#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dlo n TYR 3 N 0.00 0.00 -4.07 9.51 4.01 -1.26 -5.15 117.16 120.20 3dlo n TYR 3 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3dlo n TYR 3 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 38.96 3dlo n TYR 3 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3dlo s PRO 5 N 3.51 1.41 -0.13 -0.72 0.04 -1.26 -4.99 135.00 132.85 3dlo s PRO 5 Ca 0.00 -1.38 -0.18 0.00 0.04 0.00 0.00 61.00 59.48 3dlo s PRO 5 Cb 0.00 0.40 -0.04 0.00 0.04 0.00 0.00 34.50 34.90 3dlo s PRO 5 CO 0.00 -0.54 0.49 0.42 0.04 0.00 0.00 177.00 177.41 3dlo s ILE 6 N -4.06 5.17 -0.22 0.56 -1.09 -0.65 0.06 121.20 120.97 3dlo s ILE 6 Ca 0.28 0.96 -0.10 0.00 -2.23 0.00 0.00 60.65 59.56 3dlo s ILE 6 Cb 0.02 -3.83 -0.05 0.00 -1.58 0.00 0.00 42.46 37.03 3dlo s ILE 6 CO 0.10 0.29 0.13 -0.69 -1.23 0.00 0.00 174.94 173.54 3dlo s VAL 7 N 0.84 5.29 -0.06 2.92 1.01 -0.88 -0.07 120.40 129.45 3dlo s VAL 7 Ca 0.26 0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.44 3dlo s VAL 7 Cb -0.15 -3.44 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 3dlo s VAL 7 CO 0.10 0.40 -0.20 0.54 0.00 0.00 0.00 175.10 175.94 3dlo s VAL 8 N 0.69 1.70 -0.19 2.92 0.11 -0.66 -0.62 120.40 124.35 3dlo s VAL 8 Ca 0.07 -0.85 -0.04 0.00 -2.93 0.00 0.00 61.98 58.23 3dlo s VAL 8 Cb -0.12 -1.46 -0.02 0.00 -1.53 0.00 0.00 36.38 33.25 3dlo s VAL 8 CO 0.01 0.48 -0.02 0.00 -3.33 0.00 0.00 175.10 172.24 3dlo s ALA 9 N 0.10 2.98 -0.01 1.54 0.00 -0.93 -0.36 121.76 125.08 3dlo s ALA 9 Ca -0.08 -0.95 0.06 0.00 0.00 0.00 0.00 51.96 50.99 3dlo s ALA 9 Cb -0.14 -1.68 -0.02 0.00 0.00 0.00 0.00 23.12 21.29 3dlo s ALA 9 CO 0.04 -0.06 -0.20 0.14 0.00 0.00 0.00 175.76 175.68 3dlo s VAL 10 N 0.84 1.58 -0.05 0.00 -7.23 -1.00 -4.45 120.40 110.09 3dlo s VAL 10 Ca -0.00 -0.89 -0.04 0.00 -1.81 0.00 0.00 61.98 59.24 3dlo s VAL 10 Cb -0.14 -1.32 -0.01 0.00 0.56 0.00 0.00 36.38 35.47 3dlo s VAL 10 CO 0.02 0.41 -0.07 -0.67 -0.31 0.00 0.00 175.10 174.48 3dlo n ASP 11 N 2.50 0.56 -4.26 4.85 2.03 -1.26 -4.59 116.55 116.38 3dlo n ASP 11 Ca -0.15 0.27 -0.26 0.00 0.52 0.00 0.00 54.79 55.17 3dlo n ASP 11 Cb 0.53 -0.60 -0.08 0.00 -0.72 0.00 0.00 41.12 40.25 3dlo n ASP 11 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3dlo s LYS 12 N -1.45 1.92 -0.02 -0.67 1.02 -1.26 -4.94 119.74 114.34 3dlo s LYS 12 Ca -0.06 -2.16 -0.30 0.00 0.02 0.00 0.00 55.97 53.47 3dlo s LYS 12 Cb 0.01 -0.78 -0.04 0.00 -0.52 0.00 0.00 37.83 36.50 3dlo s LYS 12 CO 0.09 -0.41 1.24 0.15 -0.92 0.00 0.00 175.35 175.50 3dlo s LYS 13 N -3.76 4.35 0.11 1.68 1.02 -1.26 -4.73 119.74 117.15 3dlo s LYS 13 Ca 0.24 1.75 -0.25 0.00 0.02 0.00 0.00 55.97 57.73 3dlo s LYS 13 Cb 0.03 -3.52 0.07 0.00 -0.52 0.00 0.00 37.83 33.90 3dlo s LYS 13 CO 0.13 -0.43 0.76 -1.54 -0.92 0.00 0.00 175.35 173.35 3dlo s SER 14 N 1.47 -0.41 0.33 2.83 1.04 -1.26 -4.97 113.70 112.72 3dlo s SER 14 Ca 0.58 -0.12 0.06 0.00 0.48 0.00 0.00 55.95 56.96 3dlo s SER 14 Cb -0.27 0.53 0.73 0.00 0.10 0.00 0.00 66.02 67.11 3dlo s SER 14 CO 0.24 -0.88 1.84 0.44 0.98 0.00 0.00 173.24 175.86 3dlo h ASP 15 N 2.00 0.75 -0.52 7.02 5.19 -2.00 -0.57 116.42 128.30 3dlo h ASP 15 Ca -0.27 0.05 -0.11 0.00 -0.62 0.00 0.00 57.03 56.08 3dlo h ASP 15 Cb 1.27 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.67 3dlo h ASP 15 CO 0.32 0.36 -0.12 -0.09 -3.12 0.00 0.00 179.24 176.60 3dlo h ARG 16 N 0.79 0.99 -0.86 3.56 2.43 -1.95 -2.59 114.38 116.75 3dlo h ARG 16 Ca 0.49 -0.38 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 3dlo h ARG 16 Cb 0.71 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 3dlo h ARG 16 CO -0.26 1.05 0.44 0.00 -1.51 0.00 0.00 179.97 179.70 3dlo h ALA 17 N 0.91 1.16 -0.96 2.80 0.00 -1.43 -0.68 119.26 121.06 3dlo h ALA 17 Ca 0.13 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.98 3dlo h ALA 17 Cb 0.69 -0.34 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 3dlo h ALA 17 CO 0.05 0.66 0.60 1.49 0.00 0.00 0.00 179.25 182.05 3dlo h GLU 18 N 1.21 1.01 -0.37 0.00 4.81 -1.07 -0.75 114.58 119.43 3dlo h GLU 18 Ca 0.30 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.38 3dlo h GLU 18 Cb 0.07 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 3dlo h GLU 18 CO -0.04 0.67 -0.12 0.00 -0.73 0.00 0.00 179.01 178.79 3dlo h ARG 19 N 1.04 0.73 -0.26 1.92 3.08 -0.97 0.13 114.38 120.05 3dlo h ARG 19 Ca 0.44 -0.29 0.06 0.00 0.07 0.00 0.00 59.98 60.25 3dlo h ARG 19 Cb 0.29 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.25 3dlo h ARG 19 CO -0.21 0.89 -0.11 0.28 -1.07 0.00 0.00 179.97 179.75 3dlo h VAL 20 N 0.52 0.65 -0.40 2.04 2.07 -0.72 -2.15 116.25 118.26 3dlo h VAL 20 Ca 0.09 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.50 3dlo h VAL 20 Cb 0.64 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 3dlo h VAL 20 CO 0.04 0.00 -0.19 -0.07 0.02 0.00 0.00 177.57 177.37 3dlo h LEU 21 N -0.06 0.79 -0.60 2.57 3.38 -0.91 -1.87 115.31 118.60 3dlo h LEU 21 Ca 0.13 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 3dlo h LEU 21 Cb 0.26 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3dlo h LEU 21 CO -0.30 0.97 0.30 0.03 0.09 0.00 0.00 178.44 179.52 3dlo h ARG 22 N 0.69 0.86 -0.43 1.13 3.08 -0.55 0.23 114.38 119.38 3dlo h ARG 22 Ca 0.10 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 3dlo h ARG 22 Cb 0.69 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 3dlo h ARG 22 CO 0.05 0.69 0.01 0.35 -1.07 0.00 0.00 179.97 180.00 3dlo h PHE 23 N 0.82 0.82 -0.95 3.04 3.57 -1.24 -2.15 116.94 120.84 3dlo h PHE 23 Ca 0.21 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.58 3dlo h PHE 23 Cb 0.10 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.58 3dlo h PHE 23 CO -0.00 0.81 0.63 0.00 -2.23 0.00 0.00 178.31 177.52 3dlo h ALA 24 N 0.91 1.21 -0.47 2.41 0.00 -1.21 -0.98 119.26 121.12 3dlo h ALA 24 Ca 0.12 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3dlo h ALA 24 Cb 0.48 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3dlo h ALA 24 CO 0.02 0.61 0.27 0.00 0.00 0.00 0.00 179.25 180.15 3dlo h ALA 25 N 1.35 1.59 -0.06 0.00 0.00 -0.75 -0.35 119.26 121.05 3dlo h ALA 25 Ca 0.35 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 3dlo h ALA 25 Cb -0.15 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.45 3dlo h ALA 25 CO -0.08 0.35 -0.24 1.49 0.00 0.00 0.00 179.25 180.78 3dlo h GLU 26 N 0.65 0.27 -0.78 0.00 4.81 -0.90 0.21 114.58 118.84 3dlo h GLU 26 Ca 0.17 -0.21 0.09 0.00 -0.13 0.00 0.00 59.36 59.28 3dlo h GLU 26 Cb -0.01 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.34 3dlo h GLU 26 CO -0.03 0.84 0.43 0.93 -0.73 0.00 0.00 179.01 180.46 3dlo h GLU 27 N -0.25 0.72 -0.05 1.92 4.39 -0.90 -1.69 114.58 118.72 3dlo h GLU 27 Ca -0.01 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 3dlo h GLU 27 Cb 0.88 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.36 3dlo h GLU 27 CO 0.05 0.48 0.01 0.00 -1.16 0.00 0.00 179.01 178.39 3dlo h ALA 28 N 1.43 0.07 -0.68 3.43 0.00 -0.76 -1.72 119.26 121.03 3dlo h ALA 28 Ca 0.37 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.28 3dlo h ALA 28 Cb 0.33 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.98 3dlo h ALA 28 CO -0.24 -0.29 0.03 0.00 0.00 0.00 0.00 179.25 178.75 3dlo h ARG 29 N -0.16 0.13 -0.33 0.00 3.08 -0.38 0.16 114.38 116.87 3dlo h ARG 29 Ca 0.02 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.91 3dlo h ARG 29 Cb 0.28 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3dlo h ARG 29 CO 0.00 0.09 -0.38 -0.07 -1.07 0.00 0.00 179.97 178.54 3dlo h LEU 30 N 0.13 0.83 0.00 3.04 3.38 -1.23 -3.33 115.31 118.13 3dlo h LEU 30 Ca 0.36 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3dlo h LEU 30 Cb 0.61 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3dlo h LEU 30 CO -0.57 1.11 -0.94 0.54 0.09 0.00 0.00 178.44 178.67 3dlo n ARG 31 N -4.05 0.39 -2.41 1.13 1.74 -0.65 -4.98 116.66 107.82 3dlo n ARG 31 Ca -0.02 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 3dlo n ARG 31 Cb 0.53 -1.68 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 3dlo n ARG 31 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dlo n GLY 32 N 1.30 0.88 3.08 -0.13 0.00 0.51 -5.07 105.19 105.76 3dlo n GLY 32 Ca 0.02 -0.65 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 3dlo n GLY 32 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dlo s VAL 33 N -2.99 0.38 0.75 1.61 -7.23 -1.10 -5.06 120.40 106.75 3dlo s VAL 33 Ca 0.00 -1.45 -0.11 0.00 -1.81 0.00 0.00 61.98 58.61 3dlo s VAL 33 Cb 0.00 -1.04 0.04 0.00 0.56 0.00 0.00 36.38 35.94 3dlo s VAL 33 CO 0.00 -0.70 1.08 -2.16 -0.31 0.00 0.00 175.10 173.01 3dlo s PRO 34 N -2.75 2.50 -0.17 4.82 0.04 -1.26 -4.52 135.00 133.66 3dlo s PRO 34 Ca -0.01 0.74 -0.07 0.00 0.04 0.00 0.00 61.00 61.69 3dlo s PRO 34 Cb -0.01 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 3dlo s PRO 34 CO -0.04 -1.35 0.06 0.08 0.04 0.00 0.00 177.00 175.79 3dlo s VAL 35 N -3.13 4.79 -0.30 -0.36 1.01 0.21 -1.63 120.40 120.98 3dlo s VAL 35 Ca 0.59 -0.04 -0.09 0.00 0.00 0.00 0.00 61.98 62.44 3dlo s VAL 