#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bne s ILE 4 N nan 4.86 -0.01 0.00 1.01 -1.26 -4.83 121.20 nan 1bne s ILE 4 Ca nan 0.74 0.13 0.00 0.00 0.00 0.00 60.65 nan 1bne s ILE 4 Cb nan -4.09 0.22 0.00 0.01 0.00 0.00 42.46 nan 1bne s ILE 4 CO nan -0.29 1.09 -0.46 0.00 0.00 0.00 174.94 nan 1bne n ASN 5 N 6.09 -0.02 -4.76 3.58 2.04 -1.26 -4.84 115.26 116.08 1bne n ASN 5 Ca -0.00 -2.00 -0.22 0.00 -0.44 0.00 0.00 54.58 51.91 1bne n ASN 5 Cb 0.49 0.01 -0.05 0.00 -2.53 0.00 0.00 39.78 37.69 1bne n ASN 5 CO 0.00 0.00 0.00 0.42 -0.44 0.00 0.00 177.26 177.24 1bne s THR 6 N -0.06 4.00 0.17 5.53 -4.23 -1.26 -0.05 115.64 119.74 1bne s THR 6 Ca 0.17 -1.59 -0.15 0.00 -1.18 0.00 0.00 61.69 58.94 1bne s THR 6 Cb 0.20 -3.18 0.06 0.00 1.34 0.00 0.00 72.50 70.91 1bne s THR 6 CO -0.08 -0.34 1.74 -0.26 -0.54 0.00 0.00 174.62 175.14 1bne h PHE 7 N 1.62 0.23 -0.22 3.99 0.04 -1.99 -1.85 116.94 118.75 1bne h PHE 7 Ca -0.47 0.02 -0.11 0.00 2.80 0.00 0.00 57.97 60.22 1bne h PHE 7 Cb 1.24 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 39.35 1bne h PHE 7 CO 0.60 0.07 -0.28 -0.44 -0.60 0.00 0.00 178.31 177.66 1bne h ASP 8 N 0.28 0.63 -0.12 2.17 3.32 -1.99 -2.56 116.42 118.15 1bne h ASP 8 Ca 0.20 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1bne h ASP 8 Cb 0.21 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1bne h ASP 8 CO -0.22 1.01 0.07 1.23 -1.72 0.00 0.00 179.24 179.60 1bne h GLY 9 N 0.27 0.17 1.04 2.75 0.00 -1.95 -2.04 103.07 103.31 1bne h GLY 9 Ca 0.03 -0.06 -0.12 0.00 0.00 0.00 0.00 47.33 47.18 1bne h GLY 9 CO 0.07 0.05 -0.21 -2.08 0.00 0.00 0.00 176.54 174.37 1bne h VAL 10 N 0.15 1.28 -0.01 4.60 2.07 -1.42 -2.07 116.25 120.85 1bne h VAL 10 Ca 0.05 -1.36 0.01 0.00 0.82 0.00 0.00 66.70 66.22 1bne h VAL 10 Cb -0.01 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1bne h VAL 10 CO -0.02 0.46 -0.07 0.00 0.02 0.00 0.00 177.57 177.96 1bne h ALA 11 N 0.81 -0.06 -0.61 1.67 0.00 -1.43 0.53 119.26 120.18 1bne h ALA 11 Ca 0.09 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1bne h ALA 11 Cb 0.78 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1bne h ALA 11 CO 0.06 -0.56 0.19 -0.44 0.00 0.00 0.00 179.25 178.50 1bne h ASP 12 N -0.11 0.85 -0.22 0.00 3.32 -1.39 -0.90 116.42 117.96 1bne h ASP 12 Ca 0.03 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1bne h ASP 12 Cb 0.15 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1bne h ASP 12 CO -0.08 0.80 0.10 0.22 -1.72 0.00 0.00 179.24 178.56 1bne h TYR 13 N 0.89 0.33 -0.42 4.55 5.03 -0.74 -2.55 116.97 124.07 1bne h TYR 13 Ca 0.20 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.48 1bne h TYR 13 Cb 0.26 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.42 1bne h TYR 13 CO 0.02 0.34 0.23 -0.07 -1.32 0.00 0.00 178.16 177.36 1bne h LEU 14 N 0.22 0.52 -1.83 2.82 3.38 0.47 -1.14 115.31 119.76 1bne h LEU 14 Ca 0.08 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1bne h LEU 14 Cb 0.14 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1bne h LEU 14 CO -0.01 0.46 -0.07 1.56 0.09 0.00 0.00 178.44 180.48 1bne h GLN 15 N 0.54 0.00 0.00 1.13 4.20 -1.09 -1.22 115.11 118.66 1bne h GLN 15 Ca 0.15 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.51 1bne h GLN 15 Cb 0.06 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.78 1bne h GLN 15 CO -0.02 0.07 -2.32 2.41 -0.67 0.00 0.00 178.83 178.30 1bne n THR 16 N -3.30 1.33 0.53 -0.54 -1.04 -0.97 -4.67 114.28 105.63 1bne n THR 16 Ca -0.01 -0.51 0.08 0.00 -2.04 0.00 0.00 64.05 61.58 1bne n THR 16 Cb 0.26 -1.33 -0.11 0.00 -1.82 0.00 0.00 70.33 67.33 1bne n THR 16 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1bne n TYR 17 N -3.19 0.00 -3.35 -1.42 4.01 -0.45 -5.00 117.16 107.76 1bne n TYR 17 Ca -0.41 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.09 1bne n TYR 17 Cb 0.94 -0.14 0.06 0.00 -0.31 0.00 0.00 39.34 39.89 1bne n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1bne n HIS 18 N -1.64 -2.49 -3.48 -0.72 8.25 -0.46 -4.98 115.22 109.70 1bne n HIS 18 Ca 0.01 0.80 -0.11 0.00 -0.26 0.00 0.00 57.72 58.16 1bne n HIS 18 Cb 0.33 -4.80 -0.02 0.00 1.12 0.00 0.00 29.99 26.62 1bne n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1bne s LYS 19 N -6.06 1.33 0.51 -0.41 -2.85 -1.26 -5.07 119.74 105.93 1bne s LYS 19 Ca 0.47 -0.55 -0.12 0.00 -1.00 0.00 0.00 55.97 54.77 1bne s LYS 19 Cb -0.21 0.58 -0.06 0.00 -2.06 0.00 0.00 37.83 36.09 1bne s LYS 19 CO 0.58 -0.58 0.93 -0.51 0.10 0.00 0.00 175.35 175.86 1bne s LEU 20 N -2.77 3.57 0.89 2.77 1.43 -1.26 -4.30 118.68 119.01 1bne s LEU 20 Ca 0.02 1.36 -0.12 0.00 -1.03 0.00 0.00 54.13 54.36 1bne s LEU 20 Cb -0.01 -4.32 0.08 0.00 0.03 0.00 0.00 46.19 41.97 1bne s LEU 20 CO -0.11 -0.62 0.86 -2.65 0.23 0.00 0.00 176.35 174.07 1bne n PRO 21 N -1.89 -0.21 0.05 1.29 -0.02 -1.26 -4.85 135.00 128.11 1bne n PRO 21 Ca 0.05 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.58 1bne n PRO 21 Cb 0.54 -2.17 0.23 0.00 -0.02 0.00 0.00 33.50 32.08 1bne n PRO 21 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1bne n ASP 22 N -2.73 0.18 -0.57 2.55 8.00 -1.26 -2.53 116.55 120.19 1bne n ASP 22 Ca 0.10 0.57 0.05 0.00 0.71 0.00 0.00 54.79 56.22 1bne n ASP 22 Cb 0.52 -0.60 0.13 0.00 -0.02 0.00 0.00 41.12 41.15 1bne n ASP 22 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1bne n ASN 23 N -1.73 1.63 -4.60 -2.24 6.94 -1.26 -4.85 115.26 109.14 1bne n ASN 23 Ca 0.00 -2.02 -0.32 0.00 -0.02 0.00 0.00 54.58 52.23 1bne n ASN 23 Cb 0.06 -0.21 -0.10 0.00 -2.36 0.00 0.00 39.78 37.16 1bne n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1bne s TYR 24 N -1.61 2.90 0.02 -2.53 2.02 -1.05 -0.76 117.35 116.33 1bne s TYR 24 Ca 0.20 -0.04 -0.07 0.00 -0.37 0.00 0.00 57.07 56.80 1bne s TYR 24 Cb 0.10 -1.61 -0.00 0.00 -0.40 0.00 0.00 41.96 40.06 1bne s TYR 24 CO 0.13 0.38 0.12 0.96 -1.57 0.00 0.00 175.55 175.57 1bne s ILE 25 N -1.01 0.10 0.81 2.71 -4.36 -0.86 -4.93 121.20 113.65 1bne s ILE 25 Ca 0.17 -0.84 -0.12 0.00 -0.26 0.00 0.00 60.65 59.61 1bne s ILE 25 Cb -0.11 -0.60 0.08 0.00 1.25 0.00 0.00 42.46 43.08 1bne s ILE 25 CO 0.08 -0.46 1.17 0.42 0.24 0.00 0.00 174.94 176.39 1bne s THR 26 N -1.84 2.03 0.25 8.37 -4.23 -1.22 -1.38 115.64 117.62 1bne s THR 26 Ca -0.11 -0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.35 1bne s THR 26 Cb -0.05 -3.01 0.25 0.00 1.34 0.00 0.00 72.50 71.04 1bne s THR 26 CO -0.01 -0.01 1.90 0.11 -0.54 0.00 0.00 174.62 176.08 1bne h LYS 27 N -1.04 1.20 0.45 3.99 1.57 -1.96 -0.21 116.57 120.57 1bne h LYS 27 Ca -0.46 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.24 1bne h LYS 27 Cb 1.33 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 33.35 1bne h LYS 27 CO 0.66 0.79 -0.40 0.77 -0.57 0.00 0.00 179.45 180.71 1bne h SER 28 N 1.23 -1.06 -0.57 0.86 0.02 -1.98 0.71 113.55 112.76 1bne h SER 28 Ca 0.39 0.08 0.05 0.00 -0.84 0.00 0.00 61.79 61.47 1bne h SER 28 Cb 0.01 0.35 -0.05 0.00 0.14 0.00 0.00 62.40 62.85 1bne h SER 28 CO -0.13 -0.56 0.31 -0.33 -1.14 0.00 0.00 176.83 174.98 1bne h GLU 29 N -0.85 0.57 -0.45 3.45 5.08 -1.88 0.12 114.58 120.62 1bne h GLU 