#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1brh s ILE 4 N 0.00 3.93 0.00 0.00 1.01 -1.26 -4.91 121.20 119.97 1brh s ILE 4 Ca 0.00 -1.47 0.13 0.00 0.00 0.00 0.00 60.65 59.32 1brh s ILE 4 Cb 0.00 -3.42 0.22 0.00 0.01 0.00 0.00 42.46 39.28 1brh s ILE 4 CO 0.00 -0.47 1.07 -0.46 0.00 0.00 0.00 174.94 175.09 1brh n ASN 5 N 4.83 0.48 -4.92 3.58 6.94 -1.26 -4.78 115.26 120.13 1brh n ASN 5 Ca -0.09 -1.97 -0.20 0.00 -0.02 0.00 0.00 54.58 52.29 1brh n ASN 5 Cb 0.43 -0.23 -0.02 0.00 -2.36 0.00 0.00 39.78 37.60 1brh n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1brh s THR 6 N 0.00 4.07 0.12 5.53 -4.23 -1.26 -0.28 115.64 119.59 1brh s THR 6 Ca 0.18 -1.17 -0.20 0.00 -1.18 0.00 0.00 61.69 59.32 1brh s THR 6 Cb 0.20 -3.39 -0.08 0.00 1.34 0.00 0.00 72.50 70.58 1brh s THR 6 CO -0.09 -0.20 1.75 -0.26 -0.54 0.00 0.00 174.62 175.28 1brh h PHE 7 N 1.11 0.11 -0.26 3.99 0.04 -1.99 -0.36 116.94 119.59 1brh h PHE 7 Ca -0.46 0.01 -0.19 0.00 2.80 0.00 0.00 57.97 60.12 1brh h PHE 7 Cb 1.25 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.37 1brh h PHE 7 CO 0.48 0.06 -0.58 -0.44 -0.60 0.00 0.00 178.31 177.23 1brh h ASP 8 N 0.14 0.94 -0.24 2.17 3.32 -1.99 -1.54 116.42 119.22 1brh h ASP 8 Ca 0.07 -0.52 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1brh h ASP 8 Cb 0.03 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 1brh h ASP 8 CO -0.06 1.31 0.16 1.23 -1.72 0.00 0.00 179.24 180.16 1brh h GLY 9 N 0.72 0.35 1.89 2.75 0.00 -1.93 -1.67 103.07 105.18 1brh h GLY 9 Ca 0.01 -0.14 -0.22 0.00 0.00 0.00 0.00 47.33 46.98 1brh h GLY 9 CO 0.13 0.13 -1.07 -0.24 0.00 0.00 0.00 176.54 175.48 1brh h VAL 10 N 0.32 1.64 -0.19 4.60 3.04 -1.08 -2.12 116.25 122.46 1brh h VAL 10 Ca 0.09 -3.34 0.02 0.00 -1.01 0.00 0.00 66.70 62.46 1brh h VAL 10 Cb -0.02 2.84 -0.02 0.00 -2.01 0.00 0.00 31.29 32.08 1brh h VAL 10 CO -0.02 0.94 0.05 0.00 -1.01 0.00 0.00 177.57 177.53 1brh h ALA 11 N 0.95 0.20 -0.44 3.17 0.00 -1.21 0.03 119.26 121.94 1brh h ALA 11 Ca -0.04 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1brh h ALA 11 Cb 1.81 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.61 1brh h ALA 11 CO 0.14 -0.38 -0.28 -0.44 0.00 0.00 0.00 179.25 178.29 1brh h ASP 12 N 0.14 1.00 -0.61 0.00 3.32 -1.35 -2.21 116.42 116.70 1brh h ASP 12 Ca 0.08 -0.40 -0.04 0.00 0.02 0.00 0.00 57.03 56.69 1brh h ASP 12 Cb 0.06 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 1brh h ASP 12 CO -0.09 1.20 0.22 0.22 -1.72 0.00 0.00 179.24 179.06 1brh h TYR 13 N 0.81 0.96 -0.39 4.55 5.03 -1.14 -2.53 116.97 124.25 1brh h TYR 13 Ca 0.09 -0.08 -0.15 0.00 2.58 0.00 0.00 58.73 61.17 1brh h TYR 13 Cb 0.86 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 38.85 1brh h TYR 13 CO 0.05 0.77 -0.33 0.00 -1.32 0.00 0.00 178.16 177.34 1brh h ALA 14 N 1.08 0.56 -0.09 1.82 0.00 -0.88 -1.20 119.26 120.56 1brh h ALA 14 Ca 0.20 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1brh h ALA 14 Cb 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1brh h ALA 14 CO -0.01 0.62 -0.32 1.96 0.00 0.00 0.00 179.25 181.50 1brh h GLN 15 N 0.72 0.16 0.00 0.00 4.20 -1.38 0.65 115.11 119.46 1brh h GLN 15 Ca 0.07 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1brh h GLN 15 Cb 0.91 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.68 1brh h GLN 15 CO 0.08 0.47 -0.24 1.15 -0.67 0.00 0.00 178.83 179.63 1brh h THR 16 N 0.14 0.83 -0.00 -0.54 2.02 -1.38 -3.39 112.91 110.60 1brh h THR 16 Ca 0.02 -1.69 0.00 0.00 0.77 0.00 0.00 66.41 65.50 1brh h THR 16 Cb 0.64 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.70 1brh h THR 16 CO 0.05 0.28 -0.43 -1.22 