#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2daf n SER 2 N 0.00 -2.96 -4.34 1.61 2.88 -1.26 -4.96 113.62 104.59 2daf n SER 2 Ca 0.00 -0.93 -0.18 0.00 -1.33 0.00 0.00 58.87 56.43 2daf n SER 2 Cb 0.00 -3.23 -0.10 0.00 -0.75 0.00 0.00 64.21 60.13 2daf n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2daf s SER 3 N -3.60 2.00 0.76 -3.46 0.15 -1.26 -5.13 113.70 103.16 2daf s SER 3 Ca 0.51 -1.20 -0.15 0.00 0.70 0.00 0.00 55.95 55.82 2daf s SER 3 Cb -0.27 -0.02 0.04 0.00 -1.71 0.00 0.00 66.02 64.05 2daf s SER 3 CO 0.88 -0.47 1.05 0.61 1.20 0.00 0.00 173.24 176.51 2daf n GLY 4 N -0.43 -0.30 0.09 9.45 0.00 -1.26 -4.98 105.19 107.76 2daf n GLY 4 Ca -0.05 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.42 2daf n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2daf h SER 5 N -0.52 0.00 -4.29 1.61 0.87 -2.04 -3.48 113.55 105.69 2daf h SER 5 Ca -0.47 -0.29 -0.49 0.00 -1.23 0.00 0.00 61.79 59.31 2daf h SER 5 Cb 1.32 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 63.02 2daf h SER 5 CO 0.46 1.17 -0.81 -0.44 -0.53 0.00 0.00 176.83 176.69 2daf s SER 6 N -6.37 1.89 0.65 6.23 0.01 -1.26 -5.15 113.70 109.69 2daf s SER 6 Ca -0.23 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 56.59 2daf s SER 6 Cb 0.04 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2daf s SER 6 CO 0.43 0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.78 2daf n GLY 7 N 2.02 -3.22 0.06 3.44 0.00 -1.26 -4.99 105.19 101.25 2daf n GLY 7 Ca -0.17 -1.07 -0.03 0.00 0.00 0.00 0.00 46.02 44.75 2daf n GLY 7 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2daf h GLN 8 N 0.00 0.00 -5.22 1.61 4.15 -2.05 -3.46 115.11 110.15 2daf h GLN 8 Ca 0.00 0.00 -0.61 0.00 0.77 0.00 0.00 58.65 58.81 2daf h GLN 8 Cb 0.00 0.00 -0.13 0.00 0.21 0.00 0.00 27.48 27.56 2daf h GLN 8 CO 0.00 0.03 -0.37 -1.21 -1.93 0.00 0.00 178.83 175.35 2daf s GLU 9 N -1.94 4.11 0.20 1.69 2.02 -1.26 -5.05 118.70 118.47 2daf s GLU 9 Ca -0.09 -0.06 -0.31 0.00 0.02 0.00 0.00 54.97 54.53 2daf s GLU 9 Cb 0.01 -3.55 -0.11 0.00 0.10 0.00 0.00 34.13 30.59 2daf s GLU 9 CO 0.14 -0.01 1.57 0.45 0.02 0.00 0.00 175.26 177.44 2daf s SER 10 N 1.10 6.53 0.00 -0.19 0.15 -1.26 -4.89 113.70 115.14 2daf s SER 10 Ca 0.13 2.71 0.00 0.00 0.70 0.00 0.00 55.95 59.49 2daf s SER 10 Cb -0.14 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2daf s SER 10 CO 0.06 -0.84 0.00 0.52 1.20 0.00 0.00 173.24 174.18 2daf n VAL 11 N 3.43 0.00 -3.91 4.45 0.31 -1.26 -5.01 118.33 116.34 2daf n VAL 11 Ca 0.12 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.14 2daf n VAL 11 Cb 0.38 -1.02 -0.07 0.00 -0.91 0.00 0.00 33.84 32.22 2daf n VAL 11 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2daf n GLU 12 N -2.73 -0.83 0.02 5.55 0.28 -1.26 -4.73 120.64 116.93 2daf n GLU 12 Ca 0.00 0.10 -0.02 0.00 -0.16 0.00 0.00 57.16 57.08 2daf n GLU 12 Cb 0.45 -3.44 -0.01 0.00 1.43 0.00 0.00 31.44 29.87 2daf n GLU 12 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2daf n ASP 13 N -1.91 1.24 0.30 -1.84 2.03 -1.26 -4.69 116.55 110.42 2daf n ASP 13 Ca -0.02 0.17 0.16 0.00 0.52 0.00 0.00 54.79 55.62 2daf n ASP 13 Cb 0.42 -0.41 0.93 0.00 -0.72 0.00 0.00 41.12 41.34 2daf n ASP 13 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2daf h SER 14 N -0.21 0.00 -4.11 1.67 0.02 -1.96 -3.32 113.55 105.63 2daf h SER 14 Ca -0.01 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.39 2daf h SER 14 Cb 0.27 0.00 0.17 0.00 0.14 0.00 0.00 62.40 62.97 2daf h SER 14 CO -0.01 0.00 0.44 0.18 -1.14 0.00 0.00 176.83 176.31 2daf n LEU 15 N -3.79 5.47 -4.02 5.07 4.77 -1.26 -3.88 117.00 119.36 2daf n LEU 15 Ca -0.03 0.75 -0.15 0.00 -0.03 0.00 0.00 56.01 56.56 2daf n LEU 15 Cb 0.08 -1.54 -0.13 0.00 -2.33 0.00 0.00 43.42 39.51 2daf n LEU 15 CO 0.27 -1.25 -0.41 0.00 -1.33 0.00 0.00 177.39 174.68 2daf s ALA 16 N -1.62 0.54 -0.94 -1.18 0.00 -0.14 -1.58 121.76 116.83 2daf s ALA 16 Ca 0.80 -0.53 -0.24 0.00 0.00 0.00 0.00 51.96 51.99 2daf s ALA 16 Cb -0.35 