#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f56 s ILE 2 N 0.00 3.39 0.00 1.34 1.01 -1.26 -4.92 121.20 120.76 2f56 s ILE 2 Ca 0.00 -1.15 0.12 0.00 0.00 0.00 0.00 60.65 59.63 2f56 s ILE 2 Cb 0.00 -2.88 0.21 0.00 0.01 0.00 0.00 42.46 39.80 2f56 s ILE 2 CO 0.00 -0.06 1.03 -0.46 0.00 0.00 0.00 174.94 175.45 2f56 n ASN 3 N 4.73 0.30 -4.95 3.58 6.94 -1.26 -4.79 115.26 119.81 2f56 n ASN 3 Ca -0.14 -1.91 -0.22 0.00 -0.02 0.00 0.00 54.58 52.30 2f56 n ASN 3 Cb 0.45 -0.14 -0.02 0.00 -2.36 0.00 0.00 39.78 37.71 2f56 n ASN 3 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2f56 s THR 4 N 0.00 5.15 0.16 5.53 -4.23 -1.26 -1.61 115.64 119.38 2f56 s THR 4 Ca 0.16 -1.01 -0.18 0.00 -1.18 0.00 0.00 61.69 59.48 2f56 s THR 4 Cb 0.19 -3.78 0.07 0.00 1.34 0.00 0.00 72.50 70.32 2f56 s THR 4 CO -0.08 -0.31 1.67 -0.26 -0.54 0.00 0.00 174.62 175.10 2f56 h PHE 5 N 1.33 -0.22 -0.22 3.99 0.04 -1.98 -0.06 116.94 119.82 2f56 h PHE 5 Ca -0.51 0.03 -0.10 0.00 2.80 0.00 0.00 57.97 60.19 2f56 h PHE 5 Cb 1.23 0.15 -0.00 0.00 2.20 0.00 0.00 35.95 39.53 2f56 h PHE 5 CO 0.47 -0.17 -0.25 -0.44 -0.60 0.00 0.00 178.31 177.32 2f56 h ASP 6 N -0.02 0.60 -0.32 2.17 3.32 -1.99 -1.23 116.42 118.95 2f56 h ASP 6 Ca 0.17 -0.49 0.00 0.00 0.02 0.00 0.00 57.03 56.73 2f56 h ASP 6 Cb 0.28 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2f56 h ASP 6 CO -0.38 0.97 0.21 1.23 -1.72 0.00 0.00 179.24 179.55 2f56 h GLY 7 N 0.24 0.46 1.71 2.75 0.00 -1.94 -1.64 103.07 104.64 2f56 h GLY 7 Ca 0.03 -0.17 -0.17 0.00 0.00 0.00 0.00 47.33 47.02 2f56 h GLY 7 CO 0.06 0.17 -0.69 -2.08 0.00 0.00 0.00 176.54 174.00 2f56 h VAL 8 N 0.44 1.40 -0.52 4.60 2.07 -1.03 -2.16 116.25 121.05 2f56 h VAL 8 Ca 0.12 -2.14 -0.06 0.00 0.82 0.00 0.00 66.70 65.44 2f56 h VAL 8 Cb -0.05 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 2f56 h VAL 8 CO -0.03 0.63 0.10 0.00 0.02 0.00 0.00 177.57 178.30 2f56 h ALA 9 N 1.07 0.69 -0.27 1.67 0.00 -0.98 -1.90 119.26 119.54 2f56 h ALA 9 Ca -0.02 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 2f56 h ALA 9 Cb 1.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2f56 h ALA 9 CO 0.11 0.42 -0.44 -0.44 0.00 0.00 0.00 179.25 178.90 2f56 h ASP 10 N 0.74 0.73 -0.48 0.00 3.32 -1.29 -2.76 116.42 116.68 2f56 h ASP 10 Ca 0.16 -0.35 -0.00 0.00 0.02 0.00 0.00 57.03 56.86 2f56 h ASP 10 Cb 0.38 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2f56 h ASP 10 CO 0.01 1.07 0.29 0.22 -1.72 0.00 0.00 179.24 179.10 2f56 h TYR 11 N 0.55 0.64 -0.41 4.55 5.03 -1.23 -2.51 116.97 123.58 2f56 h TYR 11 Ca 0.04 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.34 2f56 h TYR 11 Cb 0.98 -0.21 -0.02 0.00 1.55 0.00 0.00 36.73 39.03 2f56 h TYR 11 CO 0.05 0.45 0.26 -0.07 -1.32 0.00 0.00 178.16 177.53 2f56 h LEU 12 N 0.64 0.49 -1.13 2.82 3.38 -1.24 0.32 115.31 120.59 2f56 h LEU 12 Ca 0.17 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 2f56 h LEU 12 Cb -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2f56 h LEU 12 CO -0.03 0.38 -0.41 1.56 0.09 0.00 0.00 178.44 