0.37 0.00 0.00 175.52 174.57 1brh n TYR 17 N -4.65 0.00 -3.81 3.16 4.01 -0.46 -4.98 117.16 110.43 1brh n TYR 17 Ca -0.09 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.39 1brh n TYR 17 Cb 0.31 -0.16 0.03 0.00 -0.31 0.00 0.00 39.34 39.21 1brh n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1brh n HIS 18 N -1.04 -2.11 -3.60 -0.72 8.25 0.22 -4.96 115.22 111.25 1brh n HIS 18 Ca 0.09 0.87 -0.04 0.00 -0.26 0.00 0.00 57.72 58.38 1brh n HIS 18 Cb 0.35 -4.18 -0.02 0.00 1.12 0.00 0.00 29.99 27.26 1brh n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1brh s LYS 19 N -6.32 0.56 0.46 -0.41 -2.85 -1.25 -5.08 119.74 104.85 1brh s LYS 19 Ca 0.34 -0.26 -0.15 0.00 -1.00 0.00 0.00 55.97 54.90 1brh s LYS 19 Cb -0.17 0.23 -0.08 0.00 -2.06 0.00 0.00 37.83 35.75 1brh s LYS 19 CO 0.82 -0.25 0.90 -0.51 0.10 0.00 0.00 175.35 176.41 1brh s LEU 20 N -2.55 3.75 1.01 2.77 1.43 -1.26 -4.03 118.68 119.79 1brh s LEU 20 Ca 0.10 1.44 -0.12 0.00 -1.03 0.00 0.00 54.13 54.53 1brh s LEU 20 Cb 0.00 -4.35 0.17 0.00 0.03 0.00 0.00 46.19 42.05 1brh s LEU 20 CO -0.04 -0.48 0.94 -2.65 0.23 0.00 0.00 176.35 174.34 1brh n PRO 21 N -1.30 -1.05 0.33 1.29 -0.02 -1.26 -4.90 135.00 128.09 1brh n PRO 21 Ca 0.05 -0.26 0.21 0.00 -2.02 0.00 0.00 63.50 61.49 1brh n PRO 21 Cb 0.54 -2.21 1.16 0.00 -0.02 0.00 0.00 33.50 32.98 1brh n PRO 21 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1brh h ASP 22 N -2.08 0.00 0.00 2.55 3.32 -1.96 -2.91 116.42 115.34 1brh h ASP 22 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1brh h ASP 22 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1brh h ASP 22 CO 0.42 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.48 1brh n ASN 23 N -3.20 0.00 -4.90 6.45 6.94 -1.26 -4.86 115.26 114.43 1brh n ASN 23 Ca -0.03 -1.20 -0.33 0.00 -0.02 0.00 0.00 54.58 52.99 1brh n ASN 23 Cb 0.08 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.46 1brh n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1brh s TYR 24 N -2.00 3.55 0.02 -2.53 2.02 -1.10 -1.28 117.35 116.03 1brh s TYR 24 Ca 0.34 0.43 -0.01 0.00 -0.37 0.00 0.00 57.07 57.46 1brh s TYR 24 Cb 0.15 -1.89 -0.02 0.00 -0.40 0.00 0.00 41.96 39.81 1brh s TYR 24 CO 0.26 0.62 -0.00 0.96 -1.57 0.00 0.00 175.55 175.82 1brh s ILE 25 N -1.35 0.10 0.74 2.71 -4.36 0.35 -4.86 121.20 114.53 1brh s ILE 25 Ca 0.29 -0.84 -0.11 0.00 -0.26 0.00 0.00 60.65 59.73 1brh s ILE 25 Cb -0.13 -0.28 0.04 0.00 1.25 0.00 0.00 42.46 43.34 1brh s ILE 25 CO 0.19 -0.46 1.08 0.42 0.24 0.00 0.00 174.94 176.40 1brh s THR 26 N -1.39 3.62 0.31 8.37 -4.23 -1.19 0.39 115.64 121.52 1brh s THR 26 Ca -0.15 0.53 -0.01 0.00 -1.18 0.00 0.00 61.69 60.88 1brh s THR 26 Cb -0.09 -3.17 0.25 0.00 1.34 0.00 0.00 72.50 70.83 1brh s THR 26 CO -0.01 -0.69 1.96 0.11 -0.54 0.00 0.00 174.62 175.46 1brh h LYS 27 N -0.94 0.98 0.00 3.99 1.57 -1.96 -1.16 116.57 119.05 1brh h LYS 27 Ca -0.44 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.19 1brh h LYS 27 Cb 1.23 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1brh h LYS 27 CO 0.55 0.68 -0.31 0.66 -0.57 0.00 0.00 179.45 180.46 1brh h SER 28 N 1.01 0.00 -0.36 0.86 4.64 -1.99 -1.15 113.55 116.55 1brh h SER 28 Ca 0.27 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.46 1brh h SER 28 Cb -0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1brh h SER 28 CO -0.05 0.31 -0.26 -0.33 -0.87 0.00 0.00 176.83 175.63 1brh h GLU 29 N 0.00 0.80 -0.48 4.77 5.08 -1.74 -2.26 114.58 120.75 1brh h GLU 29 Ca -0.00 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 57.93 1brh h GLU 29 Cb 1.06 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 1brh