#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 3.49 0.49 1.61 0.08 -1.26 -5.04 117.98 117.34 1hmo s PHE 2 Ca 0.00 1.05 -0.23 0.00 0.12 0.00 0.00 56.93 57.86 1hmo s PHE 2 Cb 0.00 -2.38 -0.07 0.00 -0.57 0.00 0.00 43.02 40.00 1hmo s PHE 2 CO 0.00 0.28 1.34 -1.25 -0.10 0.00 0.00 175.22 175.50 1hmo s PRO 3 N -2.52 3.50 -0.30 0.24 0.04 -1.26 -4.98 135.00 129.72 1hmo s PRO 3 Ca 0.46 2.21 -0.16 0.00 0.04 0.00 0.00 61.00 63.54 1hmo s PRO 3 Cb -0.13 -2.46 -0.02 0.00 0.04 0.00 0.00 34.50 31.93 1hmo s PRO 3 CO 0.20 -0.90 0.43 0.42 0.04 0.00 0.00 177.00 177.19 1hmo s ILE 4 N -1.30 5.12 0.48 0.56 -1.09 -1.26 -5.04 121.20 118.67 1hmo s ILE 4 Ca 0.65 0.46 -0.24 0.00 -2.23 0.00 0.00 60.65 59.30 1hmo s ILE 4 Cb -0.39 -3.81 -0.07 0.00 -1.58 0.00 0.00 42.46 36.61 1hmo s ILE 4 CO 0.48 0.00 1.41 -2.84 -1.23 0.00 0.00 174.94 172.76 1hmo s PRO 5 N 2.18 3.49 -0.09 2.79 0.02 -1.26 -5.01 135.00 137.11 1hmo s PRO 5 Ca 0.16 2.36 -0.03 0.00 0.02 0.00 0.00 61.00 63.52 1hmo s PRO 5 Cb -0.16 -2.52 0.04 0.00 0.02 0.00 0.00 34.50 31.89 1hmo s PRO 5 CO 0.11 -0.96 0.06 0.34 -0.33 0.00 0.00 177.00 176.23 1hmo s ASP 6 N -0.65 1.64 0.73 2.53 2.15 -1.26 -3.27 116.67 118.53 1hmo s ASP 6 Ca 0.65 -0.19 -0.14 0.00 0.43 0.00 0.00 52.55 53.29 1hmo s ASP 6 Cb -0.43 -0.21 0.04 0.00 -0.30 0.00 0.00 42.92 42.02 1hmo s ASP 6 CO 0.54 -0.28 1.17 -2.16 -0.17 0.00 0.00 175.17 174.26 1hmo s PRO 7 N 2.13 2.22 -1.17 4.34 0.04 -1.26 -5.02 135.00 136.28 1hmo s PRO 7 Ca 0.04 1.61 -0.21 0.00 0.04 0.00 0.00 61.00 62.47 1hmo s PRO 7 Cb -0.14 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 1hmo s PRO 7 CO -0.05 -1.74 1.84 -0.47 0.04 0.00 0.00 177.00 176.61 1hmo s TYR 8 N -2.20 2.24 0.06 0.56 6.14 -1.20 -4.87 117.35 118.07 1hmo s TYR 8 Ca 0.71 -0.27 0.01 0.00 0.64 0.00 0.00 57.07 58.17 1hmo s TYR 8 Cb -0.25 -4.30 -0.03 0.00 0.42 0.00 0.00 41.96 37.80 1hmo s TYR 8 CO 0.46 -1.51 -0.06 0.00 0.64 0.00 0.00 175.55 175.08 1hmo s TRP 10 N -2.35 2.42 0.26 0.00 -0.00 -1.26 -4.87 118.94 113.14 1hmo s TRP 10 Ca -0.03 1.48 0.02 0.00 -0.00 0.00 0.00 56.10 57.57 1hmo s TRP 10 Cb -0.03 -3.57 -0.04 0.00 -0.00 0.00 0.00 33.47 29.82 1hmo s TRP 10 CO -0.03 -2.34 0.13 0.16 -0.00 0.00 0.00 176.95 174.88 1hmo s ASP 11 N -1.36 1.11 0.16 5.86 1.47 -1.26 -5.05 116.67 117.61 1hmo s ASP 11 Ca 0.74 -1.45 0.21 0.00 1.18 0.00 0.00 52.55 53.22 1hmo s ASP 11 Cb -0.33 0.29 0.85 0.00 -0.34 0.00 0.00 42.92 43.39 1hmo s ASP 11 CO 0.38 -0.81 1.63 2.30 0.68 0.00 0.00 175.17 179.35 1hmo n ILE 12 N -0.47 0.86 0.26 2.11 -5.35 -1.26 -1.47 119.36 114.03 1hmo n ILE 12 Ca 0.01 0.21 0.14 0.00 -0.27 0.00 0.00 62.75 62.84 1hmo n ILE 12 Cb 0.66 -1.06 0.71 0.00 -1.74 0.00 0.00 39.64 38.20 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 -0.05 7.28 4.64 -2.02 -0.13 113.55 123.27 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 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 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 -2.49 0.03 -1.68 4.77 3.01 -0.54 -4.96 117.46 115.59 1hmo n PHE 14 Ca -0.01 -0.01 -0.44 0.00 1.01 0.00 0.00 57.45 57.99 1hmo n PHE 14 Cb 0.11 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.55 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 0.93 2.13 -0.00 -1.08 1.74 -0.07 -4.87 116.66 115.44 1hmo n ARG 15 Ca 0.16 0.76 0.08 0.00 -0.77 0.00 0.00 57.85 58.08 1hmo n ARG 15 Cb 0.51 -2.44 -0.11 0.00 -1.02 0.00 0.00 32.46 29.40 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 2.06 0.00 -1.03 0.55 -2.24 -1.26 -4.99 114.28 107.37 1hmo n THR 16 Ca 0.12 -0.23 -0.01 0.00 -2.27 0.00 0.00 64.05 61.66 1hmo n THR 16 Cb 0.32 0.63 -0.00 0.00 -2.10 0.00 0.00 70.33 69.17 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 -1.67 0.00 -3.58 4.78 3.72 -1.26 -4.90 117.46 