#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 3.31 -0.22 0.00 1.01 -1.26 -4.99 121.20 nan 1bne s ILE 4 Ca nan -0.70 0.20 0.00 0.00 0.00 0.00 60.65 nan 1bne s ILE 4 Cb nan -2.60 0.44 0.00 0.01 0.00 0.00 42.46 nan 1bne s ILE 4 CO nan 0.29 1.22 -0.46 0.00 0.00 0.00 174.94 nan 1bne n ASN 5 N 4.77 0.60 -4.71 3.58 6.94 -1.26 -4.75 115.26 120.43 1bne n ASN 5 Ca -0.17 -2.06 -0.28 0.00 -0.02 0.00 0.00 54.58 52.04 1bne n ASN 5 Cb 0.49 -0.13 -0.07 0.00 -2.36 0.00 0.00 39.78 37.71 1bne n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1bne s THR 6 N -2.07 4.08 0.19 5.53 -4.23 -1.26 -0.77 115.64 117.11 1bne s THR 6 Ca 0.22 -1.11 -0.17 0.00 -1.18 0.00 0.00 61.69 59.45 1bne s THR 6 Cb 0.34 -3.00 0.17 0.00 1.34 0.00 0.00 72.50 71.34 1bne s THR 6 CO -0.08 0.01 1.62 -0.26 -0.54 0.00 0.00 174.62 175.37 1bne h PHE 7 N 3.01 -0.56 -0.11 3.99 0.04 -1.98 0.32 116.94 121.67 1bne h PHE 7 Ca -0.47 0.06 -0.20 0.00 2.80 0.00 0.00 57.97 60.15 1bne h PHE 7 Cb 1.18 0.33 0.00 0.00 2.20 0.00 0.00 35.95 39.66 1bne h PHE 7 CO 0.60 -0.31 -0.75 -0.44 -0.60 0.00 0.00 178.31 176.81 1bne h ASP 8 N -0.09 0.66 0.17 2.17 3.32 -1.99 -2.26 116.42 118.39 1bne h ASP 8 Ca 0.25 -0.43 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 1bne h ASP 8 Cb 0.49 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1bne h ASP 8 CO -0.61 1.20 -0.08 1.23 -1.72 0.00 0.00 179.24 179.26 1bne h GLY 9 N 1.00 -0.24 0.86 2.75 0.00 -1.84 -2.75 103.07 102.86 1bne h GLY 9 Ca -0.04 0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 1bne h GLY 9 CO 0.14 -0.09 -0.16 -2.08 0.00 0.00 0.00 176.54 174.35 1bne h VAL 10 N -0.47 0.69 -0.75 4.60 2.07 -0.44 -1.17 116.25 120.77 1bne h VAL 10 Ca -0.02 -0.27 0.17 0.00 0.82 0.00 0.00 66.70 67.39 1bne h VAL 10 Cb 0.37 0.84 -0.11 0.00 -1.52 0.00 0.00 31.29 30.86 1bne h VAL 10 CO 0.04 0.06 0.19 0.00 0.02 0.00 0.00 177.57 177.87 1bne h ALA 11 N 0.02 0.99 -0.11 1.67 0.00 -1.47 0.82 119.26 121.17 1bne h ALA 11 Ca -0.05 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1bne h ALA 11 Cb 0.44 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1bne h ALA 11 CO 0.08 -0.34 0.03 -0.44 0.00 0.00 0.00 179.25 178.57 1bne h ASP 12 N 0.27 0.17 -0.77 0.00 3.32 -1.48 -0.81 116.42 117.11 1bne h ASP 12 Ca 0.43 -0.22 0.06 0.00 0.02 0.00 0.00 57.03 57.33 1bne h ASP 12 Cb 0.74 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 40.19 1bne h ASP 12 CO -0.52 0.34 0.46 0.22 -1.72 0.00 0.00 179.24 178.02 1bne h TYR 13 N -0.02 0.84 -0.57 4.55 5.03 -0.42 0.40 116.97 126.78 1bne h TYR 13 Ca 0.04 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.32 1bne h TYR 13 Cb 0.24 -0.26 -0.03 0.00 1.55 0.00 0.00 36.73 38.23 1bne h TYR 13 CO 0.00 0.41 0.14 -0.07 -1.32 0.00 0.00 178.16 177.32 1bne h LEU 14 N 0.83 0.82 0.00 2.82 3.38 -0.54 0.24 115.31 122.86 1bne h LEU 14 Ca 0.35 -0.15 -0.22 0.00 0.09 0.00 0.00 57.88 57.94 1bne h LEU 14 Cb 0.20 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1bne h LEU 14 CO -0.19 0.80 -1.13 1.56 0.09 0.00 0.00 178.44 179.57 1bne h GLN 15 N 0.85 0.00 -0.05 1.13 4.20 -0.30 0.89 115.11 121.83 1bne h GLN 15 Ca 0.19 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.78 1bne h GLN 15 Cb 0.30 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.09 1bne h GLN 15 CO -0.00 0.90 -0.43 1.15 -0.67 0.00 0.00 178.83 179.77 1bne h THR 16 N 0.00 1.42 0.00 -0.54 2.02 -0.01 -3.40 112.91 112.40 1bne h THR 16 Ca -0.06 -1.87 0.00 0.00 0.77 0.00 0.00 66.41 