#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 4.86 0.00 0.00 1.01 -1.26 -4.86 121.20 120.95 1brh s ILE 4 Ca 0.00 0.69 0.09 0.00 0.00 0.00 0.00 60.65 61.43 1brh s ILE 4 Cb 0.00 -4.10 0.15 0.00 0.01 0.00 0.00 42.46 38.52 1brh s ILE 4 CO 0.00 -0.32 0.97 -0.46 0.00 0.00 0.00 174.94 175.13 1brh n ASN 5 N 6.11 0.09 -4.90 3.58 6.94 -1.26 -4.81 115.26 121.01 1brh n ASN 5 Ca -0.00 -1.83 -0.21 0.00 -0.02 0.00 0.00 54.58 52.51 1brh n ASN 5 Cb 0.48 -0.07 -0.03 0.00 -2.36 0.00 0.00 39.78 37.80 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 4.75 0.16 5.53 -4.23 -1.26 -0.43 115.64 120.16 1brh s THR 6 Ca 0.12 -1.19 -0.16 0.00 -1.18 0.00 0.00 61.69 59.28 1brh s THR 6 Cb 0.14 -3.60 0.07 0.00 1.34 0.00 0.00 72.50 70.44 1brh s THR 6 CO -0.06 -0.32 1.70 -0.26 -0.54 0.00 0.00 174.62 175.14 1brh h PHE 7 N 1.30 -0.05 -0.32 3.99 0.04 -1.99 -2.34 116.94 117.57 1brh h PHE 7 Ca -0.50 0.03 -0.14 0.00 2.80 0.00 0.00 57.97 60.17 1brh h PHE 7 Cb 1.24 0.08 -0.00 0.00 2.20 0.00 0.00 35.95 39.46 1brh h PHE 7 CO 0.50 -0.09 -0.33 -0.44 -0.60 0.00 0.00 178.31 177.35 1brh h ASP 8 N 0.09 0.84 -0.48 2.17 3.32 -1.98 -1.22 116.42 119.15 1brh h ASP 8 Ca 0.19 -0.48 -0.03 0.00 0.02 0.00 0.00 57.03 56.73 1brh h ASP 8 Cb 0.27 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1brh h ASP 8 CO -0.32 1.14 0.18 1.23 -1.72 0.00 0.00 179.24 179.75 1brh h GLY 9 N 0.55 0.78 1.22 2.75 0.00 -1.93 -2.01 103.07 104.43 1brh h GLY 9 Ca 0.05 -0.44 -0.21 0.00 0.00 0.00 0.00 47.33 46.73 1brh h GLY 9 CO 0.08 0.41 -0.74 -2.08 0.00 0.00 0.00 176.54 174.21 1brh h VAL 10 N 0.64 1.28 -0.71 4.60 2.07 -1.51 -0.99 116.25 121.64 1brh h VAL 10 Ca 0.16 -1.95 -0.03 0.00 0.82 0.00 0.00 66.70 65.70 1brh h VAL 10 Cb 0.21 1.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 1brh h VAL 10 CO -0.01 0.62 0.32 0.00 0.02 0.00 0.00 177.57 178.51 1brh h ALA 11 N 0.61 0.92 -0.13 1.67 0.00 -1.08 0.12 119.26 121.37 1brh h ALA 11 Ca -0.04 -0.16 -0.19 0.00 0.00 0.00 0.00 54.91 54.52 1brh h ALA 11 Cb 1.36 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1brh h ALA 11 CO 0.15 0.51 -0.69 -0.44 0.00 0.00 0.00 179.25 178.78 1brh h ASP 12 N 1.00 0.64 -0.17 0.00 3.32 -1.38 -2.77 116.42 117.07 1brh h ASP 12 Ca 0.24 -0.40 -0.02 0.00 0.02 0.00 0.00 57.03 56.87 1brh h ASP 12 Cb 0.16 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1brh h ASP 12 CO -0.03 1.15 0.03 0.22 -1.72 0.00 0.00 179.24 178.90 1brh h TYR 13 N 0.39 0.29 -0.77 4.55 5.03 -0.90 -2.61 116.97 122.95 1brh h TYR 13 Ca -0.02 -0.04 -0.05 0.00 2.58 0.00 0.00 58.73 61.20 1brh h TYR 13 Cb 1.27 -0.08 -0.03 0.00 1.55 0.00 0.00 36.73 39.44 1brh h TYR 13 CO 0.06 0.43 0.30 0.00 -1.32 0.00 0.00 178.16 177.62 1brh h ALA 14 N 0.83 1.00 0.00 1.82 0.00 -0.75 0.20 119.26 122.35 1brh h ALA 14 Ca 0.05 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1brh h ALA 14 Cb 0.29 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1brh h ALA 14 CO 0.00 0.64 -0.26 1.96 0.00 0.00 0.00 179.25 181.59 1brh h GLN 15 N 1.12 0.00 0.02 0.00 4.20 -1.47 0.37 115.11 119.35 1brh h GLN 15 Ca 0.25 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.60 1brh h GLN 15 Cb 0.23 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.96 1brh h GLN 15 CO -0.02 0.26 -2.01 2.41 -0.67 0.00 0.00 178.83 178.80 1brh n THR 16 N -3.66 1.56 1.05 -0.54 -1.04 -0.99 -4.57 114.28 106.10 1brh n THR 16 Ca -0.01 -0.33 0.11 0.00 -2.04 0.00 0.00 64.05 61.78 1brh n THR 16 Cb 0.38 -1.85 0.09 0.00 -1.82 0.00 0.00 70.33 67.14 1brh n THR 16 