#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlo h SER 2 N 0.00 -0.68 -5.10 1.61 0.87 -2.15 -3.48 113.55 104.62 2dlo h SER 2 Ca 0.00 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.54 2dlo h SER 2 Cb 0.00 0.18 -0.11 0.00 -0.44 0.00 0.00 62.40 62.02 2dlo h SER 2 CO 0.00 -0.29 -0.03 -0.94 -0.53 0.00 0.00 176.83 175.03 2dlo s SER 3 N -4.57 -0.23 0.00 6.23 1.04 -1.26 -5.14 113.70 109.78 2dlo s SER 3 Ca -0.12 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 55.85 2dlo s SER 3 Cb 0.01 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2dlo s SER 3 CO 0.35 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 174.21 2dlo n GLY 4 N -0.29 -0.85 3.97 7.32 0.00 -1.26 -5.18 105.19 108.90 2dlo n GLY 4 Ca -0.12 0.78 -0.21 0.00 0.00 0.00 0.00 46.02 46.48 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 6.19 -0.13 1.61 0.15 -1.26 -5.05 113.70 115.21 2dlo s SER 5 Ca 0.00 0.02 -0.25 0.00 0.70 0.00 0.00 55.95 56.42 2dlo s SER 5 Cb 0.00 -1.65 -0.26 0.00 -1.71 0.00 0.00 66.02 62.39 2dlo s SER 5 CO 0.00 -0.23 0.70 -1.28 1.20 0.00 0.00 173.24 173.63 2dlo h SER 6 N 1.02 0.14 -1.29 5.45 0.87 -2.07 -3.50 113.55 114.16 2dlo h SER 6 Ca -0.50 -0.91 0.00 0.00 -1.23 0.00 0.00 61.79 59.16 2dlo h SER 6 Cb 1.24 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2dlo h SER 6 CO 0.58 1.21 0.00 0.61 -0.53 0.00 0.00 176.83 178.71 2dlo n GLY 7 N 1.61 -0.78 3.53 5.77 0.00 -1.26 -5.14 105.19 108.92 2dlo n GLY 7 Ca -0.15 -0.89 -0.18 0.00 0.00 0.00 0.00 46.02 44.80 2dlo n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dlo s GLU 8 N -1.97 1.03 0.00 1.61 2.56 -1.26 -5.17 118.70 115.50 2dlo s GLU 8 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 54.97 55.31 2dlo s GLU 8 Cb 0.00 0.49 0.00 0.00 2.00 0.00 0.00 34.13 36.62 2dlo s GLU 8 CO 0.00 -0.30 0.00 0.41 -0.56 0.00 0.00 175.26 174.81 2dlo n GLY 9 N 1.12 -2.91 3.20 -1.50 0.00 -1.26 -5.06 105.19 98.78 2dlo n GLY 9 Ca -0.18 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 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 1.40 0.76 0.05 0.00 1.13 -1.26 -5.08 117.35 114.35 2dlo s TYR 11 Ca -0.09 0.57 0.04 0.00 -1.41 0.00 0.00 57.07 56.18 2dlo s TYR 11 Cb -0.09 -3.43 -0.02 0.00 -1.10 0.00 0.00 41.96 37.31 2dlo s TYR 11 CO -0.11 -3.71 -0.12 0.54 -2.51 0.00 0.00 175.55 169.64 2dlo s VAL 12 N -3.02 0.91 0.02 -3.49 0.11 -1.26 -5.08 120.40 108.61 2dlo s VAL 12 Ca 0.70 -1.05 -0.22 0.00 -2.93 0.00 0.00 61.98 58.48 2dlo s VAL 12 Cb -0.11 -0.88 0.07 0.00 -1.53 0.00 0.00 36.38 33.94 2dlo s VAL 12 CO 0.56 -0.15 0.99 0.00 -3.33 0.00 0.00 175.10 173.17 2dlo n ALA 13 N 1.69 -2.76 -1.86 1.54 0.00 -1.26 -5.06 120.51 112.80 2dlo n ALA 13 Ca -0.20 -0.70 -0.22 0.00 