114.56 1hmo n PHE 17 Ca 0.00 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.00 1hmo n PHE 17 Cb 0.32 -0.58 -0.09 0.00 -0.94 0.00 0.00 39.48 38.20 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 -1.87 3.46 0.24 1.38 2.02 -1.26 -5.00 117.35 116.32 1hmo s TYR 18 Ca 0.00 -1.99 -0.05 0.00 -0.37 0.00 0.00 57.07 54.66 1hmo s TYR 18 Cb 0.00 -3.47 0.34 0.00 -0.40 0.00 0.00 41.96 38.43 1hmo s TYR 18 CO 0.00 -0.98 1.85 1.79 -1.57 0.00 0.00 175.55 176.64 1hmo h THR 19 N 6.05 1.03 -0.56 -0.71 1.35 -1.99 0.14 112.91 118.22 1hmo h THR 19 Ca -0.18 -0.33 -0.05 0.00 -0.55 0.00 0.00 66.41 65.30 1hmo h THR 19 Cb 1.06 -0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 67.44 1hmo h THR 19 CO 0.83 0.18 0.15 -0.29 -0.25 0.00 0.00 175.52 176.14 1hmo h ILE 20 N 0.96 1.22 -0.14 6.82 -0.00 -1.99 -0.94 117.51 123.44 1hmo h ILE 20 Ca 0.38 -0.79 -0.05 0.00 -0.00 0.00 0.00 64.86 64.39 1hmo h ILE 20 Cb 0.18 0.63 -0.00 0.00 -0.00 0.00 0.00 36.82 37.63 1hmo h ILE 20 CO -0.18 0.30 -0.12 0.40 -0.00 0.00 0.00 178.15 178.55 1hmo h ILE 21 N 0.82 1.34 -0.18 2.19 2.04 -1.78 -2.31 117.51 119.64 1hmo h ILE 21 Ca 0.18 -1.25 0.03 0.00 1.00 0.00 0.00 64.86 64.82 1hmo h ILE 21 Cb 0.27 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.19 1hmo h ILE 21 CO -0.00 0.36 0.02 0.44 0.00 0.00 0.00 178.15 178.97 1hmo h ASP 22 N -0.05 -0.03 -0.76 1.72 3.32 -0.41 -1.36 116.42 118.84 1hmo h ASP 22 Ca 0.02 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.14 1hmo h ASP 22 Cb 0.63 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.19 1hmo h ASP 22 CO 0.03 0.01 0.50 0.44 -1.72 0.00 0.00 179.24 178.50 1hmo h ASP 23 N 0.08 0.82 -0.43 6.45 3.45 -1.18 -1.95 116.42 123.67 1hmo h ASP 23 Ca 0.08 -0.01 -0.11 0.00 0.43 0.00 0.00 57.03 57.42 1hmo h ASP 23 Cb 0.09 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.66 1hmo h ASP 23 CO -0.13 0.57 -0.18 -0.33 -1.57 0.00 0.00 179.24 177.60 1hmo h GLU 24 N 0.96 0.88 -0.89 3.56 5.08 -0.81 -3.00 114.58 120.35 1hmo h GLU 24 Ca 0.30 -0.37 0.06 0.00 -1.00 0.00 0.00 59.36 58.34 1hmo h GLU 24 Cb 0.01 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.18 1hmo h GLU 24 CO -0.08 1.02 0.58 0.45 -1.00 0.00 0.00 179.01 179.97 1hmo h HIS 25 N 0.70 1.03 -0.99 4.33 3.86 -0.83 -0.35 115.15 122.90 1hmo h HIS 25 Ca 0.10 0.03 0.09 0.00 -1.16 0.00 0.00 60.37 59.42 1hmo h HIS 25 Cb 0.74 -0.34 -0.07 0.00 1.06 0.00 0.00 27.41 28.80 1hmo h HIS 25 CO 0.05 0.55 0.63 0.87 0.86 0.00 0.00 177.93 180.90 1hmo h LYS 26 N 1.03 1.04 0.00 2.45 1.57 -1.23 -0.65 116.57 120.79 1hmo h LYS 26 Ca 0.37 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 59.00 1hmo h LYS 26 Cb 0.16 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1hmo h LYS 26 CO -0.13 0.69 -0.43 1.79 -0.57 0.00 0.00 179.45 180.79 1hmo h THR 27 N 1.07 1.25 -0.03 -0.16 1.35 -1.01 -2.58 112.91 112.80 1hmo h THR 27 Ca 0.45 -1.52 -0.26 0.00 -0.55 0.00 0.00 66.41 64.54 1hmo h THR 27 Cb 0.32 1.83 0.02 0.00 -1.73 0.00 0.00 68.15 68.58 1hmo h THR 27 CO -0.21 0.43 -0.99 -0.07 -0.25 0.00 0.00 175.52 174.43 1hmo h LEU 28 N 0.00 0.89 -0.16 3.87 3.38 -0.83 -2.26 115.31 120.20 1hmo h LEU 28 Ca -0.00 -0.69 0.03 0.00 0.09 0.00 0.00 57.88 57.31 1hmo h LEU 28 Cb 0.80 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1hmo h LEU 28 CO 0.06 1.49 -0.01 -0.26 0.09 0.00 0.00 178.44 179.81 1hmo h PHE 29 N 0.41 -0.02 -0.74 1.13 -1.00 -1.35 -2.39 116.94 112.98 1hmo h PHE 29 Ca -0.11 0.01 0.06 0.00 2.81 0.00 0.00 57.97 60.74 1hmo h PHE 29 Cb 1.63 0.04 -0.06 0.00 3.61 0.00 0.00 35.95 41.17 1hmo h PHE 29 CO 0.10 -0.03 0.43 -0.97 -1.61 0.00 0.00 178.31 176.22 1hmo h ASN 30 N 0.04 0.64 -0.65 2.17 -1.24 -1.44 -0.92 115.58 114.17 1hmo h ASN 30 Ca 0.07 0.03 0.01 0.00 0.71 0.00 0.00 56.30 57.12 1hmo h ASN 30 