#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 3.61 -0.09 1.61 1.04 -1.26 -5.15 113.70 113.46 2dlo s SER 2 Ca 0.00 -1.20 -0.06 0.00 0.48 0.00 0.00 55.95 55.18 2dlo s SER 2 Cb 0.00 -0.33 0.04 0.00 0.10 0.00 0.00 66.02 65.83 2dlo s SER 2 CO 0.00 -0.22 0.23 -0.55 0.98 0.00 0.00 173.24 173.68 2dlo s SER 3 N -3.59 -0.24 0.19 7.02 0.15 -1.26 -5.16 113.70 110.82 2dlo s SER 3 Ca 0.32 0.48 -0.24 0.00 0.70 0.00 0.00 55.95 57.21 2dlo s SER 3 Cb 0.03 0.39 0.06 0.00 -1.71 0.00 0.00 66.02 64.78 2dlo s SER 3 CO 0.16 -0.14 0.91 -0.83 1.20 0.00 0.00 173.24 174.54 2dlo s GLY 4 N 0.98 -0.15 0.15 9.45 0.00 -1.26 -5.19 107.32 111.30 2dlo s GLY 4 Ca -0.07 -0.03 -0.24 0.00 0.00 0.00 0.00 44.72 44.37 2dlo s GLY 4 CO -0.06 0.15 1.05 -1.35 0.00 0.00 0.00 173.10 172.88 2dlo s SER 5 N -2.98 -0.06 0.44 1.64 1.04 -1.26 -5.17 113.70 107.36 2dlo s SER 5 Ca 0.13 -0.52 -0.15 0.00 0.48 0.00 0.00 55.95 55.89 2dlo s SER 5 Cb -0.02 0.45 -0.08 0.00 0.10 0.00 0.00 66.02 66.47 2dlo s SER 5 CO 0.04 -0.87 0.88 -0.55 0.98 0.00 0.00 173.24 173.72 2dlo s SER 6 N -3.23 6.65 -0.37 7.02 0.15 -1.26 -5.05 113.70 117.62 2dlo s SER 6 Ca 0.18 1.41 0.01 0.00 0.70 0.00 0.00 55.95 58.25 2dlo s SER 6 Cb -0.01 -2.44 0.10 0.00 -1.71 0.00 0.00 66.02 61.96 2dlo s SER 6 CO 0.03 -0.45 0.11 -0.83 1.20 0.00 0.00 173.24 173.31 2dlo s GLY 7 N -2.87 1.96 -0.10 9.45 0.00 -1.26 -5.09 107.32 109.41 2dlo s GLY 7 Ca 0.56 -2.54 -0.06 0.00 0.00 0.00 0.00 44.72 42.69 2dlo s GLY 7 CO 0.27 0.98 0.14 1.85 0.00 0.00 0.00 173.10 176.33 2dlo s GLU 8 N 1.00 3.41 -0.17 2.90 2.12 -1.26 -5.09 118.70 121.61 2dlo s GLU 8 Ca 0.10 -0.18 -0.07 0.00 0.36 0.00 0.00 54.97 55.19 2dlo s GLU 8 Cb -0.21 -3.15 0.08 0.00 0.26 0.00 0.00 34.13 31.11 2dlo s GLU 8 CO -0.06 0.76 0.37 0.20 -0.54 0.00 0.00 175.26 175.98 2dlo s GLY 9 N -1.16 -0.28 -1.28 -1.50 0.00 -1.26 -5.07 107.32 96.76 2dlo s GLY 9 Ca 0.17 1.33 -0.12 0.00 0.00 0.00 0.00 44.72 46.10 2dlo s GLY 9 CO 0.06 2.09 1.78 0.00 0.00 0.00 0.00 173.10 177.04 2dlo s TYR 11 N 1.33 0.16 -0.08 0.00 5.04 -1.26 -5.14 117.35 117.41 2dlo s TYR 11 Ca 0.42 0.15 0.01 0.00 -2.44 0.00 0.00 57.07 55.21 2dlo s TYR 11 Cb 0.06 -0.46 0.02 0.00 0.35 0.00 0.00 41.96 41.93 2dlo s TYR 11 CO -0.00 -0.18 -0.09 0.14 -1.34 0.00 0.00 175.55 174.08 2dlo s VAL 12 N 1.78 1.01 0.32 3.14 -7.23 -1.26 -5.09 120.40 113.07 2dlo s VAL 12 Ca 0.00 -0.35 -0.08 0.00 -1.81 0.00 0.00 61.98 59.74 2dlo s VAL 12 Cb -0.12 -0.98 0.03 0.00 0.56 0.00 0.00 36.38 35.87 2dlo s VAL 12 CO -0.03 0.34 0.58 0.00 -0.31 0.00 0.00 175.10 175.68 2dlo n ALA 13 N 4.32 -1.03 -2.02 1.32 0.00 -1.26 -5.06 120.51 116.78 2dlo n ALA 13 Ca -0.19 -1.21 -0.27 0.00 0.00 0.00 0.00 53.44 51.77 2dlo n ALA 13 Cb 0.51 0.97 -0.07 0.00 0.00 0.00 0.00 19.45 20.86 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 -2.44 3.49 -0.19 0.00 -4.23 -1.26 -4.82 115.64 106.18 2dlo s THR 14 Ca 0.18 -0.83 -0.17 0.00 -1.18 0.00 0.00 61.69 59.68 2dlo s THR 14 Cb -0.03 -4.52 0.05 0.00 1.34 0.00 0.00 72.50 69.35 2dlo s THR 14 CO 0.13 -0.89 0.51 -1.48 -0.54 0.00 0.00 174.62 172.35 2dlo s LEU 15 N 11.71 0.03 0.12 4.79 0.05 -1.26 -5.15 118.68 128.97 2dlo s LEU 15 Ca 0.70 1.03 -0.30 0.00 0.05 0.00 0.00 54.13 55.61 2dlo s LEU 15 Cb -0.01 1.75 -0.06 0.00 -2.05 0.00 0.00 46.19 45.82 2dlo s LEU 15 CO 0.14 -0.18 0.97 -1.61 -0.55 0.00 0.00 176.35 175.12 2dlo s GLU 16 N 0.33 4.70 -0.12 1.48 2.02 -1.26 -4.88 118.70 120.98 2dlo s GLU 16 Ca -0.01 1.47 -0.14 0.00 0.02 0.00 0.00 54.97 56.31 2dlo s GLU 16 Cb -0.04 -3.37 -0.05 0.00 0.10 0.00 0.00 34.13 30.78 2dlo s GLU 16 CO -0.00 0.22 0.34 0.15 0.02 0.00 0.00 175.26 175.99 2dlo s LYS 17 N -0.08 4.13 0.20 1.61 1.02 -1.26 -2.08 119.74 123.28 2dlo s LYS 17 Ca 0.47 0.21 -0.33 0.00 0.02 0.00 0.00 55.97 56.34 2dlo s LYS 17 Cb -0.24 -3.36 -0.13 0.00 -0.52 0.00 0.00 37.83 33.57 2dlo s LYS 17 CO 0.30 0.36 1.54 0.00 -0.92 0.00 0.00 175.35 176.63 2dlo n ALA 19 N 2.88 3.20 -0.02 0.00 0.00 -1.05 -1.69 120.51 123.82 2dlo n ALA 19 Ca 0.14 -1.06 -0.04 0.00 0.00 0.00 0.00 53.44 52.48 2dlo n ALA 19 Cb 0.31 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.68 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 0.41 0.27 0.33 0.00 -1.04 -1.26 -4.79 114.28 108.19 2dlo n THR 20 Ca 0.16 -0.08 0.03 0.00 -2.04 0.00 0.00 64.05 62.12 2dlo n THR 20 Cb 0.74 -1.21 -0.02 0.00 -1.82 0.00 0.00 70.33 68.03 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 -0.68 -3.13 -4.12 0.00 7.64 -0.68 -5.04 113.62 107.61 2dlo n SER 22 Ca 0.02 -0.50 -0.18 0.00 1.01 0.00 0.00 58.87 59.22 2dlo n SER 22 Cb 0.14 -4.12 -0.13 0.00 -1.01 0.00 0.00 64.21 59.09 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 -4.76 0.81 -0.09 1.43 -0.21 -1.23 -4.88 119.66 110.73 2dlo s GLN 23 Ca 