#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x1y s ILE 4 N 0.00 1.81 -0.01 2.52 1.01 -1.26 -4.98 121.20 120.29 1x1y s ILE 4 Ca 0.00 -1.37 0.20 0.00 0.00 0.00 0.00 60.65 59.48 1x1y s ILE 4 Cb 0.00 -1.98 0.33 0.00 0.01 0.00 0.00 42.46 40.82 1x1y s ILE 4 CO 0.00 -0.04 1.13 -0.46 0.00 0.00 0.00 174.94 175.57 1x1y n ASN 5 N 4.57 0.55 -4.73 3.58 6.94 -1.26 -4.78 115.26 120.14 1x1y n ASN 5 Ca -0.13 -2.00 -0.24 0.00 -0.02 0.00 0.00 54.58 52.18 1x1y n ASN 5 Cb 0.44 -0.16 -0.06 0.00 -2.36 0.00 0.00 39.78 37.63 1x1y n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1x1y s THR 6 N -0.05 3.99 0.14 5.53 -4.23 -1.26 -0.86 115.64 118.90 1x1y s THR 6 Ca 0.26 -1.46 -0.23 0.00 -1.18 0.00 0.00 61.69 59.08 1x1y s THR 6 Cb 0.30 -3.08 0.01 0.00 1.34 0.00 0.00 72.50 71.08 1x1y s THR 6 CO -0.13 -0.23 1.63 -0.26 -0.54 0.00 0.00 174.62 175.09 1x1y h PHE 7 N 2.16 -0.68 -0.42 3.99 0.04 -1.98 -0.92 116.94 119.13 1x1y h PHE 7 Ca -0.47 0.04 -0.11 0.00 2.80 0.00 0.00 57.97 60.23 1x1y h PHE 7 Cb 1.22 0.33 -0.01 0.00 2.20 0.00 0.00 35.95 39.69 1x1y h PHE 7 CO 0.61 -0.33 -0.16 -0.44 -0.60 0.00 0.00 178.31 177.39 1x1y h ASP 8 N -0.28 0.86 -0.30 2.17 3.32 -1.98 -0.60 116.42 119.60 1x1y h ASP 8 Ca 0.12 -0.39 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1x1y h ASP 8 Cb 0.47 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1x1y h ASP 8 CO -0.36 1.06 0.20 1.23 -1.72 0.00 0.00 179.24 179.64 1x1y h GLY 9 N 0.66 0.43 1.28 2.75 0.00 -1.93 0.15 103.07 106.41 1x1y h GLY 9 Ca 0.10 -0.15 -0.18 0.00 0.00 0.00 0.00 47.33 47.09 1x1y h GLY 9 CO 0.05 0.15 -0.58 -2.08 0.00 0.00 0.00 176.54 174.09 1x1y h VAL 10 N 0.40 1.29 -0.41 4.60 2.07 -1.16 -1.72 116.25 121.32 1x1y h VAL 10 Ca 0.11 -1.79 -0.01 0.00 0.82 0.00 0.00 66.70 65.83 1x1y h VAL 10 Cb -0.04 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 1x1y h VAL 10 CO -0.03 0.57 0.20 0.00 0.02 0.00 0.00 177.57 178.33 1x1y h ALA 11 N 0.78 0.52 -0.67 1.67 0.00 -0.93 0.36 119.26 120.99 1x1y h ALA 11 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1x1y h ALA 11 Cb 1.17 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1x1y h ALA 11 CO 0.12 0.08 0.13 -0.44 0.00 0.00 0.00 179.25 179.14 1x1y h ASP 12 N 0.52 1.05 -0.36 0.00 3.32 -0.95 -1.60 116.42 118.40 1x1y h ASP 12 Ca 0.14 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1x1y h ASP 12 Cb 0.11 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1x1y h ASP 12 CO -0.02 1.03 0.13 0.22 -1.72 0.00 0.00 179.24 178.88 1x1y h TYR 13 N 1.02 0.56 -0.62 4.55 5.03 -1.01 -1.07 116.97 125.44 1x1y h TYR 13 Ca 0.21 -0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.47 1x1y h TYR 13 Cb 0.42 -0.17 -0.03 0.00 1.55 0.00 0.00 36.73 38.50 1x1y h TYR 13 CO 0.03 0.53 0.40 -0.07 -1.32 0.00 0.00 178.16 177.74 1x1y h LEU 14 N 0.43 0.72 -0.90 2.82 3.38 -0.74 0.16 115.31 121.18 1x1y h LEU 14 Ca 0.12 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1x1y h LEU 14 Cb 0.22 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1x1y h LEU 14 CO -0.01 0.53 -0.15 1.56 0.09 0.00 0.00 178.44 180.47 1x1y h GLN 15 N 0.84 0.65 0.20 1.13 4.20 -1.11 0.48 115.11 121.49 1x1y h GLN 15 Ca 0.23 -0.22 -0.34 0.00 0.06 0.00 0.00 58.65 58.38 1x1y h GLN 15 Cb -0.08 -0.05 0.02 0.00 0.30 0.00 0.00 27.48 27.66 1x1y h GLN 15 CO -0.05 0.77 -1.64 1.15 -0.67 0.00 0.00 178.83 178.40 1x1y h THR 16 N 0.59 1.08 -0.01 -0.54 2.02 -0.86 -3.39 112.91 111.79 1x1y h THR 16 Ca 0.10 -2.62 0.00 0.00 0.77 0.00 0.00 66.41 64.66 1x1y h THR 16 Cb 0.59 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 69.85 1x1y h THR 16 CO 0.04 0.84 -0.10 -1.22 0.37 0.00 0.00 175.52 