h GLU 29 CO 0.04 1.02 0.16 0.00 -1.00 0.00 0.00 179.01 179.23 1brh h ALA 30 N 0.77 0.63 -0.86 3.43 0.00 -1.02 -2.69 119.26 119.52 1brh h ALA 30 Ca 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1brh h ALA 30 Cb 0.82 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1brh h ALA 30 CO 0.07 0.26 0.46 1.96 0.00 0.00 0.00 179.25 182.00 1brh h GLN 31 N 0.64 1.20 -0.36 0.00 4.20 -1.12 -1.48 115.11 118.19 1brh h GLN 31 Ca 0.16 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 1brh h GLN 31 Cb 0.25 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1brh h GLN 31 CO -0.01 0.89 0.05 0.00 -0.67 0.00 0.00 178.83 179.10 1brh h ALA 32 N 1.25 1.43 0.00 3.87 0.00 -1.26 -1.67 119.26 122.87 1brh h ALA 32 Ca 0.30 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1brh h ALA 32 Cb 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1brh h ALA 32 CO -0.05 0.41 0.00 1.28 0.00 0.00 0.00 179.25 180.89 1brh n LEU 33 N -4.32 0.00 0.00 0.00 4.77 -0.86 -4.90 117.00 111.69 1brh n LEU 33 Ca 0.02 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1brh n LEU 33 Cb 0.21 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1brh n LEU 33 CO 0.38 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1brh n GLY 34 N 1.17 1.39 3.70 -0.72 0.00 -0.63 -4.90 105.19 105.20 1brh n GLY 34 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1brh n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1brh s TRP 35 N -2.00 3.16 -0.29 1.61 -0.00 -0.61 -4.94 118.94 115.86 1brh s TRP 35 Ca 0.00 1.06 0.02 0.00 -0.00 0.00 0.00 56.10 57.19 1brh s TRP 35 Cb 0.00 -3.55 0.07 0.00 -0.00 0.00 0.00 33.47 30.00 1brh s TRP 35 CO 0.00 -1.86 -0.04 0.08 -0.00 0.00 0.00 176.95 175.13 1brh s VAL 36 N 1.75 2.35 0.27 5.86 1.01 -1.26 -4.47 120.40 125.91 1brh s VAL 36 Ca 0.61 -1.81 0.01 0.00 0.00 0.00 0.00 61.98 60.79 1brh s VAL 36 Cb -0.30 -2.48 0.26 0.00 0.00 0.00 0.00 36.38 33.85 1brh s VAL 36 CO 0.27 -0.21 1.76 0.00 0.00 0.00 0.00 175.10 176.92 1brh h ALA 37 N 7.77 1.36 0.00 5.51 0.00 -2.00 -1.77 119.26 130.14 1brh h ALA 37 Ca -0.15 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1brh h ALA 37 Cb 1.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1brh h ALA 37 CO 0.49 -0.08 0.00 0.77 0.00 0.00 0.00 179.25 180.43 1brh h SER 38 N 0.65 0.00 -0.01 0.00 0.02 -2.03 -2.25 113.55 109.92 1brh h SER 38 Ca 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 1brh h SER 38 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1brh h SER 38 CO -0.37 0.00 -0.24 0.29 -1.14 0.00 0.00 176.83 175.37 1brh n LYS 39 N -2.54 1.62 -4.11 3.45 5.02 -0.68 -5.02 118.16 115.90 1brh n LYS 39 Ca -0.01 -0.93 -0.31 0.00 -2.02 0.00 0.00 58.31 55.04 1brh n LYS 39 Cb 0.10 -1.25 -0.03 0.00 -0.02 0.00 0.00 35.03 33.83 1brh n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1brh n GLY 40 N 1.05 -0.33 1.52 0.72 0.00 -0.85 -4.88 105.19 102.41 1brh n GLY 40 Ca 0.07 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.32 1brh n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1brh n ASN 41 N -2.81 4.68 -0.18 1.61 6.94 -1.26 -3.89 115.26 120.35 1brh n ASN 41 Ca -0.11 -2.48 -0.02 0.00 -0.02 0.00 0.00 54.58 51.95 1brh n ASN 41 Cb 0.59 -0.56 0.05 0.00 -2.36 0.00 0.00 39.78 37.49 1brh n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1brh h LEU 42 N 3.86 -0.53 -1.95 -4.53 5.85 -1.88 -1.10 115.31 115.03 1brh h LEU 42 Ca 0.00 0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1brh h LEU 42 Cb 1.44 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 42.82 1brh h LEU 42 CO 0.23 -0.19 0.05 0.00 -0.34 0.00 0.00 178.44 178.20 1brh h ALA 43 N 1.55 1.99 0.26 