#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bsc n ASN 5 N 0.00 0.04 -4.87 4.38 6.94 -1.26 -4.81 115.26 115.68 1bsc n ASN 5 Ca 0.00 -1.81 -0.23 0.00 -0.02 0.00 0.00 54.58 52.52 1bsc n ASN 5 Cb 0.00 -0.16 -0.04 0.00 -2.36 0.00 0.00 39.78 37.22 1bsc n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1bsc s THR 6 N 0.00 4.80 0.20 5.53 -4.23 -1.26 -1.19 115.64 119.48 1bsc s THR 6 Ca 0.02 -1.11 -0.18 0.00 -1.18 0.00 0.00 61.69 59.23 1bsc s THR 6 Cb 0.02 -3.55 0.16 0.00 1.34 0.00 0.00 72.50 70.47 1bsc s THR 6 CO -0.01 -0.25 1.60 -0.26 -0.54 0.00 0.00 174.62 175.16 1bsc h PHE 7 N 1.72 -0.73 -0.22 3.99 0.04 -1.98 0.20 116.94 119.95 1bsc h PHE 7 Ca -0.49 0.07 -0.14 0.00 2.80 0.00 0.00 57.97 60.20 1bsc h PHE 7 Cb 1.22 0.41 0.00 0.00 2.20 0.00 0.00 35.95 39.78 1bsc h PHE 7 CO 0.53 -0.35 -0.42 -0.44 -0.60 0.00 0.00 178.31 177.02 1bsc h ASP 8 N -0.12 0.76 0.46 2.17 3.32 -1.98 -0.79 116.42 120.24 1bsc h ASP 8 Ca 0.26 -0.54 -0.02 0.00 0.02 0.00 0.00 57.03 56.75 1bsc h ASP 8 Cb 0.53 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1bsc h ASP 8 CO -0.67 1.16 -0.23 1.23 -1.72 0.00 0.00 179.24 179.01 1bsc h GLY 9 N 0.39 -0.66 1.01 2.75 0.00 -1.75 -1.98 103.07 102.83 1bsc h GLY 9 Ca 0.01 0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.54 1bsc h GLY 9 CO 0.09 -0.24 0.16 -2.08 0.00 0.00 0.00 176.54 174.47 1bsc h VAL 10 N -0.63 1.25 -0.32 4.60 2.07 -0.72 -0.89 116.25 121.60 1bsc h VAL 10 Ca -0.06 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 66.61 1bsc h VAL 10 Cb 0.49 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1bsc h VAL 10 CO 0.10 0.32 0.17 0.00 0.02 0.00 0.00 177.57 178.18 1bsc h ALA 11 N 1.04 0.39 -0.37 1.67 0.00 -1.00 0.26 119.26 121.25 1bsc h ALA 11 Ca 0.19 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 1bsc h ALA 11 Cb 0.32 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1bsc h ALA 11 CO -0.00 -0.21 -0.21 -0.44 0.00 0.00 0.00 179.25 178.40 1bsc h ASP 12 N 0.35 0.72 0.25 0.00 3.32 -1.27 -2.20 116.42 117.59 1bsc h ASP 12 Ca 0.13 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1bsc h ASP 12 Cb 0.03 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 1bsc h ASP 12 CO -0.08 0.92 -0.14 0.22 -1.72 0.00 0.00 179.24 178.44 1bsc h TYR 13 N 0.63 -0.35 -0.25 4.55 5.03 -0.82 -1.68 116.97 124.09 1bsc h TYR 13 Ca 0.09 -0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.42 1bsc h TYR 13 Cb 0.69 0.12 -0.03 0.00 1.55 0.00 0.00 36.73 39.07 1bsc h TYR 13 CO 0.03 -0.22 0.08 -0.07 -1.32 0.00 0.00 178.16 176.67 1bsc h LEU 14 N -0.36 0.09 -1.44 2.82 3.38 -0.85 0.11 115.31 119.06 1bsc h LEU 14 Ca -0.03 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1bsc h LEU 14 Cb 0.29 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1bsc h LEU 14 CO 0.04 0.08 -0.15 1.56 0.09 0.00 0.00 178.44 180.07 1bsc h GLN 15 N 0.20 0.18 0.00 1.13 4.20 -1.30 0.16 115.11 119.67 1bsc h GLN 15 Ca 0.11 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 1bsc h GLN 15 Cb 0.08 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 1bsc h GLN 15 CO -0.11 0.33 -0.26 1.15 -0.67 0.00 0.00 178.83 179.27 1bsc h THR 16 N 0.17 0.34 0.00 -0.54 2.02 -0.72 -3.40 112.91 110.77 1bsc h THR 16 Ca 0.03 -1.30 0.00 0.00 0.77 0.00 0.00 66.41 65.92 1bsc h THR 16 Cb 0.37 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1bsc h THR 16 CO 0.02 0.11 -0.33 -1.22 0.37 0.00 0.00 175.52 174.48 1bsc n TYR 17 N -4.68 0.27 -3.84 3.16 4.01 0.35 -5.00 117.16 111.43 1bsc n TYR 17 Ca -0.06 0.08 -0.26 0.00 -0.16 0.00 0.00 57.90 57.49 1bsc n TYR 17 Cb 0.21 -0.51 0.02 0.00 -0.31 