175.45 1x1y n TYR 17 N -3.60 0.00 -3.79 3.16 4.01 0.02 -5.02 117.16 111.93 1x1y n TYR 17 Ca -0.21 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.27 1x1y n TYR 17 Cb 1.08 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 40.15 1x1y n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1x1y n HIS 18 N -0.13 -2.32 -3.53 -0.72 8.25 0.16 -4.96 115.22 111.96 1x1y n HIS 18 Ca 0.03 0.92 -0.08 0.00 -0.26 0.00 0.00 57.72 58.32 1x1y n HIS 18 Cb 0.14 -4.32 -0.02 0.00 1.12 0.00 0.00 29.99 26.91 1x1y n HIS 18 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1x1y s LYS 19 N -6.37 0.71 0.67 -0.41 -2.85 -1.25 -5.06 119.74 105.18 1x1y s LYS 19 Ca 0.48 -0.21 -0.11 0.00 -1.00 0.00 0.00 55.97 55.13 1x1y s LYS 19 Cb -0.23 0.33 -0.01 0.00 -2.06 0.00 0.00 37.83 35.86 1x1y s LYS 19 CO 0.80 -0.30 1.06 -0.51 0.10 0.00 0.00 175.35 176.50 1x1y s LEU 20 N -2.23 3.07 0.94 2.77 1.43 -1.26 -3.99 118.68 119.41 1x1y s LEU 20 Ca 0.05 1.39 -0.11 0.00 -1.03 0.00 0.00 54.13 54.43 1x1y s LEU 20 Cb -0.01 -4.30 0.16 0.00 0.03 0.00 0.00 46.19 42.06 1x1y s LEU 20 CO -0.07 -1.22 1.11 -2.84 0.23 0.00 0.00 176.35 173.56 1x1y s PRO 21 N -5.18 0.87 0.20 1.29 0.02 -1.26 -4.90 135.00 126.03 1x1y s PRO 21 Ca 0.57 1.23 0.19 0.00 0.02 0.00 0.00 61.00 63.01 1x1y s PRO 21 Cb -0.12 -1.73 0.85 0.00 0.02 0.00 0.00 34.50 33.52 1x1y s PRO 21 CO 0.54 -2.63 1.57 -0.25 -0.33 0.00 0.00 177.00 175.90 1x1y n ASP 22 N -4.20 0.44 -0.40 2.53 8.00 -1.26 -2.82 116.55 118.85 1x1y n ASP 22 Ca 0.09 0.64 0.01 0.00 0.71 0.00 0.00 54.79 56.24 1x1y n ASP 22 Cb 0.53 -0.72 0.05 0.00 -0.02 0.00 0.00 41.12 40.96 1x1y n ASP 22 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1x1y n ASN 23 N -2.02 1.00 -4.55 -2.24 6.94 -1.26 -4.83 115.26 108.30 1x1y n ASN 23 Ca 0.01 -2.05 -0.32 0.00 -0.02 0.00 0.00 54.58 52.20 1x1y n ASN 23 Cb 0.14 -0.26 -0.11 0.00 -2.36 0.00 0.00 39.78 37.19 1x1y n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1x1y s TYR 24 N -1.60 2.81 -0.04 -2.53 2.02 -1.13 -0.14 117.35 116.74 1x1y s TYR 24 Ca 0.07 -0.09 -0.10 0.00 -0.37 0.00 0.00 57.07 56.59 1x1y s TYR 24 Cb 0.04 -1.60 0.02 0.00 -0.40 0.00 0.00 41.96 40.02 1x1y s TYR 24 CO 0.04 0.32 0.22 0.96 -1.57 0.00 0.00 175.55 175.52 1x1y s ILE 25 N -0.91 0.04 1.02 2.71 -4.36 -0.68 -4.91 121.20 114.11 1x1y s ILE 25 Ca 0.15 -0.36 -0.13 0.00 -0.26 0.00 0.00 60.65 60.05 1x1y s ILE 25 Cb -0.11 -0.44 0.20 0.00 1.25 0.00 0.00 42.46 43.36 1x1y s ILE 25 CO 0.05 -0.20 1.10 0.42 0.24 0.00 0.00 174.94 176.55 1x1y s THR 26 N -0.76 1.97 0.21 8.37 -4.23 -1.18 -1.15 115.64 118.88 1x1y s THR 26 Ca -0.08 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 60.34 1x1y s THR 26 Cb -0.05 -2.51 0.14 0.00 1.34 0.00 0.00 72.50 71.42 1x1y s THR 26 CO 0.02 0.00 1.77 0.11 -0.54 0.00 0.00 174.62 175.98 1x1y h LYS 27 N -1.96 1.14 -0.38 3.99 1.57 -1.97 -1.46 116.57 117.50 1x1y h LYS 27 Ca -0.54 -0.20 -0.05 0.00 -1.87 0.00 0.00 60.65 57.99 1x1y h LYS 27 Cb 1.33 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1x1y h LYS 27 CO 0.56 0.92 0.05 0.66 -0.57 0.00 0.00 179.45 181.07 1x1y h SER 28 N 1.10 0.61 -0.67 0.86 4.64 -1.99 0.09 113.55 118.19 1x1y h SER 28 Ca 0.26 -0.27 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1x1y h SER 28 Cb 0.20 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 1x1y h SER 28 CO -0.02 0.72 0.40 -0.33 -0.87 0.00 0.00 176.83 176.73 1x1y h GLU 29 N 0.47 0.91 -0.49 4.77 5.08 -1.88 -0.74 114.58 122.70 1x1y h GLU 29 Ca 0.11 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1x1y h GLU 29 Cb 0.38 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1x1y h GLU 29 CO 0.01 