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 2daf s ALA 16 CO 0.44 0.05 1.77 0.99 0.00 0.00 0.00 175.76 179.00 2daf s THR 17 N -0.79 3.61 -0.45 0.00 2.01 -0.44 -2.08 115.64 117.50 2daf s THR 17 Ca -0.04 -0.49 -0.17 0.00 0.31 0.00 0.00 61.69 61.30 2daf s THR 17 Cb -0.06 -4.38 0.04 0.00 0.01 0.00 0.00 72.50 68.11 2daf s THR 17 CO 0.00 -1.30 0.44 -0.69 -0.69 0.00 0.00 174.62 172.38 2daf s VAL 18 N 8.25 5.12 0.32 3.82 1.01 -1.21 -2.62 120.40 135.10 2daf s VAL 18 Ca 0.61 -0.66 -0.21 0.00 0.00 0.00 0.00 61.98 61.73 2daf s VAL 18 Cb -0.04 -4.10 -0.10 0.00 0.00 0.00 0.00 36.38 32.14 2daf s VAL 18 CO -0.04 -0.53 0.85 -0.54 0.00 0.00 0.00 175.10 174.84 2daf s LYS 19 N 1.99 4.30 0.08 2.72 1.02 -1.18 -3.01 119.74 125.66 2daf s LYS 19 Ca 0.09 1.03 0.09 0.00 0.02 0.00 0.00 55.97 57.19 2daf s LYS 19 Cb -0.20 -2.60 -0.03 0.00 -0.52 0.00 0.00 37.83 34.48 2daf s LYS 19 CO 0.10 0.21 -0.22 0.08 -0.92 0.00 0.00 175.35 174.60 2daf s VAL 20 N -1.80 1.83 -0.04 3.17 1.01 0.17 -2.39 120.40 122.36 2daf s VAL 20 Ca 0.52 -1.46 0.01 0.00 0.00 0.00 0.00 61.98 61.05 2daf s VAL 20 Cb -0.14 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.63 2daf s VAL 20 CO 0.19 0.09 -0.05 -0.69 0.00 0.00 0.00 175.10 174.64 2daf s VAL 21 N -1.00 0.51 -0.19 2.92 1.01 -0.76 -1.18 120.40 121.71 2daf s VAL 21 Ca 0.09 -0.14 -0.23 0.00 0.00 0.00 0.00 61.98 61.69 2daf s VAL 21 Cb -0.10 -0.52 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 2daf s VAL 21 CO 0.04 0.21 0.75 -0.76 0.00 0.00 0.00 175.10 175.34 2daf s LEU 22 N 0.74 4.15 -0.03 3.92 1.43 -0.39 -1.17 118.68 127.32 2daf s LEU 22 Ca -0.10 1.02 -0.18 0.00 -1.03 0.00 0.00 54.13 53.84 2daf s LEU 22 Cb -0.13 -3.09 -0.11 0.00 0.03 0.00 0.00 46.19 42.88 2daf s LEU 22 CO 0.00 -0.37 0.77 0.40 0.23 0.00 0.00 176.35 177.39 2daf h ILE 23 N 5.22 0.28 0.00 -0.59 1.08 -1.79 1.62 117.51 123.33 2daf h ILE 23 Ca -0.29 -0.72 0.00 0.00 -0.39 0.00 0.00 64.86 63.46 2daf h ILE 23 Cb 1.13 0.45 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 2daf h ILE 23 CO 0.82 0.07 0.00 1.55 -0.69 0.00 0.00 178.15 179.89 2daf h PRO 24 N -1.05 0.00 0.00 2.37 0.13 -1.94 -3.34 132.00 128.17 2daf h PRO 24 Ca -0.05 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2daf h PRO 24 Cb 0.47 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.60 2daf h PRO 24 CO 0.08 0.00 -0.70 0.28 -0.23 0.00 0.00 178.00 177.43 2daf n VAL 25 N -2.81 1.38 0.00 1.56 0.31 -1.23 -5.04 118.33 112.50 2daf n VAL 25 Ca 0.01 0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.55 2daf n VAL 25 Cb 0.27 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.15 2daf n VAL 25 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2daf n GLY 26 N 2.20 0.54 3.79 2.92 0.00 0.55 -4.99 105.19 110.20 2daf n GLY 26 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 2daf n GLY 26 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2daf s GLN 27 N -0.76 3.27 -0.13 1.61 0.74 -1.26 -4.61 119.66 118.52 2daf s GLN 27 Ca 0.00 1.29 -0.01 0.00 0.05 0.00 0.00 55.36 56.69 2daf s GLN 27 Cb 0.00 -2.02 -0.02 0.00 1.10 0.00 0.00 33.01 32.07 2daf s GLN 27 CO 0.00 -0.86 -0.10 -1.21 -0.55 0.00 0.00 175.29 172.57 2daf s GLU 28 N -3.92 3.40 -0.05 1.67 2.02 -1.26 -1.26 118.70 119.30 2daf s GLU 28 Ca 0.65 -0.63 0.02 0.00 0.02 0.00 0.00 54.97 55.04 2daf s GLU 28 Cb -0.18 -2.70 0.01 0.00 0.10 0.00 0.00 34.13 31.36 2daf s GLU 28 CO 0.35 0.27 -0.10 0.42 0.02 0.00 0.00 175.26 176.22 2daf s ILE 29 N 0.24 0.93 -0.15 -1.63 1.01 -0.32 -4.99 121.20 116.28 2daf s ILE 29 Ca -0.07 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 2daf s ILE 29 Cb -0.15 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 2daf s ILE 29 CO 0.04 0.30 -0.08 -0.69 0.00 0.00 0.00 174.94 174.51 2daf s VAL 30 N 0.54 3.39 -0.14 2.92 1.01 -1.26 0.46 120.40 127.33 2daf s VAL 30 Ca -0.10 -0.53 -0.09 0.00 0.00 0.00 0.00 61.98 61.26 2daf s VAL 30 Cb -0.13 -2.47 0.05 0.00 0.00 0.00 0.00 36.38 33.83 2daf s VAL 30 CO 0.02 0.50 0.34 -0.51 0.00 0.00 0.00 175.10 175.45 2daf s