180.03 2f56 h GLN 13 N 0.55 0.00 0.06 1.13 4.20 -1.38 0.70 115.11 120.37 2f56 h GLN 13 Ca 0.15 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.59 2f56 h GLN 13 Cb -0.03 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 2f56 h GLN 13 CO -0.03 0.41 -1.44 1.15 -0.67 0.00 0.00 178.83 178.25 2f56 h THR 14 N 0.00 0.90 -0.01 -0.54 2.02 -1.31 -3.41 112.91 110.56 2f56 h THR 14 Ca -0.00 -2.28 0.00 0.00 0.77 0.00 0.00 66.41 64.89 2f56 h THR 14 Cb 0.79 2.47 0.00 0.00 -1.74 0.00 0.00 68.15 69.67 2f56 h THR 14 CO 0.05 0.58 -0.46 -1.22 0.37 0.00 0.00 175.52 174.84 2f56 n TYR 15 N -4.06 0.00 -2.16 3.16 4.01 0.11 -4.99 117.16 113.23 2f56 n TYR 15 Ca -0.29 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.26 2f56 n TYR 15 Cb 0.82 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.83 2f56 n TYR 15 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2f56 n HIS 16 N -0.73 -0.67 -3.75 -0.72 8.25 0.24 -4.96 115.22 112.89 2f56 n HIS 16 Ca 0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.40 2f56 n HIS 16 Cb 0.26 -3.49 -0.05 0.00 1.12 0.00 0.00 29.99 27.82 2f56 n HIS 16 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2f56 s LYS 17 N -4.60 1.12 0.51 -0.41 -2.85 -1.26 -5.04 119.74 107.22 2f56 s LYS 17 Ca 0.00 -0.86 -0.18 0.00 -1.00 0.00 0.00 55.97 53.92 2f56 s LYS 17 Cb 0.00 0.45 -0.07 0.00 -2.06 0.00 0.00 37.83 36.14 2f56 s LYS 17 CO 0.00 -0.43 1.02 -0.51 0.10 0.00 0.00 175.35 175.53 2f56 s LEU 18 N -2.86 3.72 0.99 2.77 1.43 -1.26 -4.05 118.68 119.43 2f56 s LEU 18 Ca 0.07 1.79 -0.13 0.00 -1.03 0.00 0.00 54.13 54.83 2f56 s LEU 18 Cb 0.02 -4.54 0.09 0.00 0.03 0.00 0.00 46.19 41.79 2f56 s LEU 18 CO -0.08 -0.79 0.53 -2.65 0.23 0.00 0.00 176.35 173.60 2f56 n PRO 19 N -1.34 -0.75 0.00 1.29 -0.02 -1.26 -4.90 135.00 128.03 2f56 n PRO 19 Ca 0.08 -0.18 0.12 0.00 -2.02 0.00 0.00 63.50 61.50 2f56 n PRO 19 Cb 0.53 -1.96 0.61 0.00 -0.02 0.00 0.00 33.50 32.66 2f56 n PRO 19 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2f56 n ASP 20 N -2.27 0.00 -0.50 2.55 8.00 -1.26 -2.63 116.55 120.44 2f56 n ASP 20 Ca 0.06 -0.03 0.03 0.00 0.71 0.00 0.00 54.79 55.56 2f56 n ASP 20 Cb 0.55 -0.30 0.10 0.00 -0.02 0.00 0.00 41.12 41.45 2f56 n ASP 20 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2f56 n ASN 21 N -1.30 1.41 -4.56 -2.24 6.94 -1.26 -4.87 115.26 109.38 2f56 n ASN 21 Ca 0.11 -2.06 -0.34 0.00 -0.02 0.00 0.00 54.58 52.28 2f56 n ASN 21 Cb 0.20 -0.23 -0.11 0.00 -2.36 0.00 0.00 39.78 37.27 2f56 n ASN 21 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2f56 s TYR 22 N -1.67 2.93 0.03 -2.53 2.02 -1.08 0.24 117.35 117.29 2f56 s TYR 22 Ca 0.15 -0.04 0.02 0.00 -0.37 0.00 0.00 57.07 56.83 2f56 s TYR 22 Cb 0.08 -1.73 -0.02 0.00 -0.40 0.00 0.00 41.96 39.89 2f56 s TYR 22 CO 0.09 0.27 -0.08 0.96 -1.57 0.00 0.00 175.55 175.22 2f56 s ILE 23 N -0.66 0.57 0.84 2.71 -4.36 -0.51 -4.89 121.20 114.89 2f56 s ILE 23 Ca 0.10 -0.87 -0.12 0.00 -0.26 0.00 0.00 60.65 59.50 2f56 s ILE 23 Cb -0.11 -0.59 0.09 0.00 1.25 0.00 0.00 42.46 43.10 2f56 s ILE 23 CO 0.02 -0.23 1.10 0.42 0.24 0.00 0.00 174.94 176.49 2f56 s THR 24 N -1.03 2.79 0.32 8.37 -4.23 -1.18 -0.96 115.64 119.73 2f56 s THR 24 Ca -0.06 0.26 0.01 0.00 -1.18 0.00 0.00 61.69 60.71 2f56 s THR 24 Cb -0.08 -2.96 0.27 0.00 1.34 0.00 0.00 72.50 71.07 2f56 s THR 24 CO 0.00 -0.34 1.98 0.11 -0.54 0.00 0.00 174.62 175.83 2f56 h LYS 25 N -1.25 0.96 -0.31 3.99 1.57 -1.97 -1.48 116.57 118.09 2f56 h LYS 25 Ca -0.48 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.08 2f56 h LYS 25 Cb 1.28 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 2f56 h LYS 25 CO 0.59 0.63 -0.43 0.77 -0.57 0.00 0.00 179.45 180.44 2f56 h SER 26 N 0.98 0.86 -0.64 0.86 0.02 -1.99 -0.80 113.55 112.84 2f56 h SER 26 Ca 0.29 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 2f56 h SER 26 Cb -0.05 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 2f56 h SER 26 CO -0.07 1.17 0.36 -0.33 -1.14 0.00 0.00 176.83 176.81 2f56 h GLU 27 N 0.64 0.89 -0.48 3.45 5.08 -1.88 -1.61 114.58 120.67 2f56 h GLU 27 Ca 0.04 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2f56 h GLU 27 Cb 1.00 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 2f56 h GLU 27 CO 0.10 0.66 0.17 0.00 -1.00 0.00 0.00 179.01 178.94 2f56 h ALA 28 N 1.17 0.62 -0.58 3.43 0.00 -1.10 -2.74 119.26 120.07 2f56 h ALA 28 Ca 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2f56 h ALA 28 Cb 0.03 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2f56 h ALA 28 CO -0.04 0.25 0.24 1.96 0.00 0.00 0.00 179.25 181.66 2f56 h GLN 29 N 0.63 0.83 0.00 0.00 4.20 -0.92 -1.48 115.11 118.37 2f56 h GLN 29 Ca 0.16 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 2f56 h GLN 29 Cb 0.23 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 2f56 h GLN 29 CO -0.01 0.67 -0.03 0.00 -0.67 0.00 0.00 178.83 178.79 2f56 h ALA 30 N 1.45 1.06 0.00 3.87 0.00 -1.00 -1.89 119.26 122.74 2f56 h ALA 30 Ca 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2f56 h ALA 30 Cb 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2f56 h ALA 30 CO -0.02 0.04 -0.51 1.28 0.00 0.00 0.00 179.25 180.04 2f56 n LEU 31 N -3.21 0.50 0.00 0.00 4.77 -0.64 -4.93 117.00 113.49 2f56 n LEU 31 Ca -0.01 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2f56 n LEU 31 Cb 0.21 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2f56 n LEU 31 CO 0.25 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 2f56 n GLY 32 N 1.49 1.27 3.70 -0.72 0.00 -0.71 -4.97 105.19 105.25 2f56 n GLY 32 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2f56 n GLY 32 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2f56 s TRP 33 N -2.00 2.97 -0.31 1.61 -0.00 -0.68 -4.95 118.94 115.58 2f56 s TRP 33 Ca 0.00 0.86 0.02 0.00 -0.00 0.00 0.00 56.10 56.99 2f56 s TRP 33 Cb 0.00 -3.66 0.08 0.00 -0.00 0.00 0.00 33.47 29.89 2f56 s TRP 33 CO 0.00 -2.41 -0.00 0.08 -0.00 0.00 0.00 176.95 174.61 2f56 s VAL 34 N 1.99 2.42 0.29 5.86 1.01 -1.26 -4.47 120.40 126.24 2f56 s VAL 34 Ca 0.64 -1.93 0.04 0.00 0.00 0.00 0.00 61.98 60.73 2f56 s VAL 34 Cb -0.33 -2.59 0.29 0.00 0.00 