0.66 0.17 0.00 -1.00 0.00 0.00 179.01 178.85 1x1y h ALA 30 N 1.21 0.65 -0.81 3.43 0.00 -1.08 -2.51 119.26 120.14 1x1y h ALA 30 Ca 0.24 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.04 1x1y h ALA 30 Cb -0.02 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 1x1y h ALA 30 CO -0.04 0.28 0.49 1.96 0.00 0.00 0.00 179.25 181.93 1x1y h GLN 31 N 0.66 0.86 0.00 0.00 4.20 -0.35 0.97 115.11 121.46 1x1y h GLN 31 Ca 0.16 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1x1y h GLN 31 Cb 0.24 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1x1y h GLN 31 CO -0.01 0.57 -0.03 0.00 -0.67 0.00 0.00 178.83 178.69 1x1y h ALA 32 N 1.39 1.12 -0.02 3.87 0.00 -0.74 -0.38 119.26 124.50 1x1y h ALA 32 Ca 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1x1y h ALA 32 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1x1y h ALA 32 CO -0.18 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.39 1x1y n LEU 33 N -3.30 1.77 0.00 0.00 4.77 0.24 -4.91 117.00 115.56 1x1y n LEU 33 Ca -0.02 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 1x1y n LEU 33 Cb 0.16 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1x1y n LEU 33 CO 0.25 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1x1y n GLY 34 N 1.21 1.04 3.74 -0.72 0.00 -0.15 -4.83 105.19 105.47 1x1y n GLY 34 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1x1y n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1x1y s TRP 35 N -2.00 3.17 -0.29 1.61 -0.00 -0.59 -4.97 118.94 115.87 1x1y s TRP 35 Ca 0.00 1.10 -0.02 0.00 -0.00 0.00 0.00 56.10 57.19 1x1y s TRP 35 Cb 0.00 -3.70 0.09 0.00 -0.00 0.00 0.00 33.47 29.87 1x1y s TRP 35 CO 0.00 -2.26 0.09 0.08 -0.00 0.00 0.00 176.95 174.86 1x1y s VAL 36 N 0.22 0.68 0.22 5.86 1.01 -1.26 -4.46 120.40 122.67 1x1y s VAL 36 Ca 0.59 -1.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.23 1x1y s VAL 36 Cb -0.39 -1.46 0.22 0.00 0.00 0.00 0.00 36.38 34.76 1x1y s VAL 36 CO 0.39 -0.60 1.56 0.00 0.00 0.00 0.00 175.10 176.44 1x1y h ALA 37 N 8.16 0.12 0.00 5.51 0.00 -1.99 0.73 119.26 131.80 1x1y h ALA 37 Ca -0.15 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1x1y h ALA 37 Cb 1.03 0.97 0.00 0.00 0.00 0.00 0.00 17.79 19.80 1x1y h ALA 37 CO 0.44 -0.63 0.00 0.66 0.00 0.00 0.00 179.25 179.72 1x1y h SER 38 N -0.03 0.00 0.57 0.00 4.64 -2.03 -1.22 113.55 115.49 1x1y h SER 38 Ca 0.33 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.37 1x1y h SER 38 Cb 0.59 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.63 1x1y h SER 38 CO -0.94 0.00 -1.59 0.11 -0.87 0.00 0.00 176.83 173.55 1x1y h LYS 39 N 0.00 0.01 -2.75 4.77 1.57 0.03 -3.48 116.57 116.72 1x1y h LYS 39 Ca 0.00 -0.01 -0.24 0.00 -1.87 0.00 0.00 60.65 58.53 1x1y h LYS 39 Cb 0.00 0.01 0.03 0.00 0.08 0.00 0.00 32.23 32.35 1x1y h LYS 39 CO 0.00 0.60 -0.35 0.41 -0.57 0.00 0.00 179.45 179.54 1x1y n GLY 40 N 1.53 -0.02 1.82 3.86 0.00 -0.46 -4.92 105.19 107.00 1x1y n GLY 40 Ca -0.14 -0.26 0.08 0.00 0.00 0.00 0.00 46.02 45.69 1x1y n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x1y n ASN 41 N -0.70 5.54 0.00 1.61 6.94 -1.26 -3.89 115.26 123.51 1x1y n ASN 41 Ca -0.07 -2.84 -0.09 0.00 -0.02 0.00 0.00 54.58 51.56 1x1y n ASN 41 Cb 0.57 -0.66 -0.03 0.00 -2.36 0.00 0.00 39.78 37.30 1x1y n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1x1y h LEU 42 N 4.00 -0.46 -2.44 -4.53 5.85 -1.89 -0.89 115.31 114.95 1x1y h LEU 42 Ca 0.00 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1x1y h LEU 42 Cb 1.87 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 43.12 1x1y h LEU 42 CO 0.44 -0.19 -0.02 0.00 -0.34 0.00 0.00 178.44 178.32 1x1y h ALA 