0.11 -0.76 -0.30 0.00 0.02 0.00 0.00 55.36 54.43 2dlo s GLN 23 Cb -0.01 -0.78 -0.04 0.00 1.00 0.00 0.00 33.01 33.18 2dlo s GLN 23 CO 0.57 0.18 1.51 -1.25 -2.12 0.00 0.00 175.29 174.19 2dlo s PRO 24 N -1.27 4.20 0.04 2.91 0.04 -1.26 0.12 135.00 139.78 2dlo s PRO 24 Ca -0.01 2.01 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 2dlo s PRO 24 Cb -0.08 -3.90 -0.05 0.00 0.04 0.00 0.00 34.50 30.51 2dlo s PRO 24 CO 0.01 -0.79 1.11 0.42 0.04 0.00 0.00 177.00 177.79 2dlo s ILE 25 N 3.80 4.35 0.00 0.56 1.01 -0.89 -4.89 121.20 125.15 2dlo s ILE 25 Ca 0.67 1.71 0.00 0.00 0.00 0.00 0.00 60.65 63.02 2dlo s ILE 25 Cb -0.29 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.08 2dlo s ILE 25 CO 0.24 0.14 0.00 0.18 0.00 0.00 0.00 174.94 175.51 2dlo n LEU 26 N 3.83 1.26 0.04 2.97 4.77 -1.26 -4.65 117.00 123.96 2dlo n LEU 26 Ca 0.07 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.04 2dlo n LEU 26 Cb 0.48 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 2dlo n LEU 26 CO 0.54 0.15 0.42 0.44 -1.33 0.00 0.00 177.39 177.61 2dlo h ASP 27 N 0.00 -0.08 -4.12 -1.43 3.32 -2.02 -3.46 116.42 108.62 2dlo h ASP 27 Ca 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 2dlo h ASP 27 Cb 0.59 0.02 -0.25 0.00 0.22 0.00 0.00 39.33 39.91 2dlo h ASP 27 CO 0.00 -0.05 -0.51 -0.60 -1.72 0.00 0.00 179.24 176.36 2dlo s ARG 28 N -2.89 0.28 -0.31 3.56 3.52 -1.26 -5.14 118.95 116.70 2dlo s ARG 28 Ca -0.01 0.06 -0.07 0.00 -0.13 0.00 0.00 55.73 55.57 2dlo s ARG 28 Cb 0.00 0.13 0.02 0.00 -1.56 0.00 0.00 34.95 33.53 2dlo s ARG 28 CO 0.04 -0.05 0.10 0.42 -0.81 0.00 0.00 175.30 175.00 2dlo s ILE 29 N -0.32 4.04 -0.34 4.11 1.01 -1.26 -4.44 121.20 123.99 2dlo s ILE 29 Ca -0.04 -0.77 -0.12 0.00 0.00 0.00 0.00 60.65 59.71 2dlo s ILE 29 Cb -0.03 -3.14 -0.01 0.00 0.01 0.00 0.00 42.46 39.29 2dlo s ILE 29 CO 0.01 -0.00 0.23 -0.22 0.00 0.00 0.00 174.94 174.95 2dlo s LEU 30 N 1.50 4.50 -0.16 2.97 0.20 -0.58 -4.97 118.68 122.13 2dlo s LEU 30 Ca 0.02 -0.48 -0.28 0.00 0.69 0.00 0.00 54.13 54.08 2dlo s LEU 30 Cb -0.18 -2.12 -0.01 0.00 -0.43 0.00 0.00 46.19 43.46 2dlo s LEU 30 CO 0.03 -0.24 0.97 -0.13 -0.29 0.00 0.00 176.35 176.69 2dlo s ARG 31 N 1.70 4.34 -0.18 1.98 0.52 -1.26 -0.63 118.95 125.41 2dlo s ARG 31 Ca 0.06 1.27 -0.12 0.00 -0.52 0.00 0.00 55.73 56.42 2dlo s ARG 31 Cb -0.17 -3.58 0.06 0.00 0.52 0.00 0.00 