0.00 0.00 39.34 38.74 1bsc n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1bsc n HIS 18 N -1.76 -2.07 -3.55 -0.72 8.25 0.54 -4.97 115.22 110.94 1bsc n HIS 18 Ca 0.05 0.86 -0.06 0.00 -0.26 0.00 0.00 57.72 58.31 1bsc n HIS 18 Cb 0.38 -4.11 -0.02 0.00 1.12 0.00 0.00 29.99 27.36 1bsc n HIS 18 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1bsc s LYS 19 N -6.36 0.65 0.37 -0.41 3.01 -1.26 -5.08 119.74 110.66 1bsc s LYS 19 Ca 0.33 -0.25 -0.15 0.00 -1.01 0.00 0.00 55.97 54.89 1bsc s LYS 19 Cb -0.17 0.29 -0.09 0.00 -1.01 0.00 0.00 37.83 36.85 1bsc s LYS 19 CO 0.83 -0.28 0.80 -0.51 0.51 0.00 0.00 175.35 176.69 1bsc s LEU 20 N -2.42 3.96 0.99 3.17 1.43 -1.26 -4.19 118.68 120.36 1bsc s LEU 20 Ca 0.07 1.34 -0.11 0.00 -1.03 0.00 0.00 54.13 54.40 1bsc s LEU 20 Cb -0.01 -4.18 0.19 0.00 0.03 0.00 0.00 46.19 42.22 1bsc s LEU 20 CO -0.07 -0.30 1.10 -2.16 0.23 0.00 0.00 176.35 175.15 1bsc s PRO 21 N -3.27 0.46 0.25 1.29 0.04 -1.26 -4.91 135.00 127.60 1bsc s PRO 21 Ca 0.55 1.25 0.21 0.00 0.04 0.00 0.00 61.00 63.05 1bsc s PRO 21 Cb -0.10 -1.68 0.96 0.00 0.04 0.00 0.00 34.50 33.72 1bsc s PRO 21 CO 0.20 -2.91 1.63 -0.25 0.04 0.00 0.00 177.00 175.71 1bsc n ASP 22 N -4.40 0.54 0.00 6.66 8.00 -1.26 -2.86 116.55 123.24 1bsc n ASP 22 Ca 0.08 0.68 0.01 0.00 0.71 0.00 0.00 54.79 56.27 1bsc n ASP 22 Cb 0.53 -0.78 0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1bsc n ASP 22 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1bsc n ASN 23 N -2.15 0.00 -4.74 -2.24 6.94 -1.26 -4.82 115.26 106.98 1bsc n ASN 23 Ca 0.01 -1.88 -0.33 0.00 -0.02 0.00 0.00 54.58 52.37 1bsc n ASN 23 Cb 0.14 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.49 1bsc n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1bsc s TYR 24 N -2.00 3.20 -0.03 -2.53 2.02 -1.13 -0.54 117.35 116.34 1bsc s TYR 24 Ca 0.02 0.15 -0.13 0.00 -0.37 0.00 0.00 57.07 56.74 1bsc s TYR 24 Cb 0.01 -1.71 0.02 0.00 -0.40 0.00 0.00 41.96 39.89 1bsc s TYR 24 CO 0.02 0.52 0.29 0.96 -1.57 0.00 0.00 175.55 175.77 1bsc s ILE 25 N -1.17 0.05 0.83 2.71 -4.36 -0.88 -4.92 121.20 113.48 1bsc s ILE 25 Ca 0.22 -0.43 -0.12 0.00 -0.26 0.00 0.00 60.65 60.06 1bsc s ILE 25 Cb -0.12 -0.57 0.09 0.00 1.25 0.00 0.00 42.46 43.11 1bsc s ILE 25 CO 0.13 -0.23 1.15 0.42 0.24 0.00 0.00 174.94 176.64 1bsc s THR 26 N -1.11 2.25 0.22 8.37 -4.23 -1.20 -0.59 115.64 119.35 1bsc s THR 26 Ca -0.12 0.08 -0.08 0.00 -1.18 0.00 0.00 61.69 60.39 1bsc s THR 26 Cb -0.05 -2.97 0.16 0.00 1.34 0.00 0.00 72.50 70.98 1bsc s THR 26 CO 0.03 -0.11 1.82 0.11 -0.54 0.00 0.00 174.62 175.94 1bsc h LYS 27 N -1.17 0.74 -0.55 3.99 1.57 -1.96 -1.59 116.57 117.60 1bsc h LYS 27 Ca -0.48 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.21 1bsc h LYS 27 Cb 1.32 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.44 1bsc h LYS 27 CO 0.64 0.49 0.16 0.77 -0.57 0.00 0.00 179.45 180.94 1bsc h SER 28 N 0.77 0.80 -0.31 0.86 0.02 -1.99 -0.34 113.55 113.36 1bsc h SER 28 Ca 0.32 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1bsc h SER 28 Cb 0.17 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1bsc h SER 28 CO -0.17 0.80 0.05 -0.33 -1.14 0.00 0.00 176.83 176.04 1bsc h GLU 29 N 0.76 0.52 -0.35 3.45 5.08 -1.85 -1.93 114.58 120.26 1bsc h GLU 29 Ca 0.18 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1bsc h GLU 29 Cb 0.29 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1bsc h GLU 29 CO -0.00 0.61 0.16 0.00 -1.00 0.00 0.00 179.01 178.78 1bsc h ALA 30 N 0.89 0.43 -0.86 3.43 0.00 -1.07 -2.78 119.26 119.29 1bsc h ALA 30 Ca 0.10 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.11 