29 Ca -0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1bne h GLU 29 Cb 0.74 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1bne h GLU 29 CO -0.03 0.38 0.29 0.00 -1.00 0.00 0.00 179.01 178.65 1bne h ALA 30 N 1.30 0.58 -0.74 3.43 0.00 -0.76 -1.72 119.26 121.35 1bne h ALA 30 Ca 0.25 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1bne h ALA 30 Cb 0.14 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1bne h ALA 30 CO -0.16 0.04 0.41 1.96 0.00 0.00 0.00 179.25 181.50 1bne h GLN 31 N 0.61 1.02 0.00 0.00 4.20 -0.48 -0.16 115.11 120.30 1bne h GLN 31 Ca 0.17 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 1bne h GLN 31 Cb -0.05 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.52 1bne h GLN 31 CO -0.03 0.74 -0.11 0.00 -0.67 0.00 0.00 178.83 178.75 1bne h ALA 32 N 1.43 1.73 -0.00 3.87 0.00 0.09 -2.44 119.26 123.94 1bne h ALA 32 Ca 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1bne h ALA 32 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1bne h ALA 32 CO -0.04 0.14 -0.16 1.28 0.00 0.00 0.00 179.25 180.46 1bne n LEU 33 N -4.29 0.40 0.00 0.00 4.77 -0.13 -4.93 117.00 112.82 1bne n LEU 33 Ca -0.03 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1bne n LEU 33 Cb 0.19 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1bne n LEU 33 CO 0.34 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1bne n GLY 34 N 1.36 1.08 3.71 -0.72 0.00 -0.92 -4.94 105.19 104.77 1bne n GLY 34 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1bne n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1bne s TRP 35 N -2.00 3.18 -0.31 1.61 -0.00 -0.83 -4.96 118.94 115.63 1bne s TRP 35 Ca 0.00 0.95 0.04 0.00 -0.00 0.00 0.00 56.10 57.08 1bne s TRP 35 Cb 0.00 -3.66 0.08 0.00 -0.00 0.00 0.00 33.47 29.89 1bne s TRP 35 CO 0.00 -2.33 -0.01 0.08 -0.00 0.00 0.00 176.95 174.69 1bne s VAL 36 N 1.35 2.24 0.30 5.86 1.01 -1.26 -4.50 120.40 125.40 1bne s VAL 36 Ca 0.64 -2.08 0.06 0.00 0.00 0.00 0.00 61.98 60.60 1bne s VAL 36 Cb -0.35 -2.54 0.30 0.00 0.00 0.00 0.00 36.38 33.79 1bne s VAL 36 CO 0.30 -0.38 1.70 0.00 0.00 0.00 0.00 175.10 176.71 1bne h ALA 37 N 7.67 1.55 0.00 5.51 0.00 -1.99 0.14 119.26 132.14 1bne h ALA 37 Ca -0.10 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1bne h ALA 37 Cb 1.03 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1bne h ALA 37 CO 0.50 -0.34 0.00 0.43 0.00 0.00 0.00 179.25 179.83 1bne n SER 38 N -5.01 0.00 -0.00 0.00 7.64 -1.26 -2.57 113.62 112.42 1bne n SER 38 Ca 0.24 -0.20 0.06 0.00 1.01 0.00 0.00 58.87 59.97 1bne n SER 38 Cb 0.70 -0.17 -0.07 0.00 -1.01 0.00 0.00 64.21 63.65 1bne n SER 38 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1bne n LYS 39 N -1.17 2.22 -3.16 1.43 5.02 0.45 -5.00 118.16 117.95 1bne n LYS 39 Ca 0.11 -0.04 -0.20 0.00 -2.02 0.00 0.00 58.31 56.16 1bne n LYS 39 Cb 0.11 -1.12 0.05 0.00 -0.02 0.00 0.00 35.03 34.04 1bne n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bne n GLY 40 N 1.47 -0.34 1.59 0.72 0.00 -1.06 -4.87 105.19 102.69 1bne n GLY 40 Ca 0.01 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.16 1bne n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bne n ASN 41 N -2.11 4.72 -0.15 1.61 6.94 -1.26 -3.61 115.26 121.40 1bne n ASN 41 Ca -0.05 -2.55 -0.03 0.00 -0.02 0.00 0.00 54.58 51.93 1bne n ASN 41 Cb 0.58 -0.59 0.03 0.00 -2.36 0.00 0.00 39.78 37.44 1bne n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1bne h LEU 42 N 3.75 -0.42 -1.61 -4.53 5.85 -1.89 -0.96 115.31 115.49 1bne h LEU 42 Ca 0.00 0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.93 