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1brh n TYR 17 N -4.06 0.00 -3.60 -1.42 4.01 0.69 -5.01 117.16 107.78 1brh n TYR 17 Ca -0.42 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.09 1brh n TYR 17 Cb 0.86 -0.08 0.08 0.00 -0.31 0.00 0.00 39.34 39.88 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 -0.95 -2.71 -3.61 -0.72 8.25 0.13 -4.97 115.22 110.64 1brh n HIS 18 Ca 0.07 0.99 -0.02 0.00 -0.26 0.00 0.00 57.72 58.51 1brh n HIS 18 Cb 0.37 -4.96 -0.01 0.00 1.12 0.00 0.00 29.99 26.50 1brh n HIS 18 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1brh s LYS 19 N -6.16 0.43 0.40 -0.41 3.01 -1.25 -5.07 119.74 110.69 1brh s LYS 19 Ca 0.48 -0.20 -0.10 0.00 -1.01 0.00 0.00 55.97 55.14 1brh s LYS 19 Cb -0.21 0.16 -0.06 0.00 -1.01 0.00 0.00 37.83 36.71 1brh s LYS 19 CO 0.74 -0.19 0.75 -0.51 0.51 0.00 0.00 175.35 176.65 1brh s LEU 20 N -2.62 3.84 1.04 3.17 1.43 -1.26 -4.11 118.68 120.17 1brh s LEU 20 Ca 0.12 1.08 -0.12 0.00 -1.03 0.00 0.00 54.13 54.17 1brh s LEU 20 Cb 0.02 -3.96 0.19 0.00 0.03 0.00 0.00 46.19 42.46 1brh s LEU 20 CO -0.04 -0.39 0.91 -0.81 0.23 0.00 0.00 176.35 176.25 1brh n PRO 21 N -1.33 -1.30 0.19 1.29 -0.04 -1.26 -4.89 135.00 127.66 1brh n PRO 21 Ca 0.02 -0.33 0.13 0.00 -0.04 0.00 0.00 63.50 63.28 1brh n PRO 21 Cb 0.54 -2.18 0.68 0.00 -0.04 0.00 0.00 33.50 32.50 1brh n PRO 21 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1brh h ASP 22 N -2.18 0.00 -0.05 3.54 3.32 -1.97 -3.11 116.42 115.97 1brh h ASP 22 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1brh h ASP 22 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1brh h ASP 22 CO 0.43 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.49 1brh n ASN 23 N -2.43 0.29 -4.78 6.45 6.94 -1.26 -4.84 115.26 115.63 1brh n ASN 23 Ca -0.01 -1.96 -0.34 0.00 -0.02 0.00 0.00 54.58 52.25 1brh n ASN 23 Cb 0.09 -0.04 -0.07 0.00 -2.36 0.00 0.00 39.78 37.40 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 -1.93 3.33 0.03 -2.53 2.02 -1.18 -0.99 117.35 116.10 1brh s TYR 24 Ca 0.05 0.27 0.01 0.00 -0.37 0.00 0.00 57.07 57.03 1brh s TYR 24 Cb 0.03 -1.79 -0.02 0.00 -0.40 0.00 0.00 41.96 39.77 1brh s TYR 24 CO 0.04 0.57 -0.04 0.96 -1.57 0.00 0.00 175.55 175.51 1brh s ILE 25 N -1.09 0.26 0.81 2.71 -4.36 -0.53 -4.88 121.20 114.12 1brh s ILE 25 Ca 0.19 -0.89 -0.12 0.00 -0.26 0.00 0.00 60.65 59.57 1brh s ILE 25 Cb -0.12 -0.36 0.08 0.00 1.25 0.00 0.00 42.46 43.31 1brh s ILE 25 CO 0.09 -0.41 1.13 0.42 0.24 0.00 0.00 174.94 176.41 1brh s THR 26 N -1.31 2.60 0.30 8.37 -4.23 -1.19 -0.76 115.64 119.43 1brh s THR 26 Ca -0.13 0.20 0.01 0.00 -1.18 0.00 0.00 61.69 60.59 1brh s THR 26 Cb -0.09 -3.06 0.28 0.00 1.34 0.00 0.00 72.50 70.97 1brh s THR 26 CO -0.00 -0.26 1.91 0.11 -0.54 0.00 0.00 174.62 175.84 1brh h LYS 27 N -1.10 0.98 -0.54 3.99 1.57 -1.96 -1.10 116.57 118.41 1brh h LYS 27 Ca -0.47 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.19 1brh h LYS 27 Cb 1.30 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 1brh h LYS 27 CO 0.63 0.65 0.12 0.77 -0.57 0.00 0.00 179.45 181.04 1brh h SER 28 N 1.01 0.83 -0.37 0.86 0.02 -1.99 0.69 113.55 114.59 1brh h SER 28 Ca 0.40 -0.24 -0.11 0.00 -0.84 0.00 0.00 61.79 61.00 1brh h SER 28 Cb 0.24 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 1brh h SER 28 CO -0.16 0.85 -0.16 -0.33 -1.14 0.00 0.00 176.83 175.90 1brh h GLU 29 N 0.76 0.84 -0.32 3.45 5.08 -1.82 -2.03 114.58 120.54 1brh h GLU 29 Ca 0.17 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 