0.00 0.00 0.00 53.44 52.33 2dlo n ALA 13 Cb 0.55 0.20 -0.08 0.00 0.00 0.00 0.00 19.45 20.12 2dlo n ALA 13 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2dlo s THR 14 N -2.07 3.31 -0.20 0.00 -4.23 -1.26 -4.81 115.64 106.38 2dlo s THR 14 Ca 0.23 -0.50 -0.13 0.00 -1.18 0.00 0.00 61.69 60.10 2dlo s THR 14 Cb -0.01 -4.26 0.06 0.00 1.34 0.00 0.00 72.50 69.63 2dlo s THR 14 CO 0.01 -0.56 0.50 -1.48 -0.54 0.00 0.00 174.62 172.55 2dlo s LEU 15 N 13.71 -0.21 0.51 4.79 0.05 -1.26 -5.16 118.68 131.11 2dlo s LEU 15 Ca 0.75 1.06 -0.21 0.00 0.05 0.00 0.00 54.13 55.79 2dlo s LEU 15 Cb -0.03 1.69 -0.07 0.00 -2.05 0.00 0.00 46.19 45.74 2dlo s LEU 15 CO 0.15 -0.20 1.13 -1.61 -0.55 0.00 0.00 176.35 175.26 2dlo s GLU 16 N 1.06 3.53 -0.12 1.48 2.02 -1.26 -4.82 118.70 120.59 2dlo s GLU 16 Ca -0.06 1.62 -0.03 0.00 0.02 0.00 0.00 54.97 56.52 2dlo s GLU 16 Cb -0.06 -2.13 -0.03 0.00 0.10 0.00 0.00 34.13 32.01 2dlo s GLU 16 CO -0.10 -0.71 -0.00 0.15 0.02 0.00 0.00 175.26 174.63 2dlo s LYS 17 N -3.11 3.29 0.10 1.61 1.02 -1.26 -1.53 119.74 119.86 2dlo s LYS 17 Ca 0.69 -0.43 -0.31 0.00 0.02 0.00 0.00 55.97 55.95 2dlo s LYS 17 Cb -0.24 -2.88 -0.10 0.00 -0.52 0.00 0.00 37.83 34.09 2dlo s LYS 17 CO 0.28 0.53 1.82 0.00 -0.92 0.00 0.00 175.35 177.06 2dlo n ALA 19 N 5.91 2.62 0.02 0.00 0.00 -1.01 -1.53 120.51 126.51 2dlo n ALA 19 Ca 0.18 -0.15 -0.01 0.00 0.00 0.00 0.00 53.44 53.45 2dlo n ALA 19 Cb 0.39 -1.01 -0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 0.08 0.80 1.03 0.00 -1.04 -1.26 -4.81 114.28 109.07 2dlo n THR 20 Ca 0.02 0.26 0.11 0.00 -2.04 0.00 0.00 64.05 62.40 2dlo n THR 20 Cb 0.35 -1.47 0.05 0.00 -1.82 0.00 0.00 70.33 67.44 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 -1.17 -2.38 -4.18 0.00 7.64 -0.58 -5.05 113.62 107.90 2dlo n SER 22 Ca 0.06 -0.39 -0.20 0.00 1.01 0.00 0.00 58.87 59.35 2dlo n SER 22 Cb 0.36 -3.34 -0.13 0.00 -1.01 0.00 0.00 64.21 60.09 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 -4.71 0.95 -0.03 1.43 -1.52 -1.24 -4.88 119.66 109.65 2dlo s GLN 23 Ca 0.04 -0.89 -0.30 0.00 -1.95 0.00 0.00 55.36 52.26 2dlo s GLN 23 Cb -0.00 -0.99 -0.05 0.00 -0.22 0.00 0.00 33.01 31.74 2dlo s GLN 23 CO 0.45 0.24 1.48 -1.25 -0.25 0.00 0.00 175.29 175.95 2dlo s PRO 24 N -1.45 4.24 0.05 2.91 0.04 -1.26 -0.13 135.00 139.40 2dlo s PRO 24 Ca 0.01 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.77 2dlo s PRO 24 Cb -0.09 -3.72 -0.05 0.00 0.04 0.00 0.00 34.50 30.68 2dlo s PRO 24 CO 0.02 -0.69 1.10 0.42 0.04 0.00 0.00 177.00 177.90 2dlo s ILE 25 N 3.05 4.35 0.00 0.56 1.01 -0.58 -4.89 121.20 124.70 2dlo s ILE 25 Ca 0.66 1.71 0.00 0.00 0.00 0.00 0.00 60.65 63.02 2dlo s ILE 25 Cb -0.31 