65.25 1bne h THR 16 Cb 1.81 2.41 0.00 0.00 -1.74 0.00 0.00 68.15 70.63 1bne h THR 16 CO 0.12 0.54 -0.32 -1.22 0.37 0.00 0.00 175.52 175.01 1bne n TYR 17 N -4.33 0.00 -2.18 3.16 4.01 0.84 -5.05 117.16 113.60 1bne n TYR 17 Ca -0.09 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.51 1bne n TYR 17 Cb 0.57 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.59 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 -1.16 -0.61 -3.54 -0.72 8.25 0.31 -4.98 115.22 112.77 1bne n HIS 18 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.38 1bne n HIS 18 Cb 0.10 -2.98 -0.02 0.00 1.12 0.00 0.00 29.99 28.21 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 -4.55 1.26 0.53 -0.41 -2.85 -1.26 -5.07 119.74 107.39 1bne s LYS 19 Ca 0.00 -0.54 -0.17 0.00 -1.00 0.00 0.00 55.97 54.26 1bne s LYS 19 Cb 0.00 0.53 -0.07 0.00 -2.06 0.00 0.00 37.83 36.23 1bne s LYS 19 CO 0.00 -0.56 1.02 -0.51 0.10 0.00 0.00 175.35 175.40 1bne s LEU 20 N -2.74 3.64 1.07 2.77 1.43 -1.26 -4.25 118.68 119.33 1bne s LEU 20 Ca 0.05 1.72 -0.13 0.00 -1.03 0.00 0.00 54.13 54.74 1bne s LEU 20 Cb -0.02 -4.53 0.19 0.00 0.03 0.00 0.00 46.19 41.86 1bne s LEU 20 CO -0.07 -0.80 0.80 -2.65 0.23 0.00 0.00 176.35 173.85 1bne n PRO 21 N -1.57 -1.48 0.32 1.29 -0.02 -1.26 -4.87 135.00 127.40 1bne n PRO 21 Ca 0.08 -0.39 0.19 0.00 -2.02 0.00 0.00 63.50 61.36 1bne n PRO 21 Cb 0.53 -2.11 1.05 0.00 -0.02 0.00 0.00 33.50 32.96 1bne n PRO 21 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1bne h ASP 22 N -2.22 0.00 -0.02 2.55 3.32 -1.95 -2.52 116.42 115.59 1bne h ASP 22 Ca -0.53 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.52 1bne h ASP 22 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1bne h ASP 22 CO 0.43 0.01 0.00 -0.46 -1.72 0.00 0.00 179.24 177.50 1bne n ASN 23 N -3.39 0.19 -4.81 6.45 6.94 -1.26 -4.87 115.26 114.51 1bne n ASN 23 Ca -0.03 -1.51 -0.35 0.00 -0.02 0.00 0.00 54.58 52.67 1bne n ASN 23 Cb 0.10 -0.01 -0.07 0.00 -2.36 0.00 0.00 39.78 37.44 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 -1.97 3.41 0.05 -2.53 2.02 -0.95 -0.47 117.35 116.91 1bne s TYR 24 Ca 0.26 0.35 0.01 0.00 -0.37 0.00 0.00 57.07 57.32 1bne s TYR 24 Cb 0.12 -1.84 -0.03 0.00 -0.40 0.00 0.00 41.96 39.81 1bne s TYR 24 CO 0.20 0.62 -0.05 0.96 -1.57 0.00 0.00 175.55 175.70 1bne s ILE 25 N -1.06 0.39 0.62 2.71 -4.36 0.06 -4.91 121.20 114.66 1bne s ILE 25 Ca 0.18 -1.30 -0.10 0.00 -0.26 0.00 0.00 60.65 59.16 1bne s ILE 25 Cb -0.12 -0.85 -0.02 0.00 1.25 0.00 0.00 42.46 42.72 1bne s ILE 25 CO 0.07 -0.60 1.01 0.42 0.24 0.00 0.00 174.94 176.08 1bne s THR 26 N -2.22 4.36 0.21 8.37 -4.23 -1.23 -1.28 115.64 119.63 1bne s THR 26 Ca -0.05 0.64 -0.11 0.00 -1.18 0.00 0.00 61.69 61.00 1bne s THR 26 Cb -0.04 -3.74 0.19 0.00 1.34 0.00 0.00 72.50 70.25 1bne s THR 26 CO -0.03 -0.94 1.67 0.11 -0.54 0.00 0.00 174.62 174.89 1bne h LYS 27 N -0.33 0.13 -0.40 3.99 1.57 -1.97 0.22 116.57 119.78 1bne h LYS 27 Ca -0.45 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.21 1bne h LYS 27 Cb 1.21 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 1bne h LYS 27 CO 0.62 0.08 -0.22 0.66 -0.57 0.00 0.00 179.45 180.02 1bne h SER 28 N 0.13 0.81 0.94 0.86 4.64 -1.99 0.10 113.55 119.03 1bne h SER 28 Ca 0.32 -0.29 -0.15 0.00 -0.47 0.00 0.00 61.79 61.21 1bne h SER 28 Cb 0.52 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.37 1bne h SER 28 CO -0.52 1.00 -0.69 -0.33 -0.87 0.00 0.00 176.83 175.43 1bne h GLU 29 N 0.69 