43 N 0.86 1.12 0.24 1.25 0.00 -1.83 0.22 119.26 121.12 1x1y h ALA 43 Ca 0.09 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.64 1x1y h ALA 43 Cb 0.32 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.14 1x1y h ALA 43 CO -0.23 0.03 -1.48 -0.44 0.00 0.00 0.00 179.25 177.13 1x1y h ASP 44 N 0.00 0.80 0.50 0.00 3.32 -1.53 -3.05 116.42 116.45 1x1y h ASP 44 Ca -0.00 -0.87 0.00 0.00 0.02 0.00 0.00 57.03 56.18 1x1y h ASP 44 Cb 0.16 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1x1y h ASP 44 CO 0.00 1.69 -0.99 1.33 -1.72 0.00 0.00 179.24 179.55 1x1y n VAL 45 N -3.69 0.20 -3.04 -1.35 0.24 -0.69 -4.60 118.33 105.40 1x1y n VAL 45 Ca -0.17 -0.26 -0.17 0.00 -2.04 0.00 0.00 64.34 61.70 1x1y n VAL 45 Cb 1.10 0.15 -0.03 0.00 -1.47 0.00 0.00 33.84 33.59 1x1y n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1x1y n ALA 46 N -1.84 0.84 -1.58 2.33 0.00 0.75 -4.92 120.51 116.07 1x1y n ALA 46 Ca 0.02 -2.47 -0.47 0.00 0.00 0.00 0.00 53.44 50.52 1x1y n ALA 46 Cb 0.44 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 1x1y n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1x1y n PRO 47 N 1.90 1.26 -0.59 0.00 -0.02 -1.15 -1.77 135.00 134.62 1x1y n PRO 47 Ca 0.19 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1x1y n PRO 47 Cb 0.56 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1x1y n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x1y n GLY 48 N 1.78 1.08 3.92 -1.23 0.00 -1.26 -5.00 105.19 104.48 1x1y n GLY 48 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1x1y n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x1y s LYS 49 N -0.23 3.58 0.07 1.61 -0.14 -0.73 -4.76 119.74 119.14 1x1y s LYS 49 Ca 0.00 -0.16 0.04 0.00 -1.36 0.00 0.00 55.97 54.49 1x1y s LYS 49 Cb 0.00 -2.73 -0.03 0.00 -1.68 0.00 0.00 37.83 33.39 1x1y s LYS 49 CO 0.00 0.29 -0.12 -1.12 -0.76 0.00 0.00 175.35 173.64 1x1y s SER 50 N -3.22 1.51 0.18 2.83 0.01 0.81 -4.78 113.70 111.04 1x1y s SER 50 Ca 0.41 -0.65 -0.30 0.00 1.31 0.00 0.00 55.95 56.72 1x1y s SER 50 Cb -0.11 -0.03 -0.08 0.00 0.21 0.00 0.00 66.02 66.01 1x1y s SER 50 CO 0.30 -0.13 1.27 -0.63 0.41 0.00 0.00 173.24 174.45 1x1y s ILE 51 N -1.53 3.40 -0.28 1.44 -1.09 -1.26 -1.68 121.20 120.20 1x1y s ILE 51 Ca -0.02 1.14 -0.32 0.00 -2.23 0.00 0.00 60.65 59.23 1x1y s ILE 51 Cb -0.09 -3.73 0.18 0.00 -1.58 0.00 0.00 42.46 37.25 1x1y s ILE 51 CO 0.02 0.16 1.36 -0.83 -1.23 0.00 0.00 174.94 174.42 1x1y s GLY 52 N 0.36 0.01 0.00 6.18 0.00 -0.30 -0.86 107.32 112.71 1x1y s GLY 52 Ca 0.56 2.57 0.00 0.00 0.00 0.00 0.00 44.72 47.85 1x1y s GLY 52 CO 0.37 0.98 0.00 0.61 0.00 0.00 0.00 173.10 175.05 1x1y n GLY 53 N 0.38 0.33 3.81 0.20 0.00 0.73 -3.08 105.19 107.56 1x1y n GLY 53 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1x1y n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x1y s ASP 54 N -2.22 5.76 0.29 1.61 1.01 -1.23 -4.76 116.67 117.14 1x1y s ASP 54 Ca 0.00 1.73 -0.29 0.00 0.71 0.00 0.00 52.55 54.70 1x1y s ASP 54 Cb 0.00 -2.52 -0.10 0.00 1.01 0.00 0.00 42.92 41.31 1x1y s ASP 54 CO 0.00 -1.18 1.32 -0.63 0.21 0.00 0.00 175.17 174.89 1x1y s ILE 55 N -2.64 2.82 -0.27 0.77 1.01 -1.26 -1.46 121.20 120.17 1x1y s ILE 55 Ca 0.61 0.77 -0.05 0.00 0.00 0.00 0.00 60.65 61.99 1x1y s ILE 55 Cb -0.15 -3.49 0.01 0.00 0.01 0.00 0.00 42.46 38.84 1x1y s ILE 55 CO 0.41 0.16 0.02 0.12 0.00 0.00 0.00 174.94 175.66 1x1y s PHE 56 N -0.76 3.11 0.42 3.97 5.36 -0.02 -4.76 117.98 125.31 1x1y s PHE 56 Ca 0.52 -1.19 0.17 0.00 -0.96 0.00 0.00 56.93 55.46 1x1y s PHE 56 Cb -0.39 -2.18 1.03 0.00 -0.34 0.00 0.00 43.02 41.14 1x1y s PHE 56 CO 0.48 -0.63 1.97 0.77 -1.46 0.00 