#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hmo s PHE 2 N 0.00 3.47 0.50 1.61 0.08 -1.26 -5.04 117.98 117.34 1hmo s PHE 2 Ca 0.00 0.59 -0.23 0.00 0.12 0.00 0.00 56.93 57.41 1hmo s PHE 2 Cb 0.00 -2.04 -0.06 0.00 -0.57 0.00 0.00 43.02 40.34 1hmo s PHE 2 CO 0.00 0.35 1.39 -1.25 -0.10 0.00 0.00 175.22 175.62 1hmo s PRO 3 N -2.94 3.40 -0.33 0.24 0.04 -1.26 -4.99 135.00 129.16 1hmo s PRO 3 Ca 0.42 2.33 -0.16 0.00 0.04 0.00 0.00 61.00 63.63 1hmo s PRO 3 Cb -0.12 -2.45 -0.01 0.00 0.04 0.00 0.00 34.50 31.96 1hmo s PRO 3 CO 0.26 -1.01 0.43 0.42 0.04 0.00 0.00 177.00 177.14 1hmo s ILE 4 N -1.25 5.10 0.53 0.56 -1.09 -1.26 -5.04 121.20 118.75 1hmo s ILE 4 Ca 0.66 0.26 -0.22 0.00 -2.23 0.00 0.00 60.65 59.12 1hmo s ILE 4 Cb -0.42 -3.87 -0.06 0.00 -1.58 0.00 0.00 42.46 36.53 1hmo s ILE 4 CO 0.52 -0.11 1.32 -2.65 -1.23 0.00 0.00 174.94 172.79 1hmo n PRO 5 N 5.54 1.69 -3.55 2.79 -0.02 -1.26 -4.99 135.00 135.20 1hmo n PRO 5 Ca -0.07 0.62 -0.17 0.00 -2.02 0.00 0.00 63.50 61.86 1hmo n PRO 5 Cb 0.49 -2.52 -0.13 0.00 -0.02 0.00 0.00 33.50 31.32 1hmo n PRO 5 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1hmo s ASP 6 N -0.86 1.08 0.77 2.55 2.15 -1.26 -3.07 116.67 118.03 1hmo s ASP 6 Ca 0.70 0.01 -0.14 0.00 0.43 0.00 0.00 52.55 53.55 1hmo s ASP 6 Cb -0.43 0.43 0.06 0.00 -0.30 0.00 0.00 42.92 42.69 1hmo s ASP 6 CO 0.51 -0.30 1.18 -2.16 -0.17 0.00 0.00 175.17 174.23 1hmo s PRO 7 N 2.34 1.93 -1.16 4.34 0.04 -1.26 -5.02 135.00 136.20 1hmo s PRO 7 Ca 0.05 1.66 -0.22 0.00 0.04 0.00 0.00 61.00 62.53 1hmo s PRO 7 Cb -0.15 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 1hmo s PRO 7 CO -0.11 -1.97 1.86 -0.47 0.04 0.00 0.00 177.00 176.35 1hmo s TYR 8 N -2.21 2.17 0.06 0.56 6.14 -1.18 -4.86 117.35 118.03 1hmo s TYR 8 Ca 0.71 -0.10 0.02 0.00 0.64 0.00 0.00 57.07 58.34 1hmo s TYR 8 Cb -0.27 -4.24 -0.03 0.00 0.42 0.00 0.00 41.96 37.85 1hmo s TYR 8 CO 0.49 -1.47 -0.07 0.00 0.64 0.00 0.00 175.55 175.14 1hmo s TRP 10 N -2.18 2.61 0.24 0.00 -0.00 -1.26 -4.83 118.94 113.53 1hmo s TRP 10 Ca -0.03 1.41 0.01 0.00 -0.00 0.00 0.00 56.10 57.49 1hmo s TRP 10 Cb -0.05 -3.67 -0.05 0.00 -0.00 0.00 0.00 33.47 29.70 1hmo s TRP 10 CO -0.02 -2.32 0.08 0.16 -0.00 0.00 0.00 176.95 174.86 1hmo s ASP 11 N -0.93 1.16 0.00 5.86 1.47 -1.26 -5.03 116.67 117.93 1hmo s ASP 11 Ca 0.64 -1.35 0.11 0.00 1.18 0.00 0.00 52.55 53.12 1hmo s ASP 11 Cb -0.37 0.16 0.47 0.00 -0.34 0.00 0.00 42.92 42.84 1hmo s ASP 11 CO 0.46 -0.71 1.33 2.30 0.68 0.00 0.00 175.17 179.23 1hmo n ILE 12 N -0.42 1.19 0.30 2.11 -5.35 -1.26 -1.36 119.36 114.57 1hmo n ILE 12 Ca -0.01 0.30 0.17 0.00 -0.27 0.00 0.00 62.75 62.94 1hmo n ILE 12 Cb 0.66 -1.12 0.74 0.00 -1.74 0.00 0.00 39.64 38.19 1hmo n ILE 12 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1hmo h SER 13 N 0.00 0.00 -0.02 7.28 4.64 -2.01 -2.21 113.55 121.24 1hmo h SER 13 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hmo h SER 13 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1hmo h SER 13 CO 0.00 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.45 1hmo n PHE 14 N -2.93 0.01 -1.66 4.77 3.01 -0.46 -4.97 117.46 115.23 1hmo n PHE 14 Ca 0.00 -0.00 -0.45 0.00 1.01 0.00 0.00 57.45 58.01 1hmo n PHE 14 Cb 0.24 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.69 1hmo n PHE 14 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1hmo n ARG 15 N 0.10 1.97 -0.01 -1.08 1.74 -0.83 -4.90 116.66 113.66 1hmo n ARG 15 Ca 0.19 0.70 0.08 0.00 -0.77 0.00 0.00 57.85 58.05 1hmo n ARG 15 Cb 0.34 -2.35 -0.12 0.00 -1.02 0.00 0.00 32.46 29.31 1hmo n ARG 15 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1hmo n THR 16 N 1.94 0.00 -0.74 0.55 -2.24 -1.26 -4.99 114.28 107.54 1hmo n THR 16 Ca 0.12 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1hmo n THR 16 Cb 0.31 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1hmo