34.95 31.77 2dlo s ARG 31 CO 0.10 -0.41 0.46 0.00 0.02 0.00 0.00 175.30 175.46 2dlo s ALA 32 N 2.41 -1.17 -1.64 2.13 0.00 -0.45 -4.89 121.76 118.15 2dlo s ALA 32 Ca 0.44 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.94 2dlo s ALA 32 Cb -0.17 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.04 2dlo s ALA 32 CO 0.13 -0.26 0.00 -1.33 0.00 0.00 0.00 175.76 174.30 2dlo n MET 33 N 3.73 -1.41 0.00 0.00 2.81 -1.26 -2.35 117.12 118.64 2dlo n MET 33 Ca -0.19 0.94 0.00 0.00 -1.81 0.00 0.00 57.70 56.64 2dlo n MET 33 Cb 0.56 -5.39 0.00 0.00 -0.71 0.00 0.00 33.22 27.68 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 -0.95 1.88 3.96 3.03 0.00 -1.26 -4.97 105.19 106.88 2dlo n GLY 34 Ca -0.21 -0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.35 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 1.28 -0.15 1.61 1.02 -0.99 -5.07 119.74 117.44 2dlo s LYS 35 Ca 0.00 -0.75 -0.05 0.00 0.02 0.00 0.00 55.97 55.19 2dlo s LYS 35 Cb 0.00 -2.12 -0.03 0.00 -0.52 0.00 0.00 37.83 35.16 2dlo s LYS 35 CO 0.00 -1.84 0.01 0.00 -0.92 0.00 0.00 175.35 172.61 2dlo s ALA 36 N -3.46 3.23 0.08 5.17 0.00 -1.26 -1.34 121.76 124.17 2dlo s ALA 36 Ca 0.69 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.88 2dlo s ALA 36 Cb -0.05 -1.70 -0.04 0.00 0.00 0.00 0.00 23.12 21.33 2dlo s ALA 36 CO 0.48 0.27 -0.06 0.71 0.00 0.00 0.00 175.76 177.17 2dlo s TYR 37 N 0.13 0.76 0.59 0.00 1.51 0.19 -2.52 117.35 118.01 2dlo s TYR 37 Ca 0.02 -0.91 -0.18 0.00 -1.01 0.00 0.00 57.07 54.99 2dlo s TYR 37 Cb -0.13 -0.47 -0.03 0.00 -0.11 0.00 0.00 41.96 41.22 2dlo s TYR 37 CO 0.02 -0.20 1.14 -1.01 -1.11 0.00 0.00 175.55 174.38 2dlo s HIS 38 N -3.47 2.58 -2.00 2.71 3.76 -1.26 -1.53 115.29 116.08 2dlo s HIS 38 Ca 0.08 1.54 0.10 0.00 -0.15 0.00 0.00 55.06 56.63 2dlo s HIS 38 Cb 0.04 -3.30 0.57 0.00 1.11 0.00 0.00 32.58 31.00 2dlo s HIS 38 CO -0.06 -1.77 1.01 -0.35 -0.85 0.00 0.00 174.74 172.73 2dlo n PRO 39 N -1.70 0.49 0.00 8.40 -0.04 -1.26 -2.78 135.00 138.11 2dlo n PRO 39 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2dlo n PRO 39 Cb 0.51 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 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 -0.15 0.00 0.00 0.00 0.00 46.02 45.95 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 -4.47 1.08 -3.86 0.00 7.35 -1.18 -4.88 117.46 111.50 2dlo n PHE 42 