0.00 -0.20 4.77 5.08 -1.71 -2.08 114.58 121.13 1bne h GLU 29 Ca 0.09 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.35 1bne h GLU 29 Cb 0.74 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.99 1bne h GLU 29 CO 0.06 0.69 -0.30 0.00 -1.00 0.00 0.00 179.01 178.47 1bne h ALA 30 N 1.31 0.30 -0.16 3.43 0.00 -0.34 -2.94 119.26 120.87 1bne h ALA 30 Ca -0.01 -0.40 0.03 0.00 0.00 0.00 0.00 54.91 54.53 1bne h ALA 30 Cb 1.35 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1bne h ALA 30 CO 0.09 0.32 -0.06 1.96 0.00 0.00 0.00 179.25 181.56 1bne h GLN 31 N 0.21 -0.04 -0.15 0.00 4.20 -0.88 -0.64 115.11 117.81 1bne h GLN 31 Ca 0.02 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.77 1bne h GLN 31 Cb 0.88 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.66 1bne h GLN 31 CO 0.07 -0.02 0.14 0.00 -0.67 0.00 0.00 178.83 178.34 1bne h ALA 32 N 1.11 1.88 -0.03 3.87 0.00 -1.40 -1.75 119.26 122.94 1bne h ALA 32 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1bne h ALA 32 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1bne h ALA 32 CO -0.18 -0.22 0.00 1.28 0.00 0.00 0.00 179.25 180.13 1bne n LEU 33 N -4.05 1.80 0.00 0.00 4.77 -0.92 -4.95 117.00 113.66 1bne n LEU 33 Ca 0.01 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1bne n LEU 33 Cb 0.26 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1bne n LEU 33 CO 0.30 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1bne n GLY 34 N 1.21 0.89 3.70 -0.72 0.00 -0.66 -4.87 105.19 104.74 1bne n GLY 34 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 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 3.07 -0.28 1.61 -0.00 -0.30 -4.93 118.94 116.11 1bne s TRP 35 Ca 0.00 0.89 0.01 0.00 -0.00 0.00 0.00 56.10 57.00 1bne s TRP 35 Cb 0.00 -3.68 0.08 0.00 -0.00 0.00 0.00 33.47 29.88 1bne s TRP 35 CO 0.00 -2.42 0.02 0.08 -0.00 0.00 0.00 176.95 174.62 1bne s VAL 36 N 1.66 1.53 0.27 5.86 1.01 -1.26 -4.42 120.40 125.05 1bne s VAL 36 Ca 0.64 -1.55 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1bne s VAL 36 Cb -0.35 -1.98 0.27 0.00 0.00 0.00 0.00 36.38 34.32 1bne s VAL 36 CO 0.29 -0.39 1.70 0.00 0.00 0.00 0.00 175.10 176.71 1bne h ALA 37 N 7.91 1.28 0.00 5.51 0.00 -1.99 0.32 119.26 132.29 1bne h ALA 37 Ca -0.13 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1bne h ALA 37 Cb 1.04 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1bne h ALA 37 CO 0.45 -0.30 0.00 0.77 0.00 0.00 0.00 179.25 180.17 1bne h SER 38 N 0.40 0.00 -0.01 0.00 0.02 -2.03 -2.59 113.55 109.34 1bne h SER 38 Ca 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 1bne h SER 38 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1bne h SER 38 CO -0.50 0.00 -0.62 0.29 -1.14 0.00 0.00 176.83 174.85 1bne n LYS 39 N -2.55 0.86 -4.04 3.45 5.02 0.11 -4.97 118.16 116.04 1bne n LYS 39 Ca 0.01 -0.71 -0.31 0.00 -2.02 0.00 0.00 58.31 55.28 1bne n LYS 39 Cb 0.25 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 33.77 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 1.44 -0.41 1.83 0.72 0.00 -0.79 -4.88 105.19 103.10 1bne n GLY 40 Ca 0.08 0.16 0.07 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.80 5.53 -0.18 1.61 6.94 -1.25 -3.86 115.26 121.25 1bne n ASN 41 Ca -0.03 -2.85 -0.02 0.00 -0.02 0.00 0.00 54.58 51.65 1bne n ASN 41 Cb 0.55 -0.67 0.04 0.00 -2.36 0.00 0.00 39.78 37.34 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 3.92 -0.64 -2.07 -4.53 5.85 -1.88 0.64 115.31 116.61 