ILE 31 N 0.54 -0.02 -0.18 2.22 2.07 -1.16 -4.86 121.20 119.80 2daf s ILE 31 Ca -0.06 0.08 -0.29 0.00 -1.41 0.00 0.00 60.65 58.97 2daf s ILE 31 Cb -0.15 -0.50 -0.03 0.00 0.13 0.00 0.00 42.46 41.91 2daf s ILE 31 CO 0.03 0.03 1.58 -2.16 -1.91 0.00 0.00 174.94 172.51 2daf s PRO 32 N 0.94 3.93 0.18 3.50 0.04 -1.26 -3.33 135.00 139.00 2daf s PRO 32 Ca -0.06 1.78 0.10 0.00 0.04 0.00 0.00 61.00 62.85 2daf s PRO 32 Cb -0.07 -3.99 -0.04 0.00 0.04 0.00 0.00 34.50 30.44 2daf s PRO 32 CO -0.07 -1.12 -0.16 0.12 0.04 0.00 0.00 177.00 175.81 2daf s PHE 33 N 4.73 2.51 0.03 0.56 5.36 -0.88 -4.87 117.98 125.42 2daf s PHE 33 Ca 0.70 -0.27 -0.28 0.00 -0.96 0.00 0.00 56.93 56.11 2daf s PHE 33 Cb -0.26 -1.25 -0.04 0.00 -0.34 0.00 0.00 43.02 41.13 2daf s PHE 33 CO 0.27 0.49 0.89 0.15 -1.46 0.00 0.00 175.22 175.57 2daf s LYS 34 N -2.68 4.57 0.31 10.12 -0.14 -1.26 -0.97 119.74 129.69 2daf s LYS 34 Ca 0.22 1.29 0.16 0.00 -1.36 0.00 0.00 55.97 56.28 2daf s LYS 34 Cb -0.09 -3.42 0.28 0.00 -1.68 0.00 0.00 37.83 32.92 2daf s LYS 34 CO 0.13 0.10 1.54 -0.39 -0.76 0.00 0.00 175.35 175.97 2daf h VAL 35 N 4.45 0.88 -0.96 3.17 -1.51 -1.93 -3.18 116.25 117.18 2daf h VAL 35 Ca -0.42 -2.01 -0.55 0.00 -1.23 0.00 0.00 66.70 62.48 2daf h VAL 35 Cb 1.21 2.27 -0.29 0.00 -2.13 0.00 0.00 31.29 32.35 2daf h VAL 35 CO 0.73 0.46 0.71 -0.67 -1.23 0.00 0.00 177.57 177.57 2daf n ASP 36 N -3.32 5.06 -3.84 4.19 2.03 -1.26 -2.05 116.55 117.36 2daf n ASP 36 Ca 0.01 -3.61 -0.17 0.00 0.52 0.00 0.00 54.79 51.55 2daf n ASP 36 Cb 0.66 -0.88 -0.16 0.00 -0.72 0.00 0.00 41.12 40.02 2daf n ASP 36 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2daf s THR 37 N -3.67 0.19 0.43 5.18 2.01 -1.20 -5.05 115.64 113.52 2daf s THR 37 Ca 0.57 0.04 -0.22 0.00 0.31 0.00 0.00 61.69 62.39 2daf s THR 37 Cb 0.47 -0.27 -0.12 0.00 0.01 0.00 0.00 72.50 72.59 2daf s THR 37 CO 0.07 0.13 0.57 2.30 -0.69 0.00 0.00 174.62 177.00 2daf n ILE 38 N 3.93 1.83 0.17 1.82 -5.35 -1.26 -4.39 119.36 116.11 2daf n ILE 38 Ca -0.25 -0.50 0.09 0.00 -0.27 0.00 0.00 62.75 61.83 2daf n ILE 38 Cb 0.52 -0.58 0.49 0.00 -1.74 0.00 0.00 39.64 38.32 2daf n ILE 38 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2daf n LEU 39 N 1.20 0.48 -0.04 7.28 4.77 -1.14 -2.43 117.00 127.13 2daf n LEU 39 Ca 0.11 0.71 -0.09 0.00 -0.03 0.00 0.00 56.01 56.72 2daf n LEU 39 Cb 0.40 -0.75 -0.03 0.00 -2.33 0.00 0.00 43.42 40.71 2daf n LEU 39 CO 0.55 -0.83 0.85 0.50 -1.33 0.00 0.00 177.39 177.12 2daf h LYS 40 N 0.00 0.04 -0.72 3.23 3.11 -1.86 0.65 116.57 121.02 2daf h LYS 40 Ca 0.00 -0.00 0.07 0.00 -2.81 0.00 0.00 60.65 57.91 2daf h LYS 40 Cb 0.04 -0.01 -0.10 0.00 -1.00 0.00 0.00 32.23 31.16 2daf h LYS 40 CO 0.00 0.03 -0.57 1.88 -2.81 0.00 0.00 179.45 177.97 2daf h TYR 41 N 0.04 -1.80 -0.26 1.91 -1.99 -1.82 0.22 116.97 113.26 2daf h TYR 41 Ca 0.09 0.11 -0.08 0.00 2.00 0.00 0.00 58.73 60.85 2daf h TYR 41 Cb 0.13 0.88 -0.01 0.00 2.00 0.00 0.00 36.73 39.72 2daf h TYR 41 CO -0.19 -0.43 -0.17 1.25 -0.00 0.00 0.00 178.16 178.62 2daf h LEU 42 N -0.19 0.46 0.00 3.88 5.85 -1.72 -2.98 115.31 120.60 2daf h LEU 42 Ca 0.12 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2daf h LEU 42 Cb 0.50 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2daf h LEU 42 CO -0.78 0.65 0.00 1.17 -0.34 0.00 0.00 178.44 179.14 2daf n LYS 43 N -4.18 0.00 -0.41 1.25 4.81 0.60 -2.26 118.16 117.98 2daf n LYS 43 Ca 0.00 0.47 0.33 0.00 -0.87 0.00 0.00 58.31 58.25 2daf n LYS 43 Cb 0.35 -1.34 0.63 0.00 0.02 0.00 0.00 35.03 34.68 2daf n LYS 43 CO 0.00 0.00 0.00 0.22 1.17 0.00 0.00 177.40 178.79 2daf h ASP 44 N 0.00 0.26 -0.00 3.14 1.82 -1.12 0.92 116.42 121.44 2daf h ASP 44 Ca 0.00 0.10 0.03 0.00 -0.39 0.00 0.00 57.03 56.77 2daf h ASP 44 Cb 0.00 0.07 -0.05 0.00 0.68 0.00 0.00 39.33 40.03 2daf h ASP 44 CO 0.00 -0.07 -0.35 -0.74 -1.61 0.00 0.00 179.24 176.47 2daf h HIS 45 N 0.16 -0.98 -0.15 0.28 2.76 -1.28 -0.04 115.15 115.90 2daf h HIS 45 Ca 0.73 0.03 -0.20 0.00 -2.20 0.00 0.00 60.37 58.73 2daf h HIS 45 