1brh h GLU 29 Cb 0.36 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1brh h GLU 29 CO 0.00 0.94 0.10 0.00 -1.00 0.00 0.00 179.01 179.06 1brh h ALA 30 N 1.07 0.42 -1.00 3.43 0.00 -0.83 -2.88 119.26 119.46 1brh h ALA 30 Ca 0.11 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1brh h ALA 30 Cb 0.67 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1brh h ALA 30 CO 0.05 0.06 0.66 1.96 0.00 0.00 0.00 179.25 181.98 1brh h GLN 31 N 0.36 1.23 0.00 0.00 4.20 -0.66 -1.58 115.11 118.66 1brh h GLN 31 Ca 0.10 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1brh h GLN 31 Cb 0.25 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 27.75 1brh h GLN 31 CO -0.00 0.81 0.00 0.00 -0.67 0.00 0.00 178.83 178.97 1brh n ALA 32 N -2.37 1.53 1.08 3.87 0.00 -0.78 -1.79 120.51 122.05 1brh n ALA 32 Ca 0.14 0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.79 1brh n ALA 32 Cb 0.10 -1.35 0.13 0.00 0.00 0.00 0.00 19.45 18.33 1brh n ALA 32 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1brh n LEU 33 N -2.16 1.45 0.00 0.00 4.77 -0.63 -4.96 117.00 115.47 1brh n LEU 33 Ca 0.01 -0.50 0.00 0.00 -0.03 0.00 0.00 56.01 55.49 1brh n LEU 33 Cb 0.18 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1brh n LEU 33 CO 0.17 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1brh n GLY 34 N 1.41 1.17 3.71 -0.72 0.00 -0.74 -4.94 105.19 105.07 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 3.37 -0.34 1.61 -0.00 -0.99 -4.96 118.94 115.63 1brh s TRP 35 Ca 0.00 1.24 0.00 0.00 -0.00 0.00 0.00 56.10 57.35 1brh s TRP 35 Cb 0.00 -3.45 0.09 0.00 -0.00 0.00 0.00 33.47 30.11 1brh s TRP 35 CO 0.00 -1.41 0.07 0.08 -0.00 0.00 0.00 176.95 175.69 1brh s VAL 36 N 1.25 2.77 0.36 5.86 1.01 -1.26 -4.52 120.40 125.88 1brh s VAL 36 Ca 0.59 -1.94 0.09 0.00 0.00 0.00 0.00 61.98 60.72 1brh s VAL 36 Cb -0.30 -2.84 0.32 0.00 0.00 0.00 0.00 36.38 33.56 1brh s VAL 36 CO 0.28 -0.45 1.89 0.00 0.00 0.00 0.00 175.10 176.83 1brh h ALA 37 N 7.87 1.84 0.00 5.51 0.00 -1.99 -0.62 119.26 131.86 1brh h ALA 37 Ca -0.13 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1brh h ALA 37 Cb 1.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1brh h ALA 37 CO 0.58 -0.05 0.00 0.43 0.00 0.00 0.00 179.25 180.21 1brh n SER 38 N -4.53 0.00 -0.13 0.00 7.64 -1.26 -2.17 113.62 113.17 1brh n SER 38 Ca 0.16 0.48 0.07 0.00 1.01 0.00 0.00 58.87 60.58 1brh n SER 38 Cb 0.42 -0.49 -0.05 0.00 -1.01 0.00 0.00 64.21 63.09 1brh n SER 38 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1brh n LYS 39 N -1.49 2.19 -3.61 1.43 5.02 -0.25 -5.00 118.16 116.46 1brh n LYS 39 Ca 0.03 -0.30 -0.23 0.00 -2.02 0.00 0.00 58.31 55.79 1brh n LYS 39 Cb 0.12 -1.18 0.07 0.00 -0.02 0.00 0.00 35.03 34.02 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 1.23 -0.50 1.20 0.72 0.00 -0.92 -4.87 105.19 102.05 1brh n GLY 40 Ca 0.04 0.22 0.05 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.02 4.12 -0.11 1.61 6.94 -1.26 -3.71 115.26 119.84 1brh n ASN 41 Ca -0.05 -3.12 -0.05 0.00 -0.02 0.00 0.00 54.58 51.34 1brh n ASN 41 Cb 0.58 -0.60 0.01 0.00 -2.36 0.00 0.00 39.78 37.41 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 2.13 -0.44 -2.19 -4.53 5.85 -1.88 -1.11 115.31 113.14 1brh h LEU 42 Ca 0.06 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 1brh h LEU 42 Cb 1.66 0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.96 1brh h LEU 42 CO 0.35 -0.16 -0.05 0.00 -0.34 0.00 0.00 178.44 178.24 1brh h ALA 43 N 1.30 1.57 -0.01 1.25 0.00 -1.84 