Cb 0.10 -0.10 -0.03 0.00 0.73 0.00 0.00 38.32 39.01 1hmo h ASN 30 CO -0.13 0.41 0.43 1.23 -1.29 0.00 0.00 177.43 178.07 1hmo h GLY 31 N 0.77 0.92 0.83 1.57 0.00 -1.19 -1.07 103.07 104.91 1hmo h GLY 31 Ca 0.33 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 1hmo h GLY 31 CO -0.19 0.33 -0.13 -2.22 0.00 0.00 0.00 176.54 174.34 1hmo h ILE 32 N 0.88 1.31 -0.70 2.60 2.04 -1.08 -2.88 117.51 119.68 1hmo h ILE 32 Ca 0.24 -1.21 0.12 0.00 1.00 0.00 0.00 64.86 65.00 1hmo h ILE 32 Cb -0.10 1.63 -0.08 0.00 -0.74 0.00 0.00 36.82 37.53 1hmo h ILE 32 CO -0.06 0.37 0.29 0.25 0.00 0.00 0.00 178.15 179.01 1hmo h LEU 33 N 0.18 0.30 0.17 1.44 5.85 -0.92 -0.83 115.31 121.50 1hmo h LEU 33 Ca 0.05 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1hmo h LEU 33 Cb 0.63 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1hmo h LEU 33 CO 0.04 0.15 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.95 1hmo h LEU 34 N 0.47 -0.75 -1.47 2.25 3.38 -1.11 -2.11 115.31 115.97 1hmo h LEU 34 Ca 0.37 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.47 1hmo h LEU 34 Cb 0.49 0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 1hmo h LEU 34 CO -0.34 -0.37 0.42 -0.07 0.09 0.00 0.00 178.44 178.17 1hmo h LEU 35 N -0.51 0.57 -1.91 1.67 3.38 -1.27 -0.02 115.31 117.23 1hmo h LEU 35 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1hmo h LEU 35 Cb 0.51 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1hmo h LEU 35 CO -0.12 0.38 0.00 0.77 0.09 0.00 0.00 178.44 179.55 1hmo h SER 36 N 0.66 0.00 0.24 -0.43 4.64 -0.50 -2.83 113.55 115.32 1hmo h SER 36 Ca 0.27 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.32 1hmo h SER 36 Cb 0.24 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.28 1hmo h SER 36 CO -0.08 0.00 -2.01 0.00 -0.87 0.00 0.00 176.83 173.87 1hmo n GLN 37 N -3.04 0.66 -3.15 4.77 6.02 -0.13 -4.84 117.38 117.68 1hmo n GLN 37 Ca -0.01 0.08 0.04 0.00 -0.01 0.00 0.00 57.00 57.11 1hmo n GLN 37 Cb 0.22 -1.64 -0.01 0.00 1.02 0.00 0.00 30.24 29.84 1hmo n GLN 37 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hmo s ALA 38 N -2.72 -2.80 -1.00 -1.58 0.00 -0.56 -5.08 121.76 108.03 1hmo s ALA 38 Ca -0.07 1.39 -0.23 0.00 0.00 0.00 0.00 51.96 53.05 1hmo s ALA 38 Cb 0.08 -2.48 0.03 0.00 0.00 0.00 0.00 23.12 20.75 1hmo s ALA 38 CO 0.83 -1.68 1.56 0.34 0.00 0.00 0.00 175.76 176.81 1hmo s ASP 39 N 2.88 6.22 0.41 0.00 3.68 -1.08 -4.05 116.67 124.72 1hmo s ASP 39 Ca 0.15 -1.30 0.05 0.00 2.13 0.00 0.00 52.55 53.58 1hmo s ASP 39 Cb -0.10 -2.57 -0.02 0.00 -1.45 0.00 0.00 42.92 38.78 1hmo s ASP 39 CO -0.22 -1.77 0.18 -0.46 0.13 0.00 0.00 175.17 173.03 1hmo n ASN 40 N 9.95 0.83 -0.09 -0.34 2.04 -1.26 -5.06 115.26 121.34 1hmo n ASN 40 Ca 0.35 -3.25 -0.13 0.00 -0.44 0.00 0.00 54.58 51.10 1hmo n ASN 40 Cb 0.50 1.20 -0.05 0.00 -2.53 0.00 0.00 39.78 38.91 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 1.78 0.38 -0.28 -2.53 0.00 -1.99 -1.68 119.26 114.94 1hmo h ALA 41 Ca -0.31 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.29 1hmo h ALA 41 Cb 1.25 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 1hmo h ALA 41 CO 0.49 0.34 -0.10 -0.44 0.00 0.00 0.00 179.25 179.54 1hmo h ASP 42 N 0.34 -0.36 -0.23 0.00 3.32 -1.97 -0.66 116.42 116.86 1hmo h ASP 42 Ca 0.05 0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 1hmo h ASP 42 Cb 0.78 0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1hmo h ASP 42 CO 0.06 -0.13 -0.23 0.45 -1.72 0.00 0.00 179.24 177.67 1hmo h HIS 43 N -0.05 0.79 -0.38 4.55 3.86 -1.84 -2.42 115.15 119.65 1hmo h HIS 43 Ca 0.14 -0.18 -0.14 0.00 -1.16 0.00 0.00 60.37 59.04 1hmo h HIS 43 Cb 0.26 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 1hmo h HIS 43 CO -0.30 0.87 -0.29 1.25 0.86 0.00 0.00 177.93 180.32 