Ca -0.08 0.23 -0.11 0.00 -0.76 0.00 0.00 57.45 56.73 2dlo n PHE 42 Cb 0.47 -2.53 -0.09 0.00 0.35 0.00 0.00 39.48 37.68 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 10.86 0.09 1.02 -2.13 -4.23 -1.26 -2.32 115.64 117.67 2dlo s THR 43 Ca 1.14 -0.73 -0.17 0.00 -1.18 0.00 0.00 61.69 60.75 2dlo s THR 43 Cb -0.63 -0.55 0.01 0.00 1.34 0.00 0.00 72.50 72.67 2dlo s THR 43 CO 0.36 -0.40 -0.08 0.00 -0.54 0.00 0.00 174.62 173.95 2dlo n VAL 45 N -3.68 0.17 0.00 0.00 0.24 -1.08 -3.42 118.33 110.55 2dlo n VAL 45 Ca 0.03 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.87 2dlo n VAL 45 Cb 0.59 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 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 -2.28 0.00 0.22 3.34 0.31 -1.26 -4.66 118.33 114.00 2dlo n VAL 46 Ca -0.02 0.39 0.11 0.00 -0.01 0.00 0.00 64.34 64.81 2dlo n VAL 46 Cb 0.54 -1.37 0.30 0.00 -0.91 0.00 0.00 33.84 32.40 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 -1.84 -4.01 0.00 -0.00 -1.22 -4.96 115.22 100.02 2dlo n HIS 48 Ca 0.02 0.73 -0.31 0.00 -0.00 0.00 0.00 57.72 58.17 2dlo n HIS 48 Cb 0.50 -4.26 -0.06 0.00 -0.00 0.00 0.00 29.99 26.18 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 -4.77 3.05 -0.26 -0.41 1.70 -1.26 -4.64 118.95 112.36 2dlo s ARG 49 Ca 0.12 -0.61 -0.29 0.00 -0.47 0.00 0.00 55.73 54.49 2dlo s ARG 49 Cb -0.02 -2.82 -0.03 0.00 -0.57 0.00 0.00 34.95 31.51 2dlo s ARG 49 CO 0.59 0.58 1.76 0.20 -1.08 0.00 0.00 175.30 177.36 2dlo s GLY 50 N -2.40 0.98 -0.53 3.88 0.00 -1.26 -1.13 107.32 106.86 2dlo s GLY 50 Ca 0.31 0.44 -0.01 0.00 0.00 0.00 0.00 44.72 45.46 2dlo s GLY 50 CO 0.23 3.21 1.98 1.04 0.00 0.00 0.00 173.10 179.57 2dlo n LEU 51 N 9.48 7.13 -4.39 0.66 4.77 -0.98 -4.82 117.00 128.85 2dlo n LEU 51 Ca 0.22 -3.86 -0.44 0.00 -0.03 0.00 0.00 56.01 51.89 2dlo n LEU 51 Cb 0.46 -0.96 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 2dlo n LEU 51 CO 0.67 1.31 1.19 -0.90 -1.33 0.00 0.00 177.39 178.33 2dlo n ASP 52 N -0.63 5.36 0.00 -1.43 5.75 -1.26 -3.94 116.55 120.39 2dlo n ASP 52 Ca 0.53 -3.01 0.00 0.00 -0.01 0.00 0.00 54.79 52.30 2dlo n ASP 52 Cb 0.81 -1.49 0.00 0.00 -1.03 0.00 0.00 41.12 39.41 2dlo n ASP 52 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dlo n GLY 53 N 3.47 1.71 3.08 6.12 0.00 -1.26 -5.14 105.19 113.17 2dlo n GLY 53 Ca 0.32 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.74 