1.25 0.00 -1.86 0.13 119.26 122.58 1brh h ALA 43 Ca 0.27 -0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.84 1brh h ALA 43 Cb 0.41 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.22 1brh h ALA 43 CO -0.58 -0.00 -1.47 -0.44 0.00 0.00 0.00 179.25 176.76 1brh h ASP 44 N 0.07 0.85 0.67 0.00 3.32 -1.57 -3.25 116.42 116.51 1brh h ASP 44 Ca 0.03 -0.92 0.00 0.00 0.02 0.00 0.00 57.03 56.16 1brh h ASP 44 Cb 0.05 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.32 1brh h ASP 44 CO -0.00 1.71 -1.00 1.33 -1.72 0.00 0.00 179.24 179.55 1brh n VAL 45 N -3.73 0.34 -3.08 -1.35 0.24 -0.99 -4.59 118.33 105.17 1brh n VAL 45 Ca -0.17 -0.36 -0.19 0.00 -2.04 0.00 0.00 64.34 61.57 1brh n VAL 45 Cb 1.10 -0.05 -0.04 0.00 -1.47 0.00 0.00 33.84 33.38 1brh n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1brh n ALA 46 N -1.97 1.29 -1.69 2.33 0.00 0.42 -4.90 120.51 115.99 1brh n ALA 46 Ca 0.01 -2.74 -0.44 0.00 0.00 0.00 0.00 53.44 50.27 1brh n ALA 46 Cb 0.48 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 1brh n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1brh n PRO 47 N 1.71 2.25 -1.00 0.00 -0.02 -1.23 -2.23 135.00 134.48 1brh n PRO 47 Ca 0.19 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1brh n PRO 47 Cb 0.55 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1brh n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1brh n GLY 48 N 2.54 0.99 3.88 -1.23 0.00 -1.26 -5.03 105.19 105.08 1brh n GLY 48 Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 1brh n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1brh s LYS 49 N -0.00 3.13 0.09 1.61 -0.14 -0.95 -4.80 119.74 118.68 1brh s LYS 49 Ca 0.00 -0.89 0.03 0.00 -1.36 0.00 0.00 55.97 53.75 1brh s LYS 49 Cb 0.00 -2.72 -0.04 0.00 -1.68 0.00 0.00 37.83 33.40 1brh s LYS 49 CO 0.00 0.43 -0.09 -1.12 -0.76 0.00 0.00 175.35 173.82 1brh s SER 50 N -3.71 1.26 0.05 2.83 0.01 -0.40 -4.83 113.70 108.91 1brh s SER 50 Ca 0.33 -0.82 -0.30 0.00 1.31 0.00 0.00 55.95 56.47 1brh s SER 50 Cb -0.09 0.04 -0.05 0.00 0.21 0.00 0.00 66.02 66.13 1brh s SER 50 CO 0.26 -0.31 1.02 -0.63 0.41 0.00 0.00 173.24 174.00 1brh s ILE 51 N -2.59 4.54 -0.19 1.44 -1.09 -1.26 -0.50 121.20 121.56 1brh s ILE 51 Ca 0.05 1.92 -0.32 0.00 -2.23 0.00 0.00 60.65 60.07 1brh s ILE 51 Cb -0.02 -4.23 0.15 0.00 -1.58 0.00 0.00 42.46 36.78 1brh s ILE 51 CO -0.01 0.20 1.17 -0.83 -1.23 0.00 0.00 174.94 174.24 1brh s GLY 52 N 0.66 -0.20 0.00 6.18 0.00 0.16 -1.19 107.32 112.94 1brh s GLY 52 Ca 0.52 1.99 0.00 0.00 0.00 0.00 0.00 44.72 47.22 1brh s GLY 52 CO 0.29 0.79 0.00 0.61 0.00 0.00 0.00 173.10 174.80 1brh n GLY 53 N 0.26 0.52 3.82 0.20 0.00 -0.01 -3.17 105.19 106.80 1brh n GLY 53 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1brh n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1brh s ASP 54 N -2.92 6.54 0.32 1.61 1.01 -1.25 -4.77 116.67 117.22 1brh s ASP 54 Ca 0.00 1.73 -0.28 0.00 0.71 0.00 0.00 52.55 54.71 1brh s ASP 54 Cb 0.00 -2.54 -0.09 0.00 1.01 0.00 0.00 42.92 41.30 1brh s ASP 54 CO 0.00 -0.64 1.15 -0.63 0.21 0.00 0.00 175.17 175.26 1brh s ILE 55 N -2.29 3.30 -0.24 0.77 -1.09 -1.26 -1.50 121.20 118.88 1brh s ILE 55 Ca 0.63 1.25 -0.04 0.00 -2.23 0.00 0.00 60.65 60.25 1brh s ILE 55 Cb -0.12 -3.77 0.00 0.00 -1.58 0.00 0.00 42.46 36.99 1brh s ILE 55 CO 0.23 0.25 -0.02 0.12 -1.23 0.00 0.00 174.94 174.30 1brh s PHE 56 N -1.23 3.02 0.28 3.97 5.36 0.01 -4.84 117.98 124.53 1brh s PHE 56 Ca 0.48 -1.04 -0.01 0.00 -0.96 0.00 0.00 56.93 55.41 1brh s PHE 56 Cb -0.33 -2.13 0.39 0.00 -0.34 0.00 0.00 43.02 40.62 1brh s PHE 56 CO 0.42 -0.58 1.80 0.66 -1.46 0.00 0.00 175.22 