0.43 119.26 121.95 1brh h ALA 43 Ca 0.18 -0.04 -0.26 0.00 0.00 0.00 0.00 54.91 54.79 1brh h ALA 43 Cb 0.32 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.12 1brh h ALA 43 CO -0.41 0.06 -1.02 -0.44 0.00 0.00 0.00 179.25 177.44 1brh h ASP 44 N 0.00 0.86 0.51 0.00 3.32 -1.57 -3.11 116.42 116.43 1brh h ASP 44 Ca -0.00 -0.68 -0.29 0.00 0.02 0.00 0.00 57.03 56.07 1brh h ASP 44 Cb 0.11 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1brh h ASP 44 CO 0.01 1.48 -1.53 -0.37 -1.72 0.00 0.00 179.24 177.11 1brh h VAL 45 N 0.38 1.12 -2.41 -1.35 -1.51 -0.77 -3.41 116.25 108.31 1brh h VAL 45 Ca -0.12 -2.82 -0.59 0.00 -1.23 0.00 0.00 66.70 61.94 1brh h VAL 45 Cb 1.66 2.68 -0.39 0.00 -2.13 0.00 0.00 31.29 33.11 1brh h VAL 45 CO 0.20 0.77 -0.91 0.00 -1.23 0.00 0.00 177.57 176.40 1brh n ALA 46 N -2.63 2.96 -1.63 5.19 0.00 0.08 -5.03 120.51 119.46 1brh n ALA 46 Ca -0.15 -3.52 -0.49 0.00 0.00 0.00 0.00 53.44 49.27 1brh n ALA 46 Cb 1.03 -0.82 -0.05 0.00 0.00 0.00 0.00 19.45 19.61 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 2.27 1.61 -0.36 0.00 -0.02 -1.17 -1.73 135.00 135.61 1brh n PRO 47 Ca 0.26 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1brh n PRO 47 Cb 0.46 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 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 2.84 1.56 3.93 -1.23 0.00 -1.26 -5.03 105.19 106.00 1brh n GLY 48 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.26 3.51 0.08 1.61 -0.14 -0.70 -4.85 119.74 118.99 1brh s LYS 49 Ca 0.00 -0.32 0.04 0.00 -1.36 0.00 0.00 55.97 54.33 1brh s LYS 49 Cb 0.00 -2.73 -0.03 0.00 -1.68 0.00 0.00 37.83 33.39 1brh s LYS 49 CO 0.00 0.26 -0.12 -1.12 -0.76 0.00 0.00 175.35 173.61 1brh s SER 50 N -3.64 1.50 0.03 2.83 0.01 -0.16 -4.79 113.70 109.48 1brh s SER 50 Ca 0.40 -0.66 -0.30 0.00 1.31 0.00 0.00 55.95 56.69 1brh s SER 50 Cb -0.10 -0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 1brh s SER 50 CO 0.32 -0.15 1.09 -0.63 0.41 0.00 0.00 173.24 174.29 1brh s ILE 51 N -1.62 4.45 -0.19 1.44 -1.09 -1.26 -1.45 121.20 121.47 1brh s ILE 51 Ca -0.01 1.76 -0.30 0.00 -2.23 0.00 0.00 60.65 59.87 1brh s ILE 51 Cb -0.08 -4.13 0.15 0.00 -1.58 0.00 0.00 42.46 36.82 1brh s ILE 51 CO 0.01 0.14 1.13 -0.83 -1.23 0.00 0.00 174.94 174.16 1brh s GLY 52 N 1.02 -0.17 0.00 6.18 0.00 0.06 -0.92 107.32 113.49 1brh s GLY 52 Ca 0.55 2.18 0.00 0.00 0.00 0.00 0.00 44.72 47.45 1brh s GLY 52 CO 0.29 0.96 0.00 0.61 0.00 0.00 0.00 173.10 174.96 1brh n GLY 53 N 0.52 0.66 3.84 0.20 0.00 0.61 -3.14 105.19 107.88 1brh n GLY 53 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.37 6.57 0.35 1.61 1.01 -1.23 -4.79 116.67 117.83 1brh s ASP 54 Ca 0.00 1.60 -0.28 0.00 0.71 0.00 0.00 52.55 54.59 1brh s ASP 54 Cb 0.00 -2.51 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 1brh s ASP 54 CO 0.00 -0.63 1.24 -0.63 0.21 0.00 0.00 175.17 175.36 1brh s ILE 55 N -2.58 2.93 -0.21 0.77 1.01 -1.26 -1.59 121.20 120.26 1brh s ILE 55 Ca 0.60 0.88 -0.07 0.00 0.00 0.00 0.00 60.65 62.05 1brh s ILE 55 Cb -0.10 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 1brh s ILE 55 CO 0.31 0.17 0.07 0.12 0.00 0.00 0.00 174.94 175.60 1brh s PHE 56 N -1.23 3.17 0.25 3.97 5.36 0.47 -4.82 117.98 125.15 1brh s PHE 56 Ca 0.51 -0.14 0.02 0.00 -0.96 0.00 0.00 56.93 56.36 1brh s PHE 56 Cb -0.36 -2.16 0.31 0.00 -0.34 0.00 0.00 43.02 40.47 1brh s PHE 56 CO 0.47 -0.08 1.64 0.66 -1.46 0.00 0.00 175.22 176.44 1brh h SER 57 N 7.43 0.47 -3.73 6.13 4.64 -1.96 -3.39 113.55 