1bne h LEU 42 Ca 0.00 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1bne h LEU 42 Cb 1.89 0.39 -0.00 0.00 0.37 0.00 0.00 40.66 43.31 1bne h LEU 42 CO 0.45 -0.22 0.01 0.00 -0.34 0.00 0.00 178.44 178.35 1bne h ASP 44 N 0.00 0.00 0.00 0.00 3.32 -1.23 -2.89 116.42 115.62 1bne h ASP 44 Ca 0.01 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 1bne h ASP 44 Cb 0.02 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1bne h ASP 44 CO -0.00 0.28 -1.80 1.33 -1.72 0.00 0.00 179.24 177.32 1bne n VAL 45 N -3.32 0.38 -2.93 -1.35 0.24 -0.86 -4.82 118.33 105.65 1bne n VAL 45 Ca 0.01 -0.45 -0.14 0.00 -2.04 0.00 0.00 64.34 61.72 1bne n VAL 45 Cb 0.52 -0.15 -0.00 0.00 -1.47 0.00 0.00 33.84 32.74 1bne n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bne n ALA 46 N -2.22 0.04 -1.71 2.33 0.00 0.22 -4.94 120.51 114.23 1bne n ALA 46 Ca -0.11 -2.11 -0.43 0.00 0.00 0.00 0.00 53.44 50.80 1bne n ALA 46 Cb 0.62 -1.15 -0.01 0.00 0.00 0.00 0.00 19.45 18.90 1bne n ALA 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1bne n PRO 47 N 1.80 2.30 -0.34 0.00 -0.04 -1.09 -1.67 135.00 135.96 1bne n PRO 47 Ca 0.15 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 1bne n PRO 47 Cb 0.58 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 1bne n PRO 47 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bne n GLY 48 N 1.47 2.11 3.90 0.55 0.00 -1.26 -5.03 105.19 106.93 1bne n GLY 48 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.07 3.63 0.07 1.61 -0.14 -0.67 -4.82 119.74 119.34 1bne s LYS 49 Ca 0.00 0.09 0.02 0.00 -1.36 0.00 0.00 55.97 54.71 1bne s LYS 49 Cb 0.00 -2.55 -0.03 0.00 -1.68 0.00 0.00 37.83 33.57 1bne s LYS 49 CO 0.00 0.08 -0.06 -1.12 -0.76 0.00 0.00 175.35 173.49 1bne s SER 50 N -3.45 0.91 0.14 2.83 0.01 0.39 -4.86 113.70 109.66 1bne s SER 50 Ca 0.45 -0.80 -0.30 0.00 1.31 0.00 0.00 55.95 56.62 1bne s SER 50 Cb -0.10 0.08 -0.06 0.00 0.21 0.00 0.00 66.02 66.14 1bne s SER 50 CO 0.34 -0.37 0.95 -0.63 0.41 0.00 0.00 173.24 173.94 1bne s ILE 51 N -2.65 4.41 0.00 1.44 -1.09 -1.26 -0.76 121.20 121.30 1bne s ILE 51 Ca 0.01 2.07 0.00 0.00 -2.23 0.00 0.00 60.65 60.50 1bne s ILE 51 Cb -0.01 -4.32 0.00 0.00 -1.58 0.00 0.00 42.46 36.54 1bne s ILE 51 CO -0.03 0.36 0.00 0.61 -1.23 0.00 0.00 174.94 174.65 1bne n GLY 52 N 2.09 1.65 0.00 6.18 0.00 -0.40 -0.41 105.19 114.30 1bne n GLY 52 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1bne n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bne n GLY 53 N -0.24 1.52 3.86 -0.02 0.00 0.24 -3.51 105.19 107.03 1bne n GLY 53 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.97 6.48 0.17 1.61 1.01 -1.23 -4.76 116.67 117.98 1bne s ASP 54 Ca 0.00 1.41 -0.31 0.00 0.71 0.00 0.00 52.55 54.36 1bne s ASP 54 Cb 0.00 -2.45 -0.09 0.00 1.01 0.00 0.00 42.92 41.39 1bne s ASP 54 CO 0.00 -0.62 1.43 -0.63 0.21 0.00 0.00 175.17 175.55 1bne s ILE 55 N -2.73 3.00 -0.21 0.77 -1.09 -1.26 -0.41 121.20 119.27 1bne s ILE 55 Ca 0.56 0.76 -0.06 0.00 -2.23 0.00 0.00 60.65 59.68 1bne s ILE 55 Cb -0.10 -3.49 -0.03 0.00 -1.58 0.00 0.00 42.46 37.26 1bne s ILE 55 CO 0.38 0.08 0.02 0.12 -1.23 0.00 0.00 174.94 174.32 1bne s PHE 56 N 0.71 3.07 0.28 3.97 5.36 0.59 -4.84 117.98 127.12 1bne s PHE 56 Ca 0.63 -0.40 0.01 0.00 -0.96 0.00 0.00 56.93 56.21 1bne s PHE 56 Cb -0.39 -2.13 0.40 0.00 -0.34 0.00 0.00 43.02 40.56 1bne s PHE 56 CO 0.34 -0.24 1.74 1.03 -1.46 0.00 0.00 175.22 176.64 1bne h SER 57 N 7.62 0.58 -6.16 6.13 0.87 -1.96 -3.36 113.55 117.27 1bne h SER 57 Ca -0.37 -0.17 -0.45 0.00 -1.23 0.00 0.00 61.79 59.57 1bne h SER 57 Cb 1.18 -0.16 0.02 0.00 -0.44 0.00 0.00 62.40 63.00 1bne h SER 57 CO 0.61 0.75 -0.74 -3.20 -0.53 0.00 0.00 176.83 173.72 1bne n ASN 58 N -4.17 -5.07 -0.29 6.23 5.15 -1.26 -4.88 115.26 110.97 1bne n ASN 58 Ca 0.01 -0.71 0.10 0.00 -0.60 0.00 0.00 54.58 53.38 1bne n ASN 58 Cb 0.36 -4.24 0.26 0.00 -0.53 0.00 0.00 39.78 35.63 1bne n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1bne h ARG 59 N -2.26 0.40 -0.55 1.20 -0.00 -2.00 -2.35 114.38 108.83 1bne h ARG 59 Ca -0.58 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 58.88 1bne h ARG 59 Cb 1.37 -0.09 0.00 0.00 0.00 0.00 0.00 29.97 31.25 1bne h ARG 59 CO 0.63 0.26 0.00 0.39 0.00 0.00 0.00 179.97 181.26 1bne n GLU 60 N -5.04 2.44 -2.37 0.04 1.02 -1.26 -4.95 120.64 110.52 1bne n GLU 60 Ca 0.19 -1.64 -0.09 0.00 -0.02 0.00 0.00 57.16 55.61 1bne n GLU 60 Cb 0.57 -1.55 -0.01 0.00 -0.02 0.00 0.00 31.44 30.44 1bne n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bne n GLY 61 N 0.90 -0.40 0.17 0.62 0.00 -0.88 -4.82 105.19 100.77 1bne n GLY 61 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.30 1bne n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bne h LYS 62 N 0.00 0.00 -6.33 1.61 1.57 -1.92 -3.42 116.57 108.07 1bne h LYS 62 Ca -0.20 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.91 1bne h LYS 62 Cb 1.11 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.27 1bne h LYS 62 CO 0.24 0.00 -0.68 -0.51 -0.57 0.00 0.00 179.45 177.93 1bne s LEU 63 N -5.15 3.31 -0.10 2.94 1.43 -1.26 -4.92 118.68 114.93 1bne s LEU 63 Ca 0.05 -0.17 -0.32 0.00 -1.03 0.00 0.00 54.13 52.67 1bne s LEU 63 Cb 0.09 -1.98 -0.10 0.00 0.03 0.00 0.00 46.19 44.24 1bne s LEU 63 CO 0.52 0.23 2.00 -2.65 0.23 0.00 0.00 176.35 176.68 1bne n PRO 64 N 1.07 2.26 -3.08 1.29 -0.02 -1.26 -4.97 135.00 130.29 1bne n PRO 64 Ca -0.13 0.79 -0.23 0.00 -2.02 0.00 0.00 63.50 61.90 1bne n PRO 64 Cb 0.52 -2.85 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 1bne n PRO 64 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1bne s GLY 65 N 5.26 1.51 -0.30 -1.23 0.00 -1.26 -5.08 107.32 106.22 1bne s GLY 65 Ca 0.95 -1.01 -0.24 0.00 0.00 0.00 0.00 44.72 44.41 1bne s GLY 65 CO 0.46 -0.87 1.40 1.25 0.00 0.00 0.00 173.10 175.34 1bne s LYS 66 N -4.50 0.09 0.04 2.90 2.20 -1.26 -5.07 119.74 114.15 1bne s LYS 66 Ca 0.46 0.11 -0.31 0.00 -0.36 0.00 0.00 55.97 55.88 1bne s LYS 66 Cb -0.10 0.04 -0.07 0.00 -1.51 0.00 0.00 37.83 36.20 1bne s LYS 66 CO 0.38 -0.01 1.53 -1.54 -0.36 0.00 0.00 175.35 175.34 1bne s SER 67 N 0.10 6.72 0.00 1.43 1.04 -1.26 -1.29 113.70 120.44 1bne s SER 67 Ca 0.06 2.32 0.00 0.00 0.48 0.00 0.00 55.95 58.81 1bne s SER 67 Cb -0.05 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1bne s SER 67 CO -0.15 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 173.88 1bne n GLY 68 N 3.82 0.23 3.63 7.32 0.00 -1.26 -5.04 105.19 113.89 1bne n GLY 68 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.95 4.10 -0.04 1.61 3.52 -0.41 -4.94 118.95 121.85 1bne s ARG 69 Ca 0.00 0.37 0.06 0.00 -0.13 0.00 0.00 55.73 56.03 1bne s ARG 69 Cb 0.00 -3.63 -0.02 0.00 -1.56 0.00 0.00 34.95 29.74 1bne s ARG 69 CO 0.00 -0.31 -0.21 0.95 -0.81 0.00 0.00 175.30 174.92 1bne s THR 70 N 2.17 2.48 -0.05 4.11 -4.23 -1.26 -4.77 115.64 114.08 1bne s THR 70 Ca 0.22 -0.94 0.00 0.00 -1.18 0.00 0.00 61.69 59.80 1bne s THR 70 Cb -0.16 -1.92 -0.03 0.00 1.34 0.00 0.00 72.50 71.73 1bne s THR 70 CO 0.09 0.58 -0.02 0.26 -0.54 0.00 0.00 174.62 174.99 1bne s TRP 71 N -0.54 3.06 0.21 3.99 0.52 -1.26 -0.87 118.94 124.04 1bne s TRP 71 Ca 0.08 0.10 0.08 0.00 0.02 0.00 0.00 56.10 56.38 1bne s TRP 71 Cb -0.11 -1.72 -0.05 0.00 -1.15 0.00 0.00 33.47 30.44 1bne s TRP 71 CO 0.01 0.43 -0.16 1.03 0.02 0.00 0.00 176.95 178.28 1bne s ARG 72 N -1.12 1.36 0.17 4.98 0.52 0.59 -0.30 118.95 125.15 1bne s ARG 72 Ca 0.15 -1.59 0.06 0.00 -0.52 0.00 0.00 55.73 53.84 1bne s ARG 72 Cb -0.11 -1.22 -0.04 0.00 0.52 0.00 0.00 34.95 34.09 1bne s ARG 72 CO 0.05 0.21 -0.13 -1.83 0.02 0.00 0.00 175.30 173.62 1bne s GLU 73 N -3.52 1.17 -0.06 3.54 -1.05 0.45 -1.73 118.70 117.50 1bne s GLU 73 Ca 0.22 -1.46 -0.08 0.00 -0.15 0.00 0.00 54.97 53.50 1bne s GLU 73 Cb -0.02 -0.90 0.02 0.00 -0.44 0.00 0.00 34.13 32.78 1bne s GLU 73 CO 0.08 0.15 0.20 0.00 0.95 0.00 0.00 175.26 176.63 1bne s ALA 74 N -2.91 -0.49 0.37 -0.84 0.00 -0.68 0.79 121.76 118.00 1bne s ALA 74 Ca 0.17 0.44 -0.25 0.00 0.00 0.00 0.00 51.96 52.32 1bne s ALA 74 Cb -0.01 -0.24 -0.09 0.00 0.00 0.00 0.00 23.12 22.79 1bne s ALA 74 CO 0.04 -0.13 1.09 -0.51 0.00 0.00 0.00 175.76 176.25 1bne s ASP 75 N -0.23 6.80 0.08 0.00 1.11 0.46 -1.12 116.67 123.77 1bne s ASP 75 Ca -0.03 2.17 0.09 0.00 0.18 0.00 0.00 52.55 54.96 1bne s ASP 75 Cb -0.03 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.33 1bne s ASP 75 CO 0.01 -0.47 -0.25 -0.63 1.18 0.00 0.00 175.17 175.01 1bne s ILE 76 N -1.48 2.02 -1.78 0.77 -1.09 -0.27 -4.74 121.20 114.63 1bne s ILE 76 Ca 0.55 -1.51 0.00 0.00 -2.23 0.00 0.00 60.65 57.46 1bne s ILE 76 Cb -0.26 -1.77 0.00 0.00 -1.58 0.00 0.00 42.46 38.84 1bne s ILE 76 CO 0.33 0.17 0.00 0.59 -1.23 0.00 0.00 174.94 174.81 1bne n ASN 77 N 1.38 -5.83 -4.66 3.58 3.02 0.05 -4.60 115.26 108.21 1bne n ASN 77 Ca -0.18 0.01 -0.43 0.00 -0.03 0.00 0.00 54.58 53.95 1bne n ASN 77 Cb 0.53 -4.86 -0.03 0.00 -0.61 0.00 0.00 39.78 34.81 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 -3.01 3.34 -0.03 3.10 5.04 -1.26 -4.93 117.35 119.59 1bne s TYR 78 Ca 0.00 1.39 -0.03 0.00 -2.44 0.00 0.00 57.07 55.99 1bne s TYR 78 Cb 0.00 -3.21 -0.01 0.00 0.35 0.00 0.00 41.96 39.09 1bne s TYR 78 CO 0.00 -0.45 -0.06 0.25 -1.34 0.00 0.00 175.55 173.95 1bne n THR 79 N 5.27 0.29 -3.81 4.34 -2.24 -1.26 -4.98 114.28 111.89 1bne n THR 79 Ca 0.10 0.36 -0.05 0.00 -2.27 0.00 0.00 64.05 62.19 1bne n THR 79 Cb 0.47 -1.57 -0.01 0.00 -2.10 0.00 0.00 70.33 67.11 1bne n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bne n GLY 81 N -0.49 -0.43 3.79 0.00 0.00 -1.25 -4.89 105.19 101.92 1bne n GLY 81 Ca -0.05 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.35 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 2.84 0.60 1.61 0.08 -1.26 -4.48 117.98 117.38 1bne s PHE 82 Ca 0.00 1.51 -0.18 0.00 0.12 0.00 0.00 56.93 58.38 1bne s PHE 82 Cb 0.00 -3.03 -0.03 0.00 -0.57 0.00 0.00 43.02 39.39 1bne s PHE 82 CO 0.00 -1.42 1.16 1.03 -0.10 0.00 0.00 175.22 175.89 1bne s ARG 83 N -4.46 3.00 0.00 0.44 0.52 -1.26 -4.98 118.95 112.21 1bne s ARG 83 Ca 0.63 1.65 0.00 0.00 -0.52 0.00 0.00 55.73 57.49 1bne s ARG 83 Cb -0.17 -1.95 0.00 0.00 0.52 0.00 0.00 34.95 33.35 1bne s ARG 83 CO 0.46 -1.14 0.00 0.27 0.02 0.00 0.00 175.30 174.90 1bne n ASN 84 N -1.76 0.00 -0.73 0.23 0.23 -1.26 -5.03 115.26 106.94 1bne n ASN 84 Ca 0.12 -0.15 0.08 0.00 -0.53 0.00 0.00 54.58 54.11 1bne n ASN 84 Cb 0.51 