0.19 0.46 -0.61 -4.36 -1.25 -5.15 121.20 108.74 2dlo s ILE 54 Ca 0.00 -1.58 -0.23 0.00 -0.26 0.00 0.00 60.65 58.59 2dlo s ILE 54 Cb 0.00 -1.27 -0.07 0.00 1.25 0.00 0.00 42.46 42.37 2dlo s ILE 54 CO 0.00 -0.87 1.16 -2.16 0.24 0.00 0.00 174.94 173.31 2dlo s PRO 55 N -3.44 3.76 0.27 0.37 0.04 -1.26 -4.97 135.00 129.76 2dlo s PRO 55 Ca 0.02 1.77 -0.15 0.00 0.04 0.00 0.00 61.00 62.68 2dlo s PRO 55 Cb 0.04 -2.40 0.01 0.00 0.04 0.00 0.00 34.50 32.19 2dlo s PRO 55 CO -0.08 -0.55 0.58 -0.59 0.04 0.00 0.00 177.00 176.39 2dlo s PHE 56 N -1.55 0.21 -0.10 0.56 -0.12 -1.26 -3.92 117.98 111.80 2dlo s PHE 56 Ca 0.64 -0.62 -0.12 0.00 -0.05 0.00 0.00 56.93 56.77 2dlo s PHE 56 Cb -0.28 0.38 0.03 0.00 -0.63 0.00 0.00 43.02 42.52 2dlo s PHE 56 CO 0.34 -1.12 0.33 -0.08 -0.05 0.00 0.00 175.22 174.64 2dlo s THR 57 N -3.80 0.01 0.34 -4.49 -1.32 -1.15 -4.91 115.64 100.32 2dlo s THR 57 Ca 0.19 -0.09 0.07 0.00 -1.21 0.00 0.00 61.69 60.65 2dlo s THR 57 Cb -0.03 -0.50 -0.01 0.00 -1.51 0.00 0.00 72.50 70.46 2dlo s THR 57 CO 0.09 -0.05 0.46 0.68 -2.21 0.00 0.00 174.62 173.59 2dlo s VAL 58 N -0.10 3.94 0.37 5.08 -7.23 -1.26 -0.58 120.40 120.61 2dlo s VAL 58 Ca -0.03 -1.03 0.01 0.00 -1.81 0.00 0.00 61.98 59.12 2dlo s VAL 58 Cb -0.03 -3.36 0.01 0.00 0.56 0.00 0.00 36.38 33.56 2dlo s VAL 58 CO 0.01 -0.15 0.05 -0.90 -0.31 0.00 0.00 175.10 173.80 2dlo n ASP 59 N -1.63 2.89 -0.35 4.85 5.75 -1.22 -4.87 116.55 121.98 2dlo n ASP 59 Ca 0.00 -2.56 0.15 0.00 -0.01 0.00 0.00 54.79 52.37 2dlo n ASP 59 Cb 0.58 0.21 0.35 0.00 -1.03 0.00 0.00 41.12 41.23 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 1.10 1.73 -0.29 2.12 0.00 -2.00 0.56 119.26 122.48 2dlo h ALA 60 Ca -0.30 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 2dlo h ALA 60 Cb 0.92 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 2dlo h ALA 60 CO 0.49 -0.14 0.13 0.25 0.00 0.00 0.00 179.25 179.97 2dlo n THR 61 N -4.82 1.43 -4.17 0.00 -2.24 -1.26 -4.85 114.28 98.36 2dlo n THR 61 Ca 0.25 -0.61 -0.33 0.00 -2.27 0.00 0.00 64.05 61.09 2dlo n THR 61 Cb 0.65 -0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 68.22 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 -2.08 -4.32 3.42 2.88 0.20 -4.89 113.62 108.89 2dlo n SER 62 Ca 0.16 -1.04 -0.46 0.00 -1.33 0.00 0.00 58.87 56.20 2dlo n SER 62 Cb 0.77 -2.69 -0.04 0.00 -0.75 