n THR 16 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1hmo n PHE 17 N -1.93 0.00 -3.57 4.78 3.72 -1.26 -4.92 117.46 114.29 1hmo n PHE 17 Ca -0.02 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.97 1hmo n PHE 17 Cb 0.38 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.83 1hmo n PHE 17 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1hmo s TYR 18 N -2.99 3.35 0.25 1.38 2.02 -1.26 -4.97 117.35 115.13 1hmo s TYR 18 Ca 0.00 -1.58 -0.04 0.00 -0.37 0.00 0.00 57.07 55.08 1hmo s TYR 18 Cb 0.00 -3.15 0.36 0.00 -0.40 0.00 0.00 41.96 38.77 1hmo s TYR 18 CO 0.00 -0.89 1.86 1.79 -1.57 0.00 0.00 175.55 176.74 1hmo h THR 19 N 6.07 1.06 -0.50 -0.71 1.35 -1.99 -0.23 112.91 117.96 1hmo h THR 19 Ca -0.23 -0.36 -0.05 0.00 -0.55 0.00 0.00 66.41 65.22 1hmo h THR 19 Cb 1.08 -0.08 -0.02 0.00 -1.73 0.00 0.00 68.15 67.40 1hmo h THR 19 CO 0.80 0.19 0.11 -0.29 -0.25 0.00 0.00 175.52 176.08 1hmo h ILE 20 N 1.05 1.24 -0.11 6.82 -0.00 -1.99 -0.23 117.51 124.29 1hmo h ILE 20 Ca 0.40 -0.87 -0.00 0.00 -0.00 0.00 0.00 64.86 64.38 1hmo h ILE 20 Cb 0.17 0.85 -0.00 0.00 -0.00 0.00 0.00 36.82 37.83 1hmo h ILE 20 CO -0.17 0.31 0.05 0.40 -0.00 0.00 0.00 178.15 178.75 1hmo h ILE 21 N 0.69 1.11 -0.31 2.19 1.08 -1.81 -2.00 117.51 118.46 1hmo h ILE 21 Ca 0.16 -0.32 0.03 0.00 -0.39 0.00 0.00 64.86 64.33 1hmo h ILE 21 Cb 0.35 1.13 -0.03 0.00 -3.07 0.00 0.00 36.82 35.20 1hmo h ILE 21 CO 0.00 0.10 0.13 0.44 -0.69 0.00 0.00 178.15 178.13 1hmo h ASP 22 N 0.05 0.17 -1.00 1.72 3.32 -0.67 0.33 116.42 120.34 1hmo h ASP 22 Ca 0.04 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.14 1hmo h ASP 22 Cb 0.11 -0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.60 1hmo h ASP 22 CO -0.00 0.13 0.66 0.44 -1.72 0.00 0.00 179.24 178.75 1hmo h ASP 23 N 0.28 1.11 -0.53 6.45 3.45 -0.96 -2.31 116.42 123.90 1hmo h ASP 23 Ca 0.13 -0.02 -0.08 0.00 0.43 0.00 0.00 57.03 57.50 1hmo h ASP 23 Cb 0.08 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.57 1hmo h ASP 23 CO -0.12 0.77 0.04 -0.33 -1.57 0.00 0.00 179.24 178.03 1hmo h GLU 24 N 1.29 0.91 -0.89 3.56 5.08 -0.83 -2.97 114.58 120.74 1hmo h GLU 24 Ca 0.39 -0.27 0.08 0.00 -1.00 0.00 0.00 59.36 58.55 1hmo h GLU 24 Cb -0.05 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.04 1hmo h GLU 24 CO -0.11 0.91 0.55 0.45 -1.00 0.00 0.00 179.01 179.82 1hmo h HIS 25 N 0.79 1.02 -0.83 4.33 3.86 -0.54 0.50 115.15 124.28 1hmo h HIS 25 Ca 0.16 0.03 0.16 0.00 -1.16 0.00 0.00 60.37 59.55 1hmo h HIS 25 Cb 0.48 -0.33 -0.06 0.00 1.06 0.00 0.00 27.41 28.56 1hmo h HIS 25 CO 0.04 0.49 0.55 0.87 0.86 0.00 0.00 177.93 180.73 1hmo h LYS 26 N 0.97 0.49 0.00 2.45 1.57 -1.27 0.29 116.57 121.08 1hmo h LYS 26 Ca 0.40 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 59.05 1hmo h LYS 26 Cb 0.24 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1hmo h LYS 26 CO -0.20 0.33 -0.48 1.79 -0.57 0.00 0.00 179.45 180.31 1hmo h THR 27 N 0.51 1.12 0.07 -0.16 1.35 -0.85 -2.44 112.91 112.50 1hmo h THR 27 Ca 0.42 -1.80 -0.28 0.00 -0.55 0.00 0.00 66.41 64.19 1hmo h THR 27 Cb 0.87 2.04 0.02 0.00 -1.73 0.00 0.00 68.15 69.36 1hmo h THR 27 CO -0.16 0.47 -1.15 -0.07 -0.25 0.00 0.00 175.52 174.36 1hmo h LEU 28 N 0.00 0.86 -0.24 3.87 3.38 -0.16 -2.18 115.31 120.84 1hmo h LEU 28 Ca -0.00 -0.75 0.04 0.00 0.09 0.00 0.00 57.88 57.26 1hmo h LEU 28 Cb 1.00 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 1hmo h LEU 28 CO 0.06 1.55 0.00 -0.26 0.09 0.00 0.00 178.44 179.89 1hmo h PHE 29 N 0.31 -0.01 -0.57 1.13 -1.00 -1.21 -2.25 116.94 113.34 1hmo h PHE 29 Ca -0.16 0.02 0.06 0.00 2.81 0.00 0.00 57.97 60.70 1hmo h PHE 29 Cb 1.82 0.04 -0.05 0.00 3.61 0.00 0.00 35.95 41.36 1hmo h PHE 29 CO 0.10 -0.03 0.28 -0.97 -1.61 0.00 0.00 178.31 176.08 1hmo h ASN 30 N 0.08 0.39 -0.59 2.17 -1.24 -1.40 0.77 115.58 115.75 1hmo h ASN 30 Ca 0.11 0.04 0.04 0.00 0.71 