1bne h LEU 42 Cb 1.52 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 42.80 1bne h LEU 42 CO 0.29 -0.15 0.36 0.00 -0.34 0.00 0.00 178.44 178.61 1bne h ASP 44 N 0.47 -0.09 0.97 0.00 3.32 -1.54 -2.97 116.42 116.57 1bne h ASP 44 Ca 0.24 -0.20 -0.19 0.00 0.02 0.00 0.00 57.03 56.90 1bne h ASP 44 Cb 0.35 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 1bne h ASP 44 CO -0.07 0.15 -1.09 -0.37 -1.72 0.00 0.00 179.24 176.14 1bne h VAL 45 N -0.33 1.04 -2.23 -1.35 -1.51 -1.26 -3.41 116.25 107.21 1bne h VAL 45 Ca -0.01 -2.64 -0.57 0.00 -1.23 0.00 0.00 66.70 62.25 1bne h VAL 45 Cb 0.28 2.47 -0.37 0.00 -2.13 0.00 0.00 31.29 31.54 1bne h VAL 45 CO 0.02 0.60 -0.99 0.00 -1.23 0.00 0.00 177.57 175.97 1bne n ALA 46 N -2.37 2.60 -1.62 5.19 0.00 0.43 -5.04 120.51 119.72 1bne n ALA 46 Ca -0.05 -3.08 -0.50 0.00 0.00 0.00 0.00 53.44 49.82 1bne n ALA 46 Cb 0.88 -0.79 -0.05 0.00 0.00 0.00 0.00 19.45 19.49 1bne n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bne n PRO 47 N 2.57 1.48 -0.89 0.00 -0.02 -1.12 -1.96 135.00 135.07 1bne n PRO 47 Ca 0.28 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1bne n PRO 47 Cb 0.49 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1bne n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bne n GLY 48 N 2.74 0.71 3.94 -1.23 0.00 -1.26 -5.05 105.19 105.04 1bne n GLY 48 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1bne n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bne s LYS 49 N -0.11 3.40 0.10 1.61 -0.14 -0.83 -4.80 119.74 118.97 1bne s LYS 49 Ca 0.00 -0.70 0.04 0.00 -1.36 0.00 0.00 55.97 53.95 1bne s LYS 49 Cb 0.00 -2.90 -0.04 0.00 -1.68 0.00 0.00 37.83 33.21 1bne s LYS 49 CO 0.00 0.48 -0.10 -1.12 -0.76 0.00 0.00 175.35 173.84 1bne s SER 50 N -3.57 1.50 0.05 2.83 0.01 0.06 -4.85 113.70 109.73 1bne s SER 50 Ca 0.34 -0.82 -0.30 0.00 1.31 0.00 0.00 55.95 56.49 1bne s SER 50 Cb -0.10 0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.09 1bne s SER 50 CO 0.28 -0.26 0.96 -0.63 0.41 0.00 0.00 173.24 174.01 1bne s ILE 51 N -2.45 4.69 -0.25 1.44 -1.09 -1.26 -2.04 121.20 120.24 1bne s ILE 51 Ca 0.06 2.04 -0.30 0.00 -2.23 0.00 0.00 60.65 60.22 1bne s ILE 51 Cb -0.03 -4.31 0.18 0.00 -1.58 0.00 0.00 42.46 36.72 1bne s ILE 51 CO 0.00 0.24 1.28 -0.83 -1.23 0.00 0.00 174.94 174.40 1bne s GLY 52 N 0.48 -0.01 0.00 6.18 0.00 -0.48 -0.96 107.32 112.53 1bne s GLY 52 Ca 0.49 2.59 0.00 0.00 0.00 0.00 0.00 44.72 47.80 1bne s GLY 52 CO 0.29 1.06 0.00 0.61 0.00 0.00 0.00 173.10 175.06 1bne n GLY 53 N 0.53 1.65 3.79 0.20 0.00 0.14 -3.39 105.19 108.11 1bne n GLY 53 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1bne n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bne s ASP 54 N -1.92 6.79 0.33 1.61 1.01 -1.24 -4.77 116.67 118.49 1bne s ASP 54 Ca 0.00 1.89 -0.29 0.00 0.71 0.00 0.00 52.55 54.87 1bne s ASP 54 Cb 0.00 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.26 1bne s ASP 54 CO 0.00 -0.46 1.32 -0.63 0.21 0.00 0.00 175.17 175.60 1bne s ILE 55 N -1.86 2.69 -0.21 0.77 -1.09 -1.26 -0.63 121.20 119.61 1bne s ILE 55 Ca 0.60 0.69 -0.05 0.00 -2.23 0.00 0.00 60.65 59.67 1bne s ILE 55 Cb -0.17 -3.44 -0.02 0.00 -1.58 0.00 0.00 42.46 37.25 1bne s ILE 55 CO 0.21 0.16 -0.01 0.12 -1.23 0.00 0.00 174.94 174.20 1bne s PHE 56 N -1.09 3.01 0.31 3.97 5.36 -0.17 -4.82 117.98 124.55 1bne s PHE 56 Ca 0.49 -0.62 0.06 0.00 -0.96 0.00 0.00 56.93 55.91 1bne s PHE 56 Cb -0.40 -2.10 0.51 0.00 -0.34 0.00 0.00 43.02 40.69 1bne s PHE 56 CO 0.53 -0.35 1.76 0.77 -1.46 0.00 