.13 0.00 -1.04 -1.26 -4.79 114.28 108.11 2dlo n THR 20 Ca 0.17 -0.11 0.01 0.00 -2.04 0.00 0.00 64.05 62.08 2dlo n THR 20 Cb 0.75 -0.86 -0.01 0.00 -1.82 0.00 0.00 70.33 68.39 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 -0.73 -2.87 -4.14 0.00 7.64 -0.62 -5.04 113.62 107.86 2dlo n SER 22 Ca 0.01 -0.48 -0.19 0.00 1.01 0.00 0.00 58.87 59.22 2dlo n SER 22 Cb 0.05 -4.00 -0.13 0.00 -1.01 0.00 0.00 64.21 59.12 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 -4.79 0.84 -0.16 1.43 -0.21 -1.23 -4.89 119.66 110.65 2dlo s GLN 23 Ca 0.08 -0.82 -0.29 0.00 0.02 0.00 0.00 55.36 54.36 2dlo s GLN 23 Cb -0.01 -0.83 -0.03 0.00 1.00 0.00 0.00 33.01 33.14 2dlo s GLN 23 CO 0.55 0.20 1.57 -1.25 -2.12 0.00 0.00 175.29 174.24 2dlo s PRO 24 N -1.37 3.98 -0.02 2.91 0.04 -1.26 0.22 135.00 139.49 2dlo s PRO 24 Ca -0.01 1.81 -0.30 0.00 0.04 0.00 0.00 61.00 62.55 2dlo s PRO 24 Cb -0.09 -3.98 -0.05 0.00 0.04 0.00 0.00 34.50 30.43 2dlo s PRO 24 CO 0.02 -1.07 1.31 0.42 0.04 0.00 0.00 177.00 177.72 2dlo s ILE 25 N 4.59 3.94 0.00 0.56 1.01 -0.38 -4.87 121.20 126.06 2dlo s ILE 25 Ca 0.69 1.30 0.00 0.00 0.00 0.00 0.00 60.65 62.64 2dlo s ILE 25 Cb -0.27 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.37 2dlo s ILE 25 CO 0.27 -0.00 0.00 0.18 0.00 0.00 0.00 174.94 175.39 2dlo n LEU 26 N 5.27 0.98 0.00 2.97 4.77 -1.26 -4.57 117.00 125.16 2dlo n LEU 26 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2dlo n LEU 26 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2dlo n LEU 26 CO 0.57 0.10 0.44 0.47 -1.33 0.00 0.00 177.39 177.64 2dlo n ASP 27 N -2.65 0.00 -3.90 -1.43 8.00 -1.26 -4.90 116.55 110.41 2dlo n ASP 27 Ca 0.00 0.89 -0.11 0.00 0.71 0.00 0.00 54.79 56.28 2dlo n ASP 27 Cb 0.40 -0.41 -0.11 0.00 -0.02 0.00 0.00 41.12 40.97 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 -2.58 0.29 -0.22 -1.24 3.52 -1.26 -5.14 118.95 112.32 2dlo s ARG 28 Ca 0.00 -0.30 -0.04 0.00 -0.13 0.00 0.00 55.73 55.26 2dlo s ARG 28 Cb 0.00 0.12 -0.01 0.00 -1.56 0.00 0.00 34.95 33.50 2dlo s ARG 28 CO 0.00 -0.06 -0.04 0.42 -0.81 0.00 0.00 175.30 174.82 2dlo s ILE 29 N -0.92 3.42 -0.34 4.11 1.01 -1.26 -4.44 121.20 122.78 2dlo s ILE 29 Ca -0.10 -0.48 -0.09 0.00 0.00 0.00 0.00 60.65 59.98 2dlo s ILE 29 Cb -0.06 -2.56 0.02 0.00 0.01 0.00 0.00 42.46 39.86 2dlo s ILE 29 CO 0.00 0.41 0.15 -0.22 0.00 0.00 0.00 174.94 175.29 2dlo s LEU 30 N 1.49 4.36 -0.13 2.97 0.20 -0.23 -4.98 118.68 122.36 2dlo s LEU 30 Ca 0.06 -0.87 -0.29 0.00 0.69 0.00 0.00 54.13 53.71 2dlo s LEU 30 Cb -0.14 -1.96 -0.01 0.00 -0.43 0.00 0.00 46.19 43.64 2dlo s LEU 30 CO -0.03 -0.30 1.04 -0.13 -0.29 0.00 0.00 176.35 176.64 2dlo s ARG 31 N 1.53 4.37 -0.19 1.98 0.52 -1.26 -0.84 118.95 125.06 2dlo s ARG 31 Ca 0.02 1.41 -0.11 0.00 -0.52 0.00 0.00 55.73 56.53 2dlo s ARG 31 Cb -0.18 -3.57 0.06 0.00 0.52 0.00 0.00 34.95 31.78 2dlo s ARG 31 CO 0.05 -0.41 0.47 0.00 0.02 0.00 0.00 175.30 175.43 2dlo s ALA 32 N 2.34 -1.22 -1.55 2.13 0.00 -0.48 -4.89 121.76 118.10 2dlo s ALA 32 Ca 0.48 1.67 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2dlo s ALA 32 Cb -0.18 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 21.94 2dlo s ALA 32 CO 0.15 -0.28 0.00 -1.33 0.00 0.00 0.00 175.76 174.30 2dlo n MET 33 N 4.09 -1.38 0.00 0.00 2.81 -1.26 -2.25 117.12 119.13 2dlo n MET 33 Ca -0.21 0.89 0.00 0.00 -1.81 0.00 0.00 57.70 56.56 2dlo n MET 33 Cb 0.56 -5.33 0.00 0.00 -0.71 0.00 0.00 33.22 27.74 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 -0.99 2.19 3.96 3.03 0.00 -1.26 -4.97 105.19 107.15 2dlo n GLY 34 Ca -0.20 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.48 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 1.22 -0.13 1.61 1.02 -0.95 -5.07 119.74 117.43 2dlo s LYS 35 Ca 0.00 -0.77 -0.01 0.00 0.02 0.00 0.00 55.97 55.21 2dlo s LYS 35 Cb 0.00 -2.11 -0.02 0.00 -0.52 0.00 0.00 37.83 35.18 2dlo s LYS 35 CO 0.00 -1.88 -0.09 0.00 -0.92 0.00 0.00 175.35 172.46 2dlo s ALA 36 N -3.49 2.79 0.11 5.17 0.00 -1.26 -1.38 121.76 123.70 2dlo s ALA 36 Ca 0.70 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.80 2dlo s ALA 36 Cb -0.05 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.69 2dlo s ALA 36 CO 0.48 0.27 -0.03 0.71 0.00 0.00 0.00 175.76 177.20 2dlo s TYR 37 N 0.24 0.88 0.56 0.00 1.51 -0.02 -2.65 117.35 117.87 2dlo s TYR 37 Ca -0.06 -1.01 -0.18 0.00 -1.01 0.00 0.00 57.07 54.80 2dlo s TYR 37 Cb -0.15 -0.52 -0.05 0.00 -0.11 0.00 0.00 41.96 41.13 2dlo s TYR 37 CO 0.04 -0.26 1.10 -1.01 -1.11 0.00 0.00 175.55 174.31 2dlo s HIS 38 N -3.75 2.75 -2.00 2.71 3.76 -1.26 -1.06 115.29 116.43 2dlo s HIS 38 Ca 0.15 1.55 0.10 0.00 -0.15 0.00 0.00 55.06 56.71 2dlo s HIS 38 Cb 0.06 -3.20 0.58 0.00 1.11 0.00 0.00 32.58 31.13 2dlo s HIS 38 CO -0.03 -1.42 1.02 -0.35 -0.85 0.00 0.00 174.74 173.11 2dlo n PRO 39 N -1.51 0.49 0.00 8.40 -0.04 -1.26 -2.88 135.00 138.20 2dlo n PRO 39 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2dlo n PRO 39 Cb 0.52 -1.31 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 0.19 0.55 0.00 -1.26 -4.81 105.19 99.85 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 -4.41 1.13 -4.13 0.00 7.35 -1.19 -4.87 117.46 111.34 2dlo n PHE 42 Ca -0.04 0.14 -0.10 0.00 -0.76 0.00 0.00 57.45 56.69 2dlo n PHE 42 Cb 0.38 -2.46 -0.09 0.00 0.35 0.00 0.00 39.48 37.66 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 11.34 0.07 0.92 -2.13 -4.23 -1.26 -2.71 115.64 117.64 2dlo s THR 43 Ca 1.07 -1.84 -0.12 0.00 -1.18 0.00 0.00 61.69 59.62 2dlo s THR 43 Cb -0.43 -2.11 0.14 0.00 1.34 0.00 0.00 72.50 71.45 2dlo s THR 43 CO 0.30 -0.34 1.09 0.00 -0.54 0.00 0.00 174.62 175.13 2dlo n VAL 45 N -3.97 0.31 0.00 0.00 0.24 -1.22 -3.46 118.33 110.23 2dlo n VAL 45 Ca 0.07 -0.55 0.00 0.00 -2.04 0.00 0.00 64.34 61.82 2dlo n VAL 45 Cb 0.55 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.76 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 -2.43 0.00 0.23 3.34 0.31 -1.26 -4.63 118.33 113.88 2dlo n VAL 46 Ca -0.05 0.30 0.12 0.00 -0.01 0.00 0.00 64.34 64.70 2dlo n VAL 46 Cb 0.62 -1.21 0.38 0.00 -0.91 0.00 0.00 33.84 32.71 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 -3.17 -2.21 -4.11 0.00 -0.00 -1.23 -4.96 115.22 99.55 2dlo n HIS 48 Ca 0.02 0.86 -0.26 0.00 -0.00 0.00 0.00 57.72 58.35 2dlo n HIS 48 Cb 0.46 -4.56 -0.06 0.00 -0.00 0.00 0.00 29.99 25.83 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 -4.87 2.80 -0.35 -0.41 1.70 -1.26 -4.66 118.95 111.90 2dlo s ARG 49 Ca 0.19 -0.95 -0.29 0.00 -0.47 0.00 0.00 55.73 54.22 2dlo s ARG 49 Cb -0.03 -2.57 -0.00 0.00 -0.57 0.00 0.00 34.95 31.78 2dlo s ARG 49 CO 0.70 0.47 1.55 0.20 -1.08 0.00 0.00 175.30 177.14 2dlo s GLY 50 N -3.17 1.05 -0.46 3.88 0.00 -1.26 -1.60 107.32 105.75 2dlo s GLY 50 Ca 0.30 0.09 0.02 0.00 0.00 0.00 0.00 44.72 45.13 2dlo s GLY 50 CO 0.23 2.94 1.89 1.04 0.00 0.00 0.00 173.10 179.20 2dlo n LEU 51 N 9.11 6.70 -4.45 0.66 4.77 -1.10 -4.88 117.00 127.81 2dlo n LEU 51 Ca 0.19 -3.61 -0.43 0.00 -0.03 0.00 0.00 56.01 52.13 2dlo n LEU 51 Cb 0.47 -0.87 -0.04 0.00 -2.33 0.00 0.00 43.42 40.65 2dlo n LEU 51 CO 0.68 1.14 0.77 1.51 -1.33 0.00 0.00 177.39 180.16 2dlo s ASP 52 N -1.13 6.24 0.00 -1.43 -4.77 -1.26 -3.67 116.67 110.65 2dlo s ASP 52 Ca 0.52 -1.19 0.00 0.00 -3.30 0.00 