176.06 1brh h SER 57 N 8.12 0.72 -2.23 6.13 4.64 -1.96 -3.38 113.55 125.59 1brh h SER 57 Ca -0.38 -0.16 -0.30 0.00 -0.47 0.00 0.00 61.79 60.49 1brh h SER 57 Cb 1.14 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.03 1brh h SER 57 CO 0.60 0.77 -0.39 -3.20 -0.87 0.00 0.00 176.83 173.73 1brh n ASN 58 N -4.24 -4.57 -0.04 4.97 5.15 -1.26 -4.88 115.26 110.39 1brh n ASN 58 Ca 0.03 -0.03 -0.09 0.00 -0.60 0.00 0.00 54.58 53.89 1brh n ASN 58 Cb 0.27 -3.69 -0.03 0.00 -0.53 0.00 0.00 39.78 35.80 1brh n ASN 58 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 1brh h ARG 59 N -0.07 -0.32 -0.01 1.20 9.65 -2.00 -1.62 114.38 121.20 1brh h ARG 59 Ca -0.36 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.54 1brh h ARG 59 Cb 1.26 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.92 1brh h ARG 59 CO 0.42 -0.22 0.00 -0.85 2.80 0.00 0.00 179.97 182.13 1brh n GLU 60 N -5.41 0.36 -2.03 0.20 0.28 -1.26 -4.86 120.64 107.93 1brh n GLU 60 Ca -0.02 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.86 1brh n GLU 60 Cb 0.33 -1.01 -0.03 0.00 1.43 0.00 0.00 31.44 32.17 1brh n GLU 60 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1brh n GLY 61 N -0.12 0.17 0.15 -1.84 0.00 -0.61 -4.91 105.19 98.03 1brh n GLY 61 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1brh n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1brh h LYS 62 N 0.00 0.06 -5.92 1.61 1.57 -1.89 -3.44 116.57 108.55 1brh h LYS 62 Ca -0.29 -0.04 -0.61 0.00 -1.87 0.00 0.00 60.65 57.84 1brh h LYS 62 Cb 1.08 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.33 1brh h LYS 62 CO 0.37 0.61 -0.24 -0.51 -0.57 0.00 0.00 179.45 179.11 1brh s LEU 63 N -7.79 4.44 0.11 2.94 1.43 -1.26 -5.02 118.68 113.54 1brh s LEU 63 Ca -0.02 0.87 -0.33 0.00 -1.03 0.00 0.00 54.13 53.62 1brh s LEU 63 Cb 0.13 -2.51 -0.12 0.00 0.03 0.00 0.00 46.19 43.72 1brh s LEU 63 CO 0.76 0.31 1.76 -0.81 0.23 0.00 0.00 176.35 178.61 1brh n PRO 64 N 2.01 2.52 -3.30 1.29 -0.04 -1.26 -4.99 135.00 131.23 1brh n PRO 64 Ca -0.14 0.92 -0.24 0.00 -0.04 0.00 0.00 63.50 63.99 1brh n PRO 64 Cb 0.53 -2.76 -0.01 0.00 -0.04 0.00 0.00 33.50 31.21 1brh n PRO 64 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1brh s GLY 65 N 2.23 1.37 -0.22 0.55 0.00 -1.26 -5.07 107.32 104.93 1brh s GLY 65 Ca 0.82 -0.92 -0.29 0.00 0.00 0.00 0.00 44.72 44.33 1brh s GLY 65 CO 0.39 -0.84 1.12 1.25 0.00 0.00 0.00 173.10 175.02 1brh s LYS 66 N -4.36 0.41 0.09 2.90 2.20 -1.26 -5.07 119.74 114.65 1brh s LYS 66 Ca 0.41 0.18 -0.32 0.00 -0.36 0.00 0.00 55.97 55.88 1brh s LYS 66 Cb -0.10 0.20 -0.11 0.00 -1.51 0.00 0.00 37.83 36.31 1brh s LYS 66 CO 0.37 -0.11 1.83 0.45 -0.36 0.00 0.00 175.35 177.52 1brh n SER 67 N 0.97 3.87 0.00 1.43 2.88 -1.26 -0.76 113.62 120.75 1brh n SER 67 Ca -0.08 0.99 0.00 0.00 -1.33 0.00 0.00 58.87 58.45 1brh n SER 67 Cb 0.58 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.53 1brh n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1brh n GLY 68 N 4.19 0.63 3.76 0.46 0.00 -1.26 -5.01 105.19 107.97 1brh n GLY 68 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1brh n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1brh s ARG 69 N -0.21 4.24 0.05 1.61 3.52 0.06 -4.93 118.95 123.30 1brh s ARG 69 Ca 0.00 0.52 0.06 0.00 -0.13 0.00 0.00 55.73 56.18 1brh s ARG 69 Cb 0.00 -3.36 -0.03 0.00 -1.56 0.00 0.00 34.95 30.00 1brh s ARG 69 CO 0.00 0.34 -0.17 0.95 -0.81 0.00 0.00 175.30 175.61 1brh s THR 70 N -0.00 1.37 -0.04 4.11 -4.23 -1.26 -4.79 115.64 110.80 1brh s THR 70 Ca 0.27 -1.17 -0.01 0.00 -1.18 0.00 0.00 61.69 59.59 1brh s THR 70 Cb -0.16 -1.23 -0.04 0.00 1.34 0.00 