0.00 0.00 56.30 57.20 1hmo h ASN 30 Cb 0.14 -0.03 -0.04 0.00 0.73 0.00 0.00 38.32 39.12 1hmo h ASN 30 CO -0.19 0.25 0.33 1.23 -1.29 0.00 0.00 177.43 177.77 1hmo h GLY 31 N 0.53 0.84 1.05 1.57 0.00 -1.10 -0.19 103.07 105.76 1hmo h GLY 31 Ca 0.26 -0.24 -0.15 0.00 0.00 0.00 0.00 47.33 47.21 1hmo h GLY 31 CO -0.20 0.18 -0.38 -2.22 0.00 0.00 0.00 176.54 173.92 1hmo h ILE 32 N 0.64 1.29 -0.13 2.60 2.04 -0.99 -2.69 117.51 120.28 1hmo h ILE 32 Ca 0.25 -1.55 0.02 0.00 1.00 0.00 0.00 64.86 64.58 1hmo h ILE 32 Cb 0.09 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1hmo h ILE 32 CO -0.14 0.51 -0.02 0.25 0.00 0.00 0.00 178.15 178.75 1hmo h LEU 33 N 0.58 -0.09 -0.72 1.44 5.85 -0.45 -1.56 115.31 120.35 1hmo h LEU 33 Ca 0.04 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.89 1hmo h LEU 33 Cb 0.96 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.99 1hmo h LEU 33 CO 0.09 -0.03 0.37 -0.07 -0.34 0.00 0.00 178.44 178.46 1hmo h LEU 34 N 0.02 0.50 -1.52 2.25 3.38 -1.01 -0.62 115.31 118.31 1hmo h LEU 34 Ca 0.06 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1hmo h LEU 34 Cb 0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1hmo h LEU 34 CO -0.12 0.29 -0.04 -0.07 0.09 0.00 0.00 178.44 178.58 1hmo h LEU 35 N 0.63 0.24 -0.98 1.67 3.38 -1.06 -1.31 115.31 117.89 1hmo h LEU 35 Ca 0.35 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.19 1hmo h LEU 35 Cb 0.35 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1hmo h LEU 35 CO -0.26 0.32 -0.47 0.77 0.09 0.00 0.00 178.44 178.89 1hmo h SER 36 N 0.25 0.00 0.45 -0.43 4.64 -0.18 -2.85 113.55 115.43 1hmo h SER 36 Ca 0.06 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.13 1hmo h SER 36 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1hmo h SER 36 CO 0.01 0.47 -1.06 1.56 -0.87 0.00 0.00 176.83 176.95 1hmo h GLN 37 N 0.00 0.36 -0.88 4.77 4.20 -0.40 -3.45 115.11 119.71 1hmo h GLN 37 Ca -0.00 -0.46 0.13 0.00 0.06 0.00 0.00 58.65 58.38 1hmo h GLN 37 Cb 0.91 0.15 -0.21 0.00 0.30 0.00 0.00 27.48 28.62 1hmo h GLN 37 CO 0.06 1.15 -0.12 0.00 -0.67 0.00 0.00 178.83 179.25 1hmo s ALA 38 N -3.04 -2.59 -1.30 3.87 0.00 -0.58 -5.09 121.76 113.03 1hmo s ALA 38 Ca -0.05 1.78 -0.18 0.00 0.00 0.00 0.00 51.96 53.51 1hmo s ALA 38 Cb 0.08 -2.23 0.08 0.00 0.00 0.00 0.00 23.12 21.05 1hmo s ALA 38 CO 0.87 -1.32 1.73 -3.47 0.00 0.00 0.00 175.76 173.57 1hmo n ASP 39 N 5.42 4.94 -3.90 0.00 4.64 -1.08 -4.25 116.55 122.32 1hmo n ASP 39 Ca -0.04 -2.92 -0.25 0.00 -1.38 0.00 0.00 54.79 50.20 1hmo n ASP 39 Cb 0.52 -1.74 -0.06 0.00 -1.04 0.00 0.00 41.12 38.80 1hmo n ASP 39 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 1hmo n ASN 40 N 8.18 2.17 -0.12 1.67 2.04 -1.26 -5.05 115.26 122.89 1hmo n ASN 40 Ca 0.48 -2.88 -0.11 0.00 -0.44 0.00 0.00 54.58 51.63 1hmo n ASN 40 Cb 0.46 0.60 -0.03 0.00 -2.53 0.00 0.00 39.78 38.28 1hmo n ASN 40 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1hmo h ALA 41 N 1.41 0.46 -0.16 -2.53 0.00 -1.99 -1.56 119.26 114.89 1hmo h ALA 41 Ca -0.32 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.36 1hmo h ALA 41 Cb 1.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1hmo h ALA 41 CO 0.51 0.24 0.05 -0.44 0.00 0.00 0.00 179.25 179.61 1hmo h ASP 42 N 0.42 0.05 -0.46 0.00 3.32 -1.97 -0.71 116.42 117.07 1hmo h ASP 42 Ca 0.09 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1hmo h ASP 42 Cb 0.48 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1hmo h ASP 42 CO 0.02 0.05 0.21 0.45 -1.72 0.00 0.00 179.24 178.25 1hmo h HIS 43 N 0.12 0.67 -0.65 4.55 3.86 -1.85 -2.07 115.15 119.79 1hmo h HIS 43 Ca 0.07 -0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 1hmo h HIS 43 Cb 0.05 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.29 1hmo h HIS 43 CO -0.12 0.55 0.15 1.25 0.86 0.00 0.00 177.93 180.62 1hmo h LEU 44 N 0.59 1.00 -0.31 2.43 5.85 -1.12 -2.27 115.31 121.48 1hmo h LEU 44 Ca 0.16 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.68 1hmo h LEU 44 Cb 0.14 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1hmo h LEU 44 CO -0.02 0.98 0.05 0.78 -0.34 0.00 0.00 178.44 179.89 1hmo h ASN 45 N 0.97 -0.02 -0.07 1.25 -0.26 -1.08 0.14 115.58 116.51 1hmo h ASN 45 Ca 0.20 0.05 0.03 0.00 -0.56 0.00 0.00 56.30 56.02 1hmo h ASN 45 Cb 0.38 0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.69 1hmo h ASN 45 CO 0.00 0.03 -0.09 -0.08 -1.06 0.00 0.00 177.43 176.23 1hmo h GLU 46 N 0.15 -0.12 -0.25 0.81 4.57 -1.26 0.15 114.58 118.64 1hmo h GLU 46 Ca 0.15 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.32 1hmo h GLU 46 Cb 0.17 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1hmo h GLU 46 CO -0.20 -0.08 0.11 1.25 -1.18 0.00 0.00 179.01 178.91 1hmo h LEU 47 N -0.12 0.33 -0.59 1.64 5.85 -1.25 -1.46 115.31 119.72 1hmo h LEU 47 Ca 0.06 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1hmo h LEU 47 Cb 0.21 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1hmo h LEU 47 CO -0.15 0.38 0.37 -0.09 -0.34 0.00 0.00 178.44 178.62 1hmo h ARG 48 N 0.26 0.79 0.46 1.25 9.65 -0.50 -1.02 114.38 125.27 1hmo h ARG 48 Ca 0.08 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1hmo h ARG 48 Cb 0.15 -0.17 0.00 0.00 -1.39 0.00 0.00 29.97 28.56 1hmo h ARG 48 CO -0.01 0.55 -0.22 -0.09 2.80 0.00 0.00 179.97 183.00 1hmo h ARG 49 N 0.79 -0.59 -0.96 0.20 2.43 -0.62 -1.75 114.38 113.89 1hmo h ARG 49 Ca 0.21 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.49 1hmo h ARG 49 Cb -0.05 0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 1hmo h ARG 49 CO -0.04 -0.34 0.62 0.00 -1.51 0.00 0.00 179.97 178.71 1hmo h THR 51 N 1.11 1.02 -0.48 0.00 2.02 -1.20 0.46 112.91 115.84 1hmo h THR 51 Ca 0.42 -0.45 0.03 0.00 0.77 0.00 0.00 66.41 67.17 1hmo h THR 51 Cb 0.19 1.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 1hmo h THR 51 CO -0.16 0.11 0.27 1.23 0.37 0.00 0.00 175.52 177.34 1hmo h GLY 52 N -0.34 0.67 0.85 2.16 0.00 -1.02 0.56 103.07 105.95 1hmo h GLY 52 Ca -0.01 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 1hmo h GLY 52 CO 0.02 0.16 -0.01 1.70 0.00 0.00 0.00 176.54 178.41 1hmo h LYS 53 N 0.54 -0.04 -0.10 4.80 3.64 -1.30 -2.17 116.57 121.95 1hmo h LYS 53 Ca 0.20 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1hmo h LYS 53 Cb 0.04 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1hmo h LYS 53 CO -0.10 0.12 0.06 1.25 -2.27 0.00 0.00 179.45 178.52 1hmo h HIS 54 N -0.19 0.13 -0.82 1.91 2.76 -0.59 -0.68 115.15 117.67 1hmo h HIS 54 Ca -0.00 0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.25 1hmo h HIS 54 Cb 0.18 -0.04 -0.07 0.00 1.55 0.00 0.00 27.41 29.03 1hmo h HIS 54 CO -0.02 0.10 0.48 0.74 -1.30 0.00 0.00 177.93 177.92 1hmo h PHE 55 N 0.12 0.87 -0.24 5.26 0.04 -0.90 0.11 116.94 122.21 1hmo h PHE 55 Ca 0.04 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.74 1hmo h PHE 55 Cb 0.00 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 37.88 1hmo h PHE 55 CO -0.07 0.39 -0.21 1.25 -0.60 0.00 0.00 178.31 179.07 1hmo h LEU 56 N 0.83 0.60 -0.63 1.54 5.85 -1.18 -1.74 115.31 120.58 1hmo h LEU 56 Ca 0.38 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1hmo h LEU 56 Cb 0.29 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1hmo h LEU 56 CO -0.22 0.94 0.41 0.78 -0.34 0.00 0.00 178.44 180.00 1hmo h ASN 57 N 0.27 0.74 -0.15 1.25 -0.26 -0.77 -0.31 115.58 116.36 1hmo h ASN 57 Ca 0.04 -0.03 -0.11 0.00 -0.56 0.00 0.00 56.30 55.64 1hmo h ASN 57 Cb 0.75 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.81 1hmo h ASN 57 CO 0.05 0.55 -0.25 -0.08 -1.06 0.00 0.00 177.43 176.64 1hmo h GLU 58 N 0.86 0.60 -0.62 0.81 4.81 -0.72 -1.34 114.58 118.98 1hmo h GLU 58 Ca 0.23 -0.24 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1hmo h GLU 58 Cb -0.08 