0.00 175.22 176.46 1bne h SER 57 N 7.74 0.33 -5.77 6.13 0.02 -1.95 -3.39 113.55 116.65 1bne h SER 57 Ca -0.37 -0.11 -0.36 0.00 -0.84 0.00 0.00 61.79 60.10 1bne h SER 57 Cb 1.17 -0.09 0.14 0.00 0.14 0.00 0.00 62.40 63.77 1bne h SER 57 CO 0.60 0.62 -0.75 -3.20 -1.14 0.00 0.00 176.83 172.96 1bne n ASN 58 N -4.12 -3.29 0.23 3.07 5.15 -1.26 -4.88 115.26 110.17 1bne n ASN 58 Ca -0.01 -0.62 0.07 0.00 -0.60 0.00 0.00 54.58 53.42 1bne n ASN 58 Cb 0.40 -4.97 0.54 0.00 -0.53 0.00 0.00 39.78 35.23 1bne n ASN 58 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 1bne h ARG 59 N -2.13 0.00 -0.01 1.20 9.65 -2.00 -2.37 114.38 118.72 1bne h ARG 59 Ca -0.59 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.29 1bne h ARG 59 Cb 1.35 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.93 1bne h ARG 59 CO 0.53 0.18 -0.23 0.39 2.80 0.00 0.00 179.97 183.64 1bne n GLU 60 N -4.16 0.97 -3.47 0.20 4.71 -1.26 -4.92 120.64 112.71 1bne n GLU 60 Ca -0.02 -0.59 -0.25 0.00 -0.01 0.00 0.00 57.16 56.29 1bne n GLU 60 Cb 0.25 -1.49 0.04 0.00 -1.01 0.00 0.00 31.44 29.23 1bne n GLU 60 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1bne n GLY 61 N 1.32 -0.52 0.13 0.62 0.00 -0.89 -4.87 105.19 100.99 1bne n GLY 61 Ca 0.13 0.18 -0.01 0.00 0.00 0.00 0.00 46.02 46.31 1bne n GLY 61 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1bne h LYS 62 N -1.85 0.00 -6.10 1.61 3.11 -1.92 -3.44 116.57 107.98 1bne h LYS 62 Ca -0.54 0.00 -0.59 0.00 -2.81 0.00 0.00 60.65 56.71 1bne h LYS 62 Cb 1.36 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 32.55 1bne h LYS 62 CO 0.59 0.63 -0.34 -0.51 -2.81 0.00 0.00 179.45 177.01 1bne s LEU 63 N -7.47 4.29 0.09 5.20 1.43 -1.26 -5.00 118.68 115.96 1bne s LEU 63 Ca -0.01 0.55 -0.31 0.00 -1.03 0.00 0.00 54.13 53.34 1bne s LEU 63 Cb 0.12 -3.18 -0.08 0.00 0.03 0.00 0.00 46.19 43.08 1bne s LEU 63 CO 0.76 0.10 1.48 -2.16 0.23 0.00 0.00 176.35 176.76 1bne s PRO 64 N -2.50 4.27 0.65 1.29 0.04 -1.26 -5.00 135.00 132.48 1bne s PRO 64 Ca 0.38 2.16 -0.08 0.00 0.04 0.00 0.00 61.00 63.50 1bne s PRO 64 Cb -0.12 -3.38 0.02 0.00 0.04 0.00 0.00 34.50 31.05 1bne s PRO 64 CO 0.24 -0.56 0.99 0.20 0.04 0.00 0.00 177.00 177.90 1bne s GLY 65 N 1.58 1.62 -0.18 0.56 0.00 -1.26 -5.07 107.32 104.57 1bne s GLY 65 Ca 0.67 -0.64 -0.32 0.00 0.00 0.00 0.00 44.72 44.44 1bne s GLY 65 CO 0.30 -0.31 1.14 1.25 0.00 0.00 0.00 173.10 175.49 1bne s LYS 66 N -5.16 0.39 0.05 2.90 2.20 -1.26 -5.07 119.74 113.79 1bne s LYS 66 Ca 0.56 -0.03 -0.31 0.00 -0.36 0.00 0.00 55.97 55.84 1bne s LYS 66 Cb -0.11 0.18 -0.06 0.00 -1.51 0.00 0.00 37.83 36.34 1bne s LYS 66 CO 0.47 -0.15 1.23 -1.12 -0.36 0.00 0.00 175.35 175.42 1bne s SER 67 N -1.64 7.04 0.00 1.43 0.01 -1.26 -2.44 113.70 116.84 1bne s SER 67 Ca 0.05 2.02 0.00 0.00 1.31 0.00 0.00 55.95 59.34 1bne s SER 67 Cb -0.01 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.65 1bne s SER 67 CO -0.04 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 173.70 1bne n GLY 68 N 3.29 1.53 3.67 3.44 0.00 -1.26 -4.98 105.19 110.87 1bne n GLY 68 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1bne n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bne s ARG 69 N -0.01 4.31 0.14 1.61 3.52 -1.02 -4.95 118.95 122.55 1bne s ARG 69 Ca 0.00 1.03 0.10 0.00 -0.13 0.00 0.00 55.73 56.73 1bne s ARG 69 Cb 0.00 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.78 1bne s ARG 69 CO 0.00 -0.31 -0.20 0.95 -0.81 0.00 0.00 175.30 174.93 1bne s THR 70 N 2.07 2.64 0.05 4.11 -4.23 -1.26 -4.77 115.64 114.25 1bne s THR 70 Ca 