1hmo h LEU 44 N 0.61 0.92 -0.64 2.43 5.85 -0.93 -2.49 115.31 121.07 1hmo h LEU 44 Ca 0.09 -0.44 0.04 0.00 0.84 0.00 0.00 57.88 58.41 1hmo h LEU 44 Cb 0.72 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 1hmo h LEU 44 CO 0.06 1.17 0.37 0.78 -0.34 0.00 0.00 178.44 180.47 1hmo h ASN 45 N 0.68 0.58 -0.11 1.25 -0.26 -1.11 0.18 115.58 116.79 1hmo h ASN 45 Ca 0.07 0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.83 1hmo h ASN 45 Cb 0.87 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 38.02 1hmo h ASN 45 CO 0.08 0.39 0.07 -0.08 -1.06 0.00 0.00 177.43 176.83 1hmo h GLU 46 N 0.71 0.15 -0.10 0.81 4.57 -1.35 -1.00 114.58 118.37 1hmo h GLU 46 Ca 0.27 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.43 1hmo h GLU 46 Cb 0.10 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.65 1hmo h GLU 46 CO -0.14 0.13 0.04 1.25 -1.18 0.00 0.00 179.01 179.10 1hmo h LEU 47 N 0.12 0.13 -0.19 1.64 5.85 -1.13 -2.39 115.31 119.34 1hmo h LEU 47 Ca 0.04 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.65 1hmo h LEU 47 Cb 0.02 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 1hmo h LEU 47 CO -0.01 0.26 -0.16 -0.09 -0.34 0.00 0.00 178.44 178.10 1hmo h ARG 48 N -0.00 -0.16 0.46 1.25 9.65 -0.54 0.15 114.38 125.20 1hmo h ARG 48 Ca 0.03 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 1hmo h ARG 48 Cb 0.17 0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 1hmo h ARG 48 CO -0.00 -0.11 -0.48 -0.09 2.80 0.00 0.00 179.97 182.09 1hmo h ARG 49 N -0.17 -0.92 -0.81 0.20 2.43 -1.18 -0.97 114.38 112.97 1hmo h ARG 49 Ca 0.12 0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.43 1hmo h ARG 49 Cb 0.34 0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.05 1hmo h ARG 49 CO -0.29 -0.61 0.53 0.00 -1.51 0.00 0.00 179.97 178.09 1hmo h THR 51 N 0.82 1.30 -0.64 0.00 2.02 -0.57 -0.11 112.91 115.74 1hmo h THR 51 Ca 0.36 -1.11 0.03 0.00 0.77 0.00 0.00 66.41 66.46 1hmo h THR 51 Cb 0.33 2.03 -0.04 0.00 -1.74 0.00 0.00 68.15 68.74 1hmo h THR 51 CO -0.14 0.28 0.40 1.23 0.37 0.00 0.00 175.52 177.66 1hmo h GLY 52 N -0.54 0.92 0.85 2.16 0.00 -1.00 -0.18 103.07 105.28 1hmo h GLY 52 Ca -0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 1hmo h GLY 52 CO 0.01 0.25 0.03 1.70 0.00 0.00 0.00 176.54 178.53 1hmo h LYS 53 N 0.78 0.37 -0.33 4.80 3.64 -1.36 -2.31 116.57 122.17 1hmo h LYS 53 Ca 0.26 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1hmo h LYS 53 Cb 0.02 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1hmo h LYS 53 CO -0.11 0.52 0.15 1.25 -2.27 0.00 0.00 179.45 178.99 1hmo h HIS 54 N 0.17 0.48 -0.72 1.91 2.76 -0.81 -1.28 115.15 117.66 1hmo h HIS 54 Ca 0.07 -0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.21 1hmo h HIS 54 Cb 0.33 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 29.11 1hmo h HIS 54 CO 0.02 0.44 0.47 0.74 -1.30 0.00 0.00 177.93 178.30 1hmo h PHE 55 N 0.39 0.91 -0.35 5.26 0.04 -1.02 -0.80 116.94 121.36 1hmo h PHE 55 Ca 0.11 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.80 1hmo h PHE 55 Cb 0.14 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 1hmo h PHE 55 CO -0.01 0.58 -0.15 1.25 -0.60 0.00 0.00 178.31 179.38 1hmo h LEU 56 N 0.98 0.74 -0.53 1.54 5.85 -1.25 -1.35 115.31 121.29 1hmo h LEU 56 Ca 0.26 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1hmo h LEU 56 Cb -0.10 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 1hmo h LEU 56 CO -0.06 0.98 0.33 0.78 -0.34 0.00 0.00 178.44 180.13 1hmo h ASN 57 N 0.51 0.62 -0.50 1.25 -0.26 -0.96 0.98 115.58 117.21 1hmo h ASN 57 Ca 0.08 -0.04 -0.05 0.00 -0.56 0.00 0.00 56.30 55.73 1hmo h ASN 57 Cb 0.69 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.77 1hmo h ASN 57 CO 0.05 0.47 0.11 -0.08 -1.06 0.00 0.00 177.43 176.92 