1bsc h ALA 30 Cb 0.34 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1bsc h ALA 30 CO 0.01 -0.22 0.52 1.96 0.00 0.00 0.00 179.25 181.51 1bsc h GLN 31 N 0.34 0.86 0.00 0.00 4.20 -0.95 -0.46 115.11 119.10 1bsc h GLN 31 Ca 0.15 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 1bsc h GLN 31 Cb 0.08 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 1bsc h GLN 31 CO -0.12 0.57 -0.13 0.00 -0.67 0.00 0.00 178.83 178.47 1bsc h ALA 32 N 1.45 1.12 0.00 3.87 0.00 -1.17 -1.22 119.26 123.31 1bsc h ALA 32 Ca 0.40 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1bsc h ALA 32 Cb 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1bsc h ALA 32 CO -0.22 0.17 -0.51 1.28 0.00 0.00 0.00 179.25 179.96 1bsc n LEU 33 N -3.42 0.51 0.00 0.00 4.77 -0.23 -4.93 117.00 113.70 1bsc n LEU 33 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1bsc n LEU 33 Cb 0.31 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1bsc n LEU 33 CO 0.30 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1bsc n GLY 34 N 1.49 1.24 3.71 -0.72 0.00 -0.46 -4.98 105.19 105.48 1bsc n GLY 34 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1bsc n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1bsc s TRP 35 N -2.00 3.37 -0.35 1.61 -0.00 -0.92 -4.96 118.94 115.69 1bsc s TRP 35 Ca 0.00 1.18 0.03 0.00 -0.00 0.00 0.00 56.10 57.30 1bsc s TRP 35 Cb 0.00 -3.52 0.10 0.00 -0.00 0.00 0.00 33.47 30.06 1bsc s TRP 35 CO 0.00 -1.68 0.08 0.08 -0.00 0.00 0.00 176.95 175.43 1bsc s VAL 36 N 1.06 1.85 0.25 5.86 1.01 -1.26 -4.50 120.40 124.67 1bsc s VAL 36 Ca 0.61 -2.14 -0.06 0.00 0.00 0.00 0.00 61.98 60.39 1bsc s VAL 36 Cb -0.32 -2.37 0.26 0.00 0.00 0.00 0.00 36.38 33.95 1bsc s VAL 36 CO 0.30 -0.65 1.65 0.00 0.00 0.00 0.00 175.10 176.40 1bsc h ALA 37 N 7.65 0.88 0.00 5.51 0.00 -1.99 0.40 119.26 131.71 1bsc h ALA 37 Ca -0.07 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1bsc h ALA 37 Cb 1.01 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1bsc h ALA 37 CO 0.51 -0.41 0.02 0.77 0.00 0.00 0.00 179.25 180.15 1bsc h SER 38 N 0.16 0.00 0.00 0.00 0.02 -2.03 -2.07 113.55 109.63 1bsc h SER 38 Ca 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 1bsc h SER 38 Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 1bsc h SER 38 CO -0.61 0.00 -1.41 0.29 -1.14 0.00 0.00 176.83 173.96 1bsc n LYS 39 N -2.48 0.73 -2.91 3.45 5.02 0.10 -5.00 118.16 117.08 1bsc n LYS 39 Ca -0.02 -0.09 -0.16 0.00 -2.02 0.00 0.00 58.31 56.02 1bsc n LYS 39 Cb 0.07 -1.41 0.03 0.00 -0.02 0.00 0.00 35.03 33.70 1bsc n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bsc n GLY 40 N 1.43 -0.12 1.32 0.72 0.00 -0.78 -4.92 105.19 102.84 1bsc n GLY 40 Ca -0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 1bsc n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bsc n ASN 41 N -1.29 2.99 0.06 1.61 6.94 -1.25 -3.66 115.26 120.66 1bsc n ASN 41 Ca -0.05 -3.61 -0.12 0.00 -0.02 0.00 0.00 54.58 50.78 1bsc n ASN 41 Cb 0.57 -0.66 -0.06 0.00 -2.36 0.00 0.00 39.78 37.27 1bsc n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1bsc h LEU 42 N 1.20 -0.16 -2.65 -4.53 5.85 -1.89 -1.26 115.31 111.86 1bsc h LEU 42 Ca 0.25 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.00 1bsc h LEU 42 Cb 1.85 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.94 1bsc h LEU 42 CO 0.49 -0.09 0.08 0.00 -0.34 0.00 0.00 178.44 178.58 1bsc h ALA 43 N 0.85 1.23 0.16 1.25 0.00 -1.85 0.61 119.26 121.52 1bsc h ALA 43 Ca 0.02 -0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 1bsc h ALA 43 Cb 0.13 