0.00 175.22 176.36 1x1y h SER 57 N 8.14 0.00 -6.16 6.13 0.02 -1.95 -3.37 113.55 116.37 1x1y h SER 57 Ca -0.32 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.18 1x1y h SER 57 Cb 1.12 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.68 1x1y h SER 57 CO 0.59 0.21 -0.73 -3.20 -1.14 0.00 0.00 176.83 172.56 1x1y n ASN 58 N -4.13 -5.36 -0.33 3.07 5.15 -1.26 -4.85 115.26 107.55 1x1y n ASN 58 Ca -0.02 -0.70 0.08 0.00 -0.60 0.00 0.00 54.58 53.33 1x1y n ASN 58 Cb 0.28 -4.25 0.24 0.00 -0.53 0.00 0.00 39.78 35.52 1x1y n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1x1y h ARG 59 N -2.29 0.78 -0.17 1.20 3.08 -2.01 -1.30 114.38 113.67 1x1y h ARG 59 Ca -0.58 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.43 1x1y h ARG 59 Cb 1.37 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1x1y h ARG 59 CO 0.64 0.52 0.00 0.39 -1.07 0.00 0.00 179.97 180.44 1x1y n GLU 60 N -4.74 1.53 -2.76 0.04 1.02 -1.26 -4.94 120.64 109.53 1x1y n GLU 60 Ca 0.19 -0.81 -0.20 0.00 -0.02 0.00 0.00 57.16 56.33 1x1y n GLU 60 Cb 0.42 -1.29 0.01 0.00 -0.02 0.00 0.00 31.44 30.55 1x1y n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x1y n GLY 61 N 0.97 -0.51 0.14 0.62 0.00 -0.49 -4.88 105.19 101.05 1x1y n GLY 61 Ca 0.12 0.05 0.02 0.00 0.00 0.00 0.00 46.02 46.22 1x1y n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x1y h LYS 62 N -0.58 0.00 -6.09 1.61 1.57 -1.92 -3.45 116.57 107.71 1x1y h LYS 62 Ca -0.44 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 57.78 1x1y h LYS 62 Cb 1.32 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.60 1x1y h LYS 62 CO 0.51 0.53 -0.42 -0.51 -0.57 0.00 0.00 179.45 178.99 1x1y s LEU 63 N -6.70 4.30 -0.30 2.94 1.43 -1.26 -5.00 118.68 114.09 1x1y s LEU 63 Ca 0.02 0.28 -0.38 0.00 -1.03 0.00 0.00 54.13 53.03 1x1y s LEU 63 Cb 0.09 -3.02 -0.14 0.00 0.03 0.00 0.00 46.19 43.15 1x1y s LEU 63 CO 0.74 0.04 1.98 -2.65 0.23 0.00 0.00 176.35 176.68 1x1y n PRO 64 N -0.44 1.18 -3.87 1.29 -0.02 -1.26 -4.94 135.00 126.94 1x1y n PRO 64 Ca -0.06 0.39 -0.37 0.00 -2.02 0.00 0.00 63.50 61.44 1x1y n PRO 64 Cb 0.53 -2.29 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 1x1y n PRO 64 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1x1y s GLY 65 N 5.39 2.15 -0.28 -1.23 0.00 -1.26 -5.06 107.32 107.04 1x1y s GLY 65 Ca 1.04 -0.64 -0.20 0.00 0.00 0.00 0.00 44.72 44.92 1x1y s GLY 65 CO 0.57 -0.34 0.79 1.25 0.00 0.00 0.00 173.10 175.37 1x1y s LYS 66 N -0.93 0.67 0.17 2.90 2.20 -1.26 -5.08 119.74 118.41 1x1y s LYS 66 Ca 0.15 0.99 -0.33 0.00 -0.36 0.00 0.00 55.97 56.41 1x1y s LYS 66 Cb -0.12 0.22 -0.14 0.00 -1.51 0.00 0.00 37.83 36.28 1x1y s LYS 66 CO 0.04 -0.11 1.42 0.43 -0.36 0.00 0.00 175.35 176.77 1x1y n SER 67 N 3.47 2.48 0.00 1.43 7.64 -1.26 -0.68 113.62 126.69 1x1y n SER 67 Ca -0.17 1.12 0.00 0.00 1.01 0.00 0.00 58.87 60.83 1x1y n SER 67 Cb 0.57 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.42 1x1y n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x1y n GLY 68 N 2.67 3.14 3.70 0.23 0.00 -1.26 -5.02 105.19 108.65 1x1y n GLY 68 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1x1y n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1x1y s ARG 69 N -0.40 4.43 0.02 1.61 3.52 0.14 -4.96 118.95 123.30 1x1y s ARG 69 Ca 0.00 1.02 0.08 0.00 -0.13 0.00 0.00 55.73 56.70 1x1y s ARG 69 Cb 0.00 -3.48 -0.03 0.00 -1.56 0.00 0.00 34.95 29.88 1x1y s ARG 69 CO 0.00 -0.05 -0.22 0.95 -0.81 0.00 0.00 175.30 175.17 1x1y s THR 70 N 1.14 2.44 0.15 4.11 -4.23 -1.26 -4.72 115.64 113.27 1x1y s THR 70 Ca 0.41 -1.18 0.06 0.00 -1.18 0.00 0.00 61.69 59.80 1x1y s THR 70 Cb -0.18 -1.95 -0.04 