35 Cb -0.14 -3.15 -0.01 0.00 0.00 0.00 0.00 36.38 33.09 3dlo s VAL 35 CO 0.54 0.48 0.14 -0.31 0.00 0.00 0.00 175.10 175.95 3dlo s TYR 36 N 0.21 3.17 -0.12 5.22 1.51 0.89 -1.01 117.35 127.23 3dlo s TYR 36 Ca 0.04 -0.57 -0.18 0.00 -1.01 0.00 0.00 57.07 55.34 3dlo s TYR 36 Cb -0.12 -2.34 -0.04 0.00 -0.11 0.00 0.00 41.96 39.35 3dlo s TYR 36 CO 0.00 -0.45 0.49 0.08 -1.11 0.00 0.00 175.55 174.57 3dlo s VAL 37 N 1.61 5.17 0.09 0.71 1.01 0.50 -1.65 120.40 127.84 3dlo s VAL 37 Ca 0.05 0.98 0.09 0.00 0.00 0.00 0.00 61.98 63.10 3dlo s VAL 37 Cb -0.17 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 3dlo s VAL 37 CO 0.06 0.31 -0.25 0.68 0.00 0.00 0.00 175.10 175.90 3dlo s VAL 38 N 0.73 2.02 -0.02 2.92 -7.23 0.51 -0.11 120.40 119.22 3dlo s VAL 38 Ca 0.26 -1.52 -0.00 0.00 -1.81 0.00 0.00 61.98 58.91 3dlo s VAL 38 Cb -0.15 -1.77 0.02 0.00 0.56 0.00 0.00 36.38 35.04 3dlo s VAL 38 CO 0.11 0.16 0.04 -2.28 -0.31 0.00 0.00 175.10 172.81 3dlo s HIS 39 N -0.96 -0.00 -0.16 2.82 2.46 -1.09 -2.37 115.29 115.99 3dlo s HIS 39 Ca 0.11 0.15 -0.04 0.00 0.47 0.00 0.00 55.06 55.75 3dlo s HIS 39 Cb -0.10 -0.16 -0.03 0.00 -0.13 0.00 0.00 32.58 32.16 3dlo s HIS 39 CO 0.04 -0.08 -0.03 0.45 -2.47 0.00 0.00 174.74 172.65 3dlo s SER 40 N 0.83 4.84 0.13 9.88 0.15 -1.26 -1.00 113.70 127.27 3dlo s SER 40 Ca -0.07 -0.13 0.09 0.00 0.70 0.00 0.00 55.95 56.54 3dlo s SER 40 Cb -0.10 -1.79 -0.04 0.00 -1.71 0.00 0.00 66.02 62.38 3dlo s SER 40 CO -0.03 0.16 -0.21 -0.76 1.20 0.00 0.00 173.24 173.60 3dlo s LEU 41 N 0.42 2.35 0.07 3.45 1.43 0.19 -4.82 118.68 121.78 3dlo s LEU 41 Ca -0.03 -0.76 -0.31 0.00 -1.03 0.00 0.00 54.13 52.00 3dlo s LEU 41 Cb -0.14 -0.93 -0.18 0.00 0.03 0.00 0.00 46.19 44.97 3dlo s LEU 41 CO 0.03 0.05 1.63 -0.65 0.23 0.00 0.00 176.35 177.63 3dlo h PRO 42 N 3.73 -0.69 0.00 1.29 0.11 -1.85 -3.31 132.00 131.28 3dlo h PRO 42 Ca -0.46 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3dlo h PRO 42 Cb 1.19 0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.46 3dlo h PRO 42 CO 0.44 -0.45 0.00 0.41 -0.21 0.00 0.00 178.00 178.19 3dlo n GLY 43 N -1.35 0.55 0.00 -0.55 0.00 -1.26 -2.12 105.19 100.46 3dlo n GLY 43 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3dlo n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dlo n GLY 44 N -1.68 0.30 0.33 -0.02 0.00 -1.26 -4.87 105.19 97.99 3dlo n GLY 44 Ca 0.00 -1.87 0.15 0.00 0.00 0.00 0.00 46.02 44.30 3dlo n GLY 44 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dlo h GLY 45 N 0.00 0.00 1.99 -0.02 0.00 -2.05 -1.21 103.07 101.77 3dlo h GLY 45 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3dlo h GLY 45 CO 0.00 0.00 -0.08 3.21 0.00 0.00 0.00 176.54 179.67 3dlo h ARG 46 N 0.00 0.00 -6.52 4.80 3.08 -2.02 -3.43 114.38 110.28 3dlo h ARG 46 Ca 0.11 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.63 3dlo h ARG 46 Cb 0.48 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.54 3dlo h ARG 46 CO -0.00 0.07 0.63 0.99 -1.07 0.00 0.00 179.97 180.58 3dlo s THR 47 N -3.18 3.70 0.41 2.04 2.01 -0.46 -5.01 115.64 115.15 3dlo s THR 47 Ca 0.06 1.24 0.07 0.00 0.31 0.00 0.00 61.69 63.37 3dlo s THR 47 Cb 0.05 -3.79 -0.06 0.00 0.01 0.00 0.00 72.50 68.71 3dlo s THR 47 CO 0.68 0.11 0.10 -0.75 -0.69 0.00 0.00 174.62 174.06 3dlo s LYS 48 N 0.95 2.10 0.20 4.92 2.20 -1.26 -4.84 119.74 124.01 3dlo s LYS 48 Ca 0.60 -1.95 -0.11 0.00 -0.36 0.00 0.00 55.97 54.15 3dlo s LYS 48 Cb -0.33 -1.83 0.17 0.00 -1.51 0.00 0.00 37.83 34.33 3dlo s LYS 48 CO 0.30 -0.07 1.84 -0.44 -0.36 0.00 0.00 175.35 176.62 3dlo h ASP 49 N 1.60 0.65 1.10 1.43 5.19 -1.98 -2.53 116.42 121.88 3dlo h ASP 49 Ca -0.43 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 55.93 3dlo h ASP 49 Cb 1.25 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.61 3dlo h ASP 49 CO 0.74 0.45 -0.24 -0.33 -3.12 0.00 0.00 179.24 176.74 3dlo h GLU 50 N 0.78 0.00 -0.13 3.56 3.07 -1.99 -2.46 114.58 117.41 3dlo h GLU 50 Ca 0.26 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.96 3dlo h GLU 50 Cb 0.03 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.93 3dlo h GLU 50 CO -0.11 0.24 -0.61 -0.44 -1.40 0.00 0.00 179.01 176.69 3dlo h ASP 51 N 0.00 0.50 -0.11 1.42 3.32 -1.87 -1.33 116.42 118.35 3dlo h ASP 51 Ca -0.00 -0.29 -0.03 0.00 0.02 0.00 0.00 57.03 56.73 3dlo h ASP 51 Cb 0.86 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 3dlo h ASP 51 CO 0.03 0.99 -0.05 0.40 -1.72 0.00 0.00 179.24 178.89 3dlo h ILE 52 N 0.33 1.32 -1.00 0.35 2.04 -1.28 -0.06 117.51 119.21 3dlo h ILE 52 Ca -0.01 -1.09 0.05 0.00 1.00 0.00 0.00 64.86 64.81 3dlo h ILE 52 Cb 1.16 1.82 -0.06 0.00 -0.74 0.00 0.00 36.82 39.00 3dlo h ILE 52 CO 0.11 0.31 0.65 0.40 0.00 0.00 0.00 178.15 179.62 3dlo h ILE 53 N -0.14 1.14 0.02 -0.67 2.04 -1.41 -1.16 117.51 117.32 3dlo h ILE 53 Ca 0.02 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 3dlo h ILE 53 Cb 0.51 -0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 3dlo h ILE 53 CO 0.02 0.22 -0.01 -0.08 0.00 0.00 0.00 178.15 178.30 3dlo h GLU 54 N 1.22 -0.02 -0.96 2.37 4.81 -1.16 -1.82 114.58 119.02 3dlo h GLU 54 Ca 0.41 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.69 3dlo h GLU 54 Cb 0.07 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.40 3dlo h GLU 54 CO -0.14 0.42 0.63 0.00 -0.73 0.00 0.00 179.01 179.18 3dlo h ALA 55 N 0.50 1.41 -0.19 2.92 0.00 -0.82 -0.15 119.26 122.93 3dlo h ALA 55 Ca -0.00 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 3dlo h ALA 55 Cb 0.45 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.93 3dlo h ALA 55 CO 0.00 0.47 -0.72 0.87 0.00 0.00 0.00 179.25 179.87 3dlo h LYS 56 N 1.17 0.82 -0.62 0.00 1.79 -1.17 -2.36 116.57 116.19 3dlo h LYS 56 Ca 0.40 -0.63 -0.04 0.00 -2.18 0.00 0.00 60.65 58.19 3dlo h LYS 56 Cb 0.09 0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 3dlo h LYS 56 CO -0.14 1.25 0.23 0.93 -1.08 0.00 0.00 179.45 180.64 3dlo h GLU 57 N 0.58 0.95 -0.51 3.15 5.08 -0.93 -1.80 114.58 121.10 3dlo h GLU 57 Ca -0.04 -0.18 0.03 0.00 -1.00 0.00 0.00 59.36 58.17 3dlo h GLU 57 Cb 1.35 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 3dlo h GLU 57 CO 0.15 0.81 0.30 1.15 -1.00 0.00 0.00 179.01 180.42 3dlo h THR 58 N 0.88 1.04 -0.29 1.13 2.02 -1.00 -1.33 112.91 115.36 3dlo h THR 58 Ca 0.21 -0.20 -0.16 0.00 0.77 0.00 0.00 66.41 67.02 3dlo h THR 58 Cb 0.23 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 3dlo h THR 58 CO -0.01 0.11 -0.47 -0.07 0.37 0.00 0.00 175.52 175.45 3dlo h LEU 59 N 0.59 0.82 -0.12 2.58 3.38 -1.30 0.56 115.31 121.83 3dlo h LEU 59 Ca 0.21 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3dlo h LEU 59 Cb 0.04 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3dlo h LEU 59 CO -0.10 1.16 0.04 -1.28 0.09 0.00 0.00 178.44 178.34 3dlo h SER 60 N 0.60 0.17 -0.86 -0.43 0.87 -1.15 -1.34 113.55 111.41 3dlo h SER 60 Ca 0.03 -0.18 0.05 0.00 -1.23 0.00 0.00 61.79 60.46 3dlo h SER 60 Cb 1.03 -0.04 -0.06 0.00 -0.44 0.00 0.00 62.40 62.89 3dlo h SER 60 CO 0.10 0.30 0.54 -0.25 -0.53 0.00 0.00 176.83 177.00 3dlo h TRP 61 N 0.02 1.01 -0.33 2.24 7.01 -1.17 -2.42 115.95 122.31 3dlo h TRP 61 Ca 0.04 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.01 3dlo h TRP 61 Cb 0.19 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 3dlo h TRP 61 CO -0.01 0.54 -0.01 0.00 -2.79 0.00 0.00 178.44 176.18 3dlo h ALA 62 N 1.38 0.44 -0.75 2.65 0.00 -0.52 -2.33 119.26 120.13 3dlo h ALA 62 Ca 0.36 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3dlo h ALA 62 Cb 0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3dlo h ALA 62 CO -0.15 0.20 0.32 0.28 0.00 0.00 0.00 179.25 179.91 3dlo h VAL 63 N 0.38 1.25 -0.79 0.00 2.07 -1.20 -1.93 116.25 116.03 3dlo h VAL 63 Ca 0.09 -0.75 0.04 0.00 0.82 0.00 0.00 66.70 66.90 3dlo h VAL 63 Cb 0.46 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 3dlo h VAL 63 CO 0.02 0.31 0.52 0.77 0.02 0.00 0.00 177.57 179.21 3dlo h SER 64 N 1.08 0.83 -0.04 0.57 4.64 -1.10 -1.37 113.55 118.16 3dlo h SER 64 Ca 0.25 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 3dlo h SER 64 Cb 0.17 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3dlo h SER 64 CO -0.03 0.57 0.00 0.40 -0.87 0.00 0.00 176.83 176.91 3dlo h ILE 65 N 0.96 1.23 -0.78 0.95 1.08 -0.83 0.27 117.51 120.40 3dlo h ILE 65 Ca 0.32 -0.70 0.18 0.00 -0.39 0.00 0.00 64.86 64.27 3dlo h ILE 65 Cb 0.05 1.62 -0.12 0.00 -3.07 0.00 0.00 36.82 35.30 3dlo h ILE 65 CO -0.09 0.19 0.15 0.40 -0.69 0.00 0.00 178.15 178.10 3dlo h ILE 66 N -0.20 0.42 -0.10 -0.67 1.08 -1.07 0.13 117.51 117.09 3dlo h ILE 66 Ca 0.01 -0.07 -0.11 0.00 -0.39 0.00 0.00 64.86 64.30 3dlo h ILE 66 Cb 0.30 0.19 0.00 0.00 -3.07 0.00 0.00 36.82 34.24 3dlo h ILE 66 CO 0.00 0.04 -0.36 0.03 -0.69 0.00 0.00 178.15 177.17 3dlo h ARG 67 N 0.21 0.43 -0.04 2.37 3.08 -0.92 -1.90 114.38 117.61 3dlo h ARG 67 Ca 0.45 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 3dlo h ARG 67 Cb 0.81 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.91 3dlo h ARG 67 CO -0.59 0.95 -0.05 0.87 -1.07 0.00 0.00 179.97 180.09 3dlo h LYS 68 N -0.00 