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1bsc h ALA 43 CO -0.04 -0.09 -1.52 -0.44 0.00 0.00 0.00 179.25 177.15 1bsc h ASP 44 N 0.00 0.54 0.77 0.00 3.32 -1.61 -3.23 116.42 116.21 1bsc h ASP 44 Ca 0.01 -0.91 -0.24 0.00 0.02 0.00 0.00 57.03 55.91 1bsc h ASP 44 Cb 0.18 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1bsc h ASP 44 CO -0.00 1.69 -1.32 -0.37 -1.72 0.00 0.00 179.24 177.51 1bsc h VAL 45 N -0.08 1.21 -2.43 -1.35 -1.51 -0.46 -3.41 116.25 108.22 1bsc h VAL 45 Ca -0.30 -2.96 -0.59 0.00 -1.23 0.00 0.00 66.70 61.61 1bsc h VAL 45 Cb 1.94 2.59 -0.38 0.00 -2.13 0.00 0.00 31.29 33.31 1bsc h VAL 45 CO 0.14 0.69 -0.94 0.00 -1.23 0.00 0.00 177.57 176.24 1bsc n ALA 46 N -2.44 2.92 -1.65 5.19 0.00 0.21 -5.04 120.51 119.69 1bsc n ALA 46 Ca -0.08 -3.26 -0.47 0.00 0.00 0.00 0.00 53.44 49.63 1bsc n ALA 46 Cb 0.98 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.61 1bsc n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bsc n PRO 47 N 2.72 1.87 0.00 0.00 -0.02 -1.22 -2.19 135.00 136.16 1bsc n PRO 47 Ca 0.29 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1bsc n PRO 47 Cb 0.47 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1bsc n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bsc n GLY 48 N 2.82 1.90 3.89 -1.23 0.00 -1.26 -5.04 105.19 106.27 1bsc n GLY 48 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1bsc n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bsc s LYS 49 N -0.41 3.70 0.06 1.61 -0.14 -0.93 -4.81 119.74 118.82 1bsc s LYS 49 Ca 0.00 0.14 0.01 0.00 -1.36 0.00 0.00 55.97 54.76 1bsc s LYS 49 Cb 0.00 -2.61 -0.03 0.00 -1.68 0.00 0.00 37.83 33.50 1bsc s LYS 49 CO 0.00 0.21 -0.06 -1.12 -0.76 0.00 0.00 175.35 173.62 1bsc s SER 50 N -2.94 0.86 0.11 2.83 0.01 0.30 -4.77 113.70 110.09 1bsc s SER 50 Ca 0.46 -0.80 -0.27 0.00 1.31 0.00 0.00 55.95 56.65 1bsc s SER 50 Cb -0.11 0.09 -0.06 0.00 0.21 0.00 0.00 66.02 66.15 1bsc s SER 50 CO 0.28 -0.38 0.83 -0.63 0.41 0.00 0.00 173.24 173.74 1bsc s ILE 51 N -2.71 4.53 -0.21 1.44 -1.09 -1.26 -2.06 121.20 119.84 1bsc s ILE 51 Ca 0.01 1.79 -0.30 0.00 -2.23 0.00 0.00 60.65 59.92 1bsc s ILE 51 Cb -0.01 -4.19 0.15 0.00 -1.58 0.00 0.00 42.46 36.83 1bsc s ILE 51 CO -0.03 0.41 1.14 -0.83 -1.23 0.00 0.00 174.94 174.39 1bsc s GLY 52 N -0.42 -0.13 0.00 6.18 0.00 0.24 -0.89 107.32 112.31 1bsc s GLY 52 Ca 0.40 2.33 0.00 0.00 0.00 0.00 0.00 44.72 47.45 1bsc s GLY 52 CO 0.26 1.05 0.00 0.61 0.00 0.00 0.00 173.10 175.02 1bsc n GLY 53 N 0.63 1.96 3.79 0.20 0.00 0.93 -3.23 105.19 109.46 1bsc n GLY 53 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 1bsc n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bsc s ASP 54 N -1.86 6.43 0.34 1.61 1.01 -1.25 -4.77 116.67 118.18 1bsc s ASP 54 Ca 0.00 2.02 -0.29 0.00 0.71 0.00 0.00 52.55 54.99 1bsc s ASP 54 Cb 0.00 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.25 1bsc s ASP 54 CO 0.00 -0.72 1.32 -0.63 0.21 0.00 0.00 175.17 175.35 1bsc s ILE 55 N -1.82 2.66 -0.23 0.77 1.01 -1.26 -0.86 121.20 121.47 1bsc s ILE 55 Ca 0.64 0.66 -0.05 0.00 0.00 0.00 0.00 60.65 61.91 1bsc s ILE 55 Cb -0.20 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 38.84 1bsc s ILE 55 CO 0.24 0.16 -0.02 0.12 0.00 0.00 0.00 174.94 175.44 1bsc s PHE 56 N -1.14 2.99 0.19 3.97 5.36 -0.39 -4.81 117.98 124.15 1bsc s PHE 56 Ca 0.49 -0.85 -0.20 0.00 -0.96 0.00 0.00 56.93 55.41 1bsc s PHE 56 Cb -0.40 -2.13 0.13 0.00 -0.34 0.00 0.00 43.02 40.27 1bsc s PHE 56 CO 0.54 -0.52 1.59 0.66 -1.46 0.00 0.00 175.22 176.03 1bsc h SER 57 N 8.14 -1.15 -3.64 6.13 4.64 -1.96 -3.39 113.55 122.31 1bsc h SER 