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.06 2dlo s ILE 25 CO 0.26 0.15 0.00 0.18 0.00 0.00 0.00 174.94 175.53 2dlo n LEU 26 N 3.79 1.43 0.11 2.97 4.77 -1.26 -4.64 117.00 124.16 2dlo n LEU 26 Ca 0.07 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.01 2dlo n LEU 26 Cb 0.48 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 2dlo n LEU 26 CO 0.54 0.20 0.37 0.44 -1.33 0.00 0.00 177.39 177.61 2dlo h ASP 27 N 0.00 -0.24 -4.31 -1.43 5.19 -2.02 -3.47 116.42 110.14 2dlo h ASP 27 Ca 0.00 0.01 -0.15 0.00 -0.62 0.00 0.00 57.03 56.27 2dlo h ASP 27 Cb 0.59 0.06 -0.23 0.00 0.18 0.00 0.00 39.33 39.93 2dlo h ASP 27 CO 0.00 -0.13 -0.40 -0.60 -3.12 0.00 0.00 179.24 174.99 2dlo s ARG 28 N -3.11 0.42 -0.24 3.56 3.52 -1.26 -5.14 118.95 116.70 2dlo s ARG 28 Ca -0.04 0.08 -0.06 0.00 -0.13 0.00 0.00 55.73 55.58 2dlo s ARG 28 Cb 0.00 0.19 -0.02 0.00 -1.56 0.00 0.00 34.95 33.57 2dlo s ARG 28 CO 0.12 -0.08 0.02 0.42 -0.81 0.00 0.00 175.30 174.97 2dlo s ILE 29 N -0.49 3.87 -0.34 4.11 1.01 -1.26 -4.42 121.20 123.67 2dlo s ILE 29 Ca -0.06 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 2dlo s ILE 29 Cb -0.04 -2.80 0.01 0.00 0.01 0.00 0.00 42.46 39.64 2dlo s ILE 29 CO 0.01 0.37 0.18 -0.22 0.00 0.00 0.00 174.94 175.29 2dlo s LEU 30 N 1.55 4.42 -0.13 2.97 0.20 -0.41 -4.98 118.68 122.30 2dlo s LEU 30 Ca 0.06 -0.73 -0.29 0.00 0.69 0.00 0.00 54.13 53.86 2dlo s LEU 30 Cb -0.15 -2.02 -0.01 0.00 -0.43 0.00 0.00 46.19 43.58 2dlo s LEU 30 CO 0.00 -0.28 1.05 -0.13 -0.29 0.00 0.00 176.35 176.70 2dlo s ARG 31 N 1.60 4.37 -0.19 1.98 0.52 -1.26 -0.67 118.95 125.29 2dlo s ARG 31 Ca 0.04 1.43 -0.10 0.00 -0.52 0.00 0.00 55.73 56.58 2dlo s ARG 31 Cb -0.18 -3.58 0.07 0.00 0.52 0.00 0.00 34.95 31.78 2dlo s ARG 31 CO 0.07 -0.42 0.46 0.00 0.02 0.00 0.00 175.30 175.42 2dlo s ALA 32 N 2.38 -1.20 -1.46 2.13 0.00 -0.44 -4.89 121.76 118.27 2dlo s ALA 32 Ca 0.49 1.68 -0.01 0.00 0.00 0.00 0.00 51.96 54.11 2dlo s ALA 32 Cb -0.18 -1.05 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2dlo s ALA 32 CO 0.16 -0.34 0.14 -1.33 0.00 0.00 0.00 175.76 174.39 2dlo n MET 33 N 4.40 -2.15 0.00 0.00 2.81 -1.26 -2.30 117.12 118.61 2dlo n MET 33 Ca -0.21 0.84 0.00 0.00 -1.81 0.00 0.00 57.70 56.51 2dlo n MET 33 Cb 0.55 -5.35 0.00 0.00 -0.71 0.00 0.00 33.22 27.72 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 -1.12 2.00 3.96 3.03 0.00 -1.26 -4.96 105.19 106.84 2dlo n GLY 34 Ca -0.18 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.54 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 1.38 -0.13 1.61 1.02 -0.97 -5.07 119.74 117.57 2dlo s LYS 35 Ca 0.00 -0.71 -0.03 0.00 0.02 0.00 0.00 55.97 55.25 2dlo s LYS 35 Cb 0.00 -2.13 -0.03 0.00 -0.52 