0.00 72.50 72.41 1brh s THR 70 CO 0.13 0.04 0.06 0.26 -0.54 0.00 0.00 174.62 174.57 1brh s TRP 71 N -0.92 3.28 0.18 3.99 0.52 -1.26 -1.22 118.94 123.51 1brh s TRP 71 Ca 0.04 0.23 0.07 0.00 0.02 0.00 0.00 56.10 56.46 1brh s TRP 71 Cb -0.09 -1.77 -0.04 0.00 -1.15 0.00 0.00 33.47 30.42 1brh s TRP 71 CO 0.02 0.55 -0.14 1.03 0.02 0.00 0.00 176.95 178.43 1brh s ARG 72 N -1.43 1.23 0.24 4.98 0.52 0.18 -0.81 118.95 123.85 1brh s ARG 72 Ca 0.19 -1.51 0.06 0.00 -0.52 0.00 0.00 55.73 53.96 1brh s ARG 72 Cb -0.12 -1.00 -0.05 0.00 0.52 0.00 0.00 34.95 34.30 1brh s ARG 72 CO 0.10 0.16 -0.08 -1.83 0.02 0.00 0.00 175.30 173.67 1brh s GLU 73 N -3.51 1.41 -0.13 3.54 -1.05 -0.56 -0.80 118.70 117.59 1brh s GLU 73 Ca 0.19 -1.68 -0.17 0.00 -0.15 0.00 0.00 54.97 53.17 1brh s GLU 73 Cb -0.01 -1.03 0.04 0.00 -0.44 0.00 0.00 34.13 32.70 1brh s GLU 73 CO 0.05 0.07 0.44 0.00 0.95 0.00 0.00 175.26 176.78 1brh s ALA 74 N -3.08 -1.11 0.20 -0.84 0.00 -0.27 -0.83 121.76 115.83 1brh s ALA 74 Ca 0.26 1.08 -0.30 0.00 0.00 0.00 0.00 51.96 53.00 1brh s ALA 74 Cb 0.02 -0.50 -0.08 0.00 0.00 0.00 0.00 23.12 22.56 1brh s ALA 74 CO 0.09 -0.24 1.11 -0.51 0.00 0.00 0.00 175.76 176.21 1brh s ASP 75 N -0.22 7.24 0.07 0.00 1.11 -0.33 -0.41 116.67 124.13 1brh s ASP 75 Ca -0.04 2.15 0.08 0.00 0.18 0.00 0.00 52.55 54.92 1brh s ASP 75 Cb -0.03 -2.61 -0.03 0.00 1.07 0.00 0.00 42.92 41.31 1brh s ASP 75 CO 0.02 -0.22 -0.19 -0.63 1.18 0.00 0.00 175.17 175.33 1brh s ILE 76 N -0.44 2.73 -1.62 0.77 -1.09 -0.85 -4.67 121.20 116.02 1brh s ILE 76 Ca 0.49 -1.31 0.00 0.00 -2.23 0.00 0.00 60.65 57.59 1brh s ILE 76 Cb -0.30 -2.18 0.00 0.00 -1.58 0.00 0.00 42.46 38.40 1brh s ILE 76 CO 0.37 0.26 0.00 0.59 -1.23 0.00 0.00 174.94 174.93 1brh n ASN 77 N 1.33 -5.07 -4.76 3.58 3.02 0.62 -4.60 115.26 109.37 1brh n ASN 77 Ca -0.16 0.38 -0.40 0.00 -0.03 0.00 0.00 54.58 54.37 1brh n ASN 77 Cb 0.52 -3.92 -0.06 0.00 -0.61 0.00 0.00 39.78 35.72 1brh n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1brh s TYR 78 N -2.49 3.86 0.00 3.10 5.04 -1.26 -4.93 117.35 120.66 1brh s TYR 78 Ca 0.00 1.63 0.00 0.00 -2.44 0.00 0.00 57.07 56.26 1brh s TYR 78 Cb 0.00 -2.84 0.00 0.00 0.35 0.00 0.00 41.96 39.47 1brh s TYR 78 CO 0.00 0.40 0.00 0.25 -1.34 0.00 0.00 175.55 174.86 1brh n THR 79 N 2.08 0.00 -3.76 4.34 -2.24 -1.26 -4.95 114.28 108.49 1brh n THR 79 Ca -0.03 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.68 1brh n THR 79 Cb 0.49 -0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 67.88 1brh n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1brh s SER 80 N -4.79 -0.26 0.00 3.42 1.04 -1.26 -4.76 113.70 107.09 1brh s SER 80 Ca 0.00 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.99 1brh s SER 80 Cb 0.00 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.72 1brh s SER 80 CO 0.00 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.73 1brh n GLY 81 N -0.45 -1.77 3.75 7.32 0.00 -1.25 -4.90 105.19 107.89 1brh n GLY 81 Ca -0.06 -1.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.11 1brh n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1brh s PHE 82 N 0.00 2.37 0.73 1.61 0.08 -1.26 -4.58 117.98 116.93 1brh s PHE 82 Ca 0.00 1.59 -0.15 0.00 0.12 0.00 0.00 56.93 58.50 1brh s PHE 82 Cb 0.00 -3.21 0.04 0.00 -0.57 0.00 0.00 43.02 39.28 1brh s PHE 82 CO 0.00 -2.04 1.20 1.03 -0.10 0.00 0.00 175.22 175.31 1brh s ARG 83 N -4.37 2.14 0.10 0.44 0.52 -1.26 -5.01 118.95 111.50 1brh s ARG 83 Ca 0.67 1.73 0.01 0.00 -0.52 0.00 0.00 55.73 57.62 1brh s ARG 83 Cb -0.21 -1.84 0.02 0.00 0.52 0.00 0.00 34.95 33.44 1brh s ARG 83 CO 0.49 -1.82 0.13 0.27 0.02 0.00 0.00 