0.00 1.34 0.00 0.00 72.50 71.66 1x1y s THR 70 CO 0.19 0.44 0.03 0.26 -0.54 0.00 0.00 174.62 174.99 1x1y s TRP 71 N -0.79 2.94 0.06 3.99 0.52 -1.26 -0.71 118.94 123.69 1x1y s TRP 71 Ca 0.12 -0.09 -0.04 0.00 0.02 0.00 0.00 56.10 56.12 1x1y s TRP 71 Cb -0.10 -1.44 -0.02 0.00 -1.15 0.00 0.00 33.47 30.75 1x1y s TRP 71 CO 0.02 0.51 0.05 1.03 0.02 0.00 0.00 176.95 178.58 1x1y s ARG 72 N -2.83 0.65 0.27 4.98 0.52 -0.19 -0.84 118.95 121.50 1x1y s ARG 72 Ca 0.28 -1.02 0.03 0.00 -0.52 0.00 0.00 55.73 54.50 1x1y s ARG 72 Cb -0.10 0.24 -0.06 0.00 0.52 0.00 0.00 34.95 35.56 1x1y s ARG 72 CO 0.19 -0.15 0.03 -1.83 0.02 0.00 0.00 175.30 173.56 1x1y s GLU 73 N -3.50 1.46 -0.11 3.54 -1.05 -0.53 -1.19 118.70 117.31 1x1y s GLU 73 Ca 0.03 -1.77 -0.24 0.00 -0.15 0.00 0.00 54.97 52.84 1x1y s GLU 73 Cb 0.04 -0.64 0.06 0.00 -0.44 0.00 0.00 34.13 33.15 1x1y s GLU 73 CO -0.09 -0.16 0.57 0.00 0.95 0.00 0.00 175.26 176.53 1x1y s ALA 74 N -3.44 -1.45 0.21 -0.84 0.00 -0.43 -0.19 121.76 115.61 1x1y s ALA 74 Ca 0.33 1.27 -0.30 0.00 0.00 0.00 0.00 51.96 53.26 1x1y s ALA 74 Cb 0.07 -0.39 -0.08 0.00 0.00 0.00 0.00 23.12 22.72 1x1y s ALA 74 CO 0.12 -0.31 1.13 -0.51 0.00 0.00 0.00 175.76 176.19 1x1y s ASP 75 N -0.59 7.20 0.06 0.00 1.11 -0.04 -0.63 116.67 123.79 1x1y s ASP 75 Ca -0.07 2.18 0.09 0.00 0.18 0.00 0.00 52.55 54.93 1x1y s ASP 75 Cb -0.03 -2.61 -0.03 0.00 1.07 0.00 0.00 42.92 41.32 1x1y s ASP 75 CO 0.05 -0.25 -0.22 -0.63 1.18 0.00 0.00 175.17 175.30 1x1y s ILE 76 N -0.41 2.50 -1.61 0.77 -1.09 -0.71 -4.68 121.20 115.97 1x1y s ILE 76 Ca 0.49 -1.38 0.00 0.00 -2.23 0.00 0.00 60.65 57.53 1x1y s ILE 76 Cb -0.31 -2.05 0.00 0.00 -1.58 0.00 0.00 42.46 38.52 1x1y s ILE 76 CO 0.37 0.28 0.00 0.59 -1.23 0.00 0.00 174.94 174.95 1x1y n ASN 77 N 1.44 -4.89 -4.77 3.58 3.02 -0.04 -4.50 115.26 109.09 1x1y n ASN 77 Ca -0.17 0.29 -0.38 0.00 -0.03 0.00 0.00 54.58 54.30 1x1y n ASN 77 Cb 0.52 -3.85 -0.06 0.00 -0.61 0.00 0.00 39.78 35.79 1x1y n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1x1y s TYR 78 N -2.65 3.62 0.07 3.10 5.04 -1.26 -4.95 117.35 120.33 1x1y s TYR 78 Ca 0.00 0.96 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 1x1y s TYR 78 Cb 0.00 -2.44 0.00 0.00 0.35 0.00 0.00 41.96 39.87 1x1y s TYR 78 CO 0.00 0.39 0.00 0.25 -1.34 0.00 0.00 175.55 174.85 1x1y n THR 79 N 2.77 0.64 -3.71 4.34 -2.24 -1.26 -4.93 114.28 109.89 1x1y n THR 79 Ca -0.10 0.21 -0.07 0.00 -2.27 0.00 0.00 64.05 61.82 1x1y n THR 79 Cb 0.52 -1.44 -0.02 0.00 -2.10 0.00 0.00 70.33 67.29 1x1y n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1x1y s SER 80 N -5.52 -0.31 0.00 3.42 1.04 -1.26 -4.75 113.70 106.32 1x1y s SER 80 Ca 0.00 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.05 1x1y s SER 80 Cb 0.00 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1x1y s SER 80 CO 0.00 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.74 1x1y n GLY 81 N -0.43 -0.52 3.79 7.32 0.00 -1.25 -4.88 105.19 109.23 1x1y n GLY 81 Ca -0.07 -1.27 -0.33 0.00 0.00 0.00 0.00 46.02 44.34 1x1y n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x1y s PHE 82 N 0.00 2.82 0.57 1.61 0.08 -1.26 -4.63 117.98 117.18 1x1y s PHE 82 Ca 0.00 1.54 -0.18 0.00 0.12 0.00 0.00 56.93 58.40 1x1y s PHE 82 Cb 0.00 -3.11 -0.04 0.00 -0.57 0.00 0.00 43.02 39.30 1x1y s PHE 82 CO 0.00 -1.33 1.13 1.03 -0.10 0.00 0.00 175.22 175.94 1x1y s ARG 83 N -3.85 3.20 0.00 0.44 0.52 -1.26 -5.00 118.95 113.00 1x1y s ARG 83 Ca 0.67 1.56 0.00 0.00 -0.52 0.00 0.00 55.73 57.43 1x1y s ARG 83 Cb -0.19 -1.99 0.00 0.00 0.52 0.00 0.00 34.95 33.29 1x1y s ARG 83 CO 0.35 -0.96 0.00 0.27 0.02 0.00 0.00 175.30 