57 Ca -0.41 0.23 -0.24 0.00 -0.47 0.00 0.00 61.79 60.91 1bsc h SER 57 Cb 1.16 0.58 0.07 0.00 -0.31 0.00 0.00 62.40 63.90 1bsc h SER 57 CO 0.60 -0.30 -0.39 -3.20 -0.87 0.00 0.00 176.83 172.66 1bsc n ASN 58 N -5.44 -4.53 0.31 4.97 5.15 -1.26 -4.95 115.26 109.52 1bsc n ASN 58 Ca 0.04 -0.29 -0.17 0.00 -0.60 0.00 0.00 54.58 53.57 1bsc n ASN 58 Cb 0.36 -3.18 -0.08 0.00 -0.53 0.00 0.00 39.78 36.34 1bsc n ASN 58 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 1bsc h ARG 59 N -1.44 -0.84 0.00 1.20 -0.00 -1.99 -1.64 114.38 109.67 1bsc h ARG 59 Ca -0.33 0.06 0.00 0.00 -0.00 0.00 0.00 59.98 59.70 1bsc h ARG 59 Cb 1.22 0.19 0.00 0.00 -0.00 0.00 0.00 29.97 31.38 1bsc h ARG 59 CO 0.33 -0.56 0.00 0.39 -0.00 0.00 0.00 179.97 180.13 1bsc n GLU 60 N -5.49 0.20 -2.36 0.08 1.02 -1.26 -4.84 120.64 107.98 1bsc n GLU 60 Ca -0.12 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 56.94 1bsc n GLU 60 Cb 0.38 -1.37 -0.01 0.00 -0.02 0.00 0.00 31.44 30.43 1bsc n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bsc n GLY 61 N -0.52 -0.40 0.00 0.62 0.00 -0.62 -4.83 105.19 99.43 1bsc n GLY 61 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.19 1bsc n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bsc n LYS 62 N -2.59 0.38 -4.70 1.61 5.02 -1.26 -4.77 118.16 111.85 1bsc n LYS 62 Ca -0.09 0.03 -0.31 0.00 -2.02 0.00 0.00 58.31 55.92 1bsc n LYS 62 Cb 0.54 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.92 1bsc n LYS 62 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1bsc s LEU 63 N -2.58 2.54 0.01 -0.35 1.43 -1.26 -4.95 118.68 113.52 1bsc s LEU 63 Ca 0.25 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.61 1bsc s LEU 63 Cb 0.18 -1.48 -0.08 0.00 0.03 0.00 0.00 46.19 44.84 1bsc s LEU 63 CO 0.42 0.26 1.97 -2.84 0.23 0.00 0.00 176.35 176.38 1bsc s PRO 64 N -1.40 4.05 0.68 1.29 0.02 -1.26 -5.00 135.00 133.38 1bsc s PRO 64 Ca 0.14 2.52 -0.11 0.00 0.02 0.00 0.00 61.00 63.57 1bsc s PRO 64 Cb -0.10 -4.17 0.00 0.00 0.02 0.00 0.00 34.50 30.25 1bsc s PRO 64 CO 0.05 -1.05 1.07 0.20 -0.33 0.00 0.00 177.00 176.93 1bsc s GLY 65 N 4.70 1.64 0.00 0.52 0.00 -1.26 -5.07 107.32 107.86 1bsc s GLY 65 Ca 0.88 -0.20 0.00 0.00 0.00 0.00 0.00 44.72 45.40 1bsc s GLY 65 CO 0.40 0.14 0.00 1.17 0.00 0.00 0.00 173.10 174.81 1bsc n LYS 66 N -2.98 0.00 -1.23 2.90 4.81 -1.26 -5.05 118.16 115.35 1bsc n LYS 66 Ca 0.07 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.08 1bsc n LYS 66 Cb 0.56 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.58 1bsc n LYS 66 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1bsc n SER 67 N 0.00 -1.07 -0.82 3.14 7.64 -1.26 0.11 113.62 121.36 1bsc n SER 67 Ca 0.00 0.99 -0.10 0.00 1.01 0.00 0.00 58.87 60.77 1bsc n SER 67 Cb 0.00 -0.83 -0.04 0.00 -1.01 0.00 0.00 64.21 62.32 1bsc n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bsc n GLY 68 N 1.75 0.97 3.75 0.23 0.00 -1.26 -4.97 105.19 105.65 1bsc n GLY 68 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1bsc n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bsc s ARG 69 N -2.78 4.27 0.18 1.61 3.52 0.30 -4.95 118.95 121.10 1bsc s ARG 69 Ca 0.00 0.49 0.10 0.00 -0.13 0.00 0.00 55.73 56.19 1bsc s ARG 69 Cb 0.00 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.96 1bsc s ARG 69 CO 0.00 0.28 -0.22 -0.08 -0.81 0.00 0.00 175.30 174.47 1bsc s THR 70 N 0.20 2.16 0.05 4.11 -1.32 -1.26 -4.80 115.64 114.78 1bsc s THR 70 Ca 0.26 -1.99 0.07 0.00 -1.21 0.00 0.00 61.69 58.82 1bsc s THR 70 Cb -0.16 -2.02 -0.03 0.00 -1.51 0.00 0.00 72.50 68.78 1bsc s THR 70 CO 0.12 -0.19 -0.16 0.26 -2.21 0.00 