Cb 2.29 0.43 0.00 0.00 1.55 0.00 0.00 27.41 31.68 2daf h HIS 45 CO -0.00 -0.44 -0.70 0.74 -1.30 0.00 0.00 177.93 176.22 2daf h PHE 46 N -0.51 0.85 0.12 5.26 -1.00 -0.53 -2.81 116.94 118.32 2daf h PHE 46 Ca 0.06 -0.35 -0.00 0.00 2.81 0.00 0.00 57.97 60.48 2daf h PHE 46 Cb 0.59 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.00 2daf h PHE 46 CO -0.37 1.15 -0.19 1.03 -1.61 0.00 0.00 178.31 178.31 2daf h SER 47 N 0.45 -0.55 0.01 2.17 0.87 -0.67 0.19 113.55 116.02 2daf h SER 47 Ca -0.03 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.61 2daf h SER 47 Cb 1.30 0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 63.40 2daf h SER 47 CO 0.14 -0.23 -0.30 1.12 -0.53 0.00 0.00 176.83 177.02 2daf h HIS 48 N -0.33 -0.83 -0.39 2.24 2.07 -1.10 -0.88 115.15 115.93 2daf h HIS 48 Ca -0.01 0.03 0.06 0.00 -2.85 0.00 0.00 60.37 57.59 2daf h HIS 48 Cb 0.31 0.36 -0.09 0.00 2.57 0.00 0.00 27.41 30.56 2daf h HIS 48 CO -0.24 -0.40 -0.48 1.25 -3.07 0.00 0.00 177.93 175.00 2daf h LEU 49 N -0.46 -1.60 -2.27 6.12 7.12 -1.41 0.52 115.31 123.33 2daf h LEU 49 Ca 0.06 0.23 0.04 0.00 0.13 0.00 0.00 57.88 58.34 2daf h LEU 49 Cb 0.54 0.68 -0.01 0.00 -0.53 0.00 0.00 40.66 41.34 2daf h LEU 49 CO -0.25 -0.39 0.18 -0.07 -0.13 0.00 0.00 178.44 177.78 2daf h LEU 50 N -0.37 0.00 0.00 2.25 3.38 -0.33 -3.45 115.31 116.79 2daf h LEU 50 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2daf h LEU 50 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2daf h LEU 50 CO -0.57 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.57 2daf n GLY 51 N -1.38 0.71 3.47 0.83 0.00 0.18 -4.86 105.19 104.15 2daf n GLY 51 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 2daf n GLY 51 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2daf s ILE 52 N -2.31 2.70 0.95 -0.61 -4.36 -0.71 -4.97 121.20 111.89 2daf s ILE 52 Ca 0.00 -1.69 -0.12 0.00 -0.26 0.00 0.00 60.65 58.58 2daf s ILE 52 Cb 0.00 -2.26 0.16 0.00 1.25 0.00 0.00 42.46 41.61 2daf s ILE 52 CO 0.00 0.01 1.09 -2.16 0.24 0.00 0.00 174.94 174.12 2daf s PRO 53 N -2.37 0.83 0.05 0.37 0.04 -1.26 -3.75 135.00 128.90 2daf s PRO 53 Ca 0.19 0.66 0.25 0.00 0.04 0.00 0.00 61.00 62.15 2daf s PRO 53 Cb -0.10 -1.77 0.55 0.00 0.04 0.00 0.00 34.50 33.22 2daf s PRO 53 CO 0.10 -2.50 1.46 -2.39 0.04 0.00 0.00 177.00 173.71 2daf n HIS 54 N -4.04 0.22 0.28 0.56 1.44 -1.26 -3.57 115.22 108.85 2daf n HIS 54 Ca 0.06 0.06 0.15 0.00 -2.01 0.00 0.00 57.72 55.99 2daf n HIS 54 Cb 0.56 -0.44 0.74 0.00 0.12 0.00 0.00 29.99 30.97 2daf n HIS 54 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2daf h SER 55 N 0.00 0.00 0.00 4.39 0.87 -2.03 -2.58 113.55 114.19 2daf h SER 55 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2daf h SER 55 Cb 0.59 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2daf h SER 55 CO 0.00 0.00 -1.26 1.33 -0.53 0.00 0.00 176.83 176.37 2daf n VAL 56 N -2.60 0.00 -3.37 2.23 0.24 -1.25 -5.01 118.33 108.58 2daf n VAL 56 Ca -0.01 -0.13 -0.34 0.00 -2.04 0.00 0.00 64.34 61.83 2daf n VAL 56 Cb 0.14 0.37 -0.06 0.00 -1.47 0.00 0.00 33.84 32.82 2daf n VAL 56 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2daf s LEU 57 N -3.39 4.26 0.29 1.34 2.96 -0.97 -0.27 118.68 122.89 2daf s LEU 57 Ca -0.02 1.02 -0.03 0.00 -0.22 0.00 0.00 54.13 54.88 2daf s LEU 57 Cb 0.04 -3.46 -0.01 0.00 0.50 0.00 0.00 46.19 43.26 2daf s LEU 57 CO 0.23 0.02 0.38 -1.10 -1.32 0.00 0.00 176.35 174.57 2daf s GLN 58 N -2.33 1.66 -0.03 1.98 -1.52 -0.86 -4.84 119.66 113.72 2daf s GLN 58 Ca 0.42 -1.65 0.01 0.00 -1.95 0.00 0.00 55.36 52.19 2daf s GLN 58 Cb -0.13 0.40 0.01 0.00 -0.22 0.00 0.00 33.01 33.07 2daf s GLN 58 CO 0.20 -0.66 -0.05 0.42 -0.25 0.00 0.00 175.29 174.95 2daf s ILE 59 N -3.54 0.56 -0.18 1.08 1.01 -1.26 -3.35 121.20 115.51 2daf s ILE 59 Ca 0.32 -0.18 -0.04 0.00 0.00 0.00 0.00 60.65 60.75 2daf s ILE 59 Cb 0.01 -0.55 -0.02 0.00 0.01 0.00 0.00 42.46 41.91 2daf s ILE 59 CO 0.17 0.21 -0.03 -0.60 0.00 0.00 0.00 174.94 174.69 2daf s ARG 60 N 0.61 3.58 -0.03 