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 38.43 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 -0.44 3.52 -4.61 0.53 3.41 -1.26 -4.97 113.62 109.80 1bne n SER 85 Ca 0.00 -2.91 -0.37 0.00 -0.26 0.00 0.00 58.87 55.33 1bne n SER 85 Cb 0.00 -0.49 -0.10 0.00 -0.26 0.00 0.00 64.21 63.36 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 -1.97 6.00 0.05 4.04 1.01 -1.26 -1.97 116.67 122.58 1bne s ASP 86 Ca 0.38 0.03 0.01 0.00 0.71 0.00 0.00 52.55 53.68 1bne s ASP 86 Cb 0.30 -2.10 -0.03 0.00 1.01 0.00 0.00 42.92 42.10 1bne s ASP 86 CO 0.08 0.00 -0.06 -0.13 0.21 0.00 0.00 175.17 175.28 1bne s ARG 87 N 1.43 0.57 -0.06 8.23 1.81 0.51 -1.11 118.95 130.33 1bne s ARG 87 Ca 0.07 -0.94 0.04 0.00 -1.72 0.00 0.00 55.73 53.18 1bne s ARG 87 Cb -0.15 -0.10 -0.02 0.00 -0.45 0.00 0.00 34.95 34.23 1bne s ARG 87 CO 0.08 -0.01 -0.17 -1.50 -0.68 0.00 0.00 175.30 173.01 1bne s ILE 88 N -2.37 2.78 -0.09 1.52 2.07 -0.27 -0.63 121.20 124.22 1bne s ILE 88 Ca -0.03 -0.82 0.04 0.00 -1.41 0.00 0.00 60.65 58.43 1bne s ILE 88 Cb -0.03 -2.08 0.00 0.00 0.13 0.00 0.00 42.46 40.48 1bne s ILE 88 CO -0.03 0.58 -0.20 -0.76 -1.91 0.00 0.00 174.94 172.62 1bne s LEU 89 N -0.48 1.95 -0.00 8.50 1.02 0.17 -1.69 118.68 128.14 1bne s LEU 89 Ca 0.06 -0.47 0.02 0.00 0.02 0.00 0.00 54.13 53.75 1bne s LEU 89 Cb -0.12 -1.22 -0.00 0.00 0.02 0.00 0.00 46.19 44.87 1bne s LEU 89 CO 0.01 0.12 -0.05 -0.72 0.02 0.00 0.00 176.35 175.73 1bne s TYR 90 N 0.42 0.49 0.46 0.29 1.13 -0.70 0.51 117.35 119.95 1bne s TYR 90 Ca -0.17 -0.09 0.03 0.00 -1.41 0.00 0.00 57.07 55.43 1bne s TYR 90 Cb -0.17 -0.32 0.01 0.00 -1.10 0.00 0.00 41.96 40.38 1bne s TYR 90 CO 0.07 -0.01 0.65 -1.54 -2.51 0.00 0.00 175.55 172.21 1bne s SER 91 N -0.11 5.64 0.49 -0.18 1.04 -0.94 -0.30 113.70 119.34 1bne s SER 91 Ca 0.02 -0.02 0.33 0.00 0.48 0.00 0.00 55.95 56.76 1bne s SER 91 Cb -0.02 -1.11 1.49 0.00 0.10 0.00 0.00 66.02 66.47 1bne s SER 91 CO -0.00 -0.81 1.98 0.77 0.98 0.00 0.00 173.24 176.15 1bne h SER 92 N 0.41 0.00 -0.34 7.02 4.64 -1.36 -1.30 113.55 122.63 1bne h SER 92 Ca -0.44 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1bne h SER 92 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 1bne h SER 92 CO 0.53 0.00 0.01 -0.90 -0.87 0.00 0.00 176.83 175.60 1bne n ASP 93 N -2.82 4.15 -3.43 4.97 5.75 -1.26 -4.99 116.55 118.91 1bne n ASP 93 Ca 0.00 -3.06 -0.22 0.00 -0.01 0.00 0.00 54.79 51.49 1bne n ASP 93 Cb 0.22 -0.58 0.08 0.00 -1.03 0.00 0.00 41.12 39.80 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 -0.36 -2.72 -3.34 2.11 7.02 -0.49 -5.03 117.44 114.63 1bne n TRP 94 Ca 0.24 0.96 -0.35 0.00 -1.02 0.00 0.00 57.50 57.34 1bne n TRP 94 Cb 0.98 -4.84 -0.06 0.00 -2.42 0.00 0.00 31.31 24.97 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 -6.96 4.31 -0.07 -0.99 1.43 -1.26 -4.91 118.68 110.23 1bne s LEU 95 Ca 0.54 1.09 0.03 0.00 -1.03 0.00 0.00 54.13 54.75 1bne s LEU 95 Cb -0.24 -3.37 0.01 0.00 0.03 0.00 0.00 46.19 42.62 1bne s LEU 95 CO 0.69 0.06 -0.14 -0.63 0.23 0.00 0.00 176.35 176.57 1bne s ILE 96 N -1.53 1.23 0.15 -0.59 -1.09 -0.72 -2.22 121.20 116.42 1bne s ILE 96 Ca 0.40 -0.54 0.07 0.00 -2.23 0.00 0.00 60.65 58.35 1bne s ILE 96 Cb -0.14 -1.11 -0.04 0.00 -1.58 0.00 0.00 42.46 39.58 1bne s ILE 96 CO 0.19 0.38 -0.16 -0.31 -1.23 0.00 0.00 174.94 173.81 1bne s TYR 97 N 0.60 1.65 0.15 3.97 1.51 0.18 0.89 117.35 126.30 1bne s TYR 97 Ca -0.14 -0.51 0.06 0.00 -1.01 0.00 0.00 57.07 55.47 1bne s