1hmo h GLU 58 N 0.71 0.81 -0.86 0.81 4.81 -1.12 -0.92 114.58 118.81 1hmo h GLU 58 Ca 0.19 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1hmo h GLU 58 Cb -0.05 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.19 1hmo h GLU 58 CO -0.04 0.79 0.46 1.96 -0.73 0.00 0.00 179.01 181.45 1hmo h GLN 59 N 0.69 1.21 -0.54 1.92 4.20 -0.92 -0.36 115.11 121.32 1hmo h GLN 59 Ca 0.15 -0.15 -0.09 0.00 0.06 0.00 0.00 58.65 58.63 1hmo h GLN 59 Cb 0.35 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1hmo h GLN 59 CO 0.00 0.90 -0.02 1.96 -0.67 0.00 0.00 178.83 181.00 1hmo h GLN 60 N 1.21 0.93 -0.66 1.46 1.08 -0.41 -1.26 115.11 117.47 1hmo h GLN 60 Ca 0.30 -0.29 -0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1hmo h GLN 60 Cb 0.05 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.36 1hmo h GLN 60 CO -0.05 0.94 0.39 1.25 -0.95 0.00 0.00 178.83 180.42 1hmo h LEU 61 N 0.86 0.80 -0.51 1.46 5.85 -0.53 -2.12 115.31 121.11 1hmo h LEU 61 Ca 0.16 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1hmo h LEU 61 Cb 0.53 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1hmo h LEU 61 CO 0.03 0.63 0.31 0.24 -0.34 0.00 0.00 178.44 179.30 1hmo h MET 62 N 0.90 0.70 0.00 1.25 2.86 -0.80 -2.90 114.93 116.95 1hmo h MET 62 Ca 0.24 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 1hmo h MET 62 Cb -0.02 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 1hmo h MET 62 CO -0.04 0.51 -0.34 1.96 1.06 0.00 0.00 176.91 180.06 1hmo h GLN 63 N 0.69 0.00 0.00 1.72 4.20 -0.95 -0.84 115.11 119.93 1hmo h GLN 63 Ca 0.18 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 1hmo h GLN 63 Cb -0.01 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.77 1hmo h GLN 63 CO -0.03 0.34 -0.06 0.77 -0.67 0.00 0.00 178.83 179.17 1hmo h SER 64 N 0.00 0.00 -0.30 1.46 0.02 -1.17 -1.73 113.55 111.84 1hmo h SER 64 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1hmo h SER 64 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1hmo h SER 64 CO 0.04 0.06 0.00 -1.20 -1.14 0.00 0.00 176.83 174.60 1hmo n SER 65 N -3.73 2.95 -3.85 3.07 7.64 -1.11 -4.98 113.62 113.61 1hmo n SER 65 Ca -0.02 -2.15 -0.24 0.00 1.01 0.00 0.00 58.87 57.47 1hmo n SER 65 Cb 0.16 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 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 0.25 -4.10 -1.65 1.43 6.02 -0.65 -4.82 117.38 113.87 1hmo n GLN 66 Ca 0.12 0.51 -0.49 0.00 -0.01 0.00 0.00 57.00 57.12 1hmo n GLN 66 Cb 0.47 -4.87 -0.05 0.00 1.02 0.00 0.00 30.24 26.81 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 -4.36 2.01 0.20 1.08 -0.00 -0.34 -4.87 117.16 110.88 1hmo n TYR 67 Ca -0.28 0.38 0.06 0.00 -0.00 0.00 0.00 57.90 58.06 1hmo n TYR 67 Cb 0.67 -2.48 0.42 0.00 -0.00 0.00 0.00 39.34 37.95 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 6.02 1.16 -0.43 2.98 0.00 -1.90 -2.89 119.26 124.21 1hmo h ALA 68 Ca -0.46 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.11 1hmo h ALA 68 Cb 1.29 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1hmo h ALA 68 CO 0.87 0.41 0.05 0.41 0.00 0.00 0.00 179.25 180.99 1hmo n GLY 69 N -0.15 2.65 0.28 0.00 0.00 -1.26 -4.66 105.19 102.05 1hmo n GLY 69 Ca -0.01 -0.64 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 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 2.52 -0.63 -0.54 1.61 5.03 -1.90 -2.27 116.97 120.80 1hmo h TYR 70 Ca 0.05 -0.01 0.08 0.00 2.58 0.00 0.00 58.73 61.42 1hmo h TYR 70 Cb 1.60 0.21 -0.06 0.00 1.55 0.00 0.00 36.73 40.03 1hmo h TYR 70 CO 0.79 -0.38 0.19 0.00 -1.32 0.00 0.00 178.16 177.44 1hmo h ALA 71 N -0.12 0.67 -0.44 1.82 0.00 -1.87 0.35 119.26 119.67 1hmo h ALA 71 Ca -0.06 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1hmo h ALA 71 Cb 0.51 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1hmo