0.39 -1.68 0.07 0.00 -1.18 0.00 0.00 61.69 59.29 1bne s THR 70 Cb -0.17 -2.22 -0.03 0.00 1.34 0.00 0.00 72.50 71.42 1bne s THR 70 CO 0.13 0.04 -0.17 0.26 -0.54 0.00 0.00 174.62 174.33 1bne s TRP 71 N -1.28 2.57 0.07 3.99 0.52 -1.26 -1.48 118.94 122.08 1bne s TRP 71 Ca 0.18 -0.25 0.01 0.00 0.02 0.00 0.00 56.10 56.07 1bne s TRP 71 Cb -0.10 -1.46 -0.04 0.00 -1.15 0.00 0.00 33.47 30.73 1bne s TRP 71 CO 0.10 0.28 -0.06 1.03 0.02 0.00 0.00 176.95 178.31 1bne s ARG 72 N -1.53 0.70 0.26 4.98 0.52 -0.54 -1.00 118.95 122.33 1bne s ARG 72 Ca 0.15 -1.16 0.08 0.00 -0.52 0.00 0.00 55.73 54.28 1bne s ARG 72 Cb -0.11 -0.11 -0.05 0.00 0.52 0.00 0.00 34.95 35.20 1bne s ARG 72 CO 0.06 -0.03 -0.11 -1.83 0.02 0.00 0.00 175.30 173.41 1bne s GLU 73 N -3.31 1.51 -0.17 3.54 -1.05 0.20 -1.56 118.70 117.86 1bne s GLU 73 Ca 0.05 -1.73 -0.17 0.00 -0.15 0.00 0.00 54.97 52.98 1bne s GLU 73 Cb 0.02 -1.26 0.05 0.00 -0.44 0.00 0.00 34.13 32.50 1bne s GLU 73 CO -0.05 0.13 0.47 0.00 0.95 0.00 0.00 175.26 176.77 1bne s ALA 74 N -2.91 -1.18 0.29 -0.84 0.00 -0.73 0.23 121.76 116.63 1bne s ALA 74 Ca 0.27 1.31 -0.28 0.00 0.00 0.00 0.00 51.96 53.26 1bne s ALA 74 Cb 0.01 -0.74 -0.09 0.00 0.00 0.00 0.00 23.12 22.30 1bne s ALA 74 CO 0.11 -0.23 1.03 -0.51 0.00 0.00 0.00 175.76 176.16 1bne s ASP 75 N 0.18 7.31 0.12 0.00 1.11 -0.13 -0.48 116.67 124.77 1bne s ASP 75 Ca -0.01 2.10 0.10 0.00 0.18 0.00 0.00 52.55 54.92 1bne s ASP 75 Cb -0.03 -2.61 -0.04 0.00 1.07 0.00 0.00 42.92 41.31 1bne s ASP 75 CO 0.01 -0.10 -0.25 -0.63 1.18 0.00 0.00 175.17 175.38 1bne s ILE 76 N -1.29 2.04 -1.86 0.77 -1.09 -0.76 -4.68 121.20 114.34 1bne s ILE 76 Ca 0.46 -1.66 0.00 0.00 -2.23 0.00 0.00 60.65 57.22 1bne s ILE 76 Cb -0.27 -1.82 0.00 0.00 -1.58 0.00 0.00 42.46 38.79 1bne s ILE 76 CO 0.35 0.04 0.00 0.59 -1.23 0.00 0.00 174.94 174.69 1bne n ASN 77 N 1.02 -5.60 -4.67 3.58 3.02 0.93 -4.56 115.26 108.98 1bne n ASN 77 Ca -0.19 0.17 -0.42 0.00 -0.03 0.00 0.00 54.58 54.11 1bne n ASN 77 Cb 0.53 -4.71 -0.03 0.00 -0.61 0.00 0.00 39.78 34.97 1bne n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1bne s TYR 78 N -2.90 3.44 0.00 3.10 5.04 -1.26 -4.91 117.35 119.85 1bne s TYR 78 Ca 0.00 1.47 0.00 0.00 -2.44 0.00 0.00 57.07 56.10 1bne s TYR 78 Cb 0.00 -3.17 0.00 0.00 0.35 0.00 0.00 41.96 39.14 1bne s TYR 78 CO 0.00 -0.31 0.00 2.41 -1.34 0.00 0.00 175.55 176.31 1bne n THR 79 N 4.84 0.00 -3.80 4.34 -1.04 -1.26 -4.99 114.28 112.37 1bne n THR 79 Ca 0.09 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.05 1bne n THR 79 Cb 0.48 -0.60 -0.01 0.00 -1.82 0.00 0.00 70.33 68.38 1bne n THR 79 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bne n GLY 81 N -0.50 -0.44 3.75 0.00 0.00 -1.24 -4.90 105.19 101.86 1bne n GLY 81 Ca -0.05 -1.45 -0.36 0.00 0.00 0.00 0.00 46.02 44.16 1bne n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bne s PHE 82 N 0.00 2.38 0.62 1.61 0.08 -1.26 -4.56 117.98 116.85 1bne s PHE 82 Ca 0.00 1.53 -0.18 0.00 0.12 0.00 0.00 56.93 58.39 1bne s PHE 82 Cb 0.00 -3.46 -0.02 0.00 -0.57 0.00 0.00 43.02 38.97 1bne s PHE 82 CO 0.00 -2.21 1.25 1.03 -0.10 0.00 0.00 175.22 175.20 1bne s ARG 83 N -3.44 2.74 0.00 0.44 0.52 -1.26 -4.99 118.95 112.96 1bne s ARG 83 Ca 0.76 1.95 0.00 0.00 -0.52 0.00 0.00 55.73 57.92 1bne s ARG 83 Cb -0.29 -1.88 0.00 0.00 0.52 0.00 0.00 34.95 33.29 1bne s ARG 83 CO 0.35 -1.42 0.00 0.27 0.02 0.00 0.00 175.30 174.52 1bne n ASN 84 N -1.77 0.00 -0.97 0.23 0.23 -1.26 -5.02 115.26 106.70 1bne n ASN 84 Ca 0.15 -0.57 0.12 0.00 -0.53 0.00 0.00 54.58 53.75 1bne n