0.00 52.55 48.59 2dlo s ASP 52 Cb 0.43 -2.41 0.00 0.00 -1.09 0.00 0.00 42.92 39.85 2dlo s ASP 52 CO 0.06 -1.36 0.00 0.61 0.70 0.00 0.00 175.17 175.17 2dlo n GLY 53 N 5.37 1.28 3.10 2.12 0.00 -1.26 -5.11 105.19 110.69 2dlo n GLY 53 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 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 0.19 0.44 -0.61 -4.36 -1.24 -5.15 121.20 108.47 2dlo s ILE 54 Ca 0.00 -1.55 -0.24 0.00 -0.26 0.00 0.00 60.65 58.60 2dlo s ILE 54 Cb 0.00 -1.30 -0.08 0.00 1.25 0.00 0.00 42.46 42.34 2dlo s ILE 54 CO 0.00 -0.86 1.17 -2.16 0.24 0.00 0.00 174.94 173.33 2dlo s PRO 55 N -3.51 3.84 0.34 0.37 0.04 -1.26 -4.99 135.00 129.83 2dlo s PRO 55 Ca 0.03 1.80 -0.11 0.00 0.04 0.00 0.00 61.00 62.76 2dlo s PRO 55 Cb 0.05 -2.49 0.02 0.00 0.04 0.00 0.00 34.50 32.12 2dlo s PRO 55 CO -0.09 -0.49 0.62 -0.59 0.04 0.00 0.00 177.00 176.49 2dlo s PHE 56 N -1.50 0.48 -0.15 0.56 -0.12 -1.26 -4.15 117.98 111.84 2dlo s PHE 56 Ca 0.62 -0.93 -0.12 0.00 -0.05 0.00 0.00 56.93 56.45 2dlo s PHE 56 Cb -0.29 0.39 0.04 0.00 -0.63 0.00 0.00 43.02 42.53 2dlo s PHE 56 CO 0.36 -1.30 0.38 -0.08 -0.05 0.00 0.00 175.22 174.54 2dlo s THR 57 N -2.98 -0.01 0.51 -4.49 -1.32 -1.22 -4.90 115.64 101.23 2dlo s THR 57 Ca 0.22 0.02 0.02 0.00 -1.21 0.00 0.00 61.69 60.73 2dlo s THR 57 Cb -0.03 -0.54 0.02 0.00 -1.51 0.00 0.00 72.50 70.44 2dlo s THR 57 CO 0.14 0.01 0.72 0.68 -2.21 0.00 0.00 174.62 173.96 2dlo s VAL 58 N 0.41 3.06 0.35 5.08 -7.23 -1.26 -0.57 120.40 120.24 2dlo s VAL 58 Ca -0.02 -0.66 0.06 0.00 -1.81 0.00 0.00 61.98 59.54 2dlo s VAL 58 Cb -0.04 -3.13 -0.07 0.00 0.56 0.00 0.00 36.38 33.70 2dlo s VAL 58 CO -0.02 -0.09 0.02 -0.62 -0.31 0.00 0.00 175.10 174.09 2dlo s ASP 59 N -4.36 3.04 0.31 4.85 2.15 -1.12 -4.86 116.67 116.67 2dlo s ASP 59 Ca 0.55 -1.35 0.14 0.00 0.43 0.00 0.00 52.55 52.32 2dlo s ASP 59 Cb -0.10 -0.22 1.04 0.00 -0.30 0.00 0.00 42.92 43.33 2dlo s ASP 59 CO 0.38 -0.50 1.38 0.00 -0.17 0.00 0.00 175.17 176.26 2dlo n ALA 60 N -0.79 0.77 -0.62 3.66 0.00 -1.26 0.24 120.51 122.51 2dlo n ALA 60 Ca -0.04 0.91 -0.15 0.00 0.00 0.00 0.00 53.44 54.17 2dlo n ALA 60 Cb 0.66 -0.84 0.05 0.00 0.00 0.00 0.00 19.45 19.33 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 -5.07 2.53 -4.23 0.00 -2.24 -1.26 -4.83 114.28 99.19 2dlo n THR 61 Ca 0.30 -1.40 -0.38 0.00 -2.27 0.00 0.00 64.05 60.30 2dlo n THR 61 Cb 1.00 -1.