0.00 174.62 172.44 1bsc s TRP 71 N -1.81 2.60 0.14 9.09 0.52 -1.26 -1.43 118.94 126.79 1bsc s TRP 71 Ca 0.19 -0.23 0.03 0.00 0.02 0.00 0.00 56.10 56.12 1bsc s TRP 71 Cb -0.07 -1.47 -0.04 0.00 -1.15 0.00 0.00 33.47 30.74 1bsc s TRP 71 CO 0.09 0.29 -0.08 1.03 0.02 0.00 0.00 176.95 178.29 1bsc s ARG 72 N -1.53 1.00 0.19 4.98 0.52 0.19 -1.26 118.95 123.04 1bsc s ARG 72 Ca 0.16 -1.43 0.07 0.00 -0.52 0.00 0.00 55.73 54.01 1bsc s ARG 72 Cb -0.11 -0.46 -0.05 0.00 0.52 0.00 0.00 34.95 34.86 1bsc s ARG 72 CO 0.06 0.02 -0.14 -1.83 0.02 0.00 0.00 175.30 173.43 1bsc s GLU 73 N -3.79 1.28 -0.07 3.54 -1.05 -0.04 -0.46 118.70 118.10 1bsc s GLU 73 Ca 0.16 -1.53 -0.07 0.00 -0.15 0.00 0.00 54.97 53.38 1bsc s GLU 73 Cb 0.04 -1.08 0.02 0.00 -0.44 0.00 0.00 34.13 32.66 1bsc s GLU 73 CO -0.01 0.18 0.19 0.00 0.95 0.00 0.00 175.26 176.58 1bsc s ALA 74 N -2.84 -0.47 0.30 -0.84 0.00 0.33 -0.05 121.76 118.20 1bsc s ALA 74 Ca 0.20 0.54 -0.28 0.00 0.00 0.00 0.00 51.96 52.42 1bsc s ALA 74 Cb -0.01 -0.31 -0.09 0.00 0.00 0.00 0.00 23.12 22.70 1bsc s ALA 74 CO 0.06 -0.09 1.06 -0.51 0.00 0.00 0.00 175.76 176.28 1bsc s ASP 75 N 0.12 7.22 -0.01 0.00 1.11 -0.07 0.33 116.67 125.38 1bsc s ASP 75 Ca -0.00 2.17 0.07 0.00 0.18 0.00 0.00 52.55 54.97 1bsc s ASP 75 Cb -0.01 -2.61 -0.02 0.00 1.07 0.00 0.00 42.92 41.34 1bsc s ASP 75 CO 0.00 -0.17 -0.23 -0.63 1.18 0.00 0.00 175.17 175.32 1bsc s ILE 76 N -1.28 1.83 -1.06 0.77 -1.09 -0.82 -4.77 121.20 114.79 1bsc s ILE 76 Ca 0.47 -1.04 0.00 0.00 -2.23 0.00 0.00 60.65 57.84 1bsc s ILE 76 Cb -0.29 -1.53 0.00 0.00 -1.58 0.00 0.00 42.46 39.06 1bsc s ILE 76 CO 0.37 0.47 0.00 0.59 -1.23 0.00 0.00 174.94 175.13 1bsc n ASN 77 N 2.38 -3.93 -4.78 3.58 3.02 -0.34 -4.53 115.26 110.66 1bsc n ASN 77 Ca -0.16 0.09 -0.38 0.00 -0.03 0.00 0.00 54.58 54.10 1bsc n ASN 77 Cb 0.52 -2.91 -0.06 0.00 -0.61 0.00 0.00 39.78 36.72 1bsc n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1bsc s TYR 78 N -2.52 3.63 0.04 3.10 5.04 -1.26 -4.95 117.35 120.42 1bsc s TYR 78 Ca 0.00 0.92 0.00 0.00 -2.44 0.00 0.00 57.07 55.55 1bsc s TYR 78 Cb 0.00 -2.40 0.00 0.00 0.35 0.00 0.00 41.96 39.91 1bsc s TYR 78 CO 0.00 0.43 0.00 0.25 -1.34 0.00 0.00 175.55 174.89 1bsc n THR 79 N 2.67 0.30 -3.86 4.34 -2.24 -1.26 -4.95 114.28 109.28 1bsc n THR 79 Ca -0.11 0.10 -0.07 0.00 -2.27 0.00 0.00 64.05 61.69 1bsc n THR 79 Cb 0.52 -1.38 -0.02 0.00 -2.10 0.00 0.00 70.33 67.36 1bsc n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1bsc s SER 80 N -5.24 -0.22 0.00 3.42 1.04 -1.26 -4.73 113.70 106.70 1bsc s SER 80 Ca 0.00 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1bsc s SER 80 Cb 0.00 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.86 1bsc s SER 80 CO 0.00 -1.38 0.00 0.61 0.98 0.00 0.00 173.24 173.45 1bsc n GLY 81 N -0.47 -1.29 3.78 7.32 0.00 -1.24 -4.88 105.19 108.41 1bsc n GLY 81 Ca -0.04 -1.54 -0.36 0.00 0.00 0.00 0.00 46.02 44.07 1bsc n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bsc s PHE 82 N 0.00 3.03 0.46 1.61 0.08 -1.26 -4.37 117.98 117.54 1bsc s PHE 82 Ca 0.00 1.58 -0.25 0.00 0.12 0.00 0.00 56.93 58.39 1bsc s PHE 82 Cb 0.00 -3.25 -0.08 0.00 -0.57 0.00 0.00 43.02 39.12 1bsc s PHE 82 CO 0.00 -1.10 1.36 0.54 -0.10 0.00 0.00 175.22 175.92 1bsc n ARG 83 N -0.40 2.02 -0.23 0.44 1.74 -1.26 -5.00 116.66 113.97 1bsc n ARG 83 Ca 0.07 0.72 0.00 0.00 -0.77 0.00 0.00 57.85 57.87 1bsc n ARG 83 Cb 0.49 -2.53 0.00 0.00 -1.02 0.00 0.00 32.46 29.40 1bsc n ARG 83 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1bsc n ASN 84 N -0.20 0.00 -1.21 0.55 0.23 -1.26 -5.01 115.26 108.36 