0.05 -0.03 0.04 1.57 -0.67 -0.37 116.57 117.16 3dlo h LYS 68 Ca -0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3dlo h LYS 68 Cb 0.99 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.29 3dlo h LYS 68 CO 0.08 0.10 0.00 0.39 -0.57 0.00 0.00 179.45 179.45 3dlo n GLU 69 N -4.45 1.07 -0.83 3.15 -0.58 0.41 -4.89 120.64 114.52 3dlo n GLU 69 Ca -0.02 -0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 3dlo n GLU 69 Cb 0.15 -1.02 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 3dlo n GLU 69 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dlo n GLY 70 N 0.55 0.51 3.51 0.62 0.00 -0.15 -4.82 105.19 105.41 3dlo n GLY 70 Ca 0.01 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 3dlo n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dlo s ALA 71 N -2.00 2.87 0.09 4.61 0.00 -0.75 -4.78 121.76 121.81 3dlo s ALA 71 Ca 0.00 -1.96 -0.24 0.00 0.00 0.00 0.00 51.96 49.76 3dlo s ALA 71 Cb 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 23.12 22.85 3dlo s ALA 71 CO 0.00 0.19 0.72 -1.21 0.00 0.00 0.00 175.76 175.46 3dlo s GLU 72 N -3.57 4.46 0.03 0.00 8.01 -1.26 -3.75 118.70 122.62 3dlo s GLU 72 Ca 0.31 1.02 0.00 0.00 0.01 0.00 0.00 54.97 56.31 3dlo s GLU 72 Cb -0.02 -3.30 -0.02 0.00 -4.31 0.00 0.00 34.13 26.48 3dlo s GLU 72 CO 0.16 0.47 -0.04 0.20 0.01 0.00 0.00 175.26 176.06 3dlo s GLY 73 N -0.70 0.30 0.01 -1.39 0.00 -1.26 0.65 107.32 104.94 3dlo s GLY 73 Ca 0.35 -0.64 0.01 0.00 0.00 0.00 0.00 44.72 44.44 3dlo s GLY 73 CO 0.23 -0.70 -0.04 -0.54 0.00 0.00 0.00 173.10 172.04 3dlo s GLU 74 N -1.53 0.34 0.12 2.90 2.02 -0.18 -4.94 118.70 117.43 3dlo s GLU 74 Ca -0.14 -0.32 -0.20 0.00 0.02 0.00 0.00 54.97 54.33 3dlo s GLU 74 Cb -0.10 -0.24 -0.07 0.00 0.10 0.00 0.00 34.13 33.82 3dlo s GLU 74 CO -0.01 0.06 0.62 -1.21 0.02 0.00 0.00 175.26 174.74 3dlo s GLU 75 N -0.57 4.25 -0.31 1.61 2.02 -1.26 -0.37 118.70 124.07 3dlo s GLU 75 Ca -0.03 0.80 -0.02 0.00 0.02 0.00 0.00 54.97 55.74 3dlo s GLU 75 Cb -0.04 -3.16 0.10 0.00 0.10 0.00 0.00 34.13 31.13 3dlo s GLU 75 CO -0.00 0.58 0.13 -1.01 0.02 0.00 0.00 175.26 174.97 3dlo s HIS 76 N -1.21 0.95 0.06 1.61 3.76 0.84 -4.88 115.29 116.43 3dlo s HIS 76 Ca 0.33 -1.31 -0.30 0.00 -0.15 0.00 0.00 55.06 53.63 3dlo s HIS 76 Cb -0.19 -1.26 -0.05 0.00 1.11 0.00 0.00 32.58 32.20 3dlo s HIS 76 CO 0.21 -0.85 1.00 -1.17 -0.85 0.00 0.00 174.74 173.07 3dlo s LEU 77 N 1.79 4.43 -0.22 0.89 2.96 -1.26 -2.66 118.68 124.62 3dlo s LEU 77 Ca 0.10 1.77 -0.02 0.00 -0.22 0.00 0.00 54.13 55.76 3dlo s LEU 77 Cb -0.17 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.95 3dlo s LEU 77 CO -0.29 -0.19 -0.10 -0.76 -1.32 0.00 0.00 176.35 173.69 3dlo s LEU 78 N 0.52 2.75 -0.36 -0.68 1.43 -0.17 -4.95 118.68 117.22 3dlo s LEU 78 Ca 0.50 -0.63 0.02 0.00 -1.03 0.00 0.00 54.13 53.00 3dlo s LEU 78 Cb -0.23 -1.63 0.11 0.00 0.03 0.00 0.00 46.19 44.46 3dlo s LEU 78 CO 0.29 -0.05 0.12 -0.69 0.23 0.00 0.00 176.35 176.25 3dlo s VAL 79 N 1.37 1.69 -0.01 -1.59 1.01 -1.26 -0.63 120.40 120.98 3dlo s VAL 79 Ca 0.04 -2.15 0.02 0.00 0.00 0.00 0.00 61.98 59.89 3dlo s VAL 79 Cb -0.15 -2.24 0.03 0.00 0.00 0.00 0.00 36.38 34.03 3dlo s VAL 79 CO -0.07 -0.69 0.86 0.54 0.00 0.00 0.00 175.10 175.74 3dlo n ARG 80 N 4.23 0.35 -1.83 2.72 1.74 -1.25 -4.90 116.66 117.72 3dlo n ARG 80 Ca 0.03 -1.05 -0.11 0.00 -0.77 0.00 0.00 57.85 55.95 3dlo n ARG 80 Cb 0.40 -0.65 -0.02 0.00 -1.02 0.00 0.00 32.46 31.17 3dlo n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dlo n GLY 81 N -0.20 0.46 3.65 -0.13 0.00 -0.90 -5.01 105.19 103.05 3dlo n GLY 81 Ca 0.02 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.30 3dlo n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dlo s LYS 82 N -3.85 2.05 0.41 1.61 1.02 -1.26 -5.06 119.74 114.66 3dlo s LYS 82 Ca 0.00 -1.91 -0.20 0.00 0.02 0.00 0.00 55.97 53.88 3dlo s LYS 82 Cb 0.00 -1.83 -0.11 0.00 -0.52 0.00 0.00 37.83 35.38 3dlo s LYS 82 CO 0.00 0.01 0.92 -1.21 -0.92 0.00 0.00 175.35 174.15 3dlo s GLU 83 N -3.75 4.19 0.21 1.68 0.41 -1.26 -4.42 118.70 115.76 3dlo s GLU 83 Ca 0.36 1.05 -0.15 0.00 -0.41 0.00 0.00 54.97 55.82 3dlo s GLU 83 Cb 0.04 -2.22 0.23 0.00 -1.78 0.00 0.00 34.13 30.40 3dlo s GLU 83 CO 0.19 -0.00 1.60 -1.35 -0.49 0.00 0.00 175.26 175.21 3dlo h PRO 84 N 1.95 -0.05 -0.24 0.39 0.11 -1.95 -1.23 132.00 130.97 3dlo h PRO 84 Ca -0.49 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3dlo h PRO 84 Cb 1.18 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3dlo h PRO 84 CO 0.62 -0.04 0.07 -1.35 -0.21 0.00 0.00 