2.79 3.52 -0.76 -2.61 118.95 126.05 2daf s ARG 60 Ca -0.08 -0.55 -0.01 0.00 -0.13 0.00 0.00 55.73 54.95 2daf s ARG 60 Cb -0.12 -2.96 0.03 0.00 -1.56 0.00 0.00 34.95 30.34 2daf s ARG 60 CO 0.00 0.08 0.05 -0.47 -0.81 0.00 0.00 175.30 174.15 2daf s TYR 61 N 0.78 0.03 -1.68 5.12 5.04 -0.31 -2.38 117.35 123.96 2daf s TYR 61 Ca -0.01 0.21 0.00 0.00 -2.44 0.00 0.00 57.07 54.82 2daf s TYR 61 Cb -0.14 -0.34 0.00 0.00 0.35 0.00 0.00 41.96 41.82 2daf s TYR 61 CO 0.02 -0.14 0.00 0.43 -1.34 0.00 0.00 175.55 174.52 2daf n SER 62 N 4.70 -5.19 0.00 4.32 7.64 -1.26 -1.27 113.62 122.55 2daf n SER 62 Ca -0.17 0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2daf n SER 62 Cb 0.50 -4.27 0.00 0.00 -1.01 0.00 0.00 64.21 59.43 2daf n SER 62 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2daf n GLY 63 N -0.92 2.33 3.50 0.23 0.00 -1.26 -5.00 105.19 104.07 2daf n GLY 63 Ca -0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 2daf n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2daf s LYS 64 N -0.07 2.42 0.33 1.61 -2.85 -0.40 -5.11 119.74 115.67 2daf s LYS 64 Ca 0.00 -0.76 -0.27 0.00 -1.00 0.00 0.00 55.97 53.94 2daf s LYS 64 Cb 0.00 -2.37 -0.09 0.00 -2.06 0.00 0.00 37.83 33.31 2daf s LYS 64 CO 0.00 0.60 1.00 0.42 0.10 0.00 0.00 175.35 177.47 2daf s ILE 65 N -0.83 3.95 -0.03 3.79 -1.09 -1.26 -1.16 121.20 124.56 2daf s ILE 65 Ca 0.13 1.68 0.05 0.00 -2.23 0.00 0.00 60.65 60.28 2daf s ILE 65 Cb -0.11 -3.95 -0.02 0.00 -1.58 0.00 0.00 42.46 36.79 2daf s ILE 65 CO 0.03 0.18 -0.18 -0.76 -1.23 0.00 0.00 174.94 172.98 2daf s LEU 66 N -2.01 2.52 0.50 2.97 1.43 -1.07 -4.94 118.68 118.09 2daf s LEU 66 Ca 0.50 -0.30 0.08 0.00 -1.03 0.00 0.00 54.13 53.39 2daf s LEU 66 Cb -0.22 -1.49 0.04 0.00 0.03 0.00 0.00 46.19 44.55 2daf s LEU 66 CO 0.28 0.33 0.58 -1.59 0.23 0.00 0.00 176.35 176.18 2daf s LYS 67 N -0.76 2.45 0.02 1.70 -2.85 -1.26 -4.53 119.74 114.50 2daf s LYS 67 Ca 0.11 -1.62 -0.23 0.00 -1.00 0.00 0.00 55.97 53.23 2daf s LYS 67 Cb -0.10 -2.49 -0.13 0.00 -2.06 0.00 0.00 37.83 33.04 2daf s LYS 67 CO 0.00 -0.55 1.12 -2.95 0.10 0.00 0.00 175.35 173.08 2daf h ASN 68 N 0.57 -0.71 -1.65 0.03 -1.07 -1.97 -2.86 115.58 107.92 2daf h ASN 68 Ca -0.36 0.02 0.48 0.00 0.07 0.00 0.00 56.30 56.52 2daf h ASN 68 Cb 1.29 0.18 -0.07 0.00 -2.07 0.00 0.00 38.32 37.65 2daf h ASN 68 CO 0.49 -0.42 1.32 0.78 0.07 0.00 0.00 177.43 179.67 2daf h ASN 69 N -1.02 0.00 -3.83 6.14 4.21 -1.97 -3.22 115.58 115.90 2daf h ASN 69 Ca -0.09 0.00 -0.48 0.00 1.21 0.00 0.00 56.30 56.94 2daf h ASN 69 Cb 0.64 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.83 2daf h ASN 69 CO 0.14 0.00 0.37 -1.61 -1.29 0.00 0.00 177.43 175.04 2daf s GLU 70 N -4.75 4.67 0.24 0.81 2.02 -1.08 -4.94 118.70 115.67 2daf s GLU 70 Ca -0.04 1.48 0.10 0.00 0.02 0.00 0.00 54.97 56.52 2daf s GLU 70 Cb 0.23 -3.03 -0.04 0.00 0.10 0.00 0.00 34.13 31.39 2daf s GLU 70 CO 0.77 0.33 -0.07 0.99 0.02 0.00 0.00 175.26 177.30 2daf s THR 71 N -1.38 3.17 0.17 3.63 2.01 -1.26 -2.88 115.64 119.11 2daf s THR 71 Ca 0.46 -1.94 -0.14 0.00 0.31 0.00 0.00 61.69 60.38 2daf s THR 71 Cb -0.24 -2.65 0.06 0.00 0.01 0.00 0.00 72.50 69.68 2daf s THR 71 CO 0.30 -0.30 1.80 -0.07 -0.69 0.00 0.00 174.62 175.66 2daf h LEU 72 N 2.27 0.43 -1.89 4.42 -0.00 -1.75 -0.97 115.31 117.81 2daf h LEU 72 Ca -0.44 0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.43 2daf h LEU 72 Cb 1.24 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 41.82 2daf h LEU 72 CO 0.58 0.30 -0.08 -0.37 -0.00 0.00 0.00 178.44 178.87 2daf h VAL 73 N 0.54 0.34 0.00 1.22 -1.51 -1.56 -1.66 116.25 113.62 2daf h VAL 73 Ca 0.20 -0.51 -0.02 0.00 -1.23 0.00 0.00 66.70 65.14 2daf h VAL 73 Cb 0.05 1.38 -0.00 0.00 -2.13 0.00 0.00 31.29 30.58 2daf h VAL 73 CO -0.11 0.08 -0.09 1.56 -1.23 0.00 0.00 177.57 177.79 2daf h GLN 74 N 0.00 0.00 0.00 5.19 1.08 -1.49 -3.13 115.11 116.76 2daf h GLN 74 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2daf h GLN 74 Cb 0.