123.15 1brh h SER 57 Ca -0.37 -0.20 -0.33 0.00 -0.47 0.00 0.00 61.79 60.42 1brh h SER 57 Cb 1.17 -0.13 0.05 0.00 -0.31 0.00 0.00 62.40 63.18 1brh h SER 57 CO 0.63 0.82 -0.50 -3.20 -0.87 0.00 0.00 176.83 173.72 1brh n ASN 58 N -4.03 -5.31 -0.19 4.97 5.15 -1.26 -4.91 115.26 109.67 1brh n ASN 58 Ca -0.02 -0.23 -0.07 0.00 -0.60 0.00 0.00 54.58 53.67 1brh n ASN 58 Cb 0.50 -4.16 0.03 0.00 -0.53 0.00 0.00 39.78 35.62 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 -1.14 0.75 0.00 1.20 9.65 -2.00 -2.04 114.38 120.80 1brh h ARG 59 Ca -0.44 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 1brh h ARG 59 Cb 1.30 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.72 1brh h ARG 59 CO 0.47 0.51 0.00 0.39 2.80 0.00 0.00 179.97 184.14 1brh n GLU 60 N -4.68 0.63 -4.23 0.20 1.02 -1.26 -4.89 120.64 107.43 1brh n GLU 60 Ca 0.04 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.81 1brh n GLU 60 Cb 0.03 -1.13 -0.06 0.00 -0.02 0.00 0.00 31.44 30.26 1brh n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1brh n GLY 61 N 0.16 -0.42 0.14 0.62 0.00 -0.77 -4.85 105.19 100.08 1brh n GLY 61 Ca 0.04 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.26 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 -0.89 0.00 -6.31 1.61 1.57 -1.90 -3.44 116.57 107.20 1brh h LYS 62 Ca -0.53 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 57.60 1brh h LYS 62 Cb 1.34 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.54 1brh h LYS 62 CO 0.77 0.00 -0.65 -0.51 -0.57 0.00 0.00 179.45 178.49 1brh s LEU 63 N -5.09 3.52 0.12 2.94 1.43 -1.26 -4.96 118.68 115.38 1brh s LEU 63 Ca 0.09 -0.14 -0.31 0.00 -1.03 0.00 0.00 54.13 52.74 1brh s LEU 63 Cb 0.10 -2.24 -0.09 0.00 0.03 0.00 0.00 46.19 43.99 1brh s LEU 63 CO 0.62 0.18 1.52 -2.16 0.23 0.00 0.00 176.35 176.73 1brh s PRO 64 N -2.30 4.25 0.65 1.29 0.04 -1.26 -5.03 135.00 132.64 1brh s PRO 64 Ca 0.26 2.24 -0.04 0.00 0.04 0.00 0.00 61.00 63.50 1brh s PRO 64 Cb -0.12 -3.29 0.05 0.00 0.04 0.00 0.00 34.50 31.19 1brh s PRO 64 CO 0.19 -0.57 0.93 0.20 0.04 0.00 0.00 177.00 177.79 1brh s GLY 65 N 1.40 1.74 0.00 0.56 0.00 -1.26 -5.09 107.32 104.67 1brh s GLY 65 Ca 0.69 -1.08 0.00 0.00 0.00 0.00 0.00 44.72 44.32 1brh s GLY 65 CO 0.31 -0.71 0.00 1.17 0.00 0.00 0.00 173.10 173.87 1brh n LYS 66 N -2.73 0.00 -1.17 2.90 4.81 -1.26 -5.06 118.16 115.65 1brh n LYS 66 Ca 0.08 0.00 -0.45 0.00 -0.87 0.00 0.00 58.31 57.07 1brh n LYS 66 Cb 0.60 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.60 1brh n LYS 66 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1brh n SER 67 N 0.00 -0.23 -0.22 3.14 2.88 -1.26 0.30 113.62 118.23 1brh n SER 67 Ca 0.00 0.92 -0.03 0.00 -1.33 0.00 0.00 58.87 58.43 1brh n SER 67 Cb 0.00 -0.74 -0.01 0.00 -0.75 0.00 0.00 64.21 62.71 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 1.28 0.56 3.64 0.46 0.00 -1.26 -5.01 105.19 104.87 1brh n GLY 68 Ca 0.16 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.45 4.00 0.14 1.61 3.52 0.15 -4.91 118.95 122.01 1brh s ARG 69 Ca 0.00 -0.32 0.07 0.00 -0.13 0.00 0.00 55.73 55.35 1brh s ARG 69 Cb 0.00 -3.28 -0.04 0.00 -1.56 0.00 0.00 34.95 30.06 1brh s ARG 69 CO 0.00 0.23 -0.06 0.99 -0.81 0.00 0.00 175.30 175.65 1brh s THR 70 N 0.50 3.49 -0.02 4.11 2.01 -1.26 -4.81 115.64 119.66 1brh s THR 70 Ca 0.04 -1.38 0.08 0.00 0.31 0.00 0.00 61.69 60.75 1brh s THR 70 Cb -0.12 -2.69 -0.02 0.00 0.01 0.00 0.00 72.50 69.67 1brh s THR 70 CO 0.00 -0.00 -0.25 0.26 -0.69 0.00 0.00 174.62 173.94 1brh s TRP 71 N -1.48 2.26 0.16 4.92 0.52 -1.26 -0.85 118.94 123.21 1brh s TRP 71 Ca 0.24 -0.43 0.05 0.00 0.02 0.00 0.00 56.10 55.98 1brh s TRP 71 Cb -0.10 -1.45 -0.05 0.00 -1.15 0.00 0.00 33.47 30.72 1brh s TRP 71 CO 0.16 -0.03 -0.10 1.03 0.02 0.00 0.00 176.95 178.03 1brh s ARG 72 N -0.61 1.10 0.16 4.98 0.52 0.98 -0.40 118.95 125.68 1brh s ARG 72 Ca 0.10 -1.48 0.06 0.00 -0.52 0.00 0.00 55.73 53.89 1brh s ARG 72 Cb -0.10 -0.65 -0.04 0.00 0.52 0.00 0.00 34.95 34.68 1brh s ARG 72 CO -0.01 0.07 -0.13 -1.83 0.02 0.00 0.00 175.30 173.42 1brh s GLU 73 N -3.75 1.13 -0.08 3.54 -1.05 -0.62 -0.75 118.70 117.12 1brh s GLU 73 Ca 0.18 -1.43 -0.10 0.00 -0.15 0.00 0.00 54.97 53.47 1brh s GLU 73 Cb 0.03 -0.86 0.02 0.00 -0.44 0.00 0.00 34.13 32.88 1brh s GLU 73 CO 0.02 0.14 0.27 0.00 0.95 0.00 0.00 175.26 176.63 1brh s ALA 74 N -2.88 -0.66 0.27 -0.84 0.00 -0.49 -0.28 121.76 116.88 1brh s ALA 74 Ca 0.16 0.65 -0.29 0.00 0.00 0.00 0.00 51.96 52.48 1brh s ALA 74 Cb -0.01 -0.35 -0.09 0.00 0.00 0.00 0.00 23.12 22.67 1brh s ALA 74 CO 0.03 -0.15 1.01 -0.51 0.00 0.00 0.00 175.76 176.14 1brh s ASP 75 N -0.13 7.45 0.06 0.00 1.11 -0.10 -1.10 116.67 123.96 1brh s ASP 75 Ca -0.03 2.08 0.09 0.00 0.18 0.00 0.00 52.55 54.87 1brh s ASP 75 Cb -0.03 -2.61 -0.03 0.00 1.07 0.00 0.00 42.92 41.32 1brh s ASP 75 CO 0.01 0.00 -0.26 -0.63 1.18 0.00 0.00 175.17 175.47 1brh s ILE 76 N -1.22 2.12 -1.50 0.77 -1.09 -0.59 -4.75 121.20 114.95 1brh s ILE 76 Ca 0.44 -1.44 0.00 0.00 -2.23 0.00 0.00 60.65 57.42 1brh s ILE 76 Cb -0.28 -1.83 0.00 0.00 -1.58 0.00 0.00 42.46 38.77 1brh s ILE 76 CO 0.35 0.31 0.00 0.59 -1.23 0.00 0.00 174.94 174.96 1brh n ASN 77 N 1.63 -4.73 -4.74 3.58 3.02 0.43 -4.57 115.26 109.87 1brh n ASN 77 Ca -0.17 0.24 -0.40 0.00 -0.03 0.00 0.00 54.58 54.23 1brh n ASN 77 Cb 0.52 -3.66 -0.05 0.00 -0.61 0.00 0.00 39.78 35.98 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 -2.62 3.69 0.09 3.10 5.04 -1.26 -4.95 117.35 120.42 1brh s TYR 78 Ca 0.00 1.36 0.00 0.00 -2.44 0.00 0.00 57.07 55.99 1brh s TYR 78 Cb 0.00 -2.77 0.00 0.00 0.35 0.00 0.00 41.96 39.54 1brh s TYR 78 CO 0.00 0.25 0.00 0.25 -1.34 0.00 0.00 175.55 174.71 1brh n THR 79 N 3.01 0.61 -3.85 4.34 -2.24 -1.26 -4.95 114.28 109.94 1brh n THR 79 Ca -0.03 0.20 -0.08 0.00 -2.27 0.00 0.00 64.05 61.87 1brh n THR 79 Cb 0.51 -1.35 -0.03 0.00 -2.10 0.00 0.00 70.33 67.36 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 -5.49 -0.23 0.00 3.42 1.04 -1.26 -4.75 113.70 106.43 1brh s SER 80 Ca 0.00 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.80 1brh s SER 80 Cb 0.00 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.77 1brh s SER 80 CO 0.00 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.63 1brh n GLY 81 N -0.41 -0.76 3.75 7.32 0.00 -1.24 -4.88 105.19 108.97 1brh n GLY 81 Ca -0.05 -1.24 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 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 2.40 0.44 1.61 0.08 -1.26 -4.46 117.98 116.78 1brh s PHE 82 Ca 0.00 1.54 -0.25 0.00 0.12 0.00 0.00 56.93 58.34 1brh s PHE 82 Cb 0.00 -3.41 -0.08 0.00 -0.57 0.00 0.00 43.02 38.96 1brh s PHE 82 CO 0.00 -2.13 1.32 1.03 -0.10 0.00 0.00 175.22 175.34 1brh s ARG 83 N -3.55 3.78 0.00 0.44 0.52 -1.26 -5.00 118.95 113.88 1brh s ARG 83 Ca 0.75 2.17 0.00 0.00 -0.52 0.00 0.00 55.73 58.13 1brh s ARG 83 Cb -0.28 -2.63 0.00 0.00 0.52 0.00 0.00 34.95 32.56 1brh s ARG 83 CO 0.36 -0.65 0.00 0.27 0.02 0.00 0.00 175.30 175.30 1brh n ASN 84 N -0.15 0.00 -1.01 0.23 0.23 -1.26 -5.01 