1bsc n ASN 84 Ca 0.07 -0.88 0.12 0.00 -0.53 0.00 0.00 54.58 53.36 1bsc n ASN 84 Cb 0.41 0.00 0.24 0.00 -2.08 0.00 0.00 39.78 38.35 1bsc n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1bsc n SER 85 N -2.64 3.60 -4.72 0.53 3.41 -1.26 -4.92 113.62 107.61 1bsc n SER 85 Ca 0.00 -2.00 -0.40 0.00 -0.26 0.00 0.00 58.87 56.21 1bsc n SER 85 Cb 0.00 -0.30 -0.05 0.00 -0.26 0.00 0.00 64.21 63.60 1bsc n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1bsc s ASP 86 N -1.39 7.02 0.10 4.04 1.01 -1.26 -2.38 116.67 123.81 1bsc s ASP 86 Ca 0.41 1.23 -0.08 0.00 0.71 0.00 0.00 52.55 54.83 1bsc s ASP 86 Cb 0.24 -2.42 -0.01 0.00 1.01 0.00 0.00 42.92 41.74 1bsc s ASP 86 CO 0.32 -0.11 0.18 -0.13 0.21 0.00 0.00 175.17 175.65 1bsc s ARG 87 N 0.71 0.88 -0.01 8.23 1.81 0.19 -1.94 118.95 128.82 1bsc s ARG 87 Ca 0.38 -1.04 0.05 0.00 -1.72 0.00 0.00 55.73 53.40 1bsc s ARG 87 Cb -0.18 0.33 -0.03 0.00 -0.45 0.00 0.00 34.95 34.62 1bsc s ARG 87 CO 0.19 -0.28 -0.14 0.14 -0.68 0.00 0.00 175.30 174.53 1bsc s VAL 88 N -3.89 3.07 -0.19 3.52 -7.23 0.15 -1.59 120.40 114.25 1bsc s VAL 88 Ca 0.08 -0.90 -0.01 0.00 -1.81 0.00 0.00 61.98 59.34 1bsc s VAL 88 Cb 0.05 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.74 1bsc s VAL 88 CO -0.09 0.46 -0.14 -0.76 -0.31 0.00 0.00 175.10 174.26 1bsc s LEU 89 N -1.12 2.40 0.01 1.32 2.01 0.40 -0.51 118.68 123.19 1bsc s LEU 89 Ca 0.14 -0.56 0.04 0.00 0.01 0.00 0.00 54.13 53.76 1bsc s LEU 89 Cb -0.11 -1.57 -0.01 0.00 0.01 0.00 0.00 46.19 44.51 1bsc s LEU 89 CO 0.04 -0.00 -0.12 -0.72 1.01 0.00 0.00 176.35 176.55 1bsc s TYR 90 N 1.34 1.07 0.42 0.29 1.13 0.39 -0.92 117.35 121.07 1bsc s TYR 90 Ca 0.05 -0.26 0.06 0.00 -1.41 0.00 0.00 57.07 55.51 1bsc s TYR 90 Cb -0.13 -0.66 0.01 0.00 -1.10 0.00 0.00 41.96 40.07 1bsc s TYR 90 CO -0.09 -0.00 0.58 -1.54 -2.51 0.00 0.00 175.55 171.98 1bsc s SER 91 N -0.64 5.69 0.36 -0.18 1.04 -0.91 0.53 113.70 119.61 1bsc s SER 91 Ca 0.03 -0.27 0.26 0.00 0.48 0.00 0.00 55.95 56.45 1bsc s SER 91 Cb -0.06 -0.87 1.28 0.00 0.10 0.00 0.00 66.02 66.47 1bsc s SER 91 CO 0.00 -0.73 1.80 0.77 0.98 0.00 0.00 173.24 176.06 1bsc h SER 92 N 0.61 0.00 -0.26 7.02 4.64 -1.60 -0.71 113.55 123.25 1bsc h SER 92 Ca -0.42 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.81 1bsc h SER 92 Cb 1.28 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.31 1bsc h SER 92 CO 0.48 0.00 -0.06 -0.90 -0.87 0.00 0.00 176.83 175.48 1bsc n ASP 93 N -2.44 2.92 -3.64 4.97 5.75 -1.26 -4.99 116.55 117.87 1bsc n ASP 93 Ca -0.00 -3.44 -0.27 0.00 -0.01 0.00 0.00 54.79 51.07 1bsc n ASP 93 Cb 0.13 -0.58 0.04 0.00 -1.03 0.00 0.00 41.12 39.68 1bsc n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1bsc n TRP 94 N -0.95 -2.33 -3.24 2.11 7.02 -0.27 -5.02 117.44 114.76 1bsc n TRP 94 Ca 0.26 0.82 -0.33 0.00 -1.02 0.00 0.00 57.50 57.24 1bsc n TRP 94 Cb 0.93 -4.18 -0.06 0.00 -2.42 0.00 0.00 31.31 25.58 1bsc n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1bsc s LEU 95 N -7.11 4.13 -0.09 -0.99 1.43 -1.26 -4.87 118.68 109.92 1bsc s LEU 95 Ca 0.56 1.16 0.01 0.00 -1.03 0.00 0.00 54.13 54.84 1bsc s LEU 95 Cb -0.27 -3.88 0.02 0.00 0.03 0.00 0.00 46.19 42.09 1bsc s LEU 95 CO 0.69 -0.13 -0.10 -0.63 0.23 0.00 0.00 176.35 176.42 1bsc s ILE 96 N -1.87 1.08 0.35 -0.59 -1.09 -1.20 -2.14 121.20 115.74 1bsc s ILE 96 Ca 0.50 -0.38 0.09 0.00 -2.23 0.00 0.00 60.65 58.63 1bsc s ILE 96 Cb -0.11 -1.04 -0.07 0.00 -1.58 0.00 0.00 42.46 39.66 1bsc s ILE 96 CO 0.19 0.36 -0.07 -0.31 -1.23 0.00 0.00 174.94 173.88 1bsc s TYR 97 N 1.18 2.37 0.07 3.97 1.51 -0.09 -0.12 117.35 126.24 