h ALA 71 CO 0.09 -0.21 0.18 0.93 0.00 0.00 0.00 179.25 180.24 1hmo h GLU 72 N 0.37 0.67 -0.45 0.00 3.07 -1.92 -0.91 114.58 115.41 1hmo h GLU 72 Ca 0.26 -0.12 -0.07 0.00 -0.50 0.00 0.00 59.36 58.93 1hmo h GLU 72 Cb 0.30 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 1hmo h GLU 72 CO -0.27 0.61 0.01 1.25 -1.40 0.00 0.00 179.01 179.21 1hmo h HIS 73 N 0.57 0.85 -0.95 4.33 2.76 -0.77 -2.44 115.15 119.51 1hmo h HIS 73 Ca 0.15 -0.14 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1hmo h HIS 73 Cb 0.20 -0.22 -0.05 0.00 1.55 0.00 0.00 27.41 28.89 1hmo h HIS 73 CO 0.00 0.82 0.57 -0.22 -1.30 0.00 0.00 177.93 177.81 1hmo h LYS 74 N 0.63 1.29 -0.74 5.26 3.64 -0.08 -2.15 116.57 124.42 1hmo h LYS 74 Ca 0.13 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 1hmo h LYS 74 Cb 0.48 -0.27 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 1hmo h LYS 74 CO 0.02 0.90 0.28 -0.22 -2.27 0.00 0.00 179.45 178.16 1hmo h LYS 75 N 1.31 1.11 -0.70 1.90 1.63 -1.01 -0.99 116.57 119.83 1hmo h LYS 75 Ca 0.34 -0.21 -0.01 0.00 -0.85 0.00 0.00 60.65 59.92 1hmo h LYS 75 Cb -0.06 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.37 1hmo h LYS 75 CO -0.06 0.92 0.39 0.00 -3.45 0.00 0.00 179.45 177.25 1hmo h ALA 76 N 1.14 0.90 -0.06 5.00 0.00 -0.93 -2.25 119.26 123.06 1hmo h ALA 76 Ca 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1hmo h ALA 76 Cb 0.24 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1hmo h ALA 76 CO -0.02 0.41 0.03 0.45 0.00 0.00 0.00 179.25 180.12 1hmo h HIS 77 N 0.96 0.08 -0.94 0.00 3.86 -1.04 -2.89 115.15 115.17 1hmo h HIS 77 Ca 0.25 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.51 1hmo h HIS 77 Cb 0.03 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.42 1hmo h HIS 77 CO -0.00 0.13 0.61 -0.44 0.86 0.00 0.00 177.93 179.09 1hmo h ASP 78 N -0.00 0.99 -0.48 2.45 3.45 -1.01 -1.32 116.42 120.50 1hmo h ASP 78 Ca 0.02 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.47 1hmo h ASP 78 Cb 0.08 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.62 1hmo h ASP 78 CO -0.00 0.65 0.25 0.44 -1.57 0.00 0.00 179.24 179.01 1hmo h ASP 79 N 1.14 0.61 -0.45 6.45 3.45 -1.35 -1.99 116.42 124.27 1hmo h ASP 79 Ca 0.39 -0.11 -0.14 0.00 0.43 0.00 0.00 57.03 57.60 1hmo h ASP 79 Cb 0.09 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 1hmo h ASP 79 CO -0.15 0.54 -0.28 0.15 -1.57 0.00 0.00 179.24 177.94 1hmo h PHE 80 N 0.63 1.15 -0.77 4.55 3.57 -1.19 -2.25 116.94 122.62 1hmo h PHE 80 Ca 0.17 -0.30 0.08 0.00 3.53 0.00 0.00 57.97 61.45 1hmo h PHE 80 Cb 0.08 -0.26 -0.07 0.00 2.79 0.00 0.00 35.95 38.50 1hmo h PHE 80 CO -0.01 1.14 0.43 0.82 -2.23 0.00 0.00 178.31 178.45 1hmo h ILE 81 N 0.83 0.92 -0.69 1.41 1.08 -1.10 -1.35 117.51 118.60 1hmo h ILE 81 Ca 0.09 -0.25 0.03 0.00 -0.39 0.00 0.00 64.86 64.34 1hmo h ILE 81 Cb 0.87 0.11 -0.05 0.00 -3.07 0.00 0.00 36.82 34.69 1hmo h ILE 81 CO 0.08 0.14 0.43 -0.74 -0.69 0.00 0.00 178.15 177.36 1hmo h HIS 82 N 0.74 0.80 -0.67 1.37 2.76 -1.10 0.30 115.15 119.35 1hmo h HIS 82 Ca 0.36 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.52 1hmo h HIS 82 Cb 0.31 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 28.98 1hmo h HIS 82 CO -0.07 0.45 0.29 0.87 -1.30 0.00 0.00 177.93 178.16 1hmo h LYS 83 N 0.83 0.99 -0.01 5.26 1.79 -0.76 -1.61 116.57 123.07 1hmo h LYS 83 Ca 0.28 -0.17 -0.10 0.00 -2.18 0.00 0.00 60.65 58.48 1hmo h LYS 83 Cb 0.04 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 30.51 1hmo h LYS 83 CO -0.12 0.81 -0.47 -0.07 -1.08 0.00 0.00 179.45 178.52 1hmo h LEU 84 N 0.94 0.03 -0.26 2.94 3.38 -0.73 -2.09 115.31 119.53 1hmo h LEU 84 Ca 0.23 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1hmo h LEU 84 Cb 0.18 