#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpg h ILE 5 N 0.00 1.08 0.00 2.41 2.04 -1.98 -1.47 117.51 119.60 3hpg h ILE 5 Ca 0.00 -0.32 -0.11 0.00 1.00 0.00 0.00 64.86 65.42 3hpg h ILE 5 Cb 0.00 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.12 3hpg h ILE 5 CO 0.00 0.17 -0.54 -0.65 0.00 0.00 0.00 178.15 177.13 3hpg h PRO 6 N 0.94 0.00 0.39 2.37 0.11 -2.02 -2.04 132.00 131.76 3hpg h PRO 6 Ca 0.34 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.43 3hpg h PRO 6 Cb 0.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.26 3hpg h PRO 6 CO -0.11 0.54 -0.19 1.25 -0.21 0.00 0.00 178.00 179.28 3hpg h LEU 7 N 0.00 -0.44 -0.82 2.35 6.46 -1.89 -2.36 115.31 118.60 3hpg h LEU 7 Ca -0.01 -0.13 0.19 0.00 -0.12 0.00 0.00 57.88 57.82 3hpg h LEU 7 Cb 1.03 0.12 -0.12 0.00 -0.73 0.00 0.00 40.66 40.95 3hpg h LEU 7 CO 0.07 -0.06 0.27 0.00 -0.62 0.00 0.00 178.44 178.10 3hpg h ALA 8 N -0.50 1.19 -0.40 1.25 0.00 -1.20 0.21 119.26 119.80 3hpg h ALA 8 Ca -0.05 0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 3hpg h ALA 8 Cb 0.55 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3hpg h ALA 8 CO 0.09 -0.35 -0.11 1.49 0.00 0.00 0.00 179.25 180.37 3hpg h GLU 9 N 0.32 0.70 -0.17 0.00 4.81 -1.36 0.16 114.58 119.04 3hpg h GLU 9 Ca 0.49 -0.22 -0.04 0.00 -0.13 0.00 0.00 59.36 59.46 3hpg h GLU 9 Cb 0.90 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 3hpg h GLU 9 CO -0.54 0.79 -0.05 1.49 -0.73 0.00 0.00 179.01 179.98 3hpg h GLU 10 N 0.64 0.32 0.00 1.92 4.81 -0.47 -2.52 114.58 119.29 3hpg h GLU 10 Ca 0.11 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 3hpg h GLU 10 Cb 0.56 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3hpg h GLU 10 CO 0.03 0.60 -0.33 1.49 -0.73 0.00 0.00 179.01 180.08 3hpg h GLU 11 N 0.03 0.00 -0.17 1.92 4.57 -0.91 -2.59 114.58 117.43 3hpg h GLU 11 Ca 0.04 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.17 3hpg h GLU 11 Cb 0.49 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.07 3hpg h GLU 11 CO 0.02 0.33 -0.09 1.25 -1.18 0.00 0.00 179.01 179.33 3hpg h HIS 12 N 0.00 0.42 0.00 0.92 2.76 -0.57 -2.80 115.15 115.87 3hpg h HIS 12 Ca -0.00 -0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.06 3hpg h HIS 12 Cb 0.92 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.78 3hpg h HIS 12 CO 0.00 0.68 0.21 -0.91 -1.30 0.00 0.00 177.93 176.61 3hpg h ASN 13 N 0.03 0.00 0.10 3.26 2.35 -1.04 0.40 115.58 120.68 3hpg h ASN 13 Ca 0.04 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.54 3hpg h ASN 13 Cb 0.58 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.94 3hpg h ASN 13 CO 0.03 0.00 -1.26 0.11 -1.65 0.00 0.00 177.43 174.66 3hpg h LYS 14 N 0.00 0.21 0.00 0.81 1.57 -1.49 -3.43 116.57 114.23 3hpg h LYS 14 Ca 0.00 -0.35 -0.00 0.00 -1.87 0.00 0.00 60.65 58.43 3hpg h LYS 14 Cb 0.42 0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 3hpg h LYS 14 CO 0.00 1.17 -1.02 0.91 -0.57 0.00 0.00 179.45 179.93 3hpg n TRP 15 N -4.03 0.00 -3.04 -1.35 5.03 -0.52 -5.08 117.44 108.45 3hpg n TRP 15 Ca -0.24 0.00 -0.13 0.00 3.03 0.00 0.00 57.50 60.16 3hpg n TRP 15 Cb 0.84 -0.01 0.06 0.00 -1.03 0.00 0.00 31.31 31.17 3hpg n TRP 15 CO 0.00 0.00 0.00 0.72 -0.03 0.00 0.00 177.69 178.38 3hpg n HIS 16 N -1.68 -1.93 -1.82 -5.99 8.25 0.13 -5.02 115.22 107.15 3hpg n HIS 16 Ca -0.00 0.73 -0.30 0.00 -0.26 0.00 0.00 57.72 57.89 3hpg n HIS 16 Cb 0.18 -4.13 0.04 0.00 1.12 0.00 0.00 29.99 27.19 3hpg n HIS 16 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3hpg s GLN 17 N -4.55 3.02 1.00 -0.41 1.11 -1.26 -5.04 119.66 113.52 3hpg s GLN 17 Ca 0.22 0.60 -0.18 0.00 0.01 0.00 0.00 55.36 56.02 3hpg s GLN 17 Cb -0.03 -2.03 -0.11 0.00 -1.01 0.00 0.00 33.01 29.84 3hpg s GLN 17 CO 0.60 -0.95 -0.62 -0.25 0.01 0.00 0.00 175.29 174.08 3hpg n ASP 18 N -2.98 -4.68 0.19 5.90 8.00 -1.26 -4.77 116.55 116.95 3hpg n ASP 18 Ca 0.07 0.17 0.03 0.00 0.71 0.00 0.00 54.79 55.77 3hpg n ASP 18 Cb 0.56 -0.83 0.36 0.00 -0.02 0.00 0.00 41.12 41.20 3hpg n ASP 18 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hpg h ALA 19 N -1.17 1.38 0.04 2.24 0.00 -1.89 -2.47 119.26 117.39 3hpg h ALA 19 Ca -0.44 -0.33 -0.23 0.00 0.00 0.00 0.00 54.91 53.91 3hpg h ALA 19 Cb 1.31 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hpg h ALA 19 CO 0.26 0.46 -1.01 0.28 0.00 0.00 0.00 179.25 179.23 3hpg h VAL 20 N 0.00 1.46 -0.27 0.00 2.07 -1.90 -2.25 116.25 115.37 3hpg h VAL 20 Ca -0.00 -2.70 -0.14 0.00 0.82 0.00 0.00 66.70 64.68 3hpg h VAL 20 Cb 0.66 2.60 -0.00 0.00 -1.52 0.00 0.00 31.29 33.02 3hpg h VAL 20 CO 0.05 0.79 -0.37 0.28 0.02 0.00 0.00 177.57 178.34 3hpg h SER 21 N 0.14 0.79 -0.81 0.57 0.02 -1.88 -1.38 113.55 111.01 3hpg h SER 21 Ca -0.08 -0.51 0.06 0.00 -0.84 0.00 0.00 61.79 60.42 3hpg h SER 21 Cb 1.68 -0.23 -0.06 0.00 0.14 0.00 0.00 62.40 63.93 3hpg h SER 21 CO 0.17 1.14 0.49 -0.07 -1.14 0.00 0.00 176.83 177.42 3hpg h LEU 22 N 0.46 0.75 0.01 5.07 3.38 -1.44 -1.04 115.31 122.51 3hpg h LEU 22 Ca 0.03 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 3hpg h LEU 22 Cb 0.96 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3hpg h LEU 22 CO 0.09 0.48 -0.00 -0.74 0.09 0.00 0.00 178.44 178.35 3hpg h HIS 23 N 0.88 -0.01 0.00 1.13 2.76 -1.26 -2.59 115.15 116.07 3hpg h HIS 23 Ca 0.36 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.53 3hpg h HIS 23 Cb 0.19 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.16 3hpg h HIS 23 CO -0.05 0.18 0.00 -0.07 -1.30 0.00 0.00 177.93 176.69 3hpg h LEU 24 N -0.20 0.00 0.00 0.26 3.38 -0.89 -0.95 115.31 116.91 3hpg h LEU 24 Ca -0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 3hpg h LEU 24 Cb 0.19 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 3hpg h LEU 24 CO 0.00 0.00 -2.41 1.21 0.09 0.00 0.00 178.44 177.33 3hpg n GLU 25 N -2.68 0.62 -0.09 1.13 2.13 -0.42 -4.53 120.64 116.80 3hpg n GLU 25 Ca 0.02 0.14 0.09 0.00 0.66 0.00 0.00 57.16 58.07 3hpg n GLU 25 Cb 0.33 -1.50 0.13 0.00 0.27 0.00 0.00 31.44 30.67 3hpg n GLU 25 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 3hpg n PHE 26 N -3.22 0.23 -2.09 4.31 3.72 -0.98 -4.98 117.46 114.44 3hpg n PHE 26 Ca -0.44 -0.16 -0.19 0.00 -0.05 0.00 0.00 57.45 56.62 3hpg n PHE 26 Cb 0.97 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.47 3hpg n PHE 26 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hpg n GLY 27 N 1.03 0.34 3.82 1.37 0.00 -0.36 -4.83 105.19 106.56 3hpg n GLY 27 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 3hpg n GLY 27 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hpg s ILE 28 N -2.81 4.36 0.15 -0.61 -4.36 -1.24 -4.99 121.20 111.70 3hpg s ILE 28 Ca 0.00 1.34 -0.34 0.00 -0.26 0.00 0.00 60.65 61.39 3hpg s ILE 28 Cb 0.00 -3.62 -0.15 0.00 1.25 0.00 0.00 42.46 39.94 3hpg s ILE 28 CO 0.00 -0.44 1.45 -2.65 0.24 0.00 0.00 174.94 173.54 3hpg n PRO 29 N -1.03 1.73 0.15 0.37 -0.02 -1.26 -4.57 135.00 130.38 3hpg n PRO 29 Ca 0.07 0.62 0.11 0.00 -2.02 0.00 0.00 63.50 62.28 3hpg n PRO 29 Cb 0.54 -2.32 0.55 0.00 -0.02 0.00 0.00 33.50 32.25 3hpg n PRO 29 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3hpg n ARG 30 N 2.81 0.14 0.06 -0.52 1.85 -1.26 0.32 116.66 120.07 3hpg n ARG 30 Ca 0.17 0.60 -0.09 0.00 -1.00 0.00 0.00 57.85 57.53 