115.26 108.29 1brh n ASN 84 Ca 0.05 -0.38 0.08 0.00 -0.53 0.00 0.00 54.58 53.80 1brh n ASN 84 Cb 0.44 0.00 0.26 0.00 -2.08 0.00 0.00 39.78 38.40 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 -1.13 3.93 -4.63 0.53 3.41 -1.26 -4.93 113.62 109.53 1brh n SER 85 Ca 0.00 -2.68 -0.35 0.00 -0.26 0.00 0.00 58.87 55.58 1brh n SER 85 Cb 0.00 -0.48 -0.10 0.00 -0.26 0.00 0.00 64.21 63.37 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 -1.46 5.80 0.03 4.04 1.01 -1.26 -1.89 116.67 122.95 1brh s ASP 86 Ca 0.40 0.08 -0.02 0.00 0.71 0.00 0.00 52.55 53.72 1brh s ASP 86 Cb 0.29 -2.02 -0.02 0.00 1.01 0.00 0.00 42.92 42.18 1brh s ASP 86 CO 0.13 0.12 -0.00 -0.13 0.21 0.00 0.00 175.17 175.50 1brh s ARG 87 N 0.72 0.47 -0.12 8.23 1.81 -0.09 -1.54 118.95 128.43 1brh s ARG 87 Ca 0.05 -0.83 -0.02 0.00 -1.72 0.00 0.00 55.73 53.21 1brh s ARG 87 Cb -0.13 0.17 -0.03 0.00 -0.45 0.00 0.00 34.95 34.51 1brh s ARG 87 CO 0.02 -0.09 -0.05 -1.50 -0.68 0.00 0.00 175.30 173.00 1brh s ILE 88 N -2.50 3.86 -0.20 1.52 2.07 -0.26 -0.89 121.20 124.79 1brh s ILE 88 Ca -0.06 -0.39 -0.02 0.00 -1.41 0.00 0.00 60.65 58.76 1brh s ILE 88 Cb -0.02 -2.65 -0.00 0.00 0.13 0.00 0.00 42.46 39.92 1brh s ILE 88 CO -0.05 0.54 -0.09 -0.76 -1.91 0.00 0.00 174.94 172.67 1brh s LEU 89 N -0.12 2.68 0.00 8.50 2.01 -0.20 -1.39 118.68 130.16 1brh s LEU 89 Ca 0.02 -0.45 0.04 0.00 0.01 0.00 0.00 54.13 53.75 1brh s LEU 89 Cb -0.13 -1.66 -0.01 0.00 0.01 0.00 0.00 46.19 44.40 1brh s LEU 89 CO 0.03 0.01 -0.13 -0.72 1.01 0.00 0.00 176.35 176.55 1brh s TYR 90 N 1.30 1.12 0.36 0.29 -0.85 0.07 -0.75 117.35 118.89 1brh s TYR 90 Ca 0.04 -0.24 0.07 0.00 -0.52 0.00 0.00 57.07 56.42 1brh s TYR 90 Cb -0.14 -0.71 -0.01 0.00 0.38 0.00 0.00 41.96 41.48 1brh s TYR 90 CO -0.05 -0.01 0.44 -1.54 -1.52 0.00 0.00 175.55 172.87 1brh s SER 91 N -0.48 5.63 0.57 -0.18 1.04 -1.06 -0.01 113.70 119.21 1brh s SER 91 Ca 0.04 -0.38 0.26 0.00 0.48 0.00 0.00 55.95 56.35 1brh s SER 91 Cb -0.05 -0.97 1.58 0.00 0.10 0.00 0.00 66.02 66.68 1brh s SER 91 CO -0.00 -0.51 2.11 0.77 0.98 0.00 0.00 173.24 176.59 1brh h SER 92 N 0.94 0.00 -0.68 7.02 4.64 -1.34 0.37 113.55 124.50 1brh h SER 92 Ca -0.44 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.70 1brh h SER 92 Cb 1.26 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.24 1brh h SER 92 CO 0.53 0.00 0.22 -0.90 -0.87 0.00 0.00 176.83 175.80 1brh n ASP 93 N -4.00 4.75 -3.73 4.97 5.75 -1.26 -4.96 116.55 118.07 1brh n ASP 93 Ca 0.02 -3.22 -0.26 0.00 -0.01 0.00 0.00 54.79 51.32 1brh n ASP 93 Cb 0.30 -0.72 0.06 0.00 -1.03 0.00 0.00 41.12 39.73 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 -0.17 -2.64 -2.84 2.11 7.02 0.13 -5.03 117.44 116.03 1brh n TRP 94 Ca 0.38 0.97 -0.36 0.00 -1.02 0.00 0.00 57.50 57.47 1brh n TRP 94 Cb 1.33 -4.61 -0.06 0.00 -2.42 0.00 0.00 31.31 25.54 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 -7.28 4.28 -0.12 -0.99 1.43 -1.26 -4.85 118.68 109.90 1brh s LEU 95 Ca 0.60 1.75 0.00 0.00 -1.03 0.00 0.00 54.13 55.45 1brh s LEU 95 Cb -0.28 -4.03 0.02 0.00 0.03 0.00 0.00 46.19 41.93 1brh s LEU 95 CO 0.77 -0.10 -0.10 -0.63 0.23 0.00 0.00 176.35 176.52 1brh s ILE 96 N -1.69 1.22 0.28 -0.59 -1.09 -1.26 -2.55 121.20 115.53 1brh s ILE 96 Ca 0.51 -0.43 0.10 0.00 -2.23 0.00 0.00 60.65 58.60 1brh s ILE 96 Cb -0.17 -1.19 -0.05 0.00 -1.58 0.00 0.00 42.46 39.47 1brh s ILE 96 CO 0.22 0.40 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.86 1brh s TYR 97 N 1.48 2.18 0.15 3.97 1.51 0.07 -0.80 