ASN 84 Cb 0.49 0.00 0.19 0.00 -2.08 0.00 0.00 39.78 38.38 1bne n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1bne n SER 85 N -1.71 2.97 -4.80 0.53 3.41 -1.26 -4.94 113.62 107.82 1bne n SER 85 Ca 0.00 -1.94 -0.38 0.00 -0.26 0.00 0.00 58.87 56.29 1bne n SER 85 Cb 0.00 -0.09 -0.06 0.00 -0.26 0.00 0.00 64.21 63.80 1bne n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1bne s ASP 86 N -1.81 6.77 -0.04 4.04 1.01 -1.26 -2.43 116.67 122.96 1bne s ASP 86 Ca 0.33 0.92 -0.17 0.00 0.71 0.00 0.00 52.55 54.34 1bne s ASP 86 Cb 0.21 -2.26 0.03 0.00 1.01 0.00 0.00 42.92 41.91 1bne s ASP 86 CO 0.31 0.23 0.38 -0.13 0.21 0.00 0.00 175.17 176.16 1bne s ARG 87 N -0.56 0.68 -0.13 8.23 1.81 0.39 -1.83 118.95 127.55 1bne s ARG 87 Ca 0.24 0.01 -0.04 0.00 -1.72 0.00 0.00 55.73 54.21 1bne s ARG 87 Cb -0.16 0.31 -0.04 0.00 -0.45 0.00 0.00 34.95 34.61 1bne s ARG 87 CO 0.12 -0.18 0.03 -1.50 -0.68 0.00 0.00 175.30 173.10 1bne s ILE 88 N -1.02 4.58 -0.12 1.52 2.07 0.37 -0.69 121.20 127.90 1bne s ILE 88 Ca -0.11 -0.13 0.02 0.00 -1.41 0.00 0.00 60.65 59.02 1bne s ILE 88 Cb -0.04 -2.99 0.01 0.00 0.13 0.00 0.00 42.46 39.57 1bne s ILE 88 CO 0.04 0.55 -0.19 -0.76 -1.91 0.00 0.00 174.94 172.68 1bne s LEU 89 N -0.41 1.91 0.02 8.50 1.43 0.78 -1.78 118.68 129.13 1bne s LEU 89 Ca 0.09 -0.51 0.05 0.00 -1.03 0.00 0.00 54.13 52.73 1bne s LEU 89 Cb -0.12 -1.25 -0.02 0.00 0.03 0.00 0.00 46.19 44.83 1bne s LEU 89 CO 0.02 0.06 -0.14 -0.72 0.23 0.00 0.00 176.35 175.80 1bne s TYR 90 N 0.82 1.27 0.42 0.29 1.13 -0.60 0.56 117.35 121.23 1bne s TYR 90 Ca -0.09 -0.30 0.08 0.00 -1.41 0.00 0.00 57.07 55.35 1bne s TYR 90 Cb -0.16 -0.78 -0.00 0.00 -1.10 0.00 0.00 41.96 39.92 1bne s TYR 90 CO -0.00 0.01 0.50 -1.54 -2.51 0.00 0.00 175.55 172.01 1bne s SER 91 N -0.79 5.44 0.49 -0.18 1.04 -0.60 -1.47 113.70 117.64 1bne s SER 91 Ca 0.04 -0.54 0.33 0.00 0.48 0.00 0.00 55.95 56.25 1bne s SER 91 Cb -0.07 -0.64 1.47 0.00 0.10 0.00 0.00 66.02 66.89 1bne s SER 91 CO 0.01 -0.71 1.97 0.77 0.98 0.00 0.00 173.24 176.25 1bne h SER 92 N 0.79 0.00 -0.55 7.02 4.64 -1.62 -1.36 113.55 122.48 1bne h SER 92 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1bne h SER 92 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1bne h SER 92 CO 0.50 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.56 1bne n ASP 93 N -2.82 4.45 -3.22 4.97 5.75 -1.26 -4.99 116.55 119.43 1bne n ASP 93 Ca 0.00 -2.50 -0.21 0.00 -0.01 0.00 0.00 54.79 52.07 1bne n ASP 93 Cb 0.22 -0.53 0.07 0.00 -1.03 0.00 0.00 41.12 39.85 1bne n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1bne n TRP 94 N 0.77 -2.52 -3.23 2.11 7.02 -0.51 -5.02 117.44 116.06 1bne n TRP 94 Ca 0.23 0.89 -0.39 0.00 -1.02 0.00 0.00 57.50 57.22 1bne n TRP 94 Cb 0.85 -4.57 -0.06 0.00 -2.42 0.00 0.00 31.31 25.11 1bne n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1bne s LEU 95 N -6.52 4.40 -0.11 -0.99 1.43 -1.26 -4.88 118.68 110.74 1bne s LEU 95 Ca 0.49 1.11 0.03 0.00 -1.03 0.00 0.00 54.13 54.74 1bne s LEU 95 Cb -0.22 -2.89 0.00 0.00 0.03 0.00 0.00 46.19 43.12 1bne s LEU 95 CO 0.64 0.09 -0.22 -0.63 0.23 0.00 0.00 176.35 176.46 1bne s ILE 96 N -0.11 2.17 0.31 -0.59 -1.09 -0.92 -1.55 121.20 119.42 1bne s ILE 96 Ca 0.30 -0.97 0.07 0.00 -2.23 0.00 0.00 60.65 57.82 1bne s ILE 96 Cb -0.18 -1.85 -0.06 0.00 -1.58 0.00 0.00 42.46 38.79 1bne s ILE 96 CO 0.16 0.55 -0.05 -0.31 -1.23 0.00 0.00 174.94 174.06 1bne s TYR 97 N 0.48 2.13 0.10 3.97 1.51 0.19 -0.92 117.35 124.82 1bne s TYR 97 Ca -0.15 -0.67 0.03 0.00 -1.01 0.00 0.00 57.07 55.27 1bne s