0.00 0.00 64.21 61.50 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 -6.88 3.14 -0.31 -1.46 -1.52 -1.25 -4.78 119.66 106.60 2dlo s GLN 63 Ca 0.48 -1.87 -0.28 0.00 -1.95 0.00 0.00 55.36 51.74 2dlo s GLN 63 Cb -0.27 -4.33 -0.06 0.00 -0.22 0.00 0.00 33.01 28.13 2dlo s GLN 63 CO 0.93 -1.33 2.27 -0.89 -0.25 0.00 0.00 175.29 176.02 2dlo n ILE 64 N 4.96 0.22 -3.97 1.08 5.41 -1.26 -3.38 119.36 122.42 2dlo n ILE 64 Ca -0.07 -0.51 -0.34 0.00 1.00 0.00 0.00 62.75 62.82 2dlo n ILE 64 Cb 0.42 -2.50 -0.15 0.00 -0.71 0.00 0.00 39.64 36.71 2dlo n ILE 64 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 2dlo s HIS 65 N 9.15 2.91 0.29 1.39 3.76 0.25 -2.63 115.29 130.40 2dlo s HIS 65 Ca 1.02 -1.16 -0.29 0.00 -0.15 0.00 0.00 55.06 54.47 2dlo s HIS 65 Cb -0.37 -2.05 -0.13 0.00 1.11 0.00 0.00 32.58 31.14 2dlo s HIS 65 CO 0.35 -0.63 1.25 0.00 -0.85 0.00 0.00 174.74 174.86 2dlo n ILE 67 N 0.87 -0.40 -0.14 0.00 2.08 -1.25 -0.26 119.36 120.26 2dlo n ILE 67 Ca 0.09 1.62 -0.08 0.00 0.56 0.00 0.00 62.75 64.94 2dlo n ILE 67 Cb 0.33 -2.09 -0.06 0.00 -0.75 0.00 0.00 39.64 37.06 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 -0.17 0.20 0.38 3.07 -1.92 0.88 114.58 117.02 2dlo h GLU 68 Ca 0.19 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 2dlo h GLU 68 Cb 0.36 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 2dlo h GLU 68 CO -0.67 -0.12 -0.21 -0.44 -1.40 0.00 0.00 179.01 176.18 2dlo h ASP 69 N -0.18 -0.57 -0.94 1.42 5.19 -0.96 -1.48 116.42 118.91 2dlo h ASP 69 Ca 0.06 0.05 0.27 0.00 -0.62 0.00 0.00 57.03 56.80 2dlo h ASP 69 Cb 0.34 0.20 -0.16 0.00 0.18 0.00 0.00 39.33 39.89 2dlo h ASP 69 CO -0.44 -0.31 0.20 0.15 -3.12 0.00 0.00 179.24 175.71 2dlo h PHE 70 N -0.45 0.26 0.32 4.55 3.57 0.00 0.35 116.94 125.54 2dlo h PHE 70 Ca 0.00 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2dlo h PHE 70 Cb 0.43 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.21 2dlo h PHE 70 CO -0.16 -0.34 -0.15 0.45 -2.23 0.00 0.00 178.31 175.88 2dlo h HIS 71 N 0.10 -0.40 -0.52 0.41 3.86 -0.37 -2.43 115.15 115.81 2dlo h HIS 71 Ca 0.61 -0.01 0.07 0.00 -1.16 0.00 0.00 60.37 59.88 2dlo h HIS 71 Cb 1.32 0.13 -0.10 0.00 1.06 0.00 0.00 27.41 29.82 2dlo h HIS 71 CO -0.32 -0.25 -0.49 0.00 0.86 0.00 0.00 177.93 177.73 2dlo h ARG 72 N -0.68 -0.28 -0.38 2.45 3.08 -0.50 0.60 114.38 118.68 2dlo h ARG 72 