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 2dlo n THR 61 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2dlo n SER 62 N 0.19 -1.64 -4.35 3.42 7.64 0.65 -4.83 113.62 114.69 2dlo n SER 62 Ca 0.29 -1.10 -0.45 0.00 1.01 0.00 0.00 58.87 58.61 2dlo n SER 62 Cb 0.72 -1.44 -0.04 0.00 -1.01 0.00 0.00 64.21 62.43 2dlo n SER 62 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2dlo s GLN 63 N -6.62 3.07 -0.60 1.43 -0.21 -1.21 -4.76 119.66 110.76 2dlo s GLN 63 Ca 0.75 -1.54 -0.26 0.00 0.02 0.00 0.00 55.36 54.32 2dlo s GLN 63 Cb -0.44 -4.30 -0.09 0.00 1.00 0.00 0.00 33.01 29.18 2dlo s GLN 63 CO 0.92 -1.46 2.39 0.42 -2.12 0.00 0.00 175.29 175.44 2dlo s ILE 64 N 2.14 3.02 -0.41 1.08 1.01 -1.26 -2.81 121.20 123.97 2dlo s ILE 64 Ca 0.09 0.00 -0.16 0.00 0.00 0.00 0.00 60.65 60.59 2dlo s ILE 64 Cb -0.25 -3.06 0.02 0.00 0.01 0.00 0.00 42.46 39.18 2dlo s ILE 64 CO 0.04 -0.06 0.34 -1.00 0.00 0.00 0.00 174.94 174.26 2dlo s HIS 65 N 12.97 3.22 0.18 3.97 3.76 0.26 -3.42 115.29 136.24 2dlo s HIS 65 Ca 0.95 -0.52 -0.32 0.00 -0.15 0.00 0.00 55.06 55.02 2dlo s HIS 65 Cb -0.15 -2.67 -0.16 0.00 1.11 0.00 0.00 32.58 30.71 2dlo s HIS 65 CO 0.19 -0.62 1.12 0.00 -0.85 0.00 0.00 174.74 174.59 2dlo n ILE 67 N 1.31 -0.40 -0.39 0.00 2.08 -1.26 0.25 119.36 120.95 2dlo n ILE 67 Ca 0.15 1.55 -0.10 0.00 0.56 0.00 0.00 62.75 64.90 2dlo n ILE 67 Cb 0.25 -1.97 -0.09 0.00 -0.75 0.00 0.00 39.64 37.08 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 -0.04 0.67 0.38 5.08 -1.92 0.21 114.58 118.96 2dlo h GLU 68 Ca 0.16 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2dlo h GLU 68 Cb 0.32 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.59 2dlo h GLU 68 CO -0.63 -0.02 -0.32 -0.44 -1.00 0.00 0.00 179.01 176.60 2dlo h ASP 69 N -0.04 -0.76 -0.80 1.42 3.32 -0.52 -2.81 116.42 116.23 2dlo h ASP 69 Ca 0.17 0.03 0.20 0.00 0.02 0.00 0.00 57.03 57.45 2dlo h ASP 69 Cb 0.44 0.20 -0.15 0.00 0.22 0.00 0.00 39.33 40.04 2dlo h ASP 69 CO -0.91 -0.38 -0.04 0.33 -1.72 0.00 0.00 179.24 176.51 2dlo n PHE 70 N -5.30 0.45 0.09 4.55 7.35 0.52 0.95 117.46 126.08 2dlo n PHE 70 Ca -0.11 0.97 -0.13 0.00 -0.76 0.00 0.00 57.45 57.42 2dlo n PHE 70 Cb 0.35 -1.06 -0.08 0.00 0.35 0.00 0.00 39.48 39.04 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 -0.16 0.59 -5.13 3.86 -0.60 -2.13 115.15 111.59 2dlo h HIS 71 Ca 0.46 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.64 2dlo h HIS 71 Cb 