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 2daf h GLN 74 CO 0.01 0.09 -1.20 0.72 -0.95 0.00 0.00 178.83 177.50 2daf n HIS 75 N -3.14 0.14 0.00 2.96 8.25 -0.68 -4.95 115.22 117.80 2daf n HIS 75 Ca 0.03 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 2daf n HIS 75 Cb 0.52 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.29 2daf n HIS 75 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2daf n GLY 76 N 1.38 0.68 3.03 -1.41 0.00 -0.85 -5.12 105.19 102.90 2daf n GLY 76 Ca 0.01 -0.56 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 2daf n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2daf s VAL 77 N -0.94 1.05 0.27 1.61 1.01 -0.85 -4.98 120.40 117.57 2daf s VAL 77 Ca 0.00 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.59 2daf s VAL 77 Cb 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 2daf s VAL 77 CO 0.00 0.33 0.20 -0.54 0.00 0.00 0.00 175.10 175.09 2daf s LYS 78 N 0.45 2.86 0.55 2.72 -0.14 -1.26 -4.11 119.74 120.82 2daf s LYS 78 Ca -0.09 -1.11 -0.19 0.00 -1.36 0.00 0.00 55.97 53.21 2daf s LYS 78 Cb -0.13 -2.53 -0.05 0.00 -1.68 0.00 0.00 37.83 33.44 2daf s LYS 78 CO 0.02 0.35 1.13 -1.25 -0.76 0.00 0.00 175.35 174.84 2daf s PRO 79 N -3.86 3.30 -1.23 -1.68 0.04 -1.26 -3.61 135.00 126.70 2daf s PRO 79 Ca 0.34 1.59 -0.07 0.00 0.04 0.00 0.00 61.00 62.90 2daf s PRO 79 Cb -0.07 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.47 2daf s PRO 79 CO 0.25 -0.89 1.07 1.04 0.04 0.00 0.00 177.00 178.51 2daf n GLN 80 N -1.41 -7.16 -4.39 4.56 6.02 -0.62 -4.99 117.38 109.39 2daf n GLN 80 Ca 0.11 0.77 -0.20 0.00 -0.01 0.00 0.00 57.00 57.67 2daf n GLN 80 Cb 0.51 -5.61 -0.10 0.00 1.02 0.00 0.00 30.24 26.06 2daf n GLN 80 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 2daf s GLU 81 N -6.06 1.46 -0.14 -1.09 -1.05 -1.24 -4.91 118.70 105.67 2daf s GLU 81 Ca 0.46 -1.66 -0.03 0.00 -0.15 0.00 0.00 54.97 53.58 2daf s GLU 81 Cb -0.20 -1.34 -0.03 0.00 -0.44 0.00 0.00 34.13 32.13 2daf s GLU 81 CO 0.67 0.22 -0.04 0.42 0.95 0.00 0.00 175.26 177.48 2daf s ILE 82 N -2.82 3.85 0.37 1.83 1.01 -1.26 -1.33 121.20 122.84 2daf s ILE 82 Ca 0.25 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.58 2daf s ILE 82 Cb -0.02 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 2daf s ILE 82 CO 0.10 0.51 0.20 0.68 0.00 0.00 0.00 174.94 176.43 2daf s VAL 83 N 0.20 0.28 -0.05 2.92 -7.23 -1.08 -5.05 120.40 110.40 2daf s VAL 83 Ca -0.02 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.12 2daf s VAL 83 Cb -0.14 -2.41 0.03 0.00 0.56 0.00 0.00 36.38 34.42 2daf s VAL 83 CO 0.03 0.00 0.08 -1.58 -0.31 0.00 0.00 175.10 173.32 2daf s GLN 84 N -3.60 -0.05 0.09 4.82 0.74 -1.26 -3.11 119.66 117.29 2daf s GLN 84 Ca 0.32 0.39 0.06 0.00 0.05 0.00 0.00 55.36 56.18 2daf s GLN 84 Cb 0.02 -0.43 -0.03 0.00 1.10 0.00 0.00 33.01 33.67 2daf s GLN 84 CO 0.21 -0.30 -0.15 0.14 -0.55 0.00 0.00 175.29 174.63 2daf s VAL 85 N 2.05 1.27 0.03 1.34 -7.23 -1.01 -4.74 120.40 112.11 2daf s VAL 85 Ca 0.03 -1.49 0.06 0.00 -1.81 0.00 0.00 61.98 58.76 2daf s VAL 85 Cb -0.12 -1.30 -0.03 0.00 0.56 0.00 0.00 36.38 35.48 2daf s VAL 85 CO -0.04 -0.28 -0.13 -1.61 -0.31 0.00 0.00 175.10 172.74 2daf s GLU 86 N -2.11 2.27 0.02 4.82 2.02 -1.00 -1.83 118.70 122.89 2daf s GLU 86 Ca 0.03 -0.88 0.08 0.00 0.02 0.00 0.00 54.97 54.22 2daf s GLU 86 Cb -0.08 -2.32 -0.02 0.00 0.10 0.00 0.00 34.13 31.81 2daf s GLU 86 CO 0.03 0.56 -0.24 0.42 0.02 0.00 0.00 175.26 176.05 2daf s ILE 87 N -0.97 1.91 0.01 -1.63 1.01 -0.32 -1.82 121.20 119.38 2daf s ILE 87 Ca 0.16 -1.18 -0.28 0.00 0.00 0.00 0.00 60.65 59.34 2daf s ILE 87 Cb -0.11 -1.62 0.10 0.00 0.01 0.00 0.00 42.46 40.85 2daf s ILE 87 CO 0.07 0.39 0.87 0.72 0.00 0.00 0.00 174.94 176.99 2daf s PHE 88 N -0.70 -0.36 -0.08 3.97 -0.12 -1.21 -2.20 117.98 117.28 2daf s PHE 88 Ca 0.10 0.23 -0.01 0.00 -0.05 0.00 0.00 56.93 57.19 2daf s PHE 88 Cb -0.09 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.80 2daf s PHE 88 CO 0.01 -0.56 -0.03 0.45 -0.05 0.00 0.00 175.22 175.04 2daf s SER 89 N -2.49 