178.00 177.09 3dlo h PRO 85 N -0.06 0.38 -0.62 1.05 0.11 -1.94 0.11 132.00 131.03 3dlo h PRO 85 Ca 0.30 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 3dlo h PRO 85 Cb 0.53 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.55 3dlo h PRO 85 CO -0.71 0.47 0.35 -0.44 -0.21 0.00 0.00 178.00 177.46 3dlo h ASP 86 N 0.22 0.75 -0.11 -2.05 3.32 -1.85 -1.05 116.42 115.65 3dlo h ASP 86 Ca 0.08 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3dlo h ASP 86 Cb 0.25 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3dlo h ASP 86 CO -0.00 0.59 0.06 -0.78 -1.72 0.00 0.00 179.24 177.39 3dlo h ASP 87 N 0.85 0.14 -0.25 6.45 3.58 -0.80 0.79 116.42 127.19 3dlo h ASP 87 Ca 0.22 -0.10 -0.05 0.00 0.42 0.00 0.00 57.03 57.53 3dlo h ASP 87 Cb -0.00 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 3dlo h ASP 87 CO -0.04 0.20 -0.02 0.40 -2.88 0.00 0.00 179.24 176.90 3dlo h ILE 88 N 0.07 1.27 -0.22 2.25 2.04 -0.44 -1.32 117.51 121.16 3dlo h ILE 88 Ca 0.04 -0.97 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 3dlo h ILE 88 Cb 0.09 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 3dlo h ILE 88 CO -0.01 0.30 0.09 0.58 0.00 0.00 0.00 178.15 179.12 3dlo h VAL 89 N 0.22 1.16 -0.56 1.67 2.07 -1.15 -1.29 116.25 118.38 3dlo h VAL 89 Ca 0.07 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 3dlo h VAL 89 Cb 0.46 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 3dlo h VAL 89 CO 0.02 0.16 0.29 0.44 0.02 0.00 0.00 177.57 178.50 3dlo h ASP 90 N 0.20 0.72 -0.98 0.57 3.32 -0.82 -2.04 116.42 117.39 3dlo h ASP 90 Ca 0.07 -0.11 0.07 0.00 0.02 0.00 0.00 57.03 57.08 3dlo h ASP 90 Cb 0.17 -0.18 -0.07 0.00 0.22 0.00 0.00 39.33 39.47 3dlo h ASP 90 CO -0.01 0.62 0.63 0.15 -1.72 0.00 0.00 179.24 178.92 3dlo h PHE 91 N 0.75 1.16 -0.35 4.55 3.57 -1.06 0.11 116.94 125.67 3dlo h PHE 91 Ca 0.19 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.67 3dlo h PHE 91 Cb 0.08 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.43 3dlo h PHE 91 CO -0.01 0.59 -0.01 0.00 -2.23 0.00 0.00 178.31 176.65 3dlo h ALA 92 N 1.45 0.48 -0.42 2.41 0.00 -0.57 -1.39 119.26 121.23 3dlo h ALA 92 Ca 0.43 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3dlo h ALA 92 Cb 0.20 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3dlo h ALA 92 CO -0.18 0.26 0.03 -0.44 0.00 0.00 0.00 179.25 178.91 3dlo h ASP 93 N 0.44 0.63 -0.64 0.00 3.32 -1.21 0.10 116.42 119.07 3dlo h ASP 93 Ca 0.10 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 3dlo h ASP 93 Cb 0.48 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 3dlo h ASP 93 CO 0.02 0.68 0.30 -0.33 -1.72 0.00 0.00 179.24 178.19 3dlo h GLU 94 N 0.64 0.93 -0.21 3.56 5.08 -0.14 -2.82 114.58 121.62 3dlo h GLU 94 Ca 0.13 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3dlo h GLU 94 Cb 0.36 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3dlo h GLU 94 CO 0.01 0.75 0.00 1.33 -1.00 0.00 0.00 179.01 180.10 3dlo n VAL 95 N -4.48 0.26 -3.42 3.13 0.24 -0.60 -4.96 118.33 108.50 3dlo n VAL 95 Ca 0.04 -0.50 -0.18 0.00 -2.04 0.00 0.00 64.34 61.66 3dlo n VAL 95 Cb 0.13 0.79 0.07 0.00 -1.47 0.00 0.00 33.84 33.36 3dlo n VAL 95 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3dlo n ASP 96 N 0.90 -3.89 -4.75 -1.34 2.03 -0.70 -4.43 116.55 104.36 3dlo n ASP 96 Ca 0.17 -0.71 -0.36 0.00 0.52 0.00 0.00 54.79 54.40 3dlo n ASP 96 Cb 0.48 -4.87 0.04 0.00 -0.72 0.00 0.00 41.12 36.05 3dlo n ASP 96 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3dlo s ALA 97 N -3.43 2.53 0.13 -1.67 0.00 0.28 -4.27 121.76 115.33 3dlo s ALA 97 Ca 0.21 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.25 3dlo s ALA 97 Cb -0.04 -3.48 -0.11 0.00 0.00 0.00 0.00 23.12 19.49 3dlo s ALA 97 CO 0.76 -1.27 1.30 0.82 0.00 0.00 0.00 175.76 177.37 3dlo h ILE 98 N 0.86 1.50 -2.33 0.00 2.04 -0.72 -3.47 117.51 115.38 3dlo h ILE 98 Ca -0.51 -2.77 0.09 0.00 1.00 0.00 0.00 64.86 62.68 3dlo h ILE 98 Cb 1.31 2.61 -0.15 0.00 -0.74 0.00 0.00 36.82 39.84 3dlo h ILE 98 CO 0.55 0.81 0.46 0.00 0.00 0.00 0.00 178.15 179.97 3dlo s ALA 99 N -3.04 -1.80 -0.12 1.87 0.00 -1.26 -4.31 121.76 113.10 3dlo s ALA 99 Ca -0.03 0.98 -0.03 0.00 0.00 0.00 0.00 51.96 52.87 3dlo s ALA 99 Cb 0.09 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.61 3dlo s ALA 99 CO 0.85 -0.68 0.01 0.42 0.00 0.00 0.00 175.76 176.35 3dlo s ILE 100 N -3.12 4.32 -0.13 0.00 1.01 -0.75 -2.07 121.20 120.45 3dlo s ILE 100 Ca 0.04 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.47 3dlo s ILE 100 Cb -0.01 -2.86 -0.01 0.00 