0.89 0.05 0.01 0.00 1.06 0.00 0.00 27.41 29.42 2dlo h HIS 71 CO -0.47 -0.02 -0.28 0.00 0.86 0.00 0.00 177.93 178.01 2dlo h ARG 72 N -0.26 -0.76 -0.96 2.45 3.08 0.85 0.40 114.38 119.17 2dlo h ARG 72 Ca -0.02 0.05 0.09 0.00 0.07 0.00 0.00 59.98 60.17 2dlo h ARG 72 Cb 0.21 0.17 -0.12 0.00 0.08 0.00 0.00 29.97 30.32 2dlo h ARG 72 CO 0.03 -0.51 -0.56 1.17 -1.07 0.00 0.00 179.97 179.03 2dlo n LYS 73 N -4.39 -0.42 -0.28 0.04 4.81 0.13 0.13 118.16 118.18 2dlo n LYS 73 Ca -0.10 1.45 -0.06 0.00 -0.87 0.00 0.00 58.31 58.73 2dlo n LYS 73 Cb 0.31 -2.13 0.06 0.00 0.02 0.00 0.00 35.03 33.29 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 1.21 -3.45 5.64 -1.00 -1.42 -3.34 116.94 114.58 2dlo h PHE 74 Ca 0.16 -0.11 -0.69 0.00 2.81 0.00 0.00 57.97 60.13 2dlo h PHE 74 Cb 0.40 -0.35 -0.36 0.00 3.61 0.00 0.00 35.95 39.24 2dlo h PHE 74 CO -0.98 0.94 -0.30 0.00 -1.61 0.00 0.00 178.31 176.36 2dlo s ALA 75 N -5.46 3.81 -0.42 2.45 0.00 0.14 -5.05 121.76 117.24 2dlo s ALA 75 Ca -0.12 -3.50 -0.28 0.00 0.00 0.00 0.00 51.96 48.06 2dlo s ALA 75 Cb 0.15 -2.68 -0.03 0.00 0.00 0.00 0.00 23.12 20.57 2dlo s ALA 75 CO 0.84 -2.12 1.92 -1.12 0.00 0.00 0.00 175.76 175.28 2dlo s SER 76 N 0.24 5.51 0.18 0.00 0.01 -0.64 -4.27 113.70 114.72 2dlo s SER 76 Ca 0.21 1.05 0.00 0.00 1.31 0.00 0.00 55.95 58.51 2dlo s SER 76 Cb -0.15 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2dlo s SER 76 CO -0.07 -2.06 0.00 0.61 0.41 0.00 0.00 173.24 172.13 2dlo n GLY 77 N 5.59 -5.05 3.77 3.44 0.00 -1.26 -4.90 105.19 106.78 2dlo n GLY 77 Ca 0.24 -0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.50 4.23 -0.31 1.61 0.04 -1.26 -4.97 135.00 133.84 2dlo s PRO 78 Ca 0.00 1.97 0.10 0.00 0.04 0.00 0.00 61.00 63.11 2dlo s PRO 78 Cb 0.00 -2.89 0.46 0.00 0.04 0.00 0.00 34.50 32.12 2dlo s PRO 78 CO 0.00 -0.20 1.15 0.45 0.04 0.00 0.00 177.00 178.43 2dlo n SER 79 N 0.48 4.03 -0.32 6.66 2.88 -1.26 -4.91 113.62 121.19 2dlo n SER 79 Ca 0.02 -3.35 -0.02 0.00 -1.33 0.00 0.00 58.87 54.20 2dlo n SER 79 Cb 0.45 -0.40 0.02 0.00 -0.75 0.00 0.00 64.21 63.53 2dlo n SER 79 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dlo n SER 80 N -0.61 -0.58 -0.23 -3.46 2.88 -1.26 -5.31 113.62 105.05 2dlo n SER 80 Ca 0.34 1.44 0.03 0.00 -1.33 0.00 0.00 58.87 59.35 2dlo n SER 80 Cb 0.88 -0.31 0.02 0.00 -0.75 0.00 0.00 64.21 64.05 2dlo n SER 80 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42