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 1hmo h GLU 58 CO -0.05 0.80 0.41 1.96 -0.73 0.00 0.00 179.01 181.40 1hmo h GLN 59 N 0.53 0.81 -0.52 1.92 4.20 -1.01 -1.17 115.11 119.88 1hmo h GLN 59 Ca 0.07 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 1hmo h GLN 59 Cb 0.71 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 1hmo h GLN 59 CO 0.05 0.54 0.13 1.96 -0.67 0.00 0.00 178.83 180.84 1hmo h GLN 60 N 0.84 0.82 -0.94 1.46 4.20 -0.64 -0.74 115.11 120.11 1hmo h GLN 60 Ca 0.23 -0.19 0.04 0.00 0.06 0.00 0.00 58.65 58.79 1hmo h GLN 60 Cb -0.08 -0.11 -0.06 0.00 0.30 0.00 0.00 27.48 27.53 1hmo h GLN 60 CO -0.06 0.78 0.61 1.25 -0.67 0.00 0.00 178.83 180.75 1hmo h LEU 61 N 0.72 1.00 -0.40 1.46 5.85 -0.80 -1.84 115.31 121.29 1hmo h LEU 61 Ca 0.16 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1hmo h LEU 61 Cb 0.33 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1hmo h LEU 61 CO 0.00 0.68 0.17 0.24 -0.34 0.00 0.00 178.44 179.19 1hmo h MET 62 N 1.16 0.60 -0.14 1.25 2.86 -0.89 -2.88 114.93 116.89 1hmo h MET 62 Ca 0.38 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.88 1hmo h MET 62 Cb 0.04 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1hmo h MET 62 CO -0.13 0.55 -0.09 1.96 1.06 0.00 0.00 176.91 180.26 1hmo h GLN 63 N 0.51 0.22 0.00 1.72 4.20 -0.79 -0.76 115.11 120.21 1hmo h GLN 63 Ca 0.14 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 1hmo h GLN 63 Cb 0.17 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 1hmo h GLN 63 CO -0.01 0.33 -0.01 0.77 -0.67 0.00 0.00 178.83 179.23 1hmo h SER 64 N 0.21 0.00 -0.13 1.46 0.02 -1.11 -1.55 113.55 112.45 1hmo h SER 64 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1hmo h SER 64 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1hmo h SER 64 CO 0.02 0.01 0.00 -1.20 -1.14 0.00 0.00 176.83 174.52 1hmo n SER 65 N -3.13 2.50 -3.87 3.07 7.64 -1.13 -4.98 113.62 113.73 1hmo n SER 65 Ca -0.01 -2.24 -0.26 0.00 1.01 0.00 0.00 58.87 57.37 1hmo n SER 65 Cb 0.21 -0.18 0.02 0.00 -1.01 0.00 0.00 64.21 63.25 1hmo n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hmo n GLN 66 N -0.31 -4.68 -1.65 1.43 6.02 -0.58 -4.83 117.38 112.78 1hmo n GLN 66 Ca 0.08 0.55 -0.50 0.00 -0.01 0.00 0.00 57.00 57.12 1hmo n GLN 66 Cb 0.41 -5.15 -0.05 0.00 1.02 0.00 0.00 30.24 26.47 1hmo n GLN 66 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 1hmo n TYR 67 N -4.45 1.97 0.25 1.08 -0.00 -0.32 -4.86 117.16 110.83 1hmo n TYR 67 Ca -0.15 0.40 0.12 0.00 -0.00 0.00 0.00 57.90 58.27 1hmo n TYR 67 Cb 0.61 -2.47 0.66 0.00 -0.00 0.00 0.00 39.34 38.14 1hmo n TYR 67 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1hmo h ALA 68 N 6.00 1.20 -0.46 2.98 0.00 -1.90 -2.67 119.26 124.42 1hmo h ALA 68 Ca -0.47 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1hmo h ALA 68 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1hmo h ALA 68 CO 0.86 0.19 0.00 0.41 0.00 0.00 0.00 179.25 180.71 1hmo n GLY 69 N -0.46 1.28 0.25 0.00 0.00 -1.26 -4.60 105.19 100.40 1hmo n GLY 69 Ca -0.01 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.38 1hmo n GLY 69 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1hmo h TYR 70 N 2.71 -0.58 -0.40 1.61 5.03 -1.86 -1.77 116.97 121.72 1hmo h TYR 70 Ca 0.00 0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.39 1hmo h TYR 70 Cb 0.69 0.26 -0.05 0.00 1.55 0.00 0.00 36.73 39.17 1hmo h TYR 70 CO 0.34 -0.30 0.10 0.00 -1.32 0.00 0.00 178.16 176.97 1hmo h ALA 71 N 0.53 0.45 -0.35 1.82 0.00 -1.86 0.35 119.26 120.20 1hmo h ALA 71 Ca 0.06 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1hmo h ALA 71 Cb 0.42 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1hmo h ALA 71 CO -0.20 -0.30 -0.21 0.93 0.00 0.00 0.00 179.25 179.47 1hmo h GLU 72 N 0.23 0.67 -0.31 0.00 3.07 -1.87 -1.57 114.58 114.80 1hmo h GLU 72 Ca 0.19 -0.25 -0.18 0.00 -0.50 0.00 0.00 59.36 58.62 1hmo h GLU 72 Cb 0.22 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1hmo h GLU 72 CO -0.24 0.83 -0.50 1.25 -1.40 0.00 0.00 179.01 178.95 1hmo h HIS 73 N 0.60 1.09 -0.65 4.33 2.76 -0.34 -2.78 115.15 120.15 1hmo h HIS 73 Ca 0.09 -0.37 -0.03 0.00 -2.20 0.00 0.00 60.37 57.86 1hmo h HIS 73 Cb 0.68 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.40 1hmo h HIS 73 CO 0.03 1.20 0.29 -0.22 -1.30 0.00 0.00 177.93 177.93 1hmo h LYS 74 N 0.69 0.95 -0.98 5.26 3.64 -0.09 -2.34 116.57 123.70 1hmo h LYS 74 Ca 0.03 -0.15 0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1hmo h LYS 74 Cb 1.10 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.70 1hmo h LYS 74 CO 0.11 0.77 0.64 -0.22 -2.27 0.00 0.00 179.45 178.48 1hmo h LYS 75 N 0.90 1.21 -0.40 1.90 1.63 -1.20 -0.44 116.57 120.19 1hmo h LYS 75 Ca 0.22 -0.07 -0.02 0.00 -0.85 0.00 0.00 60.65 59.93 1hmo h LYS 75 Cb 0.15 -0.27 -0.02 0.00 -0.60 0.00 0.00 32.23 31.49 1hmo h LYS 75 CO -0.02 0.80 0.18 0.00 -3.45 0.00 0.00 179.45 176.96 1hmo h ALA 76 N 1.39 0.51 -0.04 5.00 0.00 -1.19 -1.35 119.26 123.59 1hmo h ALA 76 Ca 0.38 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1hmo h ALA 76 Cb -0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1hmo h ALA 76 CO -0.12 0.08 -0.05 0.45 0.00 0.00 0.00 179.25 179.62 1hmo h HIS 77 N 0.50 -0.12 -1.00 0.00 3.86 -0.96 -2.42 115.15 115.01 1hmo h HIS 77 Ca 0.14 0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.39 1hmo h HIS 77 Cb 0.13 0.06 -0.06 0.00 1.06 0.00 0.00 27.41 28.60 1hmo h HIS 77 CO -0.01 -0.08 0.66 -0.44 0.86 0.00 0.00 177.93 178.92 1hmo h ASP 78 N -0.07 1.10 -0.64 2.45 3.45 -0.94 -0.55 116.42 121.22 1hmo h ASP 78 Ca 0.03 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.45 1hmo h ASP 78 Cb 0.12 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.60 1hmo h ASP 78 CO -0.08 0.75 0.27 0.44 -1.57 0.00 0.00 179.24 179.05 1hmo h ASP 79 N 1.27 0.89 -0.27 6.45 3.45 -1.03 -2.30 116.42 124.88 1hmo h ASP 79 Ca 0.40 -0.12 -0.13 0.00 0.43 0.00 0.00 57.03 57.61 1hmo h ASP 79 Cb 0.00 -0.23 -0.00 0.00 -0.56 0.00 0.00 39.33 38.54 1hmo h ASP 79 CO -0.13 0.79 -0.36 0.15 -1.57 0.00 0.00 179.24 178.12 1hmo h PHE 80 N 0.95 0.88 -0.63 4.55 3.57 -0.73 -2.43 116.94 123.10 1hmo h PHE 80 Ca 0.23 -0.29 0.11 0.00 3.53 0.00 0.00 57.97 61.55 1hmo h PHE 80 Cb 0.17 -0.18 -0.08 0.00 2.79 0.00 0.00 35.95 38.65 1hmo h PHE 80 CO 0.01 1.05 0.20 0.82 -2.23 0.00 0.00 178.31 178.16 1hmo h ILE 81 N 0.46 0.69 -0.79 1.41 1.08 -1.03 -0.48 117.51 118.84 1hmo h ILE 81 Ca 0.03 -0.12 0.12 0.00 -0.39 0.00 0.00 64.86 64.50 1hmo h ILE 81 Cb 0.94 0.31 -0.08 0.00 -3.07 0.00 0.00 36.82 34.92 1hmo h ILE 81 CO 0.08 0.06 0.40 -0.74 -0.69 0.00 0.00 178.15 177.27 1hmo h HIS 82 N 0.35 0.71 -0.61 1.37 2.76 -1.24 0.36 115.15 118.85 1hmo h HIS 82 Ca 0.33 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.48 1hmo h HIS 82 Cb 0.47 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.21 1hmo h HIS 82 CO -0.20 0.22 0.15 0.87 -1.30 0.00 0.00 177.93 177.66 1hmo h LYS 83 N 0.63 0.98 -0.37 5.26 1.79 -0.82 -1.55 116.57 122.48 1hmo h LYS 83 Ca 0.41 -0.23 -0.10 0.00 -2.18 0.00 0.00 60.65 58.55 1hmo h LYS 83 Cb 0.50 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.00 1hmo h LYS 83 CO -0.31 0.89 -0.16 -0.07 -1.08 0.00 0.00 179.45 178.71 1hmo h LEU 84 N 0.89 0.69 -0.33 2.94 3.38 0.30 -2.15 115.31 121.03 1hmo h LEU 84 Ca 0.19 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1hmo h LEU 84 Cb 0.35 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1hmo h LEU 84 CO 0.00 0.86 0.00 0.47 0.09 0.00 0.00 178.44 179.86 1hmo n ASP 85 N -4.15 0.76 -1.43 -0.43 10.43 0.11 -2.75 116.55 119.10 1hmo n ASP 85 Ca 0.01 0.62 -0.06 0.00 2.57 0.00 0.00 54.79 57.92 1hmo n ASP 85 Cb 0.38 -0.81 0.10 0.00 1.84 0.00 0.00 41.12 42.64 1hmo n ASP 85 