0.01 0.00 0.00 42.46 39.59 3dlo s ILE 100 CO -0.09 0.55 -0.16 -0.69 0.00 0.00 0.00 174.94 174.55 3dlo s VAL 101 N -0.36 2.72 0.08 2.92 1.01 0.21 0.17 120.40 127.15 3dlo s VAL 101 Ca 0.07 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.30 3dlo s VAL 101 Cb -0.12 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3dlo s VAL 101 CO 0.02 0.53 -0.07 0.27 0.00 0.00 0.00 175.10 175.84 3dlo s ILE 102 N 0.52 0.68 0.14 2.22 -4.36 -0.39 -2.19 121.20 117.82 3dlo s ILE 102 Ca -0.10 -1.64 -0.10 0.00 -0.26 0.00 0.00 60.65 58.55 3dlo s ILE 102 Cb -0.16 -1.31 -0.06 0.00 1.25 0.00 0.00 42.46 42.17 3dlo s ILE 102 CO 0.04 -0.68 0.47 -0.83 0.24 0.00 0.00 174.94 174.18 3dlo s GLY 103 N -2.52 2.33 -0.00 6.27 0.00 -1.26 -1.49 107.32 110.65 3dlo s GLY 103 Ca 0.04 -0.33 0.05 0.00 0.00 0.00 0.00 44.72 44.48 3dlo s GLY 103 CO -0.03 -0.15 -0.16 -0.42 0.00 0.00 0.00 173.10 172.35 3dlo s ILE 104 N -1.57 1.28 0.06 0.90 -1.09 0.35 -4.85 121.20 116.27 3dlo s ILE 104 Ca 0.39 -0.77 -0.31 0.00 -2.23 0.00 0.00 60.65 57.74 3dlo s ILE 104 Cb -0.13 -1.08 -0.07 0.00 -1.58 0.00 0.00 42.46 39.60 3dlo s ILE 104 CO 0.20 0.30 1.48 -0.13 -1.23 0.00 0.00 174.94 175.56 3dlo s ARG 105 N -0.54 4.26 -0.41 2.79 0.52 -1.26 -4.24 118.95 120.07 3dlo s ARG 105 Ca 0.06 2.13 -0.26 0.00 -0.52 0.00 0.00 55.73 57.13 3dlo s ARG 105 Cb -0.07 -3.47 0.02 0.00 0.52 0.00 0.00 34.95 31.95 3dlo s ARG 105 CO -0.00 -0.59 0.95 0.21 0.02 0.00 0.00 175.30 175.89 3dlo s LYS 106 N 2.07 3.72 -0.18 3.54 2.47 -1.26 -4.99 119.74 125.11 3dlo s LYS 106 Ca 0.67 0.43 -0.02 0.00 -1.56 0.00 0.00 55.97 55.50 3dlo s LYS 106 Cb -0.36 -3.86 -0.01 0.00 -1.46 0.00 0.00 37.83 32.14 3dlo s LYS 106 CO 0.29 -1.09 -0.09 1.03 0.16 0.00 0.00 175.35 175.64 3dlo s ARG 107 N 3.69 3.35 0.53 4.03 3.00 -1.26 -5.11 118.95 127.17 3dlo s ARG 107 Ca 0.39 -0.67 -0.19 0.00 0.00 0.00 0.00 55.73 55.27 3dlo s ARG 107 Cb -0.11 -2.81 -0.06 0.00 0.00 0.00 0.00 34.95 31.97 3dlo s ARG 107 CO 0.23 -0.03 1.05 -1.54 0.00 0.00 0.00 175.30 175.02 3dlo s SER 108 N 0.99 6.09 0.66 0.23 1.04 -1.26 -5.03 113.70 116.41 3dlo s SER 108 Ca -0.01 1.91 -0.15 0.00 0.48 0.00 0.00 55.95 58.19 3dlo s SER 108 Cb -0.15 -2.55 -0.00 0.00 0.10 0.00 0.00 66.02 63.42 3dlo s SER 108 CO -0.01 -0.96 1.10 -2.84 0.98 0.00 0.00 173.24 171.51 3dlo s PRO 109 N -3.54 2.87 -0.26 4.02 0.02 -1.26 -4.99 135.00 131.86 3dlo s PRO 109 Ca 0.66 1.31 0.22 0.00 0.02 0.00 0.00 61.00 63.22 3dlo s PRO 109 Cb -0.17 -1.96 0.50 0.00 0.02 0.00 0.00 34.50 32.88 3dlo s PRO 109 CO 0.27 -1.19 1.15 0.25 -0.33 0.00 0.00 177.00 177.15 3dlo n THR 110 N -2.47 1.12 -0.51 0.99 -2.24 -1.26 -4.89 114.28 105.03 3dlo n THR 110 Ca 0.10 -2.69 0.00 0.00 -2.27 0.00 0.00 64.05 59.19 3dlo n THR 110 Cb 0.52 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 70.03 3dlo n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dlo n GLY 111 N -0.67 0.75 3.75 3.38 0.00 -1.26 -4.98 105.19 106.17 3dlo n GLY 111 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 3dlo n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dlo s LYS 112 N -0.49 0.84 -0.32 1.61 -2.85 -1.26 -5.16 119.74 112.10 3dlo s LYS 112 Ca 0.00 -0.49 0.05 0.00 -1.00 0.00 0.00 55.97 54.53 3dlo s LYS 112 Cb 0.00 0.27 0.18 0.00 -2.06 0.00 0.00 37.83 36.22 3dlo s LYS 112 CO 0.00 -0.39 0.54 -1.17 0.10 0.00 0.00 175.35 174.43 3dlo s LEU 113 N -3.13 -1.31 0.15 2.77 2.96 -1.26 -4.50 118.68 114.35 3dlo s LEU 113 Ca 0.16 -0.27 0.05 0.00 -0.22 0.00 0.00 54.13 53.86 3dlo s LEU 113 Cb 0.01 1.70 -0.04 0.00 0.50 0.00 0.00 46.19 48.36 3dlo s LEU 113 CO 0.00 -0.28 0.09 0.27 -1.32 0.00 0.00 176.35 175.11 3dlo s ILE 114 N 2.46 4.32 -0.03 6.68 -5.25 -1.26 -5.10 121.20 123.02 3dlo s ILE 114 Ca 0.12 -1.08 -0.21 0.00 -0.99 0.00 0.00 60.65 58.48 3dlo s ILE 114 Cb -0.10 -3.17 -0.05 0.00 2.95 0.00 0.00 42.46 42.10 3dlo s ILE 114 CO -0.22 -0.05 0.60 -0.36 -1.79 0.00 0.00 174.94 173.12 3dlo s PHE 115 N -1.65 3.64 0.53 1.37 0.08 -1.26 -5.03 117.98 115.66 3dlo s PHE 115 Ca 0.30 1.16 -0.21 0.00 0.12 0.00 0.00 56.93 58.30 3dlo s PHE 115 Cb -0.10 -2.63 -0.06 0.00 -0.57 0.00 0.00 43.02 39.65 3dlo s PHE 115 CO 0.22 0.28 1.14 0.41 -0.10 0.00 0.00 175.22 177.17 3dlo n GLY 116 N 2.68 0.17 0.22 4.36 0.00 -1.26 -4.86 105.19 106.51 3dlo n GLY 116 Ca -0.06 -0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 3dlo n GLY 116 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3dlo h SER 117 N 1.15 0.37 0.45 1.61 0.87 -1.99 -2.03 113.55 113.98 3dlo h SER 117 Ca -0.49 -0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 