174.98 1x1y n ASN 84 N -1.60 0.00 -1.02 0.23 0.23 -1.26 -5.03 115.26 106.81 1x1y n ASN 84 Ca 0.11 -0.40 0.08 0.00 -0.53 0.00 0.00 54.58 53.85 1x1y n ASN 84 Cb 0.51 0.00 0.25 0.00 -2.08 0.00 0.00 39.78 38.46 1x1y n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1x1y n SER 85 N -1.19 3.71 -4.72 0.53 3.41 -1.26 -4.98 113.62 109.13 1x1y n SER 85 Ca 0.00 -2.30 -0.35 0.00 -0.26 0.00 0.00 58.87 55.95 1x1y n SER 85 Cb 0.00 -0.41 -0.08 0.00 -0.26 0.00 0.00 64.21 63.46 1x1y n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1x1y s ASP 86 N -1.15 6.22 -0.00 4.04 1.01 -1.26 -2.15 116.67 123.38 1x1y s ASP 86 Ca 0.37 0.24 -0.05 0.00 0.71 0.00 0.00 52.55 53.83 1x1y s ASP 86 Cb 0.23 -2.10 -0.00 0.00 1.01 0.00 0.00 42.92 42.06 1x1y s ASP 86 CO 0.19 0.15 0.09 -0.13 0.21 0.00 0.00 175.17 175.67 1x1y s ARG 87 N 0.50 0.37 -0.07 8.23 1.81 -0.30 -1.73 118.95 127.76 1x1y s ARG 87 Ca 0.09 -0.36 0.01 0.00 -1.72 0.00 0.00 55.73 53.75 1x1y s ARG 87 Cb -0.12 0.15 -0.03 0.00 -0.45 0.00 0.00 34.95 34.51 1x1y s ARG 87 CO -0.00 -0.08 -0.09 -1.50 -0.68 0.00 0.00 175.30 172.95 1x1y s ILE 88 N -1.14 3.51 -0.12 1.52 2.07 0.20 -1.38 121.20 125.86 1x1y s ILE 88 Ca -0.12 -0.54 0.03 0.00 -1.41 0.00 0.00 60.65 58.60 1x1y s ILE 88 Cb -0.07 -2.43 0.01 0.00 0.13 0.00 0.00 42.46 40.10 1x1y s ILE 88 CO 0.01 0.59 -0.21 -0.76 -1.91 0.00 0.00 174.94 172.65 1x1y s LEU 89 N -0.65 2.02 0.00 8.50 2.01 0.88 -1.32 118.68 130.12 1x1y s LEU 89 Ca 0.10 -0.55 0.03 0.00 0.01 0.00 0.00 54.13 53.72 1x1y s LEU 89 Cb -0.11 -1.35 -0.01 0.00 0.01 0.00 0.00 46.19 44.73 1x1y s LEU 89 CO 0.01 0.08 -0.09 -0.72 1.01 0.00 0.00 176.35 176.65 1x1y s TYR 90 N 0.73 0.81 0.52 0.29 1.13 -0.33 -0.28 117.35 120.23 1x1y s TYR 90 Ca -0.10 -0.19 0.05 0.00 -1.41 0.00 0.00 57.07 55.42 1x1y s TYR 90 Cb -0.16 -0.51 0.04 0.00 -1.10 0.00 0.00 41.96 40.23 1x1y s TYR 90 CO 0.01 -0.01 0.72 -1.54 -2.51 0.00 0.00 175.55 172.22 1x1y s SER 91 N -0.38 5.30 0.52 -0.18 1.04 -0.74 -1.02 113.70 118.23 1x1y s SER 91 Ca 0.02 -0.33 0.30 0.00 0.48 0.00 0.00 55.95 56.42 1x1y s SER 91 Cb -0.04 -0.53 1.36 0.00 0.10 0.00 0.00 66.02 66.91 1x1y s SER 91 CO -0.00 -1.10 2.00 0.77 0.98 0.00 0.00 173.24 175.88 1x1y h SER 92 N 0.24 0.00 -0.52 7.02 4.64 -1.27 -1.68 113.55 121.97 1x1y h SER 92 Ca -0.39 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.90 1x1y h SER 92 Cb 1.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 1x1y h SER 92 CO 0.46 0.10 0.04 -0.90 -0.87 0.00 0.00 176.83 175.66 1x1y n ASP 93 N -3.33 5.14 -2.63 4.97 5.75 -1.26 -4.97 116.55 120.22 1x1y n ASP 93 Ca -0.01 -3.01 -0.18 0.00 -0.01 0.00 0.00 54.79 51.58 1x1y n ASP 93 Cb 0.30 -0.66 0.04 0.00 -1.03 0.00 0.00 41.12 39.77 1x1y n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1x1y n TRP 94 N 0.21 -1.84 -3.00 2.11 7.02 -0.63 -5.02 117.44 116.28 1x1y n TRP 94 Ca 0.28 0.56 -0.38 0.00 -1.02 0.00 0.00 57.50 56.94 1x1y n TRP 94 Cb 1.15 -3.95 -0.06 0.00 -2.42 0.00 0.00 31.31 26.04 1x1y n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1x1y s LEU 95 N -5.62 4.50 -0.08 -0.99 1.43 -1.26 -4.85 118.68 111.82 1x1y s LEU 95 Ca 0.33 1.59 0.01 0.00 -1.03 0.00 0.00 54.13 55.03 1x1y s LEU 95 Cb -0.14 -3.43 0.02 0.00 0.03 0.00 0.00 46.19 42.67 1x1y s LEU 95 CO 0.40 0.14 -0.09 -0.63 0.23 0.00 0.00 176.35 176.41 1x1y s ILE 96 N -1.29 0.95 0.29 -0.59 1.01 -1.00 -1.78 121.20 118.79 1x1y s ILE 96 Ca 0.39 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.77 1x1y s ILE 96 Cb -0.21 -0.93 -0.06 0.00 0.01 0.00 0.00 42.46 41.27 1x1y s ILE 96 CO 0.24 0.33 -0.03 -0.31 0.00 0.00 0.00 174.94 175.17 1x1y s TYR 97 N 1.09 1.99 0.07 3.97 