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1hmo n THR 86 N -2.26 2.03 -1.66 -3.53 -2.24 -0.62 -5.07 114.28 100.93 1hmo n THR 86 Ca 0.04 -3.37 -0.54 0.00 -2.27 0.00 0.00 64.05 57.91 1hmo n THR 86 Cb 0.34 -0.33 -0.06 0.00 -2.10 0.00 0.00 70.33 68.18 1hmo n THR 86 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1hmo n TRP 87 N -0.76 1.89 0.56 4.78 -0.00 -0.82 -4.91 117.44 118.19 1hmo n TRP 87 Ca 0.26 0.51 0.07 0.00 -0.00 0.00 0.00 57.50 58.34 1hmo n TRP 87 Cb 0.85 -2.44 0.05 0.00 -0.00 0.00 0.00 31.31 29.78 1hmo n TRP 87 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 1hmo n ASP 88 N 4.32 2.07 0.00 5.87 3.85 -1.26 -4.99 116.55 126.41 1hmo n ASP 88 Ca 0.23 -1.54 0.00 0.00 -0.71 0.00 0.00 54.79 52.77 1hmo n ASP 88 Cb 0.18 0.03 0.00 0.00 -1.35 0.00 0.00 41.12 39.98 1hmo n ASP 88 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1hmo n GLY 89 N 0.78 0.57 3.57 6.12 0.00 -1.26 -4.98 105.19 109.99 1hmo n GLY 89 Ca 0.08 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1hmo n GLY 89 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hmo s ASP 90 N -2.00 6.55 0.38 1.61 3.68 -1.26 -4.75 116.67 120.87 1hmo s ASP 90 Ca 0.00 -1.89 0.12 0.00 2.13 0.00 0.00 52.55 52.90 1hmo s ASP 90 Cb 0.00 -2.58 0.75 0.00 -1.45 0.00 0.00 42.92 39.64 1hmo s ASP 90 CO 0.00 -1.46 1.85 0.58 0.13 0.00 0.00 175.17 176.27 1hmo h VAL 91 N 6.22 1.23 -0.46 1.11 2.07 -1.96 -2.79 116.25 121.68 1hmo h VAL 91 Ca 0.31 -1.11 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 1hmo h VAL 91 Cb 0.94 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1hmo h VAL 91 CO 1.43 0.32 0.13 0.74 0.02 0.00 0.00 177.57 180.21 1hmo h THR 92 N 0.06 1.23 0.01 2.57 2.02 -2.00 -0.58 112.91 116.22 1hmo h THR 92 Ca 0.01 -0.79 0.02 0.00 0.77 0.00 0.00 66.41 66.42 1hmo h THR 92 Cb 0.57 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1hmo h THR 92 CO 0.04 0.28 -0.13 0.22 0.37 0.00 0.00 175.52 176.31 1hmo h TYR 93 N 0.61 -0.32 -0.58 3.16 5.03 -1.90 -1.94 116.97 121.02 1hmo h TYR 93 Ca 0.15 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.48 1hmo h TYR 93 Cb 0.30 0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.69 1hmo h TYR 93 CO 0.02 -0.19 0.38 0.00 -1.32 0.00 0.00 178.16 177.04 1hmo h ALA 94 N 0.73 0.74 -0.77 1.82 0.00 -1.28 0.22 119.26 120.71 1hmo h ALA 94 Ca 0.04 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1hmo h ALA 94 Cb 0.27 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1hmo h ALA 94 CO -0.11 0.15 0.50 0.87 0.00 0.00 0.00 179.25 180.65 1hmo h LYS 95 N 0.76 0.96 0.01 0.00 1.57 -0.85 -1.42 116.57 117.60 1hmo h LYS 95 Ca 0.22 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1hmo h LYS 95 Cb -0.06 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.03 1hmo h LYS 95 CO -0.06 0.64 -0.00 -0.91 -0.57 0.00 0.00 179.45 178.55 1hmo h ASN 96 N 0.99 -0.01 -0.43 0.86 4.21 -1.21 -2.98 115.58 117.02 1hmo h ASN 96 Ca 0.29 -0.43 0.09 0.00 1.21 0.00 0.00 56.30 57.46 1hmo h ASN 96 Cb -0.05 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 37.06 1hmo h ASN 96 CO -0.09 0.43 -0.23 -0.25 -1.29 0.00 0.00 177.43 176.01 1hmo h TRP 97 N -0.44 -0.58 -0.20 1.19 7.01 -0.18 -1.92 115.95 120.83 1hmo h TRP 97 Ca -0.00 0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.03 1hmo h TRP 97 Cb 0.44 0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 27.81 1hmo h TRP 97 CO 0.08 -0.31 0.05 1.25 -2.79 0.00 0.00 178.44 176.72 1hmo h LEU 98 N -0.14 0.30 -0.33 0.65 5.85 -1.31 -0.58 115.31 119.74 1hmo h LEU 98 Ca 0.20 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.74 1hmo h LEU 98 Cb 0.46 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1hmo h LEU 98 CO -0.52 0.44 0.08 0.58 -0.34 0.00 0.00 178.44 178.69 1hmo h VAL 99 N 0.14 0.86 -0.59 1.05 2.07 -1.37 -1.89 116.25 116.53 1hmo h VAL 99 Ca 0.06 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1hmo