TYR 97 Cb -0.17 -1.27 -0.04 0.00 -0.11 0.00 0.00 41.96 40.37 1bne s TYR 97 CO 0.06 0.35 -0.08 -1.59 -1.11 0.00 0.00 175.55 173.18 1bne s LYS 98 N -3.71 0.86 -0.03 -0.62 -2.85 0.25 -0.15 119.74 113.49 1bne s LYS 98 Ca 0.32 -1.27 -0.03 0.00 -1.00 0.00 0.00 55.97 53.99 1bne s LYS 98 Cb 0.04 -0.38 0.01 0.00 -2.06 0.00 0.00 37.83 35.44 1bne s LYS 98 CO 0.14 0.03 0.08 -0.08 0.10 0.00 0.00 175.35 175.62 1bne s THR 99 N -3.09 -0.00 -0.03 3.79 -1.32 0.13 -1.99 115.64 113.13 1bne s THR 99 Ca 0.10 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.62 1bne s THR 99 Cb 0.01 -0.12 0.07 0.00 -1.51 0.00 0.00 72.50 70.96 1bne s THR 99 CO -0.02 0.00 0.92 0.35 -2.21 0.00 0.00 174.62 173.66 1bne n THR 100 N 3.05 0.83 -2.67 5.08 -2.24 -1.26 -0.46 114.28 116.62 1bne n THR 100 Ca -0.12 -0.92 -0.06 0.00 -2.27 0.00 0.00 64.05 60.68 1bne n THR 100 Cb 0.59 0.44 0.04 0.00 -2.10 0.00 0.00 70.33 69.31 1bne n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1bne n ASP 101 N -0.53 2.23 -3.61 3.42 5.75 -1.18 -4.60 116.55 118.03 1bne n ASP 101 Ca 0.04 -2.42 -0.20 0.00 -0.01 0.00 0.00 54.79 52.20 1bne n ASP 101 Cb 0.47 -0.46 0.06 0.00 -1.03 0.00 0.00 41.12 40.16 1bne n ASP 101 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1bne n HIS 102 N -0.58 -2.10 -1.91 2.11 8.25 -1.02 -2.79 115.22 117.19 1bne n HIS 102 Ca 0.14 0.89 -0.15 0.00 -0.26 0.00 0.00 57.72 58.35 1bne n HIS 102 Cb 0.83 -4.67 -0.03 0.00 1.12 0.00 0.00 29.99 27.24 1bne n HIS 102 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1bne n TYR 103 N -4.29 -0.40 -0.07 4.41 4.01 -1.26 -4.89 117.16 114.67 1bne n TYR 103 Ca -0.26 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.38 1bne n TYR 103 Cb 0.66 -2.94 -0.09 0.00 -0.31 0.00 0.00 39.34 36.66 1bne n TYR 103 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 1bne h GLN 104 N 0.00 0.00 -5.64 -0.72 4.20 -1.94 -3.47 115.11 107.55 1bne h GLN 104 Ca -0.34 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 57.91 1bne h GLN 104 Cb 1.14 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 28.71 1bne h GLN 104 CO 0.44 0.71 -0.79 0.95 -0.67 0.00 0.00 178.83 179.47 1bne s THR 105 N -2.05 1.37 0.06 -0.54 -4.23 -1.26 -5.12 115.64 103.87 1bne s THR 105 Ca -0.14 -1.48 0.06 0.00 -1.18 0.00 0.00 61.69 58.94 1bne s THR 105 Cb -0.02 -1.34 -0.03 0.00 1.34 0.00 0.00 72.50 72.46 1bne s THR 105 CO 0.49 -0.21 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.83 1bne s PHE 106 N -1.44 1.41 -0.05 3.99 0.08 -1.26 -4.36 117.98 116.36 1bne s PHE 106 Ca 0.03 -0.40 0.02 0.00 0.12 0.00 0.00 56.93 56.70 1bne s PHE 106 Cb -0.09 -0.81 0.01 0.00 -0.57 0.00 0.00 43.02 41.56 1bne s PHE 106 CO 0.03 0.09 -0.09 0.99 -0.10 0.00 0.00 175.22 176.14 1bne s THR 107 N -1.05 0.82 0.09 0.64 2.01 -0.84 -4.95 115.64 112.37 1bne s THR 107 Ca 0.02 -0.32 -0.30 0.00 0.31 0.00 0.00 61.69 61.40 1bne s THR 107 Cb -0.09 -0.77 -0.06 0.00 0.01 0.00 0.00 72.50 71.59 1bne s THR 107 CO 0.02 0.28 1.06 -0.75 -0.69 0.00 0.00 174.62 174.54 1bne s LYS 108 N 0.60 4.58 0.00 4.92 2.20 -1.26 -0.58 119.74 130.19 1bne s LYS 108 Ca -0.10 1.59 0.00 0.00 -0.36 0.00 0.00 55.97 57.10 1bne s LYS 108 Cb -0.13 -3.36 0.00 0.00 -1.51 0.00 0.00 37.83 32.83 1bne s LYS 108 CO 0.02 0.01 0.16 0.44 -0.36 0.00 0.00 175.35 175.62 1bne n ILE 109 N 3.18 0.00 -1.60 5.43 -5.35 -0.10 -4.95 119.36 115.97 1bne n ILE 109 Ca 0.05 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.20 1bne n ILE 109 Cb 0.48 1.17 0.00 0.00 -1.74 0.00 0.00 39.64 39.55 1bne n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33