0.00 0.00 37.83 35.15 2dlo s LYS 35 CO 0.00 -1.77 -0.03 0.00 -0.92 0.00 0.00 175.35 172.64 2dlo s ALA 36 N -3.44 3.09 0.10 5.17 0.00 -1.26 -1.33 121.76 124.09 2dlo s ALA 36 Ca 0.68 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.84 2dlo s ALA 36 Cb -0.06 -1.53 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 2dlo s ALA 36 CO 0.48 0.33 -0.05 0.71 0.00 0.00 0.00 175.76 177.22 2dlo s TYR 37 N -0.02 0.87 0.50 0.00 1.51 0.16 -2.41 117.35 117.95 2dlo s TYR 37 Ca 0.02 -0.96 -0.21 0.00 -1.01 0.00 0.00 57.07 54.91 2dlo s TYR 37 Cb -0.13 -0.51 -0.07 0.00 -0.11 0.00 0.00 41.96 41.14 2dlo s TYR 37 CO 0.02 -0.20 1.11 -1.01 -1.11 0.00 0.00 175.55 174.36 2dlo s HIS 38 N -3.68 2.83 -2.00 2.71 3.76 -1.26 -1.28 115.29 116.37 2dlo s HIS 38 Ca 0.13 1.56 0.11 0.00 -0.15 0.00 0.00 55.06 56.70 2dlo s HIS 38 Cb 0.06 -3.24 0.64 0.00 1.11 0.00 0.00 32.58 31.15 2dlo s HIS 38 CO -0.05 -1.31 1.08 -0.35 -0.85 0.00 0.00 174.74 173.26 2dlo n PRO 39 N -0.96 0.49 0.00 8.40 -0.04 -1.26 -2.98 135.00 138.64 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 0.51 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 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 0.16 0.55 0.00 -1.26 -4.82 105.19 99.80 2dlo n GLY 40 Ca 0.08 0.00 -0.13 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 -4.49 1.13 -3.87 0.00 7.35 -1.16 -4.88 117.46 111.54 2dlo n PHE 42 Ca -0.05 0.24 -0.10 0.00 -0.76 0.00 0.00 57.45 56.79 2dlo n PHE 42 Cb 0.37 -2.52 -0.08 0.00 0.35 0.00 0.00 39.48 37.59 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 10.29 0.12 1.07 -2.13 -4.23 -1.26 -2.42 115.64 117.08 2dlo s THR 43 Ca 1.14 -1.03 -0.13 0.00 -1.18 0.00 0.00 61.69 60.49 2dlo s THR 43 Cb -0.69 -1.03 0.18 0.00 1.34 0.00 0.00 72.50 72.30 2dlo s THR 43 CO 0.38 -0.57 0.76 0.00 -0.54 0.00 0.00 174.62 174.65 2dlo n VAL 45 N -4.48 0.30 -0.00 0.00 0.24 -1.11 -3.44 118.33 109.84 2dlo n VAL 45 Ca 0.05 -0.56 -0.00 0.00 -2.04 0.00 0.00 64.34 61.80 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 -2.40 0.01 0.19 3.34 0.31 -1.26 -4.62 118.33 113.89 2dlo n VAL 46 Ca -0.07 0.50 0.08 0.00 -0.01 0.00 0.00 64.34 64.83 2dlo n VAL 46 Cb 0.65 -1.50 0.21 0.00 -0.91 0.00 0.00 33.84 32.28 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 -3.23 -1.55 -3.97 0.00 -0.00 -1.22 -4.96 115.22 100.29 2dlo n HIS 48 Ca 0.02 0.64 -0.33 0.00 -0.00 0.00 0.00 57.72 58.05 2dlo n HIS 48 Cb 0.58 -4.00 -0.05 0.00 -0.00 0.00 0.00 29.99 26.52 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 -5.09 3.30 -0.42 -0.41 1.70 -1.26 -4.61 118.95 112.15 2dlo s ARG 49 Ca 0.07 -0.41 -0.28 0.00 -0.47 0.00 0.00 55.73 54.65 2dlo s ARG 49 Cb -0.03 -3.00 -0.02 0.00 -0.57 0.00 0.00 34.95 