3hpg n ARG 30 Cb 0.26 -1.93 -0.12 0.00 -1.05 0.00 0.00 32.46 29.62 3hpg n ARG 30 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 3hpg h THR 31 N 0.00 1.64 -0.19 8.89 1.35 -1.93 -1.36 112.91 121.31 3hpg h THR 31 Ca 0.00 -3.33 -0.16 0.00 -0.55 0.00 0.00 66.41 62.37 3hpg h THR 31 Cb 0.05 2.85 -0.01 0.00 -1.73 0.00 0.00 68.15 69.31 3hpg h THR 31 CO 0.00 0.94 -0.52 0.00 -0.25 0.00 0.00 175.52 175.69 3hpg h ALA 32 N 0.93 0.73 -0.25 6.62 0.00 -0.48 -2.72 119.26 124.09 3hpg h ALA 32 Ca -0.04 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.28 3hpg h ALA 32 Cb 1.82 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.51 3hpg h ALA 32 CO 0.14 0.68 -0.20 0.00 0.00 0.00 0.00 179.25 179.87 3hpg h ALA 33 N 1.00 0.36 -0.03 0.00 0.00 -1.28 -2.44 119.26 116.86 3hpg h ALA 33 Ca 0.01 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.58 3hpg h ALA 33 Cb 1.06 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 3hpg h ALA 33 CO 0.10 0.29 0.06 0.93 0.00 0.00 0.00 179.25 180.63 3hpg h GLU 34 N 0.28 0.00 0.07 0.00 5.08 -1.23 -2.72 114.58 116.06 3hpg h GLU 34 Ca 0.04 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 3hpg h GLU 34 Cb 0.74 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.01 3hpg h GLU 34 CO 0.05 0.00 -0.49 -0.44 -1.00 0.00 0.00 179.01 177.13 3hpg h ASP 35 N 0.00 0.32 -0.91 1.42 3.32 -1.13 -2.21 116.42 117.23 3hpg h ASP 35 Ca 0.01 -0.92 0.15 0.00 0.02 0.00 0.00 57.03 56.30 3hpg h ASP 35 Cb 0.12 -0.10 -0.10 0.00 0.22 0.00 0.00 39.33 39.48 3hpg h ASP 35 CO -0.00 1.21 0.50 0.40 -1.72 0.00 0.00 179.24 179.63 3hpg h ILE 36 N -0.53 0.75 -0.14 0.35 2.04 -1.14 0.68 117.51 119.53 3hpg h ILE 36 Ca -0.08 -0.24 -0.19 0.00 1.00 0.00 0.00 64.86 65.35 3hpg h ILE 36 Cb 1.34 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.40 3hpg h ILE 36 CO 0.09 0.13 -0.68 0.58 0.00 0.00 0.00 178.15 178.27 3hpg h VAL 37 N 0.71 1.33 0.00 1.67 2.07 -1.59 -2.87 116.25 117.58 3hpg h VAL 37 Ca 0.49 -1.98 -0.08 0.00 0.82 0.00 0.00 66.70 65.96 3hpg h VAL 37 Cb 0.69 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 3hpg h VAL 37 CO -0.35 0.61 -0.36 1.56 0.02 0.00 0.00 177.57 179.05 3hpg h GLN 38 N 0.40 0.00 -0.34 1.57 1.08 -0.62 -3.05 115.11 114.15 3hpg h GLN 38 Ca -0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 3hpg h GLN 38 Cb 1.26 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 3hpg h GLN 38 CO 0.13 0.36 0.00 1.04 -0.95 0.00 0.00 178.83 179.41 3hpg n GLN 39 N -3.62 2.27 -3.10 1.46 6.02 0.13 -4.84 117.38 115.71 3hpg n GLN 39 Ca -0.01 -1.92 -0.42 0.00 -0.01 0.00 0.00 57.00 54.64 3hpg n GLN 39 Cb 0.48 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 30.20 3hpg n GLN 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hpg h ASP 41 N 8.55 0.38 -0.35 0.00 3.32 -1.88 -1.92 116.42 124.52 3hpg h ASP 41 Ca -0.26 -0.11 0.08 0.00 0.02 0.00 0.00 57.03 56.76 3hpg h ASP 41 Cb 1.11 -0.10 -0.08 0.00 0.22 0.00 0.00 39.33 40.48 3hpg h ASP 41 CO 0.85 0.38 -0.24 0.58 -1.72 0.00 0.00 179.24 179.10 3hpg h VAL 42 N 0.36 0.37 -0.57 -1.35 2.07 -1.96 0.94 116.25 116.10 3hpg h VAL 42 Ca 0.10 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.53 3hpg h VAL 42 Cb 0.09 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 3hpg h VAL 42 CO -0.01 0.00 -0.03 0.00 0.02 0.00 0.00 177.57 177.54 3hpg h GLN 44 N 0.92 0.00 0.58 0.00 1.08 -0.97 -3.25 115.11 113.48 3hpg h GLN 44 Ca 0.16 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.33 3hpg h GLN 44 Cb 0.58 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.01 3hpg h GLN 44 CO 0.03 0.68 -0.28 1.49 -0.95 0.00 0.00 178.83 179.80 3hpg h GLU 45 N 0.00 -0.76 -2.50 1.46 4.81 -0.80 -3.33 114.58 113.47 3hpg h GLU 45 Ca -0.01 0.05 -0.73 0.00 -0.13 0.00 0.00 59.36 58.54 3hpg h GLU 45 Cb 1.42 0.17 -0.15 0.00 0.63 0.00 0.00 28.75 30.82 3hpg h GLU 45 CO 0.09 -0.45 2.02 0.09 -0.73 0.00 0.00 179.01 180.03 3hpg n ASN 46 N -5.35 7.81 -4.68 1.04 3.02 -1.00 -5.00 115.26 111.11 3hpg n ASN 46 Ca -0.12 -3.24 -0.40 0.00 -0.03 0.00 0.00 54.58 50.80 3hpg n ASN 46 Cb 0.34 -1.32 -0.06 0.00 -0.61 0.00 0.00 39.78 38.14 3hpg n ASN 46 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3hpg s LYS 47 N -1.72 4.28 0.08 3.52 2.20 -1.23 -4.92 119.74 121.96 3hpg s LYS 47 Ca 0.52 0.63 0.01 0.00 -0.36 0.00 0.00 55.97 56.77 3hpg s LYS 47 Cb 0.21 -3.53 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 3hpg s LYS 47 CO -0.12 -0.11 0.21 1.41 -0.36 0.00 0.00 175.35 176.38 3hpg s MET 48 N 1.46 3.36 0.10 4.03 -2.45 -1.26 -5.04 119.30 119.51 3hpg s MET 48 Ca 0.30 -0.51 -0.21 0.00 -1.25 0.00 0.00 55.69 54.01 3hpg s MET 48 Cb -0.16 -2.98 -0.11 0.00 1.25 0.00 0.00 34.83 32.83 3hpg s MET 48 CO 0.12 0.58 1.73 -1.35 1.05 0.00 0.00 175.02 177.15 3hpg h PRO 49 N 2.89 0.14 -2.66 4.11 0.11 -2.04 -3.43 132.00 131.11 3hpg h PRO 49 Ca -0.46 -0.01 -0.32 0.00 0.11 0.00 0.00 66.00 65.32 3hpg h PRO 49 Cb 1.17 -0.03 -0.36 0.00 0.11 0.00 0.00 31.00 31.89 3hpg h PRO 49 CO 0.73 0.12 -0.63 -1.54 -0.21 0.00 0.00 178.00 176.47 3hpg s SER 50 N -5.32 1.34 0.07 -2.05 1.04 -1.26 -5.15 113.70 102.37 3hpg s SER 50 Ca -0.13 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.15 3hpg s SER 50 Cb 0.07 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.52 3hpg s SER 50 CO 0.68 -0.31 0.00 1.07 0.98 0.00 0.00 173.24 175.65 3hpg n THR 51 N 5.32 0.00 1.35 2.02 5.66 -1.26 -4.94 114.28 122.43 3hpg n THR 51 Ca -0.06 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.07 3hpg n THR 51 Cb 0.50 -1.75 0.44 0.00 -1.55 0.00 0.00 70.33 67.97 3hpg n THR 51 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 3hpg n LEU 52 N 0.00 1.60 -4.72 1.09 4.77 -1.26 -4.63 117.00 113.85 3hpg n LEU 52 Ca 0.00 -0.61 -0.39 0.00 -0.03 0.00 0.00 56.01 54.98 3hpg n LEU 52 Cb 0.00 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 40.98 3hpg n LEU 52 CO 0.00 0.31 0.35 -0.60 -1.33 0.00 0.00 177.39 176.12 3hpg s ARG 53 N -1.88 4.41 0.00 3.23 3.52 -1.26 -4.98 118.95 121.98 3hpg s ARG 53 Ca 0.35 0.79 0.00 0.00 -0.13 0.00 0.00 55.73 56.74 3hpg s ARG 53 Cb 0.19 -3.45 0.00 0.00 -1.56 0.00 0.00 34.95 30.13 3hpg s ARG 53 CO 0.30 0.07 0.00 0.41 -0.81 0.00 0.00 175.30 175.27 3hpg n GLY 54 N 3.16 1.01 0.00 8.12 0.00 -1.26 -4.80 105.19 111.43 3hpg n GLY 54 Ca -0.02 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3hpg n GLY 54 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hpg n SER 55 N 0.00 0.00 -2.97 1.61 3.41 -1.26 -4.00 113.62 110.41 3hpg n SER 55 Ca 0.00 0.26 -0.33 0.00 -0.26 0.00 0.00 58.87 58.54 3hpg n SER 55 Cb 0.00 -0.27 -0.04 0.00 -0.26 0.00 0.00 64.21 63.63 3hpg n SER 55 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3hpg n ASN 56 N -1.27 7.30 -0.04 4.04 5.15 -1.26 -4.84 115.26 124.34 3hpg n ASN 56 Ca 0.00 -3.05 -0.13 0.00 -0.60 0.00 0.00 54.58 50.81 3hpg n ASN 56 Cb 0.01 -1.34 -0.08 0.00 -0.53 0.00 0.00 39.78 37.84 3hpg n ASN 56 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 3hpg h LYS 57 N 3.92 0.23 -6.83 1.20 6.56 -1.94 -3.40 116.57 116.32 3hpg h LYS 57 Ca 0.56 -0.12 -0.48 0.00 -1.06 0.00 0.00 60.65 59.55 3hpg h LYS 57 Cb 0.56 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.26 3hpg h LYS 57 CO 1.18 0.65 0.02 -0.98 -2.06 0.00 0.00 179.45 178.25 3hpg s ARG 58 N -4.32 