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1hmo h LEU 84 CO -0.02 0.50 0.00 0.47 0.09 0.00 0.00 178.44 179.48 1hmo n ASP 85 N -3.98 0.53 -2.59 -0.43 10.43 0.04 -3.08 116.55 117.48 1hmo n ASP 85 Ca -0.02 0.59 -0.15 0.00 2.57 0.00 0.00 54.79 57.78 1hmo n ASP 85 Cb 0.50 -0.72 0.02 0.00 1.84 0.00 0.00 41.12 42.76 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 -2.04 1.51 -1.64 -3.53 -2.24 -0.66 -5.06 114.28 100.61 1hmo n THR 86 Ca 0.04 -3.70 -0.48 0.00 -2.27 0.00 0.00 64.05 57.65 1hmo n THR 86 Cb 0.31 0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.51 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 -0.25 1.98 0.02 4.78 -0.00 -0.82 -4.90 117.44 118.24 1hmo n TRP 87 Ca 0.20 0.42 0.03 0.00 -0.00 0.00 0.00 57.50 58.15 1hmo n TRP 87 Cb 0.77 -2.45 0.06 0.00 -0.00 0.00 0.00 31.31 29.69 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 2.90 2.19 -0.02 5.87 3.85 -1.26 -4.98 116.55 125.10 1hmo n ASP 88 Ca 0.17 -1.76 -0.00 0.00 -0.71 0.00 0.00 54.79 52.48 1hmo n ASP 88 Cb 0.26 -0.09 -0.00 0.00 -1.35 0.00 0.00 41.12 39.94 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 0.15 0.47 3.47 6.12 0.00 -1.26 -4.97 105.19 109.17 1hmo n GLY 89 Ca 0.05 -0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.15 6.83 0.40 1.61 3.68 -1.26 -4.77 116.67 121.00 1hmo s ASP 90 Ca 0.00 -2.44 0.17 0.00 2.13 0.00 0.00 52.55 52.41 1hmo s ASP 90 Cb 0.00 -2.43 0.84 0.00 -1.45 0.00 0.00 42.92 39.88 1hmo s ASP 90 CO 0.00 -0.97 1.84 0.58 0.13 0.00 0.00 175.17 176.75 1hmo h VAL 91 N 5.38 1.02 -0.11 1.11 2.07 -1.96 -2.84 116.25 120.91 1hmo h VAL 91 Ca 0.25 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.50 1hmo h VAL 91 Cb 0.95 1.71 -0.00 0.00 -1.52 0.00 0.00 31.29 32.43 1hmo h VAL 91 CO 1.21 0.33 -0.03 0.74 0.02 0.00 0.00 177.57 179.84 1hmo h THR 92 N 0.00 1.29 -0.23 2.57 2.02 -2.00 -1.17 112.91 115.39 1hmo h THR 92 Ca -0.00 -0.97 0.06 0.00 0.77 0.00 0.00 66.41 66.27 1hmo h THR 92 Cb 0.69 1.72 -0.06 0.00 -1.74 0.00 0.00 68.15 68.76 1hmo h THR 92 CO 0.04 0.27 -0.18 0.22 0.37 0.00 0.00 175.52 176.25 1hmo h TYR 93 N -0.12 -0.45 -0.39 3.16 5.03 -1.92 -2.52 116.97 119.76 1hmo h TYR 93 Ca 0.03 0.03 0.04 0.00 2.58 0.00 0.00 58.73 61.41 1hmo h TYR 93 Cb 0.44 0.23 -0.04 0.00 1.55 0.00 0.00 36.73 38.92 1hmo h TYR 93 CO 0.05 -0.25 0.15 0.00 -1.32 0.00 0.00 178.16 176.79 1hmo h ALA 94 N 0.95 0.46 -0.75 1.82 0.00 -1.36 0.15 119.26 120.54 1hmo h ALA 94 Ca 0.13 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.16 1hmo h ALA 94 Cb 0.37 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1hmo h ALA 94 CO -0.33 -0.24 0.42 0.87 0.00 0.00 0.00 179.25 179.97 1hmo h LYS 95 N 0.32 0.73 -0.21 0.00 1.57 -1.03 -1.04 116.57 116.90 1hmo h LYS 95 Ca 0.18 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.84 1hmo h LYS 95 Cb 0.14 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1hmo h LYS 95 CO -0.17 0.48 -0.17 -0.91 -0.57 0.00 0.00 179.45 178.12 1hmo h ASN 96 N 0.75 0.50 -0.15 0.86 4.21 -1.28 -3.05 115.58 117.43 1hmo h ASN 96 Ca 0.35 -0.46 0.04 0.00 1.21 0.00 0.00 56.30 57.44 1hmo h ASN 96 Cb 0.26 -0.14 -0.05 0.00 -1.12 0.00 0.00 38.32 37.27 1hmo h ASN 96 CO -0.21 0.86 -0.13 -0.25 -1.29 0.00 0.00 177.43 176.40 1hmo h TRP 97 N 0.16 -0.34 0.18 1.19 7.01 -0.07 -1.98 115.95 122.10 1hmo h TRP 97 Ca 0.04 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 1hmo h TRP 97 Cb 0.70 0.17 0.00 0.00 -2.10 0.00 0.00 29.16 27.93 1hmo h TRP 97 CO 0.07 -0.20 -0.09 1.25 -2.79 0.00 0.00 178.44 176.69 1hmo h LEU 98 N -0.15 -0.21 -0.44 0.65 5.85 -1.29 0.14 115.31 119.87 1hmo h LEU 98 Ca 0.10 -0.12 0.09 0.00 0.84 0.00 0.00 57.88 58.79 1hmo h LEU 98 Cb 0.30 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.30 1hmo h LEU 98 CO -0.25 -0.00 -0.10 0.58 -0.34 0.00 0.00 