4.99 0.21 1.98 0.15 -1.26 -2.02 113.70 115.26 2daf s SER 89 Ca 0.05 0.07 -0.03 0.00 0.70 0.00 0.00 55.95 56.74 2daf s SER 89 Cb -0.01 -1.37 0.16 0.00 -1.71 0.00 0.00 66.02 63.09 2daf s SER 89 CO -0.09 0.36 1.55 0.71 1.20 0.00 0.00 173.24 176.97 2daf h THR 90 N 4.24 1.30 -3.26 6.45 1.35 -0.98 -3.35 112.91 118.66 2daf h THR 90 Ca -0.49 -1.65 -0.68 0.00 -0.55 0.00 0.00 66.41 63.04 2daf h THR 90 Cb 1.18 1.62 -0.37 0.00 -1.73 0.00 0.00 68.15 68.85 2daf h THR 90 CO 0.54 0.52 -0.24 0.20 -0.25 0.00 0.00 175.52 176.29 2daf s ASN 91 N -6.87 5.63 0.55 5.36 -0.87 -1.26 -4.88 114.94 112.59 2daf s ASN 91 Ca -0.08 -3.72 0.34 0.00 -1.57 0.00 0.00 52.86 47.83 2daf s ASN 91 Cb 0.12 -1.83 1.40 0.00 -0.02 0.00 0.00 41.25 40.92 2daf s ASN 91 CO 0.83 -0.16 2.00 1.55 -2.57 0.00 0.00 177.10 178.75 2daf h PRO 92 N 5.89 0.00 0.03 -0.60 0.13 -1.75 0.28 132.00 135.98 2daf h PRO 92 Ca 0.15 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 65.05 2daf h PRO 92 Cb 0.80 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 2daf h PRO 92 CO 0.81 0.01 -0.98 0.22 -0.23 0.00 0.00 178.00 177.83 2daf h ASP 93 N 0.00 0.33 0.04 1.44 3.58 -1.95 -2.96 116.42 116.90 2daf h ASP 93 Ca -0.00 -0.29 -0.36 0.00 0.42 0.00 0.00 57.03 56.79 2daf h ASP 93 Cb 0.50 -0.10 -0.05 0.00 1.72 0.00 0.00 39.33 41.40 2daf h ASP 93 CO 0.00 1.13 -2.07 0.18 -2.88 0.00 0.00 179.24 175.60 2daf n LEU 94 N -3.63 2.39 -3.59 2.28 4.77 -1.09 -4.77 117.00 113.36 2daf n LEU 94 Ca -0.05 0.20 -0.28 0.00 -0.03 0.00 0.00 56.01 55.86 2daf n LEU 94 Cb 0.87 -0.97 -0.11 0.00 -2.33 0.00 0.00 43.42 40.88 2daf n LEU 94 CO 0.50 0.68 -0.21 -0.31 -1.33 0.00 0.00 177.39 176.71 2daf s TYR 95 N -2.49 2.01 0.74 -1.77 1.51 0.98 -5.12 117.35 113.20 2daf s TYR 95 Ca -0.31 -2.67 -0.12 0.00 -1.01 0.00 0.00 57.07 52.96 2daf s TYR 95 Cb 0.09 -1.61 0.04 0.00 -0.11 0.00 0.00 41.96 40.37 2daf s TYR 95 CO 0.62 -0.73 1.10 -1.25 -1.11 0.00 0.00 175.55 174.19 2daf s PRO 96 N -0.43 2.43 -0.00 -1.71 0.04 -1.12 -4.31 135.00 129.90 2daf s PRO 96 Ca 0.29 1.24 -0.04 0.00 0.04 0.00 0.00 61.00 62.52 2daf s PRO 96 Cb -0.01 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 2daf s PRO 96 CO -0.17 -1.52 0.22 0.08 0.04 0.00 0.00 177.00 175.65 2daf s VAL 97 N -2.72 5.38 0.25 -0.36 1.01 -1.26 -4.92 120.40 117.78 2daf s VAL 97 Ca 0.63 -0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.66 2daf s VAL 97 Cb -0.18 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 2daf s VAL 97 CO 0.51 0.34 -0.09 -0.13 0.00 0.00 0.00 175.10 175.74 2daf s ARG 98 N -1.86 1.47 0.62 2.72 0.52 -1.26 -4.87 118.95 116.29 2daf s ARG 98 Ca 0.27 -1.71 -0.13 0.00 -0.52 0.00 0.00 55.73 53.64 2daf s ARG 98 Cb -0.13 -1.13 -0.03 0.00 0.52 0.00 0.00 34.95 34.18 2daf s ARG 98 CO 0.17 0.09 1.04 -0.98 0.02 0.00 0.00 175.30 175.64 2daf s ARG 99 N -3.70 3.33 -0.06 3.54 3.03 -1.26 -5.02 118.95 118.81 2daf s ARG 99 Ca 0.27 1.00 -0.00 0.00 2.03 0.00 0.00 55.73 59.02 2daf s ARG 99 Cb 0.02 -2.04 0.03 0.00 -1.03 0.00 0.00 34.95 31.92 2daf s ARG 99 CO 0.10 -0.79 -0.02 0.42 -1.13 0.00 0.00 175.30 173.88 2daf s ILE 100 N -2.82 0.44 0.38 4.99 1.01 -1.26 -5.08 121.20 118.86 2daf s ILE 100 Ca 0.59 0.02 -0.28 0.00 0.00 0.00 0.00 60.65 60.98 2daf s ILE 100 Cb -0.13 -0.54 -0.11 0.00 0.01 0.00 0.00 42.46 41.69 2daf s ILE 100 CO 0.45 0.24 1.49 -0.62 0.00 0.00 0.00 174.94 176.51 2daf s ASP 101 N 1.52 6.33 1.43 3.58 2.15 -1.26 -4.98 116.67 125.44 2daf s ASP 101 Ca -0.02 3.06 -0.23 0.00 0.43 0.00 0.00 52.55 55.79 2daf s ASP 101 Cb -0.13 -2.67 0.35 0.00 -0.30 0.00 0.00 42.92 40.17 2daf s ASP 101 CO -0.03 -0.88 0.87 0.61 -0.17 0.00 0.00 175.17 175.56 2daf n GLY 102 N 0.45 -3.75 1.61 2.66 0.00 -1.26 -5.04 105.19 99.87 2daf n GLY 102 Ca 0.01 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.71 2daf n GLY 102 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2daf n LEU 103 N 0.00 0.17 -0.09 0.99 7.94 -1.26 -4.91 117.00 119.85 2daf n LEU 103 Ca 0.13 0.19 -0.13 0.00 -1.11 0.00 0.00 56.01 55.10 2daf n LEU 103 Cb 