0.00 0.00 36.38 33.76 2f56 s VAL 34 CO 0.28 -0.33 1.80 0.00 0.00 0.00 0.00 175.10 176.85 2f56 h ALA 35 N 7.76 1.60 0.00 5.51 0.00 -1.99 0.13 119.26 132.27 2f56 h ALA 35 Ca -0.13 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2f56 h ALA 35 Cb 1.04 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2f56 h ALA 35 CO 0.51 0.04 0.00 0.77 0.00 0.00 0.00 179.25 180.58 2f56 h SER 36 N 0.84 0.00 0.07 0.00 0.02 -2.02 -2.48 113.55 109.97 2f56 h SER 36 Ca 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 2f56 h SER 36 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 2f56 h SER 36 CO -0.34 0.00 -1.18 0.29 -1.14 0.00 0.00 176.83 174.46 2f56 n LYS 37 N -2.75 0.17 -3.62 3.45 5.02 0.42 -5.00 118.16 115.85 2f56 n LYS 37 Ca 0.00 -0.04 -0.23 0.00 -2.02 0.00 0.00 58.31 56.02 2f56 n LYS 37 Cb 0.22 -1.51 0.07 0.00 -0.02 0.00 0.00 35.03 33.78 2f56 n LYS 37 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f56 n GLY 38 N 1.44 -0.49 1.18 0.72 0.00 -0.94 -4.88 105.19 102.22 2f56 n GLY 38 Ca 0.02 0.21 0.08 0.00 0.00 0.00 0.00 46.02 46.33 2f56 n GLY 38 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2f56 n ASN 39 N -3.01 4.30 -0.20 1.61 6.94 -1.25 -3.61 115.26 120.03 2f56 n ASN 39 Ca -0.06 -2.78 -0.04 0.00 -0.02 0.00 0.00 54.58 51.67 2f56 n ASN 39 Cb 0.58 -0.54 0.06 0.00 -2.36 0.00 0.00 39.78 37.52 2f56 n ASN 39 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2f56 h LEU 40 N 2.65 0.57 -1.97 -4.53 5.85 -1.88 -1.52 115.31 114.48 2f56 h LEU 40 Ca 0.00 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2f56 h LEU 40 Cb 1.47 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.38 2f56 h LEU 40 CO 0.25 0.40 -0.10 0.00 -0.34 0.00 0.00 178.44 178.65 2f56 h ALA 41 N 1.26 1.29 0.04 1.25 0.00 -1.85 0.53 119.26 121.78 2f56 h ALA 41 Ca 0.24 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.88 2f56 h ALA 41 Cb 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.83 2f56 h ALA 41 CO -0.11 0.13 -0.72 -0.44 0.00 0.00 0.00 179.25 178.11 2f56 h ASP 42 N 0.00 0.57 0.68 0.00 3.32 -1.65 -3.12 116.42 116.22 2f56 h ASP 42 Ca -0.00 -0.80 -0.27 0.00 0.02 0.00 0.00 57.03 55.98 2f56 h ASP 42 Cb 0.30 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2f56 h ASP 42 CO 0.01 1.31 -1.25 -0.37 -1.72 0.00 0.00 179.24 177.22 2f56 h VAL 43 N -0.10 1.47 -2.02 -1.35 -1.51 -0.94 -3.40 116.25 108.41 2f56 h VAL 43 Ca -0.10 -3.09 -0.54 0.00 -1.23 0.00 0.00 66.70 61.73 2f56 h VAL 43 Cb 1.45 2.88 -0.37 0.00 -2.13 0.00 0.00 31.29 33.13 2f56 h VAL 43 CO 0.14 0.89 -1.01 0.00 -1.23 0.00 0.00 177.57 176.35 2f56 n ALA 44 N -2.51 2.29 -1.71 5.19 0.00 0.14 -5.04 120.51 118.87 2f56 n ALA 44 Ca -0.08 -3.13 -0.43 0.00 0.00 0.00 0.00 53.44 49.80 2f56 n ALA 44 Cb 1.01 -0.83 -0.02 0.00 0.00 0.00 0.00 19.45 19.61 2f56 n ALA 44 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2f56 n PRO 45 N 2.01 2.34 0.00 0.00 -0.02 -1.18 -1.91 135.00 136.23 2f56 n PRO 45 Ca 0.24 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.55 2f56 n PRO 45 Cb 0.52 