h VAL 99 Cb 0.26 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 1hmo h VAL 99 CO -0.00 0.04 0.30 -1.13 0.02 0.00 0.00 177.57 176.80 1hmo h ASN 100 N 0.21 0.75 -0.10 0.57 -1.24 -1.32 -2.16 115.58 112.29 1hmo h ASN 100 Ca 0.15 -0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.05 1hmo h ASN 100 Cb 0.15 -0.19 -0.00 0.00 0.73 0.00 0.00 38.32 39.01 1hmo h ASN 100 CO -0.18 0.65 0.06 -0.74 -1.29 0.00 0.00 177.43 175.92 1hmo h HIS 101 N 0.80 0.12 0.35 0.67 2.76 -0.70 -0.38 115.15 118.78 1hmo h HIS 101 Ca 0.20 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.36 1hmo h HIS 101 Cb 0.08 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.00 1hmo h HIS 101 CO -0.01 0.10 -0.17 0.82 -1.30 0.00 0.00 177.93 177.38 1hmo h ILE 102 N 0.11 0.66 0.00 6.26 2.04 -1.34 0.58 117.51 125.82 1hmo h ILE 102 Ca 0.03 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1hmo h ILE 102 Cb 0.01 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1hmo h ILE 102 CO -0.01 0.06 -0.04 0.11 0.00 0.00 0.00 178.15 178.27 1hmo h LYS 103 N -0.63 0.00 0.00 2.37 1.57 -1.34 -0.36 116.57 118.17 1hmo h LYS 103 Ca -0.05 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 1hmo h LYS 103 Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1hmo h LYS 103 CO 0.08 0.04 -1.29 0.25 -0.57 0.00 0.00 179.45 177.96 1hmo n THR 104 N -3.18 0.29 -0.10 -0.16 -2.24 -0.16 -4.50 114.28 104.23 1hmo n THR 104 Ca -0.00 -0.14 -0.24 0.00 -2.27 0.00 0.00 64.05 61.40 1hmo n THR 104 Cb 0.29 -0.77 -0.11 0.00 -2.10 0.00 0.00 70.33 67.63 1hmo n THR 104 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1hmo n ILE 105 N -2.44 1.56 -0.19 2.28 2.08 0.04 -3.90 119.36 118.79 1hmo n ILE 105 Ca -0.08 -0.22 -0.08 0.00 0.56 0.00 0.00 62.75 62.93 1hmo n ILE 105 Cb 0.61 -1.94 0.05 0.00 -0.75 0.00 0.00 39.64 37.62 1hmo n ILE 105 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 1hmo h ASP 106 N -0.83 0.99 0.06 4.38 3.32 -1.06 -2.81 116.42 120.47 1hmo h ASP 106 Ca -0.47 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 56.29 1hmo h ASP 106 Cb 1.50 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.78 1hmo h ASP 106 CO -0.23 1.06 -0.02 -0.26 -1.72 0.00 0.00 179.24 178.07 1hmo h PHE 107 N 0.92 0.00 0.00 4.55 0.05 -1.24 -1.34 116.94 119.89 1hmo h PHE 107 Ca 0.16 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.95 1hmo h PHE 107 Cb 0.57 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.52 1hmo h PHE 107 CO 0.04 0.02 0.00 0.87 -0.18 0.00 0.00 178.31 179.06 1hmo h LYS 108 N 0.00 0.00 0.00 1.51 1.57 -1.61 -2.93 116.57 115.11 1hmo h LYS 108 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1hmo h LYS 108 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1hmo h LYS 108 CO 0.00 0.00 -0.41 2.48 -0.57 0.00 0.00 179.45 180.95 1hmo n TYR 109 N -2.99 0.16 -1.67 -1.35 0.18 -0.50 -4.88 117.16 106.11 1hmo n TYR 109 Ca 0.00 0.05 -0.47 0.00 1.88 0.00 0.00 57.90 59.36 1hmo n TYR 109 Cb 0.27 -0.42 -0.04 0.00 -0.38 0.00 0.00 39.34 38.77 1hmo n TYR 109 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1hmo n ARG 110 N -1.67 2.16 -0.28 -3.48 1.74 -1.11 -0.83 116.66 113.19 1hmo n ARG 110 Ca 0.05 0.78 0.00 0.00 -0.77 0.00 0.00 57.85 57.91 1hmo n ARG 110 Cb 0.36 -2.57 0.00 0.00 -1.02 0.00 0.00 32.46 29.23 1hmo n ARG 110 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hmo n GLY 111 N 3.66 1.50 0.00 -0.13 0.00 -1.26 -4.84 105.19 104.12 1hmo n GLY 111 Ca 0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 1hmo n GLY 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hmo n LYS 112 N -2.00 4.42 0.00 1.61 5.02 -0.01 -5.27 118.16 121.93 1hmo n LYS 112 Ca 0.00 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1hmo n LYS 112 Cb 0.00 -0.86 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 1hmo n LYS 112 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32