1bsc s TYR 97 Ca -0.05 -0.57 0.01 0.00 -1.01 0.00 0.00 57.07 55.46 1bsc s TYR 97 Cb -0.14 -1.44 -0.03 0.00 -0.11 0.00 0.00 41.96 40.24 1bsc s TYR 97 CO -0.02 0.51 -0.06 -1.59 -1.11 0.00 0.00 175.55 173.28 1bsc s LYS 98 N -3.65 0.66 0.01 -0.62 -2.85 -0.29 -0.45 119.74 112.55 1bsc s LYS 98 Ca 0.33 -1.09 0.00 0.00 -1.00 0.00 0.00 55.97 54.22 1bsc s LYS 98 Cb 0.04 -0.12 -0.01 0.00 -2.06 0.00 0.00 37.83 35.68 1bsc s LYS 98 CO 0.16 -0.02 -0.03 -0.08 0.10 0.00 0.00 175.35 175.49 1bsc s THR 99 N -2.86 0.15 -0.04 3.79 -1.32 -0.62 -0.78 115.64 113.96 1bsc s THR 99 Ca 0.02 -0.56 0.05 0.00 -1.21 0.00 0.00 61.69 60.00 1bsc s THR 99 Cb 0.00 -0.22 0.08 0.00 -1.51 0.00 0.00 72.50 70.85 1bsc s THR 99 CO -0.04 -0.26 0.93 0.35 -2.21 0.00 0.00 174.62 173.39 1bsc n THR 100 N 2.21 0.86 -2.71 5.08 -2.24 -1.26 -0.64 114.28 115.58 1bsc n THR 100 Ca -0.19 -0.97 -0.04 0.00 -2.27 0.00 0.00 64.05 60.59 1bsc n THR 100 Cb 0.57 0.40 0.04 0.00 -2.10 0.00 0.00 70.33 69.25 1bsc n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1bsc n ASP 101 N -0.57 2.08 -3.27 3.42 5.68 -1.18 -4.53 116.55 118.18 1bsc n ASP 101 Ca 0.04 -2.32 -0.19 0.00 -0.50 0.00 0.00 54.79 51.82 1bsc n ASP 101 Cb 0.49 -0.46 0.08 0.00 -1.14 0.00 0.00 41.12 40.08 1bsc n ASP 101 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1bsc n HIS 102 N -0.59 -2.37 -2.48 2.11 8.25 -1.00 -3.04 115.22 116.10 1bsc n HIS 102 Ca 0.13 0.90 -0.19 0.00 -0.26 0.00 0.00 57.72 58.29 1bsc n HIS 102 Cb 0.82 -4.73 -0.01 0.00 1.12 0.00 0.00 29.99 27.20 1bsc n HIS 102 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1bsc n TYR 103 N -4.40 -1.18 -0.07 4.41 4.02 -1.26 -4.89 117.16 113.79 1bsc n TYR 103 Ca -0.10 0.05 -0.12 0.00 -0.01 0.00 0.00 57.90 57.72 1bsc n TYR 103 Cb 0.59 -3.79 -0.11 0.00 -0.02 0.00 0.00 39.34 36.02 1bsc n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1bsc h GLN 104 N -0.14 0.00 -5.84 -0.72 4.20 -1.96 -3.47 115.11 107.19 1bsc h GLN 104 Ca -0.46 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 57.75 1bsc h GLN 104 Cb 1.34 0.00 -0.20 0.00 0.30 0.00 0.00 27.48 28.92 1bsc h GLN 104 CO 0.54 0.83 -0.80 0.95 -0.67 0.00 0.00 178.83 179.68 1bsc s THR 105 N -2.13 1.56 -0.04 -0.54 -4.23 -1.26 -5.11 115.64 103.88 1bsc s THR 105 Ca -0.17 -1.60 0.05 0.00 -1.18 0.00 0.00 61.69 58.79 1bsc s THR 105 Cb -0.02 -1.52 -0.01 0.00 1.34 0.00 0.00 72.50 72.30 1bsc s THR 105 CO 0.57 -0.20 -0.20 -0.36 -0.54 0.00 0.00 174.62 173.89 1bsc s PHE 106 N -1.52 1.88 -0.12 3.99 0.08 -1.26 -4.37 117.98 116.66 1bsc s PHE 106 Ca 0.07 -0.48 0.03 0.00 0.12 0.00 0.00 56.93 56.67 1bsc s PHE 106 Cb -0.08 -1.24 0.01 0.00 -0.57 0.00 0.00 43.02 41.13 1bsc s PHE 106 CO 0.04 -0.13 -0.21 0.99 -0.10 0.00 0.00 175.22 175.81 1bsc s THR 107 N -0.18 1.95 0.12 0.64 2.01 0.04 -4.96 115.64 115.27 1bsc s THR 107 Ca 0.00 -0.93 -0.31 0.00 0.31 0.00 0.00 61.69 60.77 1bsc s THR 107 Cb -0.11 -1.72 -0.07 0.00 0.01 0.00 0.00 72.50 70.61 1bsc s THR 107 CO 0.01 0.53 1.30 -0.75 -0.69 0.00 0.00 174.62 175.02 1bsc s LYS 108 N 0.72 4.39 0.00 4.92 2.20 -1.26 -1.14 119.74 129.56 1bsc s LYS 108 Ca -0.10 1.96 0.00 0.00 -0.36 0.00 0.00 55.97 57.47 1bsc s LYS 108 Cb -0.16 -3.26 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 1bsc s LYS 108 CO 0.01 -0.31 0.06 0.44 -0.36 0.00 0.00 175.35 175.19 1bsc n ILE 109 N 3.52 0.00 -0.95 5.43 -5.35 0.83 -4.95 119.36 117.90 1bsc n ILE 109 Ca 0.09 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 1bsc n ILE 109 Cb 0.44 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 1bsc n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33