3.40 0.00 3.15 1.70 -1.26 -4.68 118.95 116.94 3hpg s ARG 58 Ca -0.15 -0.03 0.16 0.00 -0.47 0.00 0.00 55.73 55.24 3hpg s ARG 58 Cb 0.04 -2.45 0.78 0.00 -0.57 0.00 0.00 34.95 32.74 3hpg s ARG 58 CO 0.73 -0.18 1.49 0.41 -1.08 0.00 0.00 175.30 176.66 3hpg n GLY 59 N -2.16 -0.91 3.15 3.88 0.00 -1.26 -4.91 105.19 102.97 3hpg n GLY 59 Ca -0.00 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 3hpg n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hpg s ILE 60 N -2.72 0.18 -1.68 -0.61 -1.09 -1.26 -4.62 121.20 109.39 3hpg s ILE 60 Ca 0.13 -1.52 -0.14 0.00 -2.23 0.00 0.00 60.65 56.89 3hpg s ILE 60 Cb 0.11 -1.46 0.13 0.00 -1.58 0.00 0.00 42.46 39.66 3hpg s ILE 60 CO 0.27 -0.81 0.53 0.47 -1.23 0.00 0.00 174.94 174.16 3hpg n ASP 61 N 0.02 -1.64 -4.29 3.58 8.00 -1.26 -4.75 116.55 116.21 3hpg n ASP 61 Ca -0.14 -1.13 -0.33 0.00 0.71 0.00 0.00 54.79 53.90 3hpg n ASP 61 Cb 0.62 -2.27 -0.15 0.00 -0.02 0.00 0.00 41.12 39.30 3hpg n ASP 61 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3hpg s HIS 62 N -3.59 2.78 0.21 1.24 5.65 -1.26 -1.18 115.29 119.15 3hpg s HIS 62 Ca 0.52 -0.92 0.11 0.00 0.25 0.00 0.00 55.06 55.01 3hpg s HIS 62 Cb -0.29 -1.87 -0.05 0.00 -1.18 0.00 0.00 32.58 29.19 3hpg s HIS 62 CO 0.96 -0.40 -0.20 -1.58 -0.65 0.00 0.00 174.74 172.88 3hpg s TRP 63 N 0.68 2.37 -0.07 3.88 0.52 -0.74 -1.42 118.94 124.16 3hpg s TRP 63 Ca -0.07 -0.32 0.03 0.00 0.02 0.00 0.00 56.10 55.75 3hpg s TRP 63 Cb -0.16 -1.13 -0.02 0.00 -1.15 0.00 0.00 33.47 31.01 3hpg s TRP 63 CO 0.02 0.56 -0.16 -1.14 0.02 0.00 0.00 176.95 176.25 3hpg s GLN 64 N -2.92 2.72 -0.09 4.98 0.74 -0.21 -0.60 119.66 124.27 3hpg s GLN 64 Ca 0.24 -0.73 0.01 0.00 0.05 0.00 0.00 55.36 54.93 3hpg s GLN 64 Cb -0.07 -2.40 -0.03 0.00 1.10 0.00 0.00 33.01 31.61 3hpg s GLN 64 CO 0.12 0.49 -0.10 0.08 -0.55 0.00 0.00 175.29 175.33 3hpg s VAL 65 N -0.39 3.42 0.08 1.34 1.01 -0.73 -0.81 120.40 124.33 3hpg s VAL 65 Ca 0.04 -0.57 -0.10 0.00 0.00 0.00 0.00 61.98 61.35 3hpg s VAL 65 Cb -0.12 -2.41 0.01 0.00 0.00 0.00 0.00 36.38 33.86 3hpg s VAL 65 CO 0.02 0.57 0.23 -0.62 0.00 0.00 0.00 175.10 175.29 3hpg s ASP 66 N -0.38 0.05 -0.09 3.32 -1.08 -0.79 -4.57 116.67 113.13 3hpg s ASP 66 Ca 0.05 -0.54 -0.10 0.00 -0.52 0.00 0.00 52.55 51.44 3hpg s ASP 66 Cb -0.12 0.35 -0.05 0.00 -1.46 0.00 0.00 42.92 41.64 3hpg s ASP 66 CO 0.02 -0.72 0.23 -0.31 0.52 0.00 0.00 175.17 174.91 3hpg s TYR 67 N -3.61 3.62 0.04 -5.34 2.02 -1.26 -0.93 117.35 111.89 3hpg s TYR 67 Ca 0.03 0.67 0.04 0.00 -0.37 0.00 0.00 57.07 57.43 3hpg s TYR 67 Cb 0.03 -2.08 -0.02 0.00 -0.40 0.00 0.00 41.96 39.50 3hpg s TYR 67 CO -0.10 0.67 -0.12 -0.08 -1.57 0.00 0.00 175.55 174.35 3hpg s THR 68 N -0.91 0.89 -0.12 -0.71 -1.32 0.27 -4.94 115.64 108.80 3hpg s THR 68 Ca 0.17 -0.95 -0.04 0.00 -1.21 0.00 0.00 61.69 59.66 3hpg s THR 68 Cb -0.13 -0.84 -0.04 0.00 -1.51 0.00 0.00 72.50 69.98 3hpg s THR 68 CO 0.07 -0.10 0.03 -1.00 -2.21 0.00 0.00 174.62 171.41 3hpg s HIS 69 N -0.93 3.23 -0.36 9.09 0.09 -1.26 -1.22 115.29 123.93 3hpg s HIS 69 Ca -0.01 0.18 0.00 0.00 -0.00 0.00 0.00 55.06 55.22 3hpg s HIS 69 Cb -0.08 -1.88 0.13 0.00 -0.00 0.00 0.00 32.58 30.74 3hpg s HIS 69 CO 0.01 0.40 0.19 -0.47 -0.00 0.00 0.00 174.74 174.87 3hpg s TYR 70 N -0.55 1.26 -0.73 1.40 5.04 -0.48 -4.99 117.35 118.31 3hpg s TYR 70 Ca 0.10 -1.81 -0.04 0.00 -2.44 0.00 0.00 57.07 52.87 3hpg s TYR 70 Cb -0.12 -1.38 -0.05 0.00 0.35 0.00 0.00 41.96 40.77 3hpg s TYR 70 CO 0.02 -0.82 0.64 -1.91 -1.34 0.00 0.00 175.55 172.14 3hpg n GLU 71 N 4.18 -1.56 -3.72 4.97 2.13 -1.26 -3.09 120.64 122.29 3hpg n GLU 71 Ca 0.06 0.62 -0.22 0.00 0.66 0.00 0.00 57.16 58.28 3hpg n GLU 71 Cb 0.38 -4.53 0.03 0.00 0.27 0.00 0.00 31.44 27.58 3hpg n GLU 71 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3hpg n ASP 72 N -2.69 -1.56 -3.65 4.31 9.92 -1.26 -4.97 116.55 116.65 3hpg n ASP 72 Ca -0.05 -0.86 -0.03 0.00 -0.53 0.00 0.00 54.79 53.32 3hpg n ASP 72 Cb 0.58 -3.90 -0.05 0.00 -0.64 0.00 0.00 41.12 37.10 3hpg n ASP 72 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 3hpg s LYS 73 N -6.00 0.55 -0.05 -1.24 1.02 -1.18 -5.17 119.74 107.67 3hpg s LYS 73 Ca 0.06 1.36 -0.07 0.00 0.02 0.00 0.00 55.97 57.33 3hpg s LYS 73 Cb -0.02 0.70 -0.04 0.00 -0.52 0.00 0.00 37.83 37.95 3hpg s LYS 73 CO 0.82 -0.20 0.21 0.42 -0.92 0.00 0.00 175.35 175.68 3hpg s ILE 74 N 2.70 5.39 -0.09 2.17 1.01 -1.26 -1.38 121.20 129.73 3hpg s ILE 74 Ca -0.06 0.21 -0.00 0.00 0.00 0.00 0.00 60.65 60.80 3hpg s ILE 74 Cb -0.11 -3.50 0.02 0.00 0.01 0.00 0.00 42.46 38.88 3hpg s ILE 74 CO -0.18 0.50 -0.06 -0.63 0.00 0.00 0.00 174.94 174.57 3hpg s ILE 75 N -1.15 0.85 -0.30 2.92 1.01 -0.36 -1.57 121.20 122.60 3hpg s ILE 75 Ca 0.21 -0.21 -0.22 0.00 0.00 0.00 0.00 60.65 60.43 3hpg s ILE 75 Cb -0.13 -0.88 -0.00 0.00 0.01 0.00 0.00 42.46 41.45 3hpg s ILE 75 CO 0.11 0.33 0.72 -0.22 0.00 0.00 0.00 174.94 175.87 3hpg s LEU 76 N 1.54 4.11 -0.31 2.97 2.96 -0.35 -0.57 118.68 129.04 3hpg s LEU 76 Ca 0.01 0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 54.50 3hpg s LEU 76 Cb -0.13 -2.97 0.06 0.00 0.50 0.00 0.00 46.19 43.65 3hpg s LEU 76 CO -0.05 -0.54 0.01 -0.69 -1.32 0.00 0.00 176.35 173.76 3hpg s VAL 77 N 2.79 2.81 0.04 1.68 1.01 -0.11 -1.98 120.40 126.65 3hpg s VAL 77 Ca 0.29 -1.61 -0.17 0.00 0.00 0.00 0.00 61.98 60.49 3hpg s VAL 77 Cb -0.15 -2.71 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 3hpg s VAL 77 CO 0.12 -0.22 0.50 0.26 0.00 0.00 0.00 175.10 175.76 3hpg s TRP 78 N 1.18 3.77 -0.08 5.22 0.52 0.59 -1.88 118.94 128.27 3hpg s TRP 78 Ca -0.03 1.15 -0.02 0.00 0.02 0.00 0.00 56.10 57.22 3hpg s TRP 78 Cb -0.20 -2.41 0.03 0.00 -1.15 0.00 0.00 33.47 29.74 3hpg s TRP 78 CO -0.03 0.60 0.02 0.08 0.02 0.00 0.00 176.95 177.65 3hpg s VAL 79 N -1.06 0.27 -0.38 4.03 1.01 0.01 -0.71 120.40 123.57 3hpg s VAL 79 Ca 0.27 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.09 3hpg s VAL 79 Cb -0.18 -0.49 0.00 0.00 0.00 0.00 0.00 36.38 35.71 3hpg s VAL 79 CO 0.16 0.20 1.48 -0.70 0.00 0.00 0.00 175.10 176.24 3hpg s GLU 80 N 2.01 3.57 0.07 2.72 -6.30 -0.07 -1.05 118.70 119.65 3hpg s GLU 80 Ca 0.05 1.08 0.12 0.00 -2.50 0.00 0.00 54.97 53.71 3hpg s GLU 80 Cb -0.13 -4.05 0.52 0.00 0.00 0.00 0.00 34.13 30.48 3hpg s GLU 80 CO -0.05 -1.57 1.36 0.25 0.02 0.00 0.00 175.26 175.27 3hpg n THR 81 N 7.04 1.33 -0.04 -1.70 -2.24 -0.50 -0.09 114.28 118.08 3hpg n THR 81 Ca 0.18 0.39 0.02 0.00 -2.27 0.00 0.00 64.05 62.36 3hpg n THR 81 Cb 0.47 -1.28 -0.15 0.00 -2.10 0.00 0.00 70.33 67.28 3hpg n THR 81 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3hpg n ASN 82 N -1.68 0.10 -0.02 3.42 2.85 -1.26 -4.60 115.26 114.07 3hpg n ASN 82 Ca 0.02 0.04 -0.00 0.00 -0.11 0.00 0.00 54.58 54.53 3hpg n ASN 82 Cb 0.10 1.40 -0.05 0.00 1.24 0.00 0.00 39.78 42.47 3hpg n ASN 82 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3hpg n SER 83 N -2.52 3.43 0.00 1.20 3.41 -1.13 -4.99 113.62 113.02 3hpg n SER 83 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 3hpg n SER 83 Cb 0.82 0.94 0.00 0.00 -0.26 0.00 0.00 64.21 65.71 3hpg n SER 83 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hpg n GLY 84 N 2.39 0.55 3.75 5.00 0.00 0.87 -4.60 105.19 113.16 3hpg n GLY 84 Ca -0.06 