TYR 97 Cb -0.16 -0.83 -0.04 0.00 -0.11 0.00 0.00 41.96 40.82 1bne s TYR 97 CO 0.04 0.25 -0.14 -1.59 -1.11 0.00 0.00 175.55 173.00 1bne s LYS 98 N -2.77 1.13 -0.02 -0.62 -2.85 0.12 0.44 119.74 115.17 1bne s LYS 98 Ca 0.13 -1.38 -0.02 0.00 -1.00 0.00 0.00 55.97 53.71 1bne s LYS 98 Cb -0.05 -0.96 0.01 0.00 -2.06 0.00 0.00 37.83 34.77 1bne s LYS 98 CO 0.05 0.17 0.06 -0.08 0.10 0.00 0.00 175.35 175.65 1bne s THR 99 N -2.52 -0.01 -0.03 3.79 -1.32 0.20 -1.39 115.64 114.36 1bne s THR 99 Ca 0.14 0.05 0.04 0.00 -1.21 0.00 0.00 61.69 60.71 1bne s THR 99 Cb -0.03 -0.10 0.06 0.00 -1.51 0.00 0.00 72.50 70.93 1bne s THR 99 CO 0.04 0.02 0.92 0.35 -2.21 0.00 0.00 174.62 173.74 1bne n THR 100 N 3.31 0.85 -2.65 5.08 -2.24 -1.25 -0.36 114.28 117.01 1bne n THR 100 Ca -0.16 -0.93 0.01 0.00 -2.27 0.00 0.00 64.05 60.70 1bne n THR 100 Cb 0.58 0.45 0.04 0.00 -2.10 0.00 0.00 70.33 69.30 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 1.41 -3.02 3.42 5.75 -1.09 -4.66 116.55 117.84 1bne n ASP 101 Ca 0.03 -2.09 -0.13 0.00 -0.01 0.00 0.00 54.79 52.59 1bne n ASP 101 Cb 0.44 -0.40 0.06 0.00 -1.03 0.00 0.00 41.12 40.20 1bne n ASP 101 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 1bne n HIS 102 N -0.15 -2.05 -1.77 2.11 -0.00 -0.83 -3.23 115.22 109.30 1bne n HIS 102 Ca 0.08 0.75 -0.20 0.00 -0.00 0.00 0.00 57.72 58.35 1bne n HIS 102 Cb 0.95 -4.10 -0.07 0.00 -0.00 0.00 0.00 29.99 26.78 1bne n HIS 102 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1bne n TYR 103 N -3.17 -0.30 -0.06 1.57 4.01 -1.26 -4.88 117.16 113.07 1bne n TYR 103 Ca -0.11 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.49 1bne n TYR 103 Cb 0.61 -3.45 -0.13 0.00 -0.31 0.00 0.00 39.34 36.06 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 0.01 -5.23 -0.72 4.20 -1.95 -3.47 115.11 107.96 1bne h GLN 104 Ca -0.42 -0.02 -0.37 0.00 0.06 0.00 0.00 58.65 57.90 1bne h GLN 104 Cb 1.30 0.01 -0.16 0.00 0.30 0.00 0.00 27.48 28.92 1bne h GLN 104 CO 0.58 0.95 -0.74 0.95 -0.67 0.00 0.00 178.83 179.91 1bne s THR 105 N -2.47 1.24 -0.00 -0.54 -4.23 -1.26 -5.11 115.64 103.27 1bne s THR 105 Ca -0.18 -1.88 0.03 0.00 -1.18 0.00 0.00 61.69 58.48 1bne s THR 105 Cb -0.02 -1.66 -0.01 0.00 1.34 0.00 0.00 72.50 72.14 1bne s THR 105 CO 0.69 -0.58 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.74 1bne s PHE 106 N -2.70 0.84 -0.08 3.99 0.08 -1.26 -4.51 117.98 114.34 1bne s PHE 106 Ca 0.12 -0.17 0.02 0.00 0.12 0.00 0.00 56.93 57.02 1bne s PHE 106 Cb -0.01 -0.53 0.01 0.00 -0.57 0.00 0.00 43.02 41.91 1bne s PHE 106 CO 0.02 -0.01 -0.13 0.99 -0.10 0.00 0.00 175.22 175.98 1bne s THR 107 N -0.27 1.26 0.16 0.64 2.01 -0.49 -4.95 115.64 114.01 1bne s THR 107 Ca 0.03 -0.53 -0.31 0.00 0.31 0.00 0.00 61.69 61.19 1bne s THR 107 Cb -0.04 -1.15 -0.09 0.00 0.01 0.00 0.00 72.50 71.23 1bne s THR 107 CO -0.00 0.39 1.43 -0.75 -0.69 0.00 0.00 174.62 175.00 1bne s LYS 108 N 0.79 4.29 0.00 4.92 2.20 -1.26 0.13 119.74 130.81 1bne s LYS 108 Ca -0.12 2.19 0.00 0.00 -0.36 0.00 0.00 55.97 57.68 1bne s LYS 108 Cb -0.16 -3.19 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 1bne s LYS 108 CO 0.02 -0.45 0.00 0.44 -0.36 0.00 0.00 175.35 175.00 1bne n ILE 109 N 3.48 0.00 -1.52 5.43 -5.35 0.26 -4.90 119.36 116.75 1bne n ILE 109 Ca 0.10 -0.30 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 1bne n ILE 109 Cb 0.41 0.88 0.00 0.00 -1.74 0.00 0.00 39.64 39.19 1bne n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33