31.33 2dlo s ARG 49 CO 0.49 0.65 1.80 0.20 -1.08 0.00 0.00 175.30 177.36 2dlo s GLY 50 N -1.99 0.62 -0.38 3.88 0.00 -1.26 -0.60 107.32 107.58 2dlo s GLY 50 Ca 0.27 -0.05 -0.02 0.00 0.00 0.00 0.00 44.72 44.92 2dlo s GLY 50 CO 0.19 3.29 2.41 1.04 0.00 0.00 0.00 173.10 180.03 2dlo n LEU 51 N 11.02 6.47 -4.32 0.66 4.77 -1.01 -4.84 117.00 129.74 2dlo n LEU 51 Ca 0.22 -3.67 -0.46 0.00 -0.03 0.00 0.00 56.01 52.06 2dlo n LEU 51 Cb 0.49 -1.15 -0.04 0.00 -2.33 0.00 0.00 43.42 40.39 2dlo n LEU 51 CO 0.69 1.48 0.26 1.51 -1.33 0.00 0.00 177.39 180.01 2dlo s ASP 52 N 0.26 6.41 0.00 -1.43 -4.77 -1.26 -4.12 116.67 111.76 2dlo s ASP 52 Ca 0.46 -2.12 0.00 0.00 -3.30 0.00 0.00 52.55 47.59 2dlo s ASP 52 Cb 0.32 -2.21 0.00 0.00 -1.09 0.00 0.00 42.92 39.93 2dlo s ASP 52 CO -0.10 -0.76 0.00 0.61 0.70 0.00 0.00 175.17 175.61 2dlo n GLY 53 N 4.77 1.12 3.23 2.12 0.00 -1.26 -5.11 105.19 110.06 2dlo n GLY 53 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 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 1.05 0.53 -0.61 -4.36 -1.26 -5.15 121.20 109.41 2dlo s ILE 54 Ca 0.00 -2.01 -0.20 0.00 -0.26 0.00 0.00 60.65 58.18 2dlo s ILE 54 Cb 0.00 -1.79 -0.06 0.00 1.25 0.00 0.00 42.46 41.86 2dlo s ILE 54 CO 0.00 -0.77 1.13 -2.16 0.24 0.00 0.00 174.94 173.39 2dlo s PRO 55 N -3.72 3.41 0.31 0.37 0.04 -1.26 -4.97 135.00 129.17 2dlo s PRO 55 Ca 0.15 1.63 -0.10 0.00 0.04 0.00 0.00 61.00 62.72 2dlo s PRO 55 Cb 0.03 -2.06 0.04 0.00 0.04 0.00 0.00 34.50 32.55 2dlo s PRO 55 CO -0.01 -0.81 0.59 1.97 0.04 0.00 0.00 177.00 178.78 2dlo n PHE 56 N -1.19 -1.94 -3.62 0.56 1.16 -1.26 -4.19 117.46 106.97 2dlo n PHE 56 Ca 0.11 -1.54 -0.14 0.00 -1.87 0.00 0.00 57.45 54.00 2dlo n PHE 56 Cb 0.51 0.69 -0.07 0.00 -1.61 0.00 0.00 39.48 38.99 2dlo n PHE 56 CO 0.00 0.00 0.00 -0.08 -1.87 0.00 0.00 176.76 174.81 2dlo s THR 57 N -2.37 0.00 0.49 1.97 -1.32 -1.22 -4.87 115.64 108.32 2dlo s THR 57 Ca 0.14 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.71 2dlo s THR 57 Cb -0.03 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.00 2dlo s THR 57 CO 0.11 0.00 0.64 0.68 -2.21 0.00 0.00 174.62 173.83 2dlo s VAL 58 N 0.23 2.56 0.39 5.08 -7.23 -1.26 0.11 120.40 120.28 2dlo s VAL 58 Ca -0.01 -1.05 0.01 0.00 -1.81 0.00 0.00 61.98 59.12 2dlo s VAL 58 Cb -0.05 -2.61 -0.00 0.00 0.56 0.00 0.00 36.38 34.28 2dlo s VAL 58 CO 0.02 0.00 0.04 -0.90 -0.31 0.00 0.00 175.10 173.95 2dlo n ASP 59 N -1.98 2.43 -0.32 4.85 5.75 -1.15 -4.87 116.55 121.26 2dlo n ASP 59 Ca 0.10 -2.81 0.17 0.00 -0.01 0.00 0.00 54.79 52.25 2dlo n ASP 59 Cb 0.61 0.49 0.42 0.00 -1.03 0.00 0.00 41.12 41.61 2dlo n ASP 59 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2dlo h ALA 60 N 