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3hpg n GLY 84 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hpg s LEU 85 N 0.00 4.36 -0.06 0.99 2.96 -1.25 -4.76 118.68 120.92 3hpg s LEU 85 Ca 0.00 2.86 0.03 0.00 -0.22 0.00 0.00 54.13 56.80 3hpg s LEU 85 Cb 0.00 -3.63 0.01 0.00 0.50 0.00 0.00 46.19 43.06 3hpg s LEU 85 CO 0.00 -0.83 -0.15 -0.51 -1.32 0.00 0.00 176.35 173.54 3hpg s ILE 86 N -0.14 1.36 -0.16 6.68 2.07 -1.26 -0.90 121.20 128.85 3hpg s ILE 86 Ca 0.61 -0.63 0.01 0.00 -1.41 0.00 0.00 60.65 59.22 3hpg s ILE 86 Cb -0.45 -1.20 0.02 0.00 0.13 0.00 0.00 42.46 40.95 3hpg s ILE 86 CO 0.48 0.40 -0.16 -0.47 -1.91 0.00 0.00 174.94 173.28 3hpg s TYR 87 N 0.43 2.36 0.01 3.50 5.04 0.11 -4.94 117.35 123.85 3hpg s TYR 87 Ca -0.12 -1.37 0.01 0.00 -2.44 0.00 0.00 57.07 53.15 3hpg s TYR 87 Cb -0.15 -1.69 -0.01 0.00 0.35 0.00 0.00 41.96 40.46 3hpg s TYR 87 CO 0.04 -0.72 -0.04 0.00 -1.34 0.00 0.00 175.55 173.49 3hpg s ALA 88 N 1.42 0.34 0.01 3.97 0.00 -1.26 -0.30 121.76 125.95 3hpg s ALA 88 Ca 0.05 -0.30 -0.02 0.00 0.00 0.00 0.00 51.96 51.68 3hpg s ALA 88 Cb -0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 3hpg s ALA 88 CO -0.11 0.04 0.03 -2.00 0.00 0.00 0.00 175.76 173.71 3hpg s GLU 89 N -0.46 0.37 -0.17 0.00 2.12 -0.84 -4.92 118.70 114.80 3hpg s GLU 89 Ca -0.02 -0.54 -0.29 0.00 0.36 0.00 0.00 54.97 54.48 3hpg s GLU 89 Cb -0.04 0.14 -0.01 0.00 0.26 0.00 0.00 34.13 34.49 3hpg s GLU 89 CO -0.00 -0.07 1.13 0.50 -0.54 0.00 0.00 175.26 176.28 3hpg s ARG 90 N -1.43 4.28 0.23 4.30 3.52 -1.26 -1.21 118.95 127.39 3hpg s ARG 90 Ca -0.15 1.51 0.04 0.00 -0.13 0.00 0.00 55.73 56.99 3hpg s ARG 90 Cb -0.09 -3.66 -0.03 0.00 -1.56 0.00 0.00 34.95 29.61 3hpg s ARG 90 CO -0.00 -0.59 0.37 0.08 -0.81 0.00 0.00 175.30 174.35 3hpg s VAL 91 N 3.02 5.25 0.01 7.11 1.01 -0.61 -4.94 120.40 131.26 3hpg s VAL 91 Ca 0.50 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.46 3hpg s VAL 91 Cb -0.19 -3.83 -0.32 0.00 0.00 0.00 0.00 36.38 32.04 3hpg s VAL 91 CO 0.12 -0.31 1.01 0.11 0.00 0.00 0.00 175.10 176.04 3hpg h LYS 92 N 1.34 0.50 -2.66 2.72 6.56 -1.96 -3.38 116.57 119.69 3hpg h LYS 92 Ca -0.51 -0.76 0.06 0.00 -1.06 0.00 0.00 60.65 58.38 3hpg h LYS 92 Cb 1.22 0.27 -0.12 0.00 -0.57 0.00 0.00 32.23 33.03 3hpg h LYS 92 CO 0.63 1.35 0.35 0.20 -2.06 0.00 0.00 179.45 179.91 3hpg s GLY 93 N -4.47 -0.46 0.00 3.86 0.00 -1.26 -4.87 107.32 100.12 3hpg s GLY 93 Ca -0.11 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.16 3hpg s GLY 93 CO 0.90 0.18 1.19 1.18 0.00 0.00 0.00 173.10 176.55 3hpg n GLU 94 N -0.35 0.95 -2.13 2.90 1.02 -1.26 -4.74 120.64 117.03 3hpg n GLU 94 Ca -0.11 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.69 3hpg n GLU 94 Cb 0.63 -1.03 0.01 0.00 -0.02 0.00 0.00 31.44 31.03 3hpg n GLU 94 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3hpg s THR 95 N 0.06 3.50 -0.47 2.62 -4.23 -1.26 -4.42 115.64 111.44 3hpg s THR 95 Ca 0.00 0.81 0.26 0.00 -1.18 0.00 0.00 61.69 61.57 3hpg s THR 95 Cb 0.00 -3.30 0.31 0.00 1.34 0.00 0.00 72.50 70.85 3hpg s THR 95 CO 0.00 -0.33 1.74 1.23 -0.54 0.00 0.00 174.62 176.73 3hpg h GLY 96 N 0.76 0.00 1.10 3.99 0.00 -1.90 -2.41 103.07 104.62 3hpg h GLY 96 Ca -0.48 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.56 3hpg h GLY 96 CO 0.57 0.00 -1.24 -1.61 0.00 0.00 0.00 176.54 174.26 3hpg h GLN 97 N 0.00 0.51 -0.09 4.80 4.15 -1.92 -1.77 115.11 120.79 3hpg h GLN 97 Ca 0.00 -0.80 -0.01 0.00 0.77 0.00 0.00 58.65 58.62 3hpg h GLN 97 Cb 0.73 0.29 -0.00 0.00 0.21 0.00 0.00 27.48 28.70 3hpg h GLN 97 CO 0.00 1.37 0.03 1.49 -1.93 0.00 0.00 178.83 179.79 3hpg h GLU 98 N 0.06 0.14 -0.34 1.69 4.81 -1.88 -3.00 114.58 116.05 3hpg h GLU 98 Ca -0.21 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.07 3hpg h GLU 98 Cb 1.95 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 31.24 3hpg h GLU 98 CO 0.23 0.29 -0.13 0.35 -0.73 0.00 0.00 179.01 179.02 3hpg h PHE 99 N -0.04 -0.31 -0.92 0.92 3.57 -1.50 0.10 116.94 118.76 3hpg h PHE 99 Ca 0.03 0.04 0.20 0.00 3.53 0.00 0.00 57.97 61.76 3hpg h PHE 99 Cb 0.21 0.19 -0.11 0.00 2.79 0.00 0.00 35.95 39.03 3hpg h PHE 99 CO -0.01 -0.21 0.48 0.00 -2.23 0.00 0.00 178.31 176.35 3hpg h ARG 100 N -0.07 0.54 -0.12 1.11 3.08 -1.29 0.27 114.38 117.91 3hpg h ARG 100 Ca 0.17 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 3hpg h ARG 100 Cb 0.33 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 3hpg h ARG 100 CO -0.39 0.36 -0.06 0.28 -1.07 0.00 0.00 179.97 179.08 3hpg h VAL 101 N 0.56 1.32 -0.89 2.04 2.07 -1.14 -2.57 116.25 117.64 3hpg h VAL 101 Ca 0.55 -1.11 0.14 0.00 0.82 0.00 0.00 66.70 67.10 3hpg h VAL 101 Cb 0.95 1.81 -0.07 0.00 -1.52 0.00 0.00 31.29 32.46 3hpg h VAL 101 CO -0.45 0.32 0.57 1.56 0.02 0.00 0.00 177.57 179.59 3hpg h GLN 102 N -0.10 0.67 0.00 1.57 1.08 -0.23 -1.30 115.11 116.79 3hpg h GLN 102 Ca 0.03 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.11 3hpg h GLN 102 Cb 0.53 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 3hpg h GLN 102 CO 0.02 0.44 -0.35 1.79 -0.95 0.00 0.00 178.83 179.78 3hpg h THR 103 N 0.69 1.09 0.04 -0.54 1.35 -0.10 -1.76 112.91 113.67 3hpg h THR 103 Ca 0.45 -1.26 -0.00 0.00 -0.55 0.00 0.00 66.41 65.05 3hpg h THR 103 Cb 0.72 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 3hpg h THR 103 CO -0.20 0.34 -0.02 0.24 -0.25 0.00 0.00 175.52 175.63 3hpg h MET 104 N 0.00 -0.06 -0.14 4.72 2.86 -0.94 0.89 114.93 122.27 3hpg h MET 104 Ca -0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3hpg h MET 104 Cb 0.68 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 3hpg h MET 104 CO 0.05 0.23 -0.02 0.87 1.06 0.00 0.00 176.91 179.09 3hpg h LYS 105 N -0.34 0.19 0.09 1.72 1.57 -1.18 -0.85 116.57 117.77 3hpg h LYS 105 Ca -0.01 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3hpg h LYS 105 Cb 0.31 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3hpg h LYS 105 CO 0.01 0.23 -0.04 2.35 -0.57 0.00 0.00 179.45 181.43 3hpg h TRP 106 N 0.19 -0.11 -0.38 -1.35 7.01 -1.19 -2.87 115.95 117.26 3hpg h TRP 106 Ca 0.05 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.15 3hpg h TRP 106 Cb 0.17 0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.25 3hpg h TRP 106 CO 0.00 0.38 0.30 -0.92 -2.79 0.00 0.00 178.44 175.42 3hpg h TYR 107 N -0.67 0.00 0.07 2.65 3.20 -0.33 -1.31 116.97 120.59 3hpg h TYR 107 Ca -0.01 0.00 -0.25 0.00 3.14 0.00 0.00 58.73 61.61 3hpg h TYR 107 Cb 0.54 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.81 3hpg h TYR 107 CO 0.10 0.00 -1.11 0.00 -1.64 0.00 0.00 178.16 175.51 3hpg h ALA 108 N 1.75 0.23 0.02 1.82 0.00 -1.10 -3.39 119.26 118.59 3hpg h ALA 108 Ca 0.18 -0.82 -0.04 0.00 0.00 0.00 0.00 54.91 54.23 3hpg h ALA 108 Cb 0.78 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3hpg h ALA 108 CO -0.00 0.94 -0.16 0.52 0.00 0.00 0.00 179.25 180.56 3hpg h MET 109 N 0.11 0.06 -6.24 0.00 2.86 -1.02 -3.44 114.93 107.26 3hpg h MET 109 Ca -0.10 -0.10 -0.48 0.00 -2.06 0.00 0.00 59.70 56.96 3hpg h MET 109 Cb 1.80 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 33.48 3hpg h MET 109 CO 0.18 1.02 -0.39 -0.06 1.06 0.00 0.00 176.91 178.72 3hpg s PHE 110 N -2.38 2.85 -0.65 -0.22 0.08 -1.00 -5.08 117.98 111.57 3hpg s PHE 110 Ca -0.18 -0.37 0.05 0.00 0.12 0.00 0.00 56.93 56.55 3hpg s PHE 110 Cb -0.02 -2.02 0.17 0.00 -0.57 0.00 0.00 43.02 40.58 3hpg s PHE 110 CO 0.72 -0.02 0.49 0.00 -0.10 0.00 0.00 175.22 176.30 3hpg n ALA 111 N -1.53 3.36 -1.68 5.36 0.00 -1.26 -4.42 120.51 120.34 3hpg n ALA 111 Ca 0.01 -4.30 -0.34 0.00 0.00 0.00 0.00 53.44 48.81 3hpg n ALA 111 Cb 0.60 -0.98 0.02 0.00 0.00 0.00 0.00 19.45 19.10 3hpg n ALA 111 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hpg s PRO 112 N -1.28 3.13 -0.19 0.00 0.05 -1.26 -5.00 135.00 130.45 3hpg s PRO 112 Ca 0.27 1.54 0.05 0.00 0.05 0.00 0.00 61.00 62.91 3hpg s PRO 112 Cb -0.02 -1.98 -0.15 0.00 0.05 0.00 0.00 34.50 32.40 3hpg s PRO 112 CO -0.17 -1.01 -0.12 1.63 0.05 0.00 0.00 177.00 177.38 3hpg n LYS 113 N -1.72 0.74 -3.84 4.56 4.01 -0.32 -4.86 118.16 116.72 3hpg n LYS 113 Ca 0.11 0.09 -0.09 0.00 -0.51 0.00 0.00 58.31 57.91 3hpg n LYS 113 Cb 0.51 -1.41 -0.07 0.00 -0.51 0.00 0.00 35.03 33.55 3hpg n LYS 113 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 3hpg s SER 114 N -5.72 0.09 -0.04 4.39 1.04 -1.09 -2.18 113.70 110.20 3hpg s SER 114 Ca -0.23 -0.63 -0.06 0.00 0.48 0.00 0.00 55.95 55.51 3hpg s SER 114 Cb 0.06 0.35 0.01 0.00 0.10 0.00 0.00 66.02 66.54 3hpg s SER 114 CO 0.52 -0.74 0.15 -0.22 0.98 0.00 0.00 173.24 173.93 3hpg s LEU 115 N -2.86 1.45 0.05 2.42 2.96 0.05 -1.80 118.68 120.96 3hpg s LEU 115 Ca 0.05 0.12 0.07 0.00 -0.22 0.00 0.00 54.13 54.14 3hpg s LEU 115 Cb 0.05 0.60 -0.03 0.00 0.50 0.00 0.00 46.19 47.30 3hpg s LEU 115 CO -0.11 -0.18 -0.17 -1.10 -1.32 0.00 0.00 176.35 173.47 3hpg s GLN 116 N -0.49 2.08 -0.05 1.98 -0.21 0.23 -1.18 119.66 122.02 3hpg s GLN 116 Ca -0.06 -0.99 -0.30 0.00 0.02 0.00 0.00 55.36 54.03 3hpg s GLN 116 Cb -0.04 -2.21 0.11 0.00 1.00 0.00 0.00 33.01 31.87 3hpg s GLN 116 CO 0.01 0.54 0.97 -1.54 -2.12 0.00 0.00 175.29 173.14 3hpg s SER 117 N -1.56 -0.31 1.16 5.90 1.04 -1.06 -1.77 113.70 117.10 3hpg s SER 117 Ca 0.16 -0.01 -0.15 0.00 0.48 0.00 0.00 55.95 56.43 3hpg s SER 117 Cb -0.11 0.33 0.27 0.00 0.10 0.00 0.00 66.02 66.61 3hpg s SER 117 CO 0.06 -0.53 1.05 1.51 0.98 0.00 0.00 173.24 176.32 3hpg s ASP 118 N -2.41 1.20 0.00 7.02 3.84 -1.26 -1.00 116.67 124.05 3hpg s ASP 118 Ca 0.06 1.10 0.00 0.00 -0.00 0.00 0.00 52.55 53.71 3hpg s ASP 118 Cb -0.01 -1.67 0.00 0.00 -1.38 0.00 0.00 42.92 39.86 3hpg s ASP 118 CO -0.08 -4.01 0.66 0.59 -0.00 0.00 0.00 175.17 172.33 3hpg n ASN 119 N -4.74 1.74 -4.36 2.11 3.02 -1.26 -4.45 115.26 107.32 3hpg n ASN 119 Ca 0.07 -1.78 -0.35 0.00 -0.03 0.00 0.00 54.58 52.49 3hpg n ASN 119 Cb 0.57 -0.45 0.08 0.00 -0.61 0.00 0.00 39.78 39.38 3hpg n ASN 119 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hpg n GLY 120 N 0.29 -2.30 0.16 7.41 0.00 -1.26 -4.64 105.19 104.85 3hpg n GLY 120 Ca 0.00 -0.56 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 3hpg n GLY 120 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hpg h PRO 121 N -0.86 -0.30 -0.69 1.61 0.11 -1.92 -1.46 132.00 128.50 3hpg h PRO 121 Ca -0.44 0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.75 3hpg h PRO 121 Cb 1.32 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.46 3hpg h PRO 121 CO 0.37 -0.14 0.46 0.00 -0.21 0.00 0.00 178.00 178.47 3hpg h ALA 122 N 0.35 1.75 0.09 -0.75 0.00 -1.89 -0.62 119.26 118.19 3hpg h ALA 122 Ca -0.03 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.60 3hpg h ALA 122 Cb 0.30 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.93 3hpg h ALA 122 CO 0.05 0.14 -1.15 0.74 0.00 0.00 0.00 179.25 179.03 3hpg h PHE 123 N 0.70 0.60 0.00 0.00 0.04 -1.84 -3.34 116.94 113.10 3hpg h PHE 123 Ca 0.30 -0.39 -0.13 0.00 2.80 0.00 0.00 57.97 60.55 3hpg h PHE 123 Cb 0.28 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.37 3hpg h PHE 123 CO -0.00 1.26 -1.08 0.28 -0.60 0.00 0.00 178.31 178.17 3hpg h VAL 124 N 0.15 0.56 -1.02 -0.55 2.07 -0.91 -3.41 116.25 113.14 3hpg h VAL 124 Ca -0.13 -1.96 -0.43 0.00 0.82 0.00 0.00 66.70 65.00 3hpg h VAL 124 Cb 1.84 2.10 0.10 0.00 -1.52 0.00 0.00 31.29 33.81 3hpg h VAL 124 CO 0.20 0.32 -0.57 0.00 0.02 0.00 0.00 177.57 177.54 3hpg n ALA 125 N -2.32 -2.42 -0.05 1.67 0.00 -0.27 -4.64 120.51 112.48 3hpg n ALA 125 Ca -0.05 0.14 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 3hpg n ALA 125 Cb 0.78 -1.03 0.07 0.00 0.00 0.00 0.00 19.45 19.26 3hpg n ALA 125 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3hpg h GLU 126 N 0.35 0.69 -0.65 0.00 4.81 -1.93 -1.64 114.58 116.21 3hpg h GLU 126 Ca -0.23 -0.34 -0.06 0.00 -0.13 0.00 0.00 59.36 58.59 3hpg h GLU 126 Cb 0.99 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.35 3hpg h GLU 126 CO 0.34 0.95 0.17 0.77 -0.73 0.00 0.00 179.01 180.52 3hpg h SER 127 N 0.57 0.97 -0.48 1.04 0.02 -1.96 -2.05 113.55 111.65 3hpg h SER 127 Ca 0.05 -0.22 -0.08 0.00 -0.84 0.00 0.00 61.79 60.70 3hpg h SER 127 Cb 0.91 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 3hpg h SER 127 CO 0.08 0.94 -0.01 0.74 -1.14 0.00 0.00 176.83 177.45 3hpg h THR 128 N 0.95 1.26 -0.40 -2.27 2.02 -1.81 -2.00 112.91 110.67 3hpg h THR 128 Ca 0.21 -1.08 -0.02 0.00 0.77 0.00 0.00 66.41 66.29 3hpg h THR 128 Cb 0.34 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 3hpg h THR 128 CO -0.00 0.38 0.17 -0.61 0.37 0.00 0.00 175.52 175.82 3hpg h GLN 129 N 0.71 0.57 -0.12 6.66 4.15 -1.08 -1.86 115.11 124.15 3hpg h GLN 129 Ca 0.14 -0.07 -0.21 0.00 0.77 0.00 0.00 58.65 59.28 3hpg h GLN 129 Cb 0.52 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.11 3hpg h GLN 129 CO 0.03 0.47 -0.76 -0.07 -1.93 0.00 0.00 178.83 176.56 3hpg h LEU 130 N 0.57 0.74 -1.03 -2.39 3.38 -1.17 -2.95 115.31 112.46 3hpg h LEU 130 Ca 0.14 -0.49 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 3hpg h LEU 130 Cb 0.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3hpg h LEU 130 CO -0.02 1.26 0.25 0.25 0.09 0.00 0.00 178.44 180.28 3hpg h LEU 131 N 0.42 0.87 -0.82 1.67 5.85 -0.88 -0.09 115.31 122.33 3hpg h LEU 131 Ca -0.04 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.46 3hpg h LEU 131 Cb 1.37 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 3hpg h LEU 131 CO 0.15 0.78 -0.16 0.24 -0.34 0.00 0.00 178.44 179.10 3hpg h MET 132 N 0.93 0.70 -0.19 1.25 2.86 -1.33 -1.62 114.93 117.53 3hpg h MET 132 Ca 0.22 -0.25 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 3hpg h MET 132 Cb 0.19 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 3hpg h MET 132 CO -0.02 0.83 0.01 0.87 1.06 0.00 0.00 176.91 179.66 3hpg h LYS 133 N 0.63 0.34 -0.95 1.72 6.56 -1.25 0.13 116.57 123.75 3hpg h LYS 133 Ca 0.10 -0.10 0.14 0.00 -1.06 0.00 0.00 60.65 59.73 3hpg h LYS 133 Cb 0.63 -0.03 -0.09 0.00 -0.57 0.00 0.00 32.23 32.17 3hpg h LYS 133 CO 0.04 0.52 0.57 -0.92 -2.06 0.00 0.00 179.45 177.60 3hpg h TYR 134 N 0.10 1.01 -0.00 -1.35 3.20 -0.78 -1.03 116.97 118.13 3hpg h TYR 134 Ca 0.06 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.96 3hpg h TYR 134 Cb 0.36 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.32 3hpg h TYR 134 CO 0.03 0.33 -0.28 1.28 -1.64 0.00 0.00 178.16 177.88 3hpg n LEU 135 N -4.72 0.29 -0.72 2.82 4.77 -0.63 -4.95 117.00 113.86 3hpg n LEU 135 Ca 0.19 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 3hpg n LEU 135 Cb 0.41 