Ca -0.04 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.10 2dlo h ARG 72 Cb 0.33 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.35 2dlo h ARG 72 CO 0.07 -0.19 -0.36 -0.22 -1.07 0.00 0.00 179.97 178.21 2dlo h LYS 73 N -0.29 -0.28 -0.80 0.04 3.64 -0.44 0.50 116.57 118.93 2dlo h LYS 73 Ca 0.13 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2dlo h LYS 73 Cb 0.57 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 2dlo h LYS 73 CO -0.66 -0.19 0.00 1.19 -2.27 0.00 0.00 179.45 177.53 2dlo n PHE 74 N -5.42 0.34 -2.20 1.91 3.01 -0.52 -3.77 117.46 110.81 2dlo n PHE 74 Ca 0.00 -0.12 -0.21 0.00 1.01 0.00 0.00 57.45 58.13 2dlo n PHE 74 Cb 0.34 -0.15 0.02 0.00 -0.01 0.00 0.00 39.48 39.69 2dlo n PHE 74 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2dlo n ALA 75 N 0.08 4.72 -2.81 4.37 0.00 0.20 -4.98 120.51 122.08 2dlo n ALA 75 Ca 0.05 -3.74 -0.28 0.00 0.00 0.00 0.00 53.44 49.47 2dlo n ALA 75 Cb 0.37 -0.43 -0.05 0.00 0.00 0.00 0.00 19.45 19.33 2dlo n ALA 75 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dlo s SER 76 N -3.60 5.65 -0.01 0.00 0.15 -1.23 -4.90 113.70 109.75 2dlo s SER 76 Ca 0.47 -0.04 -0.28 0.00 0.70 0.00 0.00 55.95 56.80 2dlo s SER 76 Cb 0.40 -1.53 0.07 0.00 -1.71 0.00 0.00 66.02 63.25 2dlo s SER 76 CO -0.00 0.10 0.63 -0.83 1.20 0.00 0.00 173.24 174.34 2dlo s GLY 77 N -2.87 -0.55 0.46 9.45 0.00 -1.26 -5.17 107.32 107.39 2dlo s GLY 77 Ca 0.31 1.08 -0.08 0.00 0.00 0.00 0.00 44.72 46.03 2dlo s GLY 77 CO 0.24 0.74 0.41 -1.55 0.00 0.00 0.00 173.10 172.93 2dlo n PRO 78 N 0.69 -1.82 -0.08 2.90 -0.04 -1.26 -5.05 135.00 130.35 2dlo n PRO 78 Ca -0.19 -0.65 -0.17 0.00 -0.04 0.00 0.00 63.50 62.46 2dlo n PRO 78 Cb 0.58 -0.61 -0.06 0.00 -0.04 0.00 0.00 33.50 33.38 2dlo n PRO 78 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dlo n SER 79 N -3.70 1.26 -4.64 3.54 3.41 -1.26 -4.94 113.62 107.29 2dlo n SER 79 Ca 0.06 0.22 -0.43 0.00 -0.26 0.00 0.00 58.87 58.45 2dlo n SER 79 Cb 0.22 -0.52 -0.02 0.00 -0.26 0.00 0.00 64.21 63.63 2dlo n SER 79 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dlo s SER 80 N -6.46 6.73 0.00 4.04 0.15 -1.26 -5.38 113.70 111.52 2dlo s SER 80 Ca -0.23 1.40 0.27 0.00 0.70 0.00 0.00 55.95 58.09 2dlo s SER 80 Cb 0.08 -2.54 0.76 0.00 -1.71 0.00 0.00 66.02 62.62 2dlo s SER 80 CO 0.30 -1.00 1.58 0.61 1.20 0.00 0.00 173.24 175.93