1.34 1.95 -0.28 2.12 0.00 -2.01 0.48 119.26 122.86 2dlo h ALA 60 Ca -0.31 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 2dlo h ALA 60 Cb 1.03 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 2dlo h ALA 60 CO 0.51 -0.31 0.13 0.25 0.00 0.00 0.00 179.25 179.83 2dlo n THR 61 N -4.68 1.42 -4.22 0.00 -2.24 -1.26 -4.85 114.28 98.45 2dlo n THR 61 Ca 0.23 -0.58 -0.35 0.00 -2.27 0.00 0.00 64.05 61.08 2dlo n THR 61 Cb 0.69 -0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 68.23 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 0.05 -2.67 -4.32 3.42 2.88 0.17 -4.90 113.62 108.25 2dlo n SER 62 Ca 0.16 -1.04 -0.44 0.00 -1.33 0.00 0.00 58.87 56.22 2dlo n SER 62 Cb 0.77 -2.66 -0.07 0.00 -0.75 0.00 0.00 64.21 61.49 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 -6.93 2.86 -0.33 -1.46 -1.52 -1.25 -4.79 119.66 106.24 2dlo s GLN 63 Ca 0.63 -1.53 -0.27 0.00 -1.95 0.00 0.00 55.36 52.24 2dlo s GLN 63 Cb -0.35 -4.10 -0.05 0.00 -0.22 0.00 0.00 33.01 28.30 2dlo s GLN 63 CO 0.93 -1.13 2.19 0.42 -0.25 0.00 0.00 175.29 177.46 2dlo s ILE 64 N 1.56 3.10 -0.34 1.08 1.01 -1.26 -2.91 121.20 123.43 2dlo s ILE 64 Ca 0.04 0.09 -0.05 0.00 0.00 0.00 0.00 60.65 60.73 2dlo s ILE 64 Cb -0.26 -3.16 0.05 0.00 0.01 0.00 0.00 42.46 39.10 2dlo s ILE 64 CO 0.04 -0.12 0.10 -1.00 0.00 0.00 0.00 174.94 173.95 2dlo s HIS 65 N 9.24 3.30 0.20 3.97 3.76 0.12 -2.75 115.29 133.13 2dlo s HIS 65 Ca 0.95 -1.69 -0.30 0.00 -0.15 0.00 0.00 55.06 53.87 2dlo s HIS 65 Cb -0.26 -2.40 -0.16 0.00 1.11 0.00 0.00 32.58 30.87 2dlo s HIS 65 CO 0.31 -0.79 0.88 0.00 -0.85 0.00 0.00 174.74 174.29 2dlo n ILE 67 N 0.59 -0.38 -0.05 0.00 2.08 -1.26 0.29 119.36 120.62 2dlo n ILE 67 Ca 0.15 1.49 -0.03 0.00 0.56 0.00 0.00 62.75 64.92 2dlo n ILE 67 Cb 0.25 -1.90 -0.02 0.00 -0.75 0.00 0.00 39.64 37.22 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 -0.06 0.52 0.38 5.08 -1.93 -0.32 114.58 118.25 2dlo h GLU 68 Ca 0.15 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2dlo h GLU 68 Cb 0.31 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2dlo h GLU 68 CO -0.60 -0.04 -0.38 -0.44 -1.00 0.00 0.00 179.01 176.54 2dlo h ASP 69 N -0.07 -1.00 -0.05 1.42 3.32 -1.15 -2.76 116.42 116.13 2dlo h ASP 69 Ca 0.02 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2dlo h ASP 69 Cb 0.13 0.31 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2dlo h ASP 69 CO -0.16 -0.57 -0.03 0.33 -1.72 0.00 0.00 179.24 177.09 2dlo n PHE 70 N -5.51 -0.02 -0.08 4.55 7.35 0.15 -0.87 117.46 123.03 2dlo n PHE 70 Ca -0.12 0.06 -0.05 0.00 -0.76 0.00 0.00 57.45 56.58 2dlo n PHE 70 Cb 0.40 -0.41 -0.04 0.00 0.35 0.00 0.00 39.48 39.78 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 -0.62 -0.85 -5.13 3.86 -1.06 -1.21 115.15 110.14 2dlo h HIS 71 Ca 0.01 0.03 0.13 0.00 -1.16 0.00 0.00 60.37 59.38 2dlo h HIS 71 Cb 0.02 0.30 -0.14 0.00 1.06 0.00 0.00 27.41 28.65 2dlo h HIS 71 CO -0.76 -0.16 -0.33 0.54 0.86 0.00 0.00 177.93 178.07 2dlo n ARG 72 N -3.69 -0.20 -0.15 2.45 5.12 -0.64 0.67 116.66 120.22 2dlo n ARG 72 Ca -0.01 1.31 -0.08 0.00 -1.93 0.00 0.00 57.85 57.14 2dlo n ARG 72 Cb 0.11 -1.94 -0.02 0.00 -1.16 0.00 0.00 32.46 29.45 2dlo n ARG 72 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 2dlo h LYS 73 N 0.00 -0.24 -0.73 5.56 1.57 0.22 0.41 116.57 123.35 2dlo h LYS 73 Ca 0.29 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 2dlo h LYS 73 Cb 0.50 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2dlo h LYS 73 CO -0.84 -0.16 0.00 1.19 -0.57 0.00 0.00 179.45 179.07 2dlo n PHE 74 N -5.42 0.99 -4.37 -1.35 3.01 0.14 -4.88 117.46 105.58 2dlo n PHE 74 Ca 0.01 -0.35 -0.26 0.00 1.01 0.00 0.00 57.45 57.86 2dlo n PHE 74 Cb 0.35 -0.27 -0.10 0.00 -0.01 0.00 0.00 39.48 39.45 2dlo n PHE 74 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2dlo s ALA 75 N -1.84 2.79 -0.42 4.37 0.00 0.21 -5.02 121.76 121.86 2dlo s ALA 75 Ca 0.27 -1.62 -0.43 0.00 0.00 0.00 0.00 51.96 50.19 2dlo s ALA 75 Cb 0.20 -0.52 -0.17 0.00 0.00 0.00 0.00 23.12 22.63 2dlo s ALA 75 CO 0.09 0.40 1.88 -1.13 0.00 0.00 0.00 175.76 177.00 2dlo n SER 76 N -0.08 1.55 -1.40 0.00 3.41 -1.26 -4.85 113.62 110.99 2dlo n SER 76 Ca -0.10 0.91 -0.03 0.00 -0.26 0.00 0.00 58.87 59.39 2dlo n SER 76 Cb 0.57 -1.01 -0.00 0.00 -0.26 0.00 0.00 64.21 63.50 2dlo n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dlo n GLY 77 N 5.39 2.48 0.18 5.00 0.00 -1.26 -5.04 105.19 111.94 2dlo n GLY 77 Ca 0.38 -1.29 0.04 0.00 0.00 0.00 0.00 46.02 45.15 2dlo n GLY 77 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlo h PRO 78 N 0.00 0.00 -4.68 1.61 0.13 -1.96 -3.38 132.00 123.72 2dlo h PRO 78 Ca -0.06 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 64.35 2dlo h PRO 78 Cb 0.25 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.18 2dlo h PRO 78 CO 0.08 0.40 0.67 -1.12 -0.23 0.00 0.00 178.00 177.80 2dlo s SER 79 N -6.68 6.70 0.84 1.44 0.01 -1.26 -5.03 113.70 109.72 2dlo s SER 79 Ca -0.02 -2.30 -0.12 0.00 1.31 0.00 0.00 55.95 54.83 2dlo s SER 79 Cb 0.13 -2.35 0.09 0.00 0.21 0.00 0.00 66.02 64.10 2dlo s SER 79 CO 0.71 -0.90 1.10 -0.94 0.41 0.00 0.00 173.24 173.61 2dlo s SER 80 N 3.16 4.13 0.00 2.44 1.04 -1.26 -5.06 113.70 118.16 2dlo s SER 80 Ca 0.30 1.29 0.00 0.00 0.48 0.00 0.00 55.95 58.01 2dlo s SER 80 Cb -0.06 -1.99 0.00 0.00 0.10 0.00 0.00 66.02 64.07 2dlo s SER 80 CO -0.09 -2.19 0.00 0.61 0.98 0.00 0.00 173.24 172.55