1.51 0.62 -0.45 117.35 126.14 1x1y s TYR 97 Ca -0.07 -0.74 -0.00 0.00 -1.01 0.00 0.00 57.07 55.24 1x1y s TYR 97 Cb -0.14 -1.18 -0.04 0.00 -0.11 0.00 0.00 41.96 40.49 1x1y s TYR 97 CO -0.01 0.24 -0.03 -1.59 -1.11 0.00 0.00 175.55 173.06 1x1y s LYS 98 N -3.75 0.69 -0.07 -0.62 -2.85 0.08 -0.09 119.74 113.14 1x1y s LYS 98 Ca 0.31 -1.27 -0.06 0.00 -1.00 0.00 0.00 55.97 53.96 1x1y s LYS 98 Cb 0.05 0.13 0.02 0.00 -2.06 0.00 0.00 37.83 35.97 1x1y s LYS 98 CO 0.13 -0.11 0.18 -0.08 0.10 0.00 0.00 175.35 175.57 1x1y s THR 99 N -3.87 -0.01 0.00 3.79 -1.32 -0.48 -0.83 115.64 112.92 1x1y s THR 99 Ca 0.10 0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.61 1x1y s THR 99 Cb 0.07 -0.26 0.00 0.00 -1.51 0.00 0.00 72.50 70.80 1x1y s THR 99 CO -0.08 0.01 0.66 0.35 -2.21 0.00 0.00 174.62 173.36 1x1y n THR 100 N 3.21 0.38 -2.19 5.08 -2.24 -1.26 -1.15 114.28 116.11 1x1y n THR 100 Ca -0.15 -0.64 -0.22 0.00 -2.27 0.00 0.00 64.05 60.78 1x1y n THR 100 Cb 0.58 0.87 0.02 0.00 -2.10 0.00 0.00 70.33 69.70 1x1y n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1x1y n ASP 101 N -0.19 4.46 -3.72 3.42 5.68 -1.24 -4.61 116.55 120.35 1x1y n ASP 101 Ca 0.00 -3.54 -0.28 0.00 -0.50 0.00 0.00 54.79 50.48 1x1y n ASP 101 Cb 0.13 -0.38 0.03 0.00 -1.14 0.00 0.00 41.12 39.76 1x1y n ASP 101 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 1x1y n HIS 102 N -0.65 -1.88 -1.11 2.11 -0.00 -0.91 -2.61 115.22 110.16 1x1y n HIS 102 Ca 0.39 0.60 -0.04 0.00 -0.00 0.00 0.00 57.72 58.66 1x1y n HIS 102 Cb 0.90 -3.70 -0.02 0.00 -0.00 0.00 0.00 29.99 27.18 1x1y n HIS 102 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1x1y n TYR 103 N -4.19 0.00 -0.01 1.57 4.02 -1.26 -4.90 117.16 112.39 1x1y n TYR 103 Ca -0.17 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.55 1x1y n TYR 103 Cb 0.63 -1.57 -0.11 0.00 -0.02 0.00 0.00 39.34 38.27 1x1y n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1x1y h GLN 104 N 0.27 0.37 -4.89 -0.72 4.20 -1.92 -3.46 115.11 108.96 1x1y h GLN 104 Ca -0.08 -0.37 -0.33 0.00 0.06 0.00 0.00 58.65 57.93 1x1y h GLN 104 Cb 0.69 0.10 -0.21 0.00 0.30 0.00 0.00 27.48 28.35 1x1y h GLN 104 CO 0.12 1.04 -0.75 0.95 -0.67 0.00 0.00 178.83 179.52 1x1y s THR 105 N -3.29 0.78 0.12 -0.54 -4.23 -1.26 -5.12 115.64 102.10 1x1y s THR 105 Ca -0.14 -1.18 0.08 0.00 -1.18 0.00 0.00 61.69 59.27 1x1y s THR 105 Cb 0.03 -0.81 -0.04 0.00 1.34 0.00 0.00 72.50 73.02 1x1y s THR 105 CO 0.80 -0.32 -0.20 -0.36 -0.54 0.00 0.00 174.62 174.00 1x1y s PHE 106 N -1.36 1.80 -0.10 3.99 0.08 -1.26 -4.47 117.98 116.65 1x1y s PHE 106 Ca -0.06 -0.43 0.02 0.00 0.12 0.00 0.00 56.93 56.57 1x1y s PHE 106 Cb -0.10 -0.96 0.02 0.00 -0.57 0.00 0.00 43.02 41.41 1x1y s PHE 106 CO 0.01 0.24 -0.13 0.99 -0.10 0.00 0.00 175.22 176.23 1x1y s THR 107 N -1.43 1.33 0.01 0.64 2.01 -0.01 -4.93 115.64 113.25 1x1y s THR 107 Ca 0.09 -0.55 -0.30 0.00 0.31 0.00 0.00 61.69 61.24 1x1y s THR 107 Cb -0.09 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.15 1x1y s THR 107 CO 0.05 0.41 1.22 -0.75 -0.69 0.00 0.00 174.62 174.85 1x1y s LYS 108 N 0.98 4.39 -0.00 4.92 2.20 -1.26 -0.74 119.74 130.22 1x1y s LYS 108 Ca -0.08 1.74 0.04 0.00 -0.36 0.00 0.00 55.97 57.31 1x1y s LYS 108 Cb -0.15 -3.46 -0.04 0.00 -1.51 0.00 0.00 37.83 32.67 1x1y s LYS 108 CO -0.01 -0.36 0.14 0.44 -0.36 0.00 0.00 175.35 175.20 1x1y n ILE 109 N 4.28 0.00 -1.32 5.43 -5.35 0.40 -4.95 119.36 117.84 1x1y n ILE 109 Ca 0.10 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.21 1x1y n ILE 109 Cb 0.46 0.93 0.00 0.00 -1.74 0.00 0.00 39.64 39.29 1x1y n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33