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3hpg n LEU 135 CO 0.25 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 3hpg n GLY 136 N 1.49 0.73 3.22 -0.72 0.00 -0.39 -5.07 105.19 104.45 3hpg n GLY 136 Ca 0.06 -0.59 -0.32 0.00 0.00 0.00 0.00 46.02 45.17 3hpg n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hpg s ILE 137 N -3.00 2.07 -0.83 -0.61 1.01 -0.03 -4.84 121.20 114.98 3hpg s ILE 137 Ca 0.00 -1.01 -0.23 0.00 0.00 0.00 0.00 60.65 59.41 3hpg s ILE 137 Cb 0.00 -1.79 0.07 0.00 0.01 0.00 0.00 42.46 40.75 3hpg s ILE 137 CO 0.00 0.56 1.20 -1.61 0.00 0.00 0.00 174.94 175.09 3hpg s GLU 138 N 0.37 3.36 -0.45 2.79 2.02 -0.93 -4.44 118.70 121.41 3hpg s GLU 138 Ca -0.18 -0.95 -0.17 0.00 0.02 0.00 0.00 54.97 53.69 3hpg s GLU 138 Cb -0.18 -4.65 0.05 0.00 0.10 0.00 0.00 34.13 29.45 3hpg s GLU 138 CO 0.08 -1.99 0.44 -1.58 0.02 0.00 0.00 175.26 172.23 3hpg s HIS 139 N 4.44 3.18 0.02 1.61 5.65 -1.26 -0.77 115.29 128.16 3hpg s HIS 139 Ca 0.34 -0.63 -0.08 0.00 0.25 0.00 0.00 55.06 54.93 3hpg s HIS 139 Cb -0.08 -3.07 -0.05 0.00 -1.18 0.00 0.00 32.58 28.20 3hpg s HIS 139 CO 0.02 -0.79 0.31 0.95 -0.65 0.00 0.00 174.74 174.59 3hpg s THR 140 N 2.00 5.22 0.05 0.89 -4.23 -0.32 -4.97 115.64 114.28 3hpg s THR 140 Ca 0.09 0.32 0.08 0.00 -1.18 0.00 0.00 61.69 61.00 3hpg s THR 140 Cb -0.20 -3.59 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 3hpg s THR 140 CO 0.10 0.38 -0.21 -0.89 -0.54 0.00 0.00 174.62 173.46 3hpg s THR 141 N -1.29 2.55 0.00 3.99 2.01 -1.26 -2.57 115.64 119.08 3hpg s THR 141 Ca 0.28 -1.28 0.00 0.00 0.31 0.00 0.00 61.69 61.00 3hpg s THR 141 Cb -0.14 -2.05 0.00 0.00 0.01 0.00 0.00 72.50 70.32 3hpg s THR 141 CO 0.16 0.34 0.00 0.61 -0.69 0.00 0.00 174.62 175.03 3hpg n GLY 142 N 1.59 2.57 3.53 4.40 0.00 -0.17 -4.92 105.19 112.19 3hpg n GLY 142 Ca -0.16 -0.93 -0.39 0.00 0.00 0.00 0.00 46.02 44.54 3hpg n GLY 142 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hpg n ILE 143 N -0.90 -0.02 -1.67 -0.61 -0.00 -1.26 -4.25 119.36 110.64 3hpg n ILE 143 Ca 0.00 -0.58 -0.47 0.00 -0.00 0.00 0.00 62.75 61.70 3hpg n ILE 143 Cb 0.00 -2.23 -0.04 0.00 -0.00 0.00 0.00 39.64 37.37 3hpg n ILE 143 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 3hpg n PRO 144 N 8.83 2.18 0.00 0.38 -0.04 -1.26 -4.89 135.00 140.19 3hpg n PRO 144 Ca 0.43 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.68 3hpg n PRO 144 Cb 0.41 -2.59 0.00 0.00 -0.04 0.00 0.00 33.50 31.28 3hpg n PRO 144 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3hpg n TRP 145 N 4.76 0.00 -2.13 0.54 4.27 -1.26 -5.03 117.44 118.59 3hpg n TRP 145 Ca 0.19 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.38 3hpg n TRP 145 Cb 0.29 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.22 3hpg n TRP 145 CO 0.00 0.00 0.00 1.21 -2.29 0.00 0.00 177.69 176.61 3hpg s ASN 146 N -1.34 5.91 0.00 -0.67 3.84 -1.26 -4.85 114.94 116.57 3hpg s ASN 146 Ca 0.00 0.93 0.07 0.00 0.21 0.00 0.00 52.86 54.07 3hpg s ASN 146 Cb 0.00 -2.53 0.36 0.00 -0.55 0.00 0.00 41.25 38.53 3hpg s ASN 146 CO 0.00 -1.76 1.01 -2.65 -2.79 0.00 0.00 177.10 170.91 3hpg n PRO 147 N 8.49 0.14 -0.09 0.43 -0.02 -1.26 -0.92 135.00 141.77 3hpg n PRO 147 Ca 0.20 0.15 -0.22 0.00 -2.02 0.00 0.00 63.50 61.61 3hpg n PRO 147 Cb 0.48 -1.50 -0.12 0.00 -0.02 0.00 0.00 33.50 32.34 3hpg n PRO 147 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3hpg n GLN 148 N -1.19 0.59 -0.03 -0.52 1.13 -1.26 -3.38 117.38 112.72 3hpg n GLN 148 Ca 0.04 0.53 -0.12 0.00 -1.94 0.00 0.00 57.00 55.51 3hpg n GLN 148 Cb 0.04 -1.74 -0.07 0.00 0.11 0.00 0.00 30.24 28.58 3hpg n GLN 148 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 3hpg h SER 149 N -0.86 0.18 -0.80 1.08 0.02 -1.89 -3.19 113.55 108.10 3hpg h SER 149 Ca -0.36 -0.37 0.03 0.00 -0.84 0.00 0.00 61.79 60.25 3hpg h SER 149 Cb 1.41 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.85 3hpg h SER 149 CO -0.17 0.51 0.52 1.56 -1.14 0.00 0.00 176.83 178.11 3hpg h GLN 150 N -0.15 0.95 -0.43 3.45 1.08 -1.22 0.24 115.11 119.03 3hpg h GLN 150 Ca 0.02 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 3hpg h GLN 150 Cb 0.43 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 3hpg h GLN 150 CO 0.01 0.63 0.23 0.00 -0.95 0.00 0.00 178.83 178.75 3hpg h ALA 151 N 1.53 0.55 -0.01 3.87 0.00 -1.57 0.35 119.26 123.99 3hpg h ALA 151 Ca 0.32 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 3hpg h ALA 151 Cb 0.03 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hpg h ALA 151 CO -0.09 0.08 -0.49 1.25 0.00 0.00 0.00 179.25 180.00 3hpg h LEU 152 N 0.56 0.44 -0.91 0.00 5.85 -1.17 -1.82 115.31 118.26 3hpg h LEU 152 Ca 0.15 -0.76 0.07 0.00 0.84 0.00 0.00 57.88 58.18 3hpg h LEU 152 Cb 0.06 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 40.89 3hpg h LEU 152 CO -0.02 1.14 0.57 0.58 -0.34 0.00 0.00 178.44 180.37 3hpg h VAL 153 N -0.21 1.02 0.11 1.05 2.07 -0.52 0.26 116.25 120.03 3hpg h VAL 153 Ca -0.06 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 3hpg h VAL 153 Cb 1.21 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3hpg h VAL 153 CO 0.10 0.18 -0.05 -0.08 0.02 0.00 0.00 177.57 177.74 3hpg h GLU 154 N 1.01 -0.15 -0.39 1.57 4.57 -0.08 -2.34 114.58 118.77 3hpg h GLU 154 Ca 0.41 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.57 3hpg h GLU 154 Cb 0.23 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 3hpg h GLU 154 CO -0.19 0.25 0.13 0.00 -1.18 0.00 0.00 179.01 178.01 3hpg h ARG 155 N -0.58 0.55 -0.24 1.92 -0.00 -1.23 -2.67 114.38 112.13 3hpg h ARG 155 Ca -0.02 -0.08 -0.02 0.00 -0.50 0.00 0.00 59.98 59.37 3hpg h ARG 155 Cb 0.46 -0.10 -0.01 0.00 0.00 0.00 0.00 29.97 30.32 3hpg h ARG 155 CO 0.03 0.48 0.08 1.15 0.00 0.00 0.00 179.97 181.71 3hpg h THR 156 N 0.55 1.19 -0.64 2.04 2.02 -0.40 -0.98 112.91 116.69 3hpg h THR 156 Ca 0.13 -0.59 -0.03 0.00 0.77 0.00 0.00 66.41 66.70 3hpg h THR 156 Cb 0.16 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 3hpg h THR 156 CO -0.01 0.19 0.29 0.45 0.37 0.00 0.00 175.52 176.82 3hpg h HIS 157 N 0.22 0.90 -0.21 3.16 -0.00 -1.13 -0.83 115.15 117.27 3hpg h HIS 157 Ca 0.08 -0.04 -0.08 0.00 -0.00 0.00 0.00 60.37 60.33 3hpg h HIS 157 Cb 0.22 -0.28 -0.00 0.00 -0.00 0.00 0.00 27.41 27.34 3hpg h HIS 157 CO 0.00 0.67 -0.18 1.96 -0.00 0.00 0.00 177.93 180.38 3hpg h GLN 158 N 0.90 0.49 -0.14 2.45 4.20 -1.38 -2.52 115.11 119.12 3hpg h GLN 158 Ca 0.22 -0.25 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 3hpg h GLN 158 Cb 0.