117.35 125.91 1brh s TYR 97 Ca 0.02 -0.45 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 1brh s TYR 97 Cb -0.13 -1.06 -0.04 0.00 -0.11 0.00 0.00 41.96 40.62 1brh s TYR 97 CO -0.07 0.58 -0.11 -1.59 -1.11 0.00 0.00 175.55 173.25 1brh s LYS 98 N -3.58 1.07 -0.01 -0.62 -2.85 0.69 -1.04 119.74 113.41 1brh s LYS 98 Ca 0.29 -1.44 -0.01 0.00 -1.00 0.00 0.00 55.97 53.81 1brh s LYS 98 Cb -0.02 -0.68 0.00 0.00 -2.06 0.00 0.00 37.83 35.08 1brh s LYS 98 CO 0.14 0.09 0.03 -0.08 0.10 0.00 0.00 175.35 175.62 1brh s THR 99 N -3.21 0.02 -0.04 3.79 -1.32 -0.07 -1.57 115.64 113.24 1brh s THR 99 Ca 0.16 -0.14 0.06 0.00 -1.21 0.00 0.00 61.69 60.56 1brh s THR 99 Cb 0.02 -0.09 0.08 0.00 -1.51 0.00 0.00 72.50 71.00 1brh s THR 99 CO 0.01 -0.07 0.98 0.35 -2.21 0.00 0.00 174.62 173.68 1brh n THR 100 N 2.83 1.06 -2.50 5.08 -2.24 -1.26 -0.91 114.28 116.34 1brh n THR 100 Ca -0.14 -1.17 -0.08 0.00 -2.27 0.00 0.00 64.05 60.40 1brh n THR 100 Cb 0.59 0.35 0.04 0.00 -2.10 0.00 0.00 70.33 69.21 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 -0.67 2.69 -3.33 3.42 5.68 -1.12 -4.55 116.55 118.66 1brh n ASP 101 Ca 0.05 -2.67 -0.17 0.00 -0.50 0.00 0.00 54.79 51.50 1brh n ASP 101 Cb 0.43 -0.42 0.08 0.00 -1.14 0.00 0.00 41.12 40.07 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 -0.59 -2.17 -1.16 2.11 8.25 -0.79 -2.67 115.22 118.19 1brh n HIS 102 Ca 0.20 0.90 -0.05 0.00 -0.26 0.00 0.00 57.72 58.51 1brh n HIS 102 Cb 0.87 -4.93 -0.02 0.00 1.12 0.00 0.00 29.99 27.03 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 -4.10 0.00 0.04 4.41 4.01 -1.26 -4.87 117.16 115.38 1brh n TYR 103 Ca -0.24 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.31 1brh n TYR 103 Cb 0.65 -1.74 -0.12 0.00 -0.31 0.00 0.00 39.34 37.82 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 0.21 0.47 -4.73 -0.72 4.20 -1.92 -3.46 115.11 109.16 1brh h GLN 104 Ca -0.11 -0.58 -0.27 0.00 0.06 0.00 0.00 58.65 57.75 1brh h GLN 104 Cb 0.73 0.18 -0.18 0.00 0.30 0.00 0.00 27.48 28.52 1brh h GLN 104 CO 0.16 1.22 -0.72 0.95 -0.67 0.00 0.00 178.83 179.77 1brh s THR 105 N -3.02 0.73 -0.01 -0.54 -4.23 -1.26 -5.11 115.64 102.21 1brh s THR 105 Ca -0.12 -1.59 0.04 0.00 -1.18 0.00 0.00 61.69 58.83 1brh s THR 105 Cb 0.04 -1.27 -0.01 0.00 1.34 0.00 0.00 72.50 72.60 1brh s THR 105 CO 0.86 -0.63 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.82 1brh s PHE 106 N -2.60 1.14 -0.09 3.99 0.08 -1.26 -4.38 117.98 114.87 1brh s PHE 106 Ca 0.03 -0.22 0.04 0.00 0.12 0.00 0.00 56.93 56.90 1brh s PHE 106 Cb -0.02 -0.73 0.00 0.00 -0.57 0.00 0.00 43.02 41.70 1brh s PHE 106 CO -0.02 -0.02 -0.22 0.99 -0.10 0.00 0.00 175.22 175.86 1brh s THR 107 N -0.33 1.87 0.02 0.64 2.01 -0.61 -4.95 115.64 114.29 1brh s THR 107 Ca 0.05 -0.91 -0.30 0.00 0.31 0.00 0.00 61.69 60.83 1brh s THR 107 Cb -0.05 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.79 1brh s THR 107 CO -0.00 0.52 1.14 -0.75 -0.69 0.00 0.00 174.62 174.83 1brh s LYS 108 N 0.38 4.45 0.00 4.92 2.20 -1.26 -0.22 119.74 130.20 1brh s LYS 108 Ca -0.17 1.65 0.00 0.00 -0.36 0.00 0.00 55.97 57.09 1brh s LYS 108 Cb -0.17 -3.42 0.00 0.00 -1.51 0.00 0.00 37.83 32.73 1brh s LYS 108 CO 0.08 -0.24 0.47 0.44 -0.36 0.00 0.00 175.35 175.74 1brh n ILE 109 N 4.07 0.13 -1.12 5.43 -5.35 0.02 -4.94 119.36 117.62 1brh n ILE 109 Ca 0.09 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1brh n ILE 109 Cb 0.48 1.12 0.00 0.00 -1.74 0.00 0.00 39.64 39.49 1brh n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33