175.30 174.38 1brh n ASN 84 N -2.75 0.32 -0.98 0.23 0.23 -1.26 -5.04 115.26 106.01 1brh n ASN 84 Ca 0.13 -1.24 0.08 0.00 -0.53 0.00 0.00 54.58 53.02 1brh n ASN 84 Cb 0.50 -0.07 0.26 0.00 -2.08 0.00 0.00 39.78 38.39 1brh n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1brh n SER 85 N -2.91 3.94 -4.68 0.53 3.41 -1.26 -4.97 113.62 107.68 1brh n SER 85 Ca 0.03 -2.78 -0.37 0.00 -0.26 0.00 0.00 58.87 55.49 1brh n SER 85 Cb 0.10 -0.50 -0.09 0.00 -0.26 0.00 0.00 64.21 63.46 1brh n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1brh s ASP 86 N -1.58 6.25 0.04 4.04 1.01 -1.26 -2.04 116.67 123.11 1brh s ASP 86 Ca 0.40 0.27 0.00 0.00 0.71 0.00 0.00 52.55 53.94 1brh s ASP 86 Cb 0.31 -2.14 -0.03 0.00 1.01 0.00 0.00 42.92 42.06 1brh s ASP 86 CO 0.12 0.04 -0.04 -0.13 0.21 0.00 0.00 175.17 175.37 1brh s ARG 87 N 0.98 0.45 -0.09 8.23 1.81 -0.33 -2.01 118.95 127.98 1brh s ARG 87 Ca 0.12 -0.83 0.01 0.00 -1.72 0.00 0.00 55.73 53.31 1brh s ARG 87 Cb -0.13 0.06 -0.02 0.00 -0.45 0.00 0.00 34.95 34.40 1brh s ARG 87 CO 0.05 -0.05 -0.12 -1.50 -0.68 0.00 0.00 175.30 172.99 1brh s ILE 88 N -2.19 3.19 -0.18 1.52 2.07 0.46 -2.04 121.20 124.02 1brh s ILE 88 Ca -0.08 -0.65 -0.03 0.00 -1.41 0.00 0.00 60.65 58.49 1brh s ILE 88 Cb -0.05 -2.30 -0.01 0.00 0.13 0.00 0.00 42.46 40.23 1brh s ILE 88 CO -0.03 0.56 -0.07 -0.76 -1.91 0.00 0.00 174.94 172.73 1brh s LEU 89 N -0.29 2.88 -0.01 8.50 2.01 0.23 -1.12 118.68 130.89 1brh s LEU 89 Ca 0.03 -0.34 0.04 0.00 0.01 0.00 0.00 54.13 53.87 1brh s LEU 89 Cb -0.13 -1.70 -0.01 0.00 0.01 0.00 0.00 46.19 44.36 1brh s LEU 89 CO 0.03 0.06 -0.14 -0.72 1.01 0.00 0.00 176.35 176.58 1brh s TYR 90 N 0.99 1.29 0.55 0.29 1.13 0.02 -0.93 117.35 120.68 1brh s TYR 90 Ca -0.00 -0.24 0.04 0.00 -1.41 0.00 0.00 57.07 55.45 1brh s TYR 90 Cb -0.15 -0.83 0.05 0.00 -1.10 0.00 0.00 41.96 39.93 1brh s TYR 90 CO -0.00 -0.02 0.76 -1.54 -2.51 0.00 0.00 175.55 172.23 1brh s SER 91 N -0.33 5.20 0.52 -0.18 1.04 -0.60 -0.64 113.70 118.70 1brh s SER 91 Ca 0.05 -0.31 0.34 0.00 0.48 0.00 0.00 55.95 56.51 1brh s SER 91 Cb -0.06 -0.49 1.45 0.00 0.10 0.00 0.00 66.02 67.03 1brh s SER 91 CO -0.01 -1.19 1.99 0.77 0.98 0.00 0.00 173.24 175.79 1brh h SER 92 N 0.15 0.00 -0.51 7.02 4.64 -1.52 -1.27 113.55 122.06 1brh h SER 92 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1brh h SER 92 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1brh h SER 92 CO 0.46 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.52 1brh n ASP 93 N -2.96 4.86 -3.13 4.97 5.75 -1.26 -4.97 116.55 119.80 1brh n ASP 93 Ca 0.00 -2.75 -0.20 0.00 -0.01 0.00 0.00 54.79 51.84 1brh n ASP 93 Cb 0.26 -0.59 0.07 0.00 -1.03 0.00 0.00 41.12 39.82 1brh n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1brh n TRP 94 N 0.51 -2.40 -2.98 2.11 7.02 -0.48 -5.04 117.44 116.19 1brh n TRP 94 Ca 0.25 0.86 -0.36 0.00 -1.02 0.00 0.00 57.50 57.23 1brh n TRP 94 Cb 0.99 -4.48 -0.06 0.00 -2.42 0.00 0.00 31.31 25.34 1brh n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1brh s LEU 95 N -6.31 4.27 -0.08 -0.99 1.43 -1.26 -4.84 118.68 110.90 1brh s LEU 95 Ca 0.44 1.55 0.01 0.00 -1.03 0.00 0.00 54.13 55.10 1brh s LEU 95 Cb -0.19 -3.87 0.02 0.00 0.03 0.00 0.00 46.19 42.17 1brh s LEU 95 CO 0.62 -0.07 -0.11 -0.63 0.23 0.00 0.00 176.35 176.40 1brh s ILE 96 N -1.67 1.13 0.17 -0.59 -1.09 -0.73 -1.56 121.20 116.85 1brh s ILE 96 Ca 0.48 -0.43 0.09 0.00 -2.23 0.00 0.00 60.65 58.57 1brh s ILE 96 Cb -0.16 -1.06 -0.04 0.00 -1.58 0.00 0.00 42.46 39.62 1brh s ILE 96 CO 0.21 0.36 -0.20 -0.31 -1.23 0.00 0.00 174.94 173.77 1brh s TYR 97 N 1.03 1.95 0.11 3.97 1.51 -0.11 -1.19 117.35 124.61 1brh s TYR 97 Ca -0.08 -0.44 0.07 0.00 -1.01 0.00 0.00 57.07 55.62 1brh s TYR 97 Cb -0.15 -0.97 -0.03 0.00 -0.11 0.00 0.00 41.96 40.70 1brh s TYR 97 CO -0.01 0.38 -0.17 -1.59 -1.11 0.00 0.00 175.55 173.05 1brh s LYS 98 N -2.75 1.04 -0.01 -0.62 -2.85 0.94 -0.60 119.74 114.89 1brh s LYS 98 Ca 0.17 -1.16 0.01 0.00 -1.00 0.00 0.00 55.97 53.99 1brh s LYS 98 Cb -0.06 -1.13 0.01 0.00 -2.06 0.00 0.00 37.83 34.59 1brh s LYS 98 CO 0.07 0.25 -0.03 -0.08 0.10 0.00 0.00 175.35 175.66 1brh s THR 99 N -1.53 0.26 0.00 3.79 -1.32 -0.87 -1.31 115.64 114.66 1brh s THR 99 Ca 0.06 -0.10 0.00 0.00 -1.21 0.00 0.00 61.69 60.45 1brh s THR 99 Cb -0.08 -0.26 0.00 0.00 -1.51 0.00 0.00 72.50 70.65 1brh s THR 99 CO 0.04 0.10 0.85 0.35 -2.21 0.00 0.00 174.62 173.75 1brh n THR 100 N 3.29 0.71 -2.45 5.08 -2.24 -1.25 -1.19 114.28 116.23 1brh n THR 100 Ca -0.16 -0.83 -0.14 0.00 -2.27 0.00 0.00 64.05 60.65 1brh n THR 100 Cb 0.57 0.66 0.03 0.00 -2.10 0.00 0.00 70.33 69.48 1brh n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1brh n ASP 101 N -0.36 3.26 -3.53 3.42 5.68 -1.19 -4.60 116.55 119.23 1brh n ASP 101 Ca 0.00 -2.98 -0.19 0.00 -0.50 0.00 0.00 54.79 51.11 1brh n ASP 101 Cb 0.20 -0.43 0.06 0.00 -1.14 0.00 0.00 41.12 39.82 1brh n ASP 101 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1brh n HIS 102 N -0.57 -2.09 -1.72 2.11 8.25 -0.87 -2.92 115.22 117.41 1brh n HIS 102 Ca 0.26 0.85 -0.19 0.00 -0.26 0.00 0.00 57.72 58.38 1brh n HIS 102 Cb 0.85 -4.55 -0.07 0.00 1.12 0.00 0.00 29.99 27.35 1brh n HIS 102 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1brh n TYR 103 N -4.06 -0.19 -0.04 4.41 4.01 -1.26 -4.89 117.16 115.13 1brh n TYR 103 Ca -0.25 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.35 1brh n TYR 103 Cb 0.66 -3.30 -0.12 0.00 -0.31 0.00 0.00 39.34 36.27 1brh n TYR 103 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 1brh h GLN 104 N 0.00 0.02 -4.97 -0.72 4.20 -1.94 -3.47 115.11 108.24 1brh h GLN 104 Ca -0.40 -0.03 -0.32 0.00 0.06 0.00 0.00 58.65 57.96 1brh h GLN 104 Cb 1.25 0.01 -0.18 0.00 0.30 0.00 0.00 27.48 28.85 1brh h GLN 104 CO 0.56 0.80 -0.74 0.95 -0.67 0.00 0.00 178.83 179.73 1brh s THR 105 N -3.09 0.92 0.05 -0.54 -4.23 -1.26 -5.10 115.64 102.39 1brh s THR 105 Ca -0.17 -1.56 0.04 0.00 -1.18 0.00 0.00 61.69 58.81 1brh s THR 105 Cb -0.01 -1.27 -0.03 0.00 1.34 0.00 0.00 72.50 72.54 1brh s THR 105 CO 0.69 -0.51 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.79 1brh s PHE 106 N -2.23 0.94 0.02 3.99 0.08 -1.26 -4.37 117.98 115.15 1brh s PHE 106 Ca 0.03 -0.46 0.02 0.00 0.12 0.00 0.00 56.93 56.64 1brh s PHE 106 Cb -0.04 -0.55 -0.01 0.00 -0.57 0.00 0.00 43.02 41.85 1brh s PHE 106 CO 0.00 -0.01 -0.06 0.95 -0.10 0.00 0.00 175.22 176.01 1brh s THR 107 N -1.26 0.40 0.17 0.64 -4.23 -0.43 -4.94 115.64 105.99 1brh s THR 107 Ca -0.05 -0.64 -0.30 0.00 -1.18 0.00 0.00 61.69 59.52 1brh s THR 107 Cb -0.10 -0.42 -0.08 0.00 1.34 0.00 0.00 72.50 73.24 1brh s THR 107 CO 0.01 -0.17 1.24 -0.75 -0.54 0.00 0.00 174.62 174.42 1brh s LYS 108 N -0.86 4.45 0.00 3.99 2.20 -1.26 -0.04 119.74 128.21 1brh s LYS 108 Ca -0.05 1.93 0.00 0.00 -0.36 0.00 0.00 55.97 57.49 1brh s LYS 108 Cb -0.06 -3.24 0.00 0.00 -1.51 0.00 0.00 37.83 33.02 1brh s LYS 108 CO -0.00 -0.17 0.00 0.44 -0.36 0.00 0.00 175.35 175.26 1brh n ILE 109 N 2.77 0.00 -1.56 5.43 -5.35 -0.33 -4.89 119.36 115.43 1brh n ILE 109 Ca 0.06 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.51 1brh n ILE 109 Cb 0.44 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 38.79 1brh n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33