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 3hpg h GLN 158 CO -0.03 0.82 -0.15 1.15 -0.67 0.00 0.00 178.83 179.95 3hpg h THR 159 N 0.18 1.18 0.46 -0.54 2.02 -0.98 0.33 112.91 115.55 3hpg h THR 159 Ca 0.04 -0.81 -0.02 0.00 0.77 0.00 0.00 66.41 66.38 3hpg h THR 159 Cb 0.71 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 3hpg h THR 159 CO 0.05 0.25 -0.22 0.25 0.37 0.00 0.00 175.52 176.22 3hpg h LEU 160 N 0.21 -0.52 -0.30 2.58 5.85 -1.07 -1.42 115.31 120.64 3hpg h LEU 160 Ca 0.04 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.73 3hpg h LEU 160 Cb 0.39 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 3hpg h LEU 160 CO 0.02 -0.22 0.07 0.11 -0.34 0.00 0.00 178.44 178.09 3hpg h LYS 161 N -0.82 0.18 -0.35 1.25 1.57 -1.35 -0.86 116.57 116.19 3hpg h LYS 161 Ca -0.06 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3hpg h LYS 161 Cb 0.56 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 3hpg h LYS 161 CO 0.10 0.12 0.18 -0.97 -0.57 0.00 0.00 179.45 178.31 3hpg h ASN 162 N 0.19 0.27 1.46 0.86 -1.24 -0.94 -1.67 115.58 114.50 3hpg h ASN 162 Ca 0.14 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.16 3hpg h ASN 162 Cb 0.14 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.15 3hpg h ASN 162 CO -0.17 0.20 0.00 0.71 -1.29 0.00 0.00 177.43 176.87 3hpg h THR 163 N 0.37 0.00 0.07 -3.57 1.35 -1.21 -2.87 112.91 107.05 3hpg h THR 163 Ca 0.15 -0.68 -0.00 0.00 -0.55 0.00 0.00 66.41 65.33 3hpg h THR 163 Cb 0.05 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 3hpg h THR 163 CO -0.10 0.00 -0.03 -0.07 -0.25 0.00 0.00 175.52 175.07 3hpg h LEU 164 N 0.00 -0.08 -1.67 3.87 3.38 -0.66 -2.45 115.31 117.71 3hpg h LEU 164 Ca 0.00 -0.09 0.23 0.00 0.09 0.00 0.00 57.88 58.10 3hpg h LEU 164 Cb 0.73 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.44 3hpg h LEU 164 CO 0.00 0.04 0.62 -0.08 0.09 0.00 0.00 178.44 179.11 3hpg h GLU 165 N -0.20 0.26 0.03 1.13 4.57 -1.10 0.90 114.58 120.17 3hpg h GLU 165 Ca -0.01 -0.02 -0.23 0.00 -1.18 0.00 0.00 59.36 57.93 3hpg h GLU 165 Cb 0.17 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.70 3hpg h GLU 165 CO 0.02 0.17 -1.00 0.87 -1.18 0.00 0.00 179.01 177.89 3hpg h LYS 166 N 0.26 0.31 0.04 1.92 1.57 -1.39 -3.39 116.57 115.89 3hpg h LYS 166 Ca 0.46 -0.37 -0.38 0.00 -1.87 0.00 0.00 60.65 58.49 3hpg h LYS 166 Cb 1.38 0.12 -0.05 0.00 0.08 0.00 0.00 32.23 33.76 3hpg h LYS 166 CO -0.13 1.09 -2.29 1.28 -0.57 0.00 0.00 179.45 178.83 3hpg n LEU 167 N -3.66 2.50 0.26 2.94 4.77 -0.16 -4.52 117.00 119.13 3hpg n LEU 167 Ca -0.06 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.08 3hpg n LEU 167 Cb 0.88 -0.79 0.88 0.00 -2.33 0.00 0.00 43.42 42.06 3hpg n LEU 167 CO 0.51 0.85 1.14 0.16 -1.33 0.00 0.00 177.39 178.71 3hpg h ILE 168 N 0.02 0.49 0.00 -0.08 3.07 -1.10 0.45 117.51 120.36 3hpg h ILE 168 Ca -0.52 0.00 -0.01 0.00 1.55 0.00 0.00 64.86 65.88 3hpg h ILE 168 Cb 1.98 0.93 -0.00 0.00 -0.27 0.00 0.00 36.82 39.46 3hpg h ILE 168 CO -0.02 0.00 -0.05 -0.65 -1.05 0.00 0.00 178.15 176.38 3hpg h PRO 169 N 0.00 0.00 -0.01 0.16 0.11 -1.81 -2.95 132.00 127.50 3hpg h PRO 169 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 3hpg h PRO 169 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 3hpg h PRO 169 CO -0.00 0.05 -0.26 -1.33 -0.21 0.00 0.00 178.00 176.24 3hpg n MET 170 N -3.31 1.24 -4.78 1.05 2.81 0.16 -4.90 117.12 109.39 3hpg n MET 170 Ca -0.01 -0.88 -0.27 0.00 -1.81 0.00 0.00 57.70 54.73 3hpg n MET 170 Cb 0.20 -1.48 -0.17 0.00 -0.71 0.00 0.00 33.22 31.07 3hpg n MET 170 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 3hpg s PHE 171 N -2.37 1.76 0.06 2.03 0.08 -1.12 -5.03 117.98 113.40 3hpg s PHE 171 Ca 0.25 -0.65 -0.30 0.00 0.12 0.00 0.00 56.93 56.34 3hpg s PHE 171 Cb 0.19 -1.24 -0.18 0.00 -0.57 0.00 0.00 43.02 41.23 3hpg s PHE 171 CO 0.49 -0.29 1.59 -0.97 -0.10 0.00 0.00 175.22 175.93 3hpg h ASN 172 N 6.80 -0.58 -3.51 1.36 -0.00 -1.90 -3.43 115.58 114.31 3hpg h ASN 172 Ca -0.28 -0.00 -0.53 0.00 -0.00 0.00 0.00 56.30 55.49 3hpg h ASN 172 Cb 1.20 0.15 -0.03 0.00 -0.00 0.00 0.00 38.32 39.64 3hpg h ASN 172 CO 0.47 -0.38 0.14 0.00 -0.00 0.00 0.00 177.43 177.66 3hpg s ALA 173 N -5.91 3.45 0.14 1.57 0.00 -1.26 -4.98 121.76 114.78 3hpg s ALA 173 Ca -0.16 0.28 -0.14 0.00 0.00 0.00 0.00 51.96 51.94 3hpg s ALA 173 Cb 0.04 -2.89 0.01 0.00 0.00 0.00 0.00 23.12 20.28 3hpg s ALA 173 CO 0.61 0.31 1.63 0.35 0.00 0.00 0.00 175.76 178.67 3hpg h PHE 174 N 4.11 0.80 -0.89 0.00 3.57 -1.95 -2.52 116.94 120.06 3hpg h PHE 174 Ca -0.48 -0.11 0.14 0.00 3.53 0.00 0.00 57.97 61.06 3hpg h PHE 174 Cb 1.20 -0.22 -0.07 0.00 2.79 0.00 0.00 35.95 39.65 3hpg h PHE 174 CO 0.64 0.75 0.58 0.93 -2.23 0.00 0.00 178.31 178.98 3hpg h GLU 175 N 0.63 0.68 0.00 1.11 3.07 -1.98 0.03 114.58 118.12 3hpg h GLU 175 Ca 0.14 -0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 58.87 3hpg h GLU 175 Cb 0.37 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 3hpg h GLU 175 CO 0.01 0.45 -0.53 0.66 -1.40 0.00 0.00 179.01 178.20 3hpg h SER 176 N 0.70 0.00 0.01 1.42 4.64 -1.92 -2.24 113.55 116.16 3hpg h SER 176 Ca 0.45 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.63 3hpg h SER 176 Cb 0.71 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.79 3hpg h SER 176 CO -0.21 0.44 -0.46 0.00 -0.87 0.00 0.00 176.83 175.74 3hpg h ALA 177 N 1.56 0.82 -0.39 5.18 0.00 -0.71 -1.20 119.26 124.51 3hpg h ALA 177 Ca -0.02 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 3hpg h ALA 177 Cb 1.35 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3hpg h ALA 177 CO 0.05 0.66 -0.06 1.25 0.00 0.00 0.00 179.25 181.15 3hpg h LEU 178 N 0.43 0.74 -0.07 0.00 5.85 -0.99 -1.65 115.31 119.61 3hpg h LEU 178 Ca 0.03 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.43 3hpg h LEU 178 Cb 0.97 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 3hpg h LEU 178 CO 0.09 0.91 -0.07 0.00 -0.34 0.00 0.00 178.44 179.02 3hpg h ALA 179 N 0.85 -0.02 -0.76 1.25 0.00 -1.36 -1.72 119.26 117.50 3hpg h ALA 179 Ca 0.10 0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.19 3hpg h ALA 179 Cb 0.57 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.41 3hpg h ALA 179 CO 0.03 -0.55 0.31 0.78 0.00 0.00 0.00 179.25 179.83 3hpg h GLY 180 N -0.10 1.17 1.83 0.00 0.00 -1.07 -0.91 103.07 103.99 3hpg h GLY 180 Ca 0.05 -0.15 -0.12 0.00 0.00 0.00 0.00 47.33 47.11 3hpg h GLY 180 CO -0.13 -0.10 -0.48 -0.91 0.00 0.00 0.00 176.54 174.92 3hpg h THR 181 N 0.45 1.34 -0.33 4.70 1.35 -0.75 -1.36 112.91 118.32 3hpg h THR 181 Ca 0.42 -1.69 -0.03 0.00 -0.55 0.00 0.00 66.41 64.57 3hpg h THR 181 Cb 0.64 1.82 -0.02 0.00 -1.73 0.00 0.00 68.15 68.86 3hpg h THR 181 CO -0.40 0.50 0.09 -0.07 -0.25 0.00 0.00 175.52 175.38 3hpg h LEU 182 N 0.15 0.43 -0.23 3.87 3.38 -0.35 -0.54 115.31 122.00 3hpg h LEU 182 Ca 0.01 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3hpg h LEU 182 Cb 0.91 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 3hpg h LEU 182 CO 0.07 0.43 0.02 0.40 0.09 0.00 0.00 178.44 179.45 3hpg h ILE 183 N 0.47 1.24 -0.02 1.22 2.04 -0.28 -0.24 117.51 121.95 3hpg h ILE 183 Ca 0.11 -0.84 -0.16 0.00 1.00 0.00 0.00 64.86 64.97 3hpg h ILE 183 Cb 0.17 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 3hpg h ILE 183 CO -0.01 0.26 -0.72 0.71 0.00 0.00 0.00 178.15 178.40 3hpg h THR 184 N 0.19 1.47 0.00 -0.27 1.35 -0.91 0.11 112.91 114.85 3hpg h THR 184 Ca 0.07 -2.34 -0.08 0.00 -0.55 0.00 0.00 66.41 63.50 3hpg h THR 184 Cb 0.37 2.26 -0.01 0.00 -1.73 0.00 0.00 68.15 69.04 3hpg h THR 184 CO 0.01 0.68 -1.09 -0.07 -0.25 0.00 0.00 175.52 174.80 3hpg h LEU 185 N 0.08 0.00 0.00 3.87 3.38 -1.17 -1.32 115.31 120.16 3hpg h LEU 185 Ca -0.02 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.59 3hpg h LEU 185 Cb 1.27 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.96 3hpg h LEU 185 CO 0.10 0.29 -2.38 0.59 0.09 0.00 0.00 178.44 177.13 3hpg n ASN 186 N -2.83 1.53 -0.04 -0.43 3.02 -0.10 -4.61 115.26 111.79 3hpg n