0.57 0.07 -0.05 0.00 0.53 0.00 0.00 43.42 44.54 2daf n LEU 103 CO 0.38 -0.65 0.60 0.74 -1.11 0.00 0.00 177.39 177.35 2daf h THR 104 N 0.00 1.31 -3.39 1.96 2.02 -1.96 -3.48 112.91 109.37 2daf h THR 104 Ca 0.00 -1.36 -0.09 0.00 0.77 0.00 0.00 66.41 65.74 2daf h THR 104 Cb 0.00 1.61 0.06 0.00 -1.74 0.00 0.00 68.15 68.08 2daf h THR 104 CO 0.00 0.43 -0.24 0.47 0.37 0.00 0.00 175.52 176.54 2daf n ASP 105 N -4.37 -2.67 -3.67 4.18 8.00 -1.26 -5.07 116.55 111.69 2daf n ASP 105 Ca -0.04 -0.20 -0.13 0.00 0.71 0.00 0.00 54.79 55.14 2daf n ASP 105 Cb 0.42 -1.90 -0.06 0.00 -0.02 0.00 0.00 41.12 39.56 2daf n ASP 105 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2daf s VAL 106 N -3.11 0.06 0.21 2.53 -7.23 -1.26 -5.18 120.40 106.41 2daf s VAL 106 Ca 0.07 -0.49 -0.19 0.00 -1.81 0.00 0.00 61.98 59.56 2daf s VAL 106 Cb -0.01 -0.96 0.03 0.00 0.56 0.00 0.00 36.38 36.00 2daf s VAL 106 CO 0.22 -0.27 0.56 -0.55 -0.31 0.00 0.00 175.10 174.76 2daf s SER 107 N -2.04 -0.30 0.25 4.85 0.15 -1.26 -4.82 113.70 110.53 2daf s SER 107 Ca -0.05 -0.45 -0.14 0.00 0.70 0.00 0.00 55.95 56.01 2daf s SER 107 Cb -0.01 0.61 -0.00 0.00 -1.71 0.00 0.00 66.02 64.91 2daf s SER 107 CO -0.03 -1.09 0.50 0.00 1.20 0.00 0.00 173.24 173.82 2daf s GLN 108 N -3.87 1.56 -0.15 5.44 -2.07 -1.26 -5.18 119.66 114.13 2daf s GLN 108 Ca 0.09 -1.22 -0.29 0.00 -1.82 0.00 0.00 55.36 52.12 2daf s GLN 108 Cb -0.02 0.48 0.09 0.00 -1.09 0.00 0.00 33.01 32.48 2daf s GLN 108 CO -0.02 -0.65 0.83 -1.50 -1.32 0.00 0.00 175.29 172.63 2daf s ILE 109 N -4.00 0.00 -0.05 3.63 2.07 -1.26 -5.16 121.20 116.43 2daf s ILE 109 Ca 0.21 0.00 -0.25 0.00 -1.41 0.00 0.00 60.65 59.20 2daf s ILE 109 Cb -0.01 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.63 2daf s ILE 109 CO 0.08 0.00 0.55 -0.51 -1.91 0.00 0.00 174.94 173.15 2daf s ILE 110 N -0.72 0.02 0.13 2.00 1.10 -1.26 -5.18 121.20 117.29 2daf s ILE 110 Ca -0.05 -0.16 -0.10 0.00 -0.51 0.00 0.00 60.65 59.84 2daf s ILE 110 Cb -0.02 -0.86 0.00 0.00 0.15 0.00 0.00 42.46 41.73 2daf s ILE 110 CO 0.04 -0.09 0.27 0.28 -2.11 0.00 0.00 174.94 173.33 2daf s THR 111 N -1.14 0.10 0.04 4.00 -1.32 -1.26 -5.16 115.64 110.90 2daf s THR 111 Ca -0.11 -1.19 0.01 0.00 -1.21 0.00 0.00 61.69 59.19 2daf s THR 111 Cb -0.02 -1.55 -0.03 0.00 -1.51 0.00 0.00 72.50 69.39 2daf s THR 111 CO 0.08 -0.44 -0.06 0.54 -2.21 0.00 0.00 174.62 172.52 2daf s VAL 112 N -3.90 0.43 -0.23 5.08 0.11 -1.26 -5.16 120.40 115.47 2daf s VAL 112 Ca 0.10 -1.20 -0.29 0.00 -2.93 0.00 0.00 61.98 57.67 2daf s VAL 112 Cb 0.04 -0.72 0.15 0.00 -1.53 0.00 0.00 36.38 34.32 2daf s VAL 112 CO -0.06 -0.52 1.16 -0.94 -3.33 0.00 0.00 175.10 171.41 2daf s SER 113 N -1.83 -0.24 -0.24 3.54 1.04 -1.26 -5.19 113.70 109.52 2daf s SER 113 Ca -0.08 0.31 -0.29 0.00 0.48 0.00 0.00 55.95 56.37 2daf s SER 113 Cb -0.07 0.26 0.17 0.00 0.10 0.00 0.00 66.02 66.48 2daf s SER 113 CO -0.01 -0.19 1.23 -0.83 0.98 0.00 0.00 173.24 174.42 2daf s GLY 114 N -0.83 -0.02 0.44 7.32 0.00 -1.26 -5.18 107.32 107.80 2daf s GLY 114 Ca 0.03 2.62 -0.07 0.00 0.00 0.00 0.00 44.72 47.30 2daf s GLY 114 CO -0.04 1.18 0.39 -1.55 0.00 0.00 0.00 173.10 173.09 2daf n PRO 115 N 0.75 -1.80 -3.43 2.90 -0.04 -1.26 -5.10 135.00 127.02 2daf n PRO 115 Ca -0.05 -0.63 -0.13 0.00 -0.04 0.00 0.00 63.50 62.65 2daf n PRO 115 Cb 0.58 -0.59 -0.02 0.00 -0.04 0.00 0.00 33.50 33.43 2daf n PRO 115 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2daf s SER 116 N -2.57 -0.58 -0.12 3.54 1.04 -1.26 -5.10 113.70 108.66 2daf s SER 116 Ca 0.26 0.08 -0.07 0.00 0.48 0.00 0.00 55.95 56.69 2daf s SER 116 Cb -0.03 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.66 2daf s SER 116 CO 0.20 -0.93 -0.14 0.28 0.98 0.00 0.00 173.24 173.63 2daf h SER 117 N 2.12 0.00 0.00 7.02 0.02 -2.11 -3.58 113.55 117.02 2daf h SER 117 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2daf h SER 117 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2daf h SER 117 CO 0.38 0.63 0.00 0.61 -1.14 0.00 0.00 176.83 177.31