178.44 178.33 1hmo h VAL 99 N -0.41 0.57 -0.19 1.05 2.07 -1.49 -2.40 116.25 115.45 1hmo h VAL 99 Ca -0.02 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1hmo h VAL 99 Cb 0.31 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1hmo h VAL 99 CO 0.04 0.00 0.10 -1.13 0.02 0.00 0.00 177.57 176.60 1hmo h ASN 100 N 0.01 0.25 -0.19 0.57 -1.24 -1.19 -2.21 115.58 111.58 1hmo h ASN 100 Ca 0.21 -0.10 0.04 0.00 0.71 0.00 0.00 56.30 57.16 1hmo h ASN 100 Cb 0.32 -0.06 -0.04 0.00 0.73 0.00 0.00 38.32 39.27 1hmo h ASN 100 CO -0.44 0.28 -0.07 -0.74 -1.29 0.00 0.00 177.43 175.17 1hmo h HIS 101 N 0.19 -0.15 0.46 0.67 2.76 -0.44 -0.49 115.15 118.16 1hmo h HIS 101 Ca 0.07 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 1hmo h HIS 101 Cb 0.09 0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.15 1hmo h HIS 101 CO -0.03 -0.11 -0.22 0.82 -1.30 0.00 0.00 177.93 177.09 1hmo h ILE 102 N -0.03 0.52 0.00 6.26 2.04 -1.43 0.21 117.51 125.08 1hmo h ILE 102 Ca 0.10 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1hmo h ILE 102 Cb 0.17 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1hmo h ILE 102 CO -0.21 0.04 0.00 0.11 0.00 0.00 0.00 178.15 178.09 1hmo h LYS 103 N -0.77 0.00 0.00 2.37 1.57 -1.34 0.39 116.57 118.79 1hmo h LYS 103 Ca -0.06 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.56 1hmo h LYS 103 Cb 0.54 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 1hmo h LYS 103 CO 0.10 0.00 -1.59 0.25 -0.57 0.00 0.00 179.45 177.65 1hmo n THR 104 N -2.65 0.59 -0.10 -0.16 -2.24 -0.20 -4.49 114.28 105.03 1hmo n THR 104 Ca 0.02 -0.23 -0.17 0.00 -2.27 0.00 0.00 64.05 61.41 1hmo n THR 104 Cb 0.32 -0.86 -0.07 0.00 -2.10 0.00 0.00 70.33 67.61 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 -2.80 1.49 -0.18 2.28 2.08 0.58 -3.99 119.36 118.81 1hmo n ILE 105 Ca -0.18 0.01 -0.04 0.00 0.56 0.00 0.00 62.75 63.09 1hmo n ILE 105 Cb 0.69 -2.16 0.06 0.00 -0.75 0.00 0.00 39.64 37.49 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 -1.00 0.46 -0.04 4.38 5.19 -0.96 -2.12 116.42 122.33 1hmo h ASP 106 Ca -0.27 0.02 0.01 0.00 -0.62 0.00 0.00 57.03 56.17 1hmo h ASP 106 Cb 1.08 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.52 1hmo h ASP 106 CO -0.16 0.32 0.12 -0.26 -3.12 0.00 0.00 179.24 176.13 1hmo h PHE 107 N 0.59 0.00 0.00 4.55 0.05 -1.11 -1.77 116.94 119.24 1hmo h PHE 107 Ca 0.24 0.00 -0.07 0.00 3.82 0.00 0.00 57.97 61.96 1hmo h PHE 107 Cb 0.10 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.04 1hmo h PHE 107 CO -0.08 0.00 -0.32 0.87 -0.18 0.00 0.00 178.31 178.60 1hmo h LYS 108 N 0.00 0.00 0.00 1.51 1.57 -1.51 -2.79 116.57 115.35 1hmo h LYS 108 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1hmo h LYS 108 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1hmo h LYS 108 CO -0.00 0.32 -0.11 2.48 -0.57 0.00 0.00 179.45 181.57 1hmo n TYR 109 N -3.96 0.22 -1.69 -1.35 0.18 -0.67 -4.87 117.16 105.04 1hmo n TYR 109 Ca -0.02 0.06 -0.45 0.00 1.88 0.00 0.00 57.90 59.38 1hmo n TYR 109 Cb 0.38 -0.56 -0.04 0.00 -0.38 0.00 0.00 39.34 38.74 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 -1.69 2.40 0.00 -3.48 1.74 -1.06 -0.76 116.66 113.82 1hmo n ARG 110 Ca 0.06 0.87 0.00 0.00 -0.77 0.00 0.00 57.85 58.01 1hmo n ARG 110 Cb 0.36 -2.68 0.00 0.00 -1.02 0.00 0.00 32.46 29.13 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 3.72 1.74 0.26 -0.13 0.00 -1.26 -4.86 105.19 104.66 1hmo n GLY 111 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 2.01 0.00 1.61 5.02 0.06 -5.27 118.16 119.59 1hmo n LYS 112 Ca 0.00 -0.64 0.00 0.00 -2.02 0.00 0.00 58.31 55.65 1hmo n LYS 112 Cb 0.00 -1.13 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 1hmo n LYS 112 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32