59.92 3dlo h SER 117 Cb 1.33 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 3dlo h SER 117 CO 0.55 0.66 -0.21 0.58 -0.53 0.00 0.00 176.83 177.88 3dlo h VAL 118 N 0.32 0.46 -0.32 2.23 2.07 -1.99 -1.84 116.25 117.18 3dlo h VAL 118 Ca 0.04 -0.46 0.07 0.00 0.82 0.00 0.00 66.70 67.18 3dlo h VAL 118 Cb 0.69 0.64 -0.08 0.00 -1.52 0.00 0.00 31.29 31.02 3dlo h VAL 118 CO 0.05 0.07 -0.21 0.00 0.02 0.00 0.00 177.57 177.50 3dlo h ALA 119 N -0.54 0.00 -0.29 1.67 0.00 -1.92 -0.64 119.26 117.53 3dlo h ALA 119 Ca -0.06 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.03 3dlo h ALA 119 Cb 0.57 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 18.76 3dlo h ALA 119 CO 0.10 -0.60 -0.24 -0.09 0.00 0.00 0.00 179.25 178.42 3dlo h ARG 120 N -0.17 -0.22 -0.48 0.00 2.43 -1.35 -1.14 114.38 113.45 3dlo h ARG 120 Ca 0.16 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.28 3dlo h ARG 120 Cb 0.42 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 3dlo h ARG 120 CO -0.42 -0.15 0.01 -0.44 -1.51 0.00 0.00 179.97 177.46 3dlo h ASP 121 N -0.23 0.75 -0.41 -3.80 3.32 -1.15 -1.70 116.42 113.20 3dlo h ASP 121 Ca 0.15 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 3dlo h ASP 121 Cb 0.46 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 3dlo h ASP 121 CO -0.42 0.81 0.21 0.58 -1.72 0.00 0.00 179.24 178.70 3dlo h VAL 122 N 0.73 1.16 -0.35 -1.35 2.07 -0.60 0.10 116.25 118.01 3dlo h VAL 122 Ca 0.15 -0.45 -0.16 0.00 0.82 0.00 0.00 66.70 67.06 3dlo h VAL 122 Cb 0.44 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3dlo h VAL 122 CO 0.02 0.17 -0.42 0.40 0.02 0.00 0.00 177.57 177.77 3dlo h ILE 123 N 0.53 1.27 0.05 4.57 2.04 -0.70 -1.45 117.51 123.83 3dlo h ILE 123 Ca 0.14 -1.59 -0.29 0.00 1.00 0.00 0.00 64.86 64.12 3dlo h ILE 123 Cb 0.09 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 3dlo h ILE 123 CO -0.02 0.53 -1.54 -0.07 0.00 0.00 0.00 178.15 177.04 3dlo h LEU 124 N 0.71 0.17 -0.56 1.44 3.38 -1.30 -3.32 115.31 115.83 3dlo h LEU 124 Ca 0.05 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 3dlo h LEU 124 Cb 1.02 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 3dlo h LEU 124 CO 0.10 1.23 -0.34 0.11 0.09 0.00 0.00 178.44 179.63 3dlo h LYS 125 N 0.03 0.00 -6.92 1.13 1.57 -0.97 -3.46 116.57 107.94 3dlo h LYS 125 Ca -0.23 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.00 3dlo h LYS 125 Cb 1.97 0.00 0.11 0.00 0.08 0.00 0.00 32.23 34.39 3dlo h LYS 125 CO 0.12 0.34 0.73 0.00 -0.57 0.00 0.00 179.45 180.06 3dlo n ALA 126 N -2.22 2.18 -1.23 3.86 0.00 -0.55 -4.91 120.51 117.63 3dlo n ALA 126 Ca 0.01 0.32 -0.11 0.00 0.00 0.00 0.00 53.44 53.67 3dlo n ALA 126 Cb 0.57 -2.39 0.23 0.00 0.00 0.00 0.00 19.45 17.85 3dlo n ALA 126 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dlo n ASN 127 N 0.35 3.68 -4.13 0.00 3.02 -1.26 -4.94 115.26 111.99 3dlo n ASN 127 Ca 0.02 -3.51 -0.09 0.00 -0.03 0.00 0.00 54.58 50.98 3dlo n ASN 127 Cb 0.39 -0.73 -0.10 0.00 -0.61 0.00 0.00 39.78 38.73 3dlo n ASN 127 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3dlo s LYS 128 N -3.17 0.81 0.55 3.52 -0.14 -1.26 -5.05 119.74 115.00 3dlo s LYS 128 Ca 0.52 -1.35 -0.20 0.00 -1.36 0.00 0.00 55.97 53.57 3dlo s LYS 128 Cb 0.44 0.21 -0.07 0.00 -1.68 0.00 0.00 37.83 36.73 3dlo s LYS 128 CO 0.08 -0.20 0.92 -2.30 -0.76 0.00 0.00 175.35 173.10 3dlo n PRO 129 N -0.02 0.98 -4.41 -1.68 -0.02 -1.26 -4.83 135.00 123.77 3dlo n PRO 129 Ca -0.09 0.37 -0.23 0.00 -2.02 0.00 0.00 63.50 61.54 3dlo n PRO 129 Cb 0.63 -2.08 -0.16 0.00 -0.02 0.00 0.00 33.50 31.86 3dlo n PRO 129 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3dlo s VAL 130 N -1.48 0.88 -0.19 -1.45 1.01 -1.26 -1.82 120.40 116.10 3dlo s VAL 130 Ca 0.71 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 62.34 3dlo s VAL 130 Cb -0.45 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.08 3dlo s VAL 130 CO 0.51 0.30 -0.07 -0.63 0.00 0.00 0.00 175.10 175.20 3dlo s ILE 131 N 0.77 3.28 -0.16 2.22 1.01 0.13 -4.97 121.20 123.48 3dlo s ILE 131 Ca -0.13 -0.54 -0.03 0.00 0.00 0.00 0.00 60.65 59.94 3dlo s ILE 131 Cb -0.15 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.84 3dlo s ILE 131 CO 0.02 0.46 -0.05 0.00 0.00 0.00 0.00 174.94 175.38 3dlo s ILE 133 N 0.43 1.68 -2.51 0.00 -1.09 -0.55 -4.95 121.20 114.22 3dlo s ILE 133 Ca -0.04 -0.84 0.28 0.00 -2.23 0.00 0.00 60.65 57.82 3dlo s ILE 133 Cb -0.14 -1.45 0.55 0.00 -1.58 0.00 0.00 42.46 39.83 3dlo s ILE 133 CO 0.03 0.48 1.74 0.29 -1.23 0.00 0.00 174.94 176.25