ASN 186 Ca -0.04 -0.09 -0.09 0.00 -0.03 0.00 0.00 54.58 54.33 3hpg n ASN 186 Cb 0.69 0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.85 3hpg n ASN 186 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3hpg n ILE 187 N -3.07 0.46 0.14 2.41 5.41 -0.63 -1.65 119.36 122.44 3hpg n ILE 187 Ca -0.40 -0.12 0.01 0.00 1.00 0.00 0.00 62.75 63.24 3hpg n ILE 187 Cb 1.01 -1.50 0.12 0.00 -0.71 0.00 0.00 39.64 38.57 3hpg n ILE 187 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3hpg h LYS 188 N -0.26 0.00 -5.91 0.38 1.79 -0.88 -3.44 116.57 108.25 3hpg h LYS 188 Ca -0.21 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.66 3hpg h LYS 188 Cb 1.20 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 31.74 3hpg h LYS 188 CO -0.12 0.58 0.46 0.50 -1.08 0.00 0.00 179.45 179.80 3hpg s ARG 189 N -3.22 3.74 0.31 3.15 3.52 -0.50 -5.02 118.95 120.94 3hpg s ARG 189 Ca 0.01 0.36 0.09 0.00 -0.13 0.00 0.00 55.73 56.06 3hpg s ARG 189 Cb 0.10 -3.82 -0.06 0.00 -1.56 0.00 0.00 34.95 29.61 3hpg s ARG 189 CO 0.74 -0.93 -0.11 0.15 -0.81 0.00 0.00 175.30 174.35 3hpg s LYS 190 N 3.28 1.72 -0.19 5.12 1.02 -1.26 -3.98 119.74 125.45 3hpg s LYS 190 Ca 0.34 -1.86 -0.27 0.00 0.02 0.00 0.00 55.97 54.19 3hpg s LYS 190 Cb -0.12 -1.58 0.09 0.00 -0.52 0.00 0.00 37.83 35.70 3hpg s LYS 190 CO 0.19 0.15 0.80 0.20 -0.92 0.00 0.00 175.35 175.77 3hpg s GLY 191 N -3.54 -0.44 0.00 -3.33 0.00 -0.80 -4.87 107.32 94.33 3hpg s GLY 191 Ca 0.31 1.95 0.00 0.00 0.00 0.00 0.00 44.72 46.98 3hpg s GLY 191 CO 0.15 1.44 0.00 0.61 0.00 0.00 0.00 173.10 175.30 3hpg n GLY 192 N 1.83 0.61 0.68 0.20 0.00 -1.26 -2.97 105.19 104.29 3hpg n GLY 192 Ca -0.15 -1.36 0.09 0.00 0.00 0.00 0.00 46.02 44.61 3hpg n GLY 192 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hpg n LEU 193 N 0.00 2.03 0.00 0.99 4.77 -1.26 -4.81 117.00 118.71 3hpg n LEU 193 Ca 0.00 -0.91 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 3hpg n LEU 193 Cb 0.00 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 3hpg n LEU 193 CO 0.00 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 3hpg n GLY 194 N 1.17 0.70 3.32 -0.72 0.00 -1.26 -5.12 105.19 103.28 3hpg n GLY 194 Ca 0.16 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 3hpg n GLY 194 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hpg s THR 195 N -0.99 3.17 0.78 2.61 -4.23 -1.16 -4.81 115.64 111.00 3hpg s THR 195 Ca 0.00 -0.58 -0.12 0.00 -1.18 0.00 0.00 61.69 59.81 3hpg s THR 195 Cb 0.00 -2.40 0.06 0.00 1.34 0.00 0.00 72.50 71.50 3hpg s THR 195 CO 0.00 0.47 1.14 -0.94 -0.54 0.00 0.00 174.62 174.74 3hpg s SER 196 N 1.08 4.76 0.31 3.99 1.04 -1.26 -1.90 113.70 121.72 3hpg s SER 196 Ca 0.00 0.98 0.01 0.00 0.48 0.00 0.00 55.95 57.43 3hpg s SER 196 Cb -0.15 -1.62 0.50 0.00 0.10 0.00 0.00 66.02 64.85 3hpg s SER 196 CO -0.01 -1.76 1.85 -0.65 0.98 0.00 0.00 173.24 173.64 3hpg h PRO 197 N -0.95 0.69 -0.16 4.02 0.11 -1.71 -1.88 132.00 132.11 3hpg h PRO 197 Ca -0.46 -0.14 -0.08 0.00 0.11 0.00 0.00 66.00 65.42 3hpg h PRO 197 Cb 1.29 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3hpg h PRO 197 CO 0.64 0.65 -0.26 1.98 -0.21 0.00 0.00 178.00 180.80 3hpg h MET 198 N 0.66 0.30 -0.11 1.05 1.85 -1.64 -0.34 114.93 116.71 3hpg h MET 198 Ca 0.14 -0.11 0.02 0.00 -0.61 0.00 0.00 59.70 59.15 3hpg h MET 198 Cb 0.31 -0.02 -0.02 0.00 0.43 0.00 0.00 31.60 32.30 3hpg h MET 198 CO 0.00 0.55 0.00 -0.44 -0.40 0.00 0.00 176.91 176.63 3hpg h ASP 199 N 0.27 -0.04 -0.27 1.39 3.32 -1.61 -1.40 116.42 118.08 3hpg h ASP 199 Ca 0.04 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3hpg h ASP 199 Cb 0.61 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 3hpg h ASP 199 CO 0.04 -0.00 0.13 0.40 -1.72 0.00 0.00 179.24 178.10 3hpg h ILE 200 N 0.04 1.14 0.29 0.35 1.08 -1.20 -0.20 117.51 119.01 3hpg h ILE 200 Ca 0.05 -0.41 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 3hpg h ILE 200 Cb 0.06 0.92 -0.02 0.00 -3.07 0.00 0.00 36.82 34.71 3hpg h ILE 200 CO -0.08 0.15 -0.25 0.15 -0.69 0.00 0.00 178.15 177.42 3hpg h PHE 201 N 0.31 -0.67 -0.56 1.37 3.57 -0.92 -1.70 116.94 118.34 3hpg h PHE 201 Ca 0.09 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.65 3hpg h PHE 201 Cb 0.11 0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.05 3hpg h PHE 201 CO -0.02 -0.37 0.28 0.82 -2.23 0.00 0.00 178.31 176.78 3hpg h ILE 202 N -0.56 0.92 -0.25 1.41 2.04 -1.23 -1.68 117.51 118.15 3hpg h ILE 202 Ca -0.02 -0.18 0.06 0.00 1.00 0.00 0.00 64.86 65.72 3hpg h ILE 202 Cb 0.50 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 3hpg h ILE 202 CO -0.03 0.10 -0.10 0.15 0.00 0.00 0.00 178.15 178.26 3hpg h PHE 203 N 0.52 -0.24 -0.90 1.37 3.57 -0.93 -0.99 116.94 119.35 3hpg h PHE 203 Ca 0.26 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.82 3hpg h PHE 203 Cb 0.20 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.03 3hpg h PHE 203 CO -0.11 -0.16 0.59 -0.91 -2.23 0.00 0.00 178.31 175.48 3hpg h ASN 204 N -0.06 0.96 -0.63 0.41 2.35 -1.12 -1.41 115.58 116.07 3hpg h ASN 204 Ca 0.13 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.79 3hpg h ASN 204 Cb 0.26 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 3hpg h ASN 204 CO -0.30 0.65 0.07 0.11 -1.65 0.00 0.00 177.43 176.32 3hpg h LYS 205 N 1.11 1.07 -0.21 0.81 1.79 -0.76 -2.43 116.57 117.95 3hpg h LYS 205 Ca 0.36 -0.30 -0.18 0.00 -2.18 0.00 0.00 60.65 58.35 3hpg h LYS 205 Cb 0.04 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.57 3hpg h LYS 205 CO -0.11 1.00 -0.59 1.49 -1.08 0.00 0.00 179.45 180.16 3hpg h GLU 206 N 0.99 0.77 -0.38 3.15 4.57 -0.83 -2.88 114.58 119.97 3hpg h GLU 206 Ca 0.19 -0.55 -0.04 0.00 -1.18 0.00 0.00 59.36 57.78 3hpg h GLU 206 Cb 0.47 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 3hpg h GLU 206 CO 0.02 1.17 0.05 1.96 -1.18 0.00 0.00 179.01 181.03 3hpg h GLN 207 N 0.50 0.58 -0.63 1.92 7.50 -1.22 -1.62 115.11 122.14 3hpg h GLN 207 Ca -0.02 -0.11 -0.00 0.00 0.50 0.00 0.00 58.65 59.02 3hpg h GLN 207 Cb 1.21 -0.09 -0.03 0.00 0.05 0.00 0.00 27.48 28.62 3hpg h GLN 207 CO 0.13 0.57 0.39 1.96 -1.50 0.00 0.00 178.83 180.37 3hpg h GLN 208 N 0.56 0.85 -0.25 1.46 4.20 -1.31 -1.29 115.11 119.34 3hpg h GLN 208 Ca 0.12 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 3hpg h GLN 208 Cb 0.28 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 3hpg h GLN 208 CO 0.00 0.60 0.03 -0.09 -0.67 0.00 0.00 178.83 178.71 3hpg h ARG 209 N 0.86 0.41 -0.57 1.46 2.43 -1.17 -2.34 114.38 115.46 3hpg h ARG 209 Ca 0.23 -0.12 0.12 0.00 -0.81 0.00 0.00 59.98 59.40 3hpg h ARG 209 Cb -0.04 -0.05 -0.10 0.00 -0.42 0.00 0.00 29.97 29.37 3hpg h ARG 209 CO -0.04 0.55 -0.03 0.82 -1.51 0.00 0.00 179.97 179.76 3hpg h ILE 210 N 0.21 0.51 -0.34 1.20 2.04 -1.22 -2.38 117.51 117.54 3hpg h ILE 210 Ca 0.07 -0.03 -0.24 0.00 1.00 0.00 0.00 64.86 65.67 3hpg h ILE 210 Cb 0.35 0.42 -0.09 0.00 -0.74 0.00 0.00 36.82 36.75 3hpg h ILE 210 CO 0.01 0.02 0.09 0.00 0.00 0.00 0.00 178.15 178.26 3hpg n GLN 211 N -5.29 1.75 0.00 2.37 6.02 -0.50 -5.11 117.38 116.63 3hpg n GLN 211 Ca 0.07 -1.15 0.00 0.00 -0.01 0.00 0.00 57.00 55.91 3hpg n GLN 211 Cb 0.32 -1.65 0.00 0.00 1.02 0.00 0.00 30.24 29.93 3hpg n GLN 211 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05