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 2f56 n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f56 n GLY 46 N 1.92 1.66 3.93 -1.23 0.00 -1.26 -5.04 105.19 105.17 2f56 n GLY 46 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 2f56 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f56 s LYS 47 N -0.46 3.51 0.14 1.61 -0.14 -0.80 -4.78 119.74 118.80 2f56 s LYS 47 Ca 0.00 -0.39 0.07 0.00 -1.36 0.00 0.00 55.97 54.29 2f56 s LYS 47 Cb 0.00 -2.81 -0.04 0.00 -1.68 0.00 0.00 37.83 33.30 2f56 s LYS 47 CO 0.00 0.36 -0.15 -1.12 -0.76 0.00 0.00 175.35 173.68 2f56 s SER 48 N -3.42 2.17 0.07 2.83 0.01 0.14 -4.83 113.70 110.66 2f56 s SER 48 Ca 0.38 -0.84 -0.30 0.00 1.31 0.00 0.00 55.95 56.50 2f56 s SER 48 Cb -0.10 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 65.98 2f56 s SER 48 CO 0.30 -0.13 1.11 -0.63 0.41 0.00 0.00 173.24 174.30 2f56 s ILE 49 N -2.19 4.26 -0.19 1.44 -1.09 -1.26 -1.42 121.20 120.74 2f56 s ILE 49 Ca 0.11 1.69 -0.35 0.00 -2.23 0.00 0.00 60.65 59.86 2f56 s ILE 49 Cb -0.05 -4.08 0.14 0.00 -1.58 0.00 0.00 42.46 36.90 2f56 s ILE 49 CO 0.04 0.17 1.29 -0.83 -1.23 0.00 0.00 174.94 174.37 2f56 s GLY 50 N 0.79 -0.29 0.00 6.18 0.00 -0.14 -0.30 107.32 113.56 2f56 s GLY 50 Ca 0.55 1.54 0.00 0.00 0.00 0.00 0.00 44.72 46.80 2f56 s GLY 50 CO 0.30 0.49 0.00 0.61 0.00 0.00 0.00 173.10 174.50 2f56 n GLY 51 N -0.14 0.50 3.83 0.20 0.00 0.81 -3.08 105.19 107.31 2f56 n GLY 51 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2f56 n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2f56 s ASP 52 N -2.36 6.70 0.24 1.61 1.01 -1.21 -4.76 116.67 117.89 2f56 s ASP 52 Ca 0.00 1.61 -0.30 0.00 0.71 0.00 0.00 52.55 54.58 2f56 s ASP 52 Cb 0.00 -2.52 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 2f56 s ASP 52 CO 0.00 -0.53 1.21 -0.63 0.21 0.00 0.00 175.17 175.43 2f56 s ILE 53 N -2.48 3.30 -0.20 0.77 1.01 -1.26 -1.37 121.20 120.97 2f56 s ILE 53 Ca 0.60 1.19 -0.05 0.00 0.00 0.00 0.00 60.65 62.39 2f56 s ILE 53 Cb -0.10 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 2f56 s ILE 53 CO 0.26 0.23 -0.01 0.12 0.00 0.00 0.00 174.94 175.54 2f56 s PHE 54 N -0.53 3.01 0.11 3.97 5.36 -0.05 -4.84 117.98 125.00 2f56 s PHE 54 Ca 0.51 -0.57 0.22 0.00 -0.96 0.00 0.00 56.93 56.13 2f56 s PHE 54 Cb -0.35 -2.09 0.78 0.00 -0.34 0.00 0.00 43.02 41.03 2f56 s PHE 54 CO 0.41 -0.31 1.77 0.66 -1.46 0.00 0.00 175.22 176.29 2f56 h SER 55 N 7.62 0.00 -6.01 6.13 4.64 -1.95 -3.39 113.55 120.59 2f56 h SER 55 Ca -0.37 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.54 2f56 h SER 55 Cb 1.18 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.34 2f56 h SER 55 CO 0.60 0.28 -0.76 -3.20 -0.87 0.00 0.00 176.83 172.89 2f56 n ASN 56 N -3.41 -3.80 -0.31 4.97 5.15 -1.26 -4.88 115.26 111.72 2f56 n ASN 56 Ca 0.00 -0.70 -0.00 0.00 -0.60 0.00 0.00 54.58 53.28 2f56 n ASN 56 Cb 0.48 -4.45 0.13 0.00 -0.53 0.00 0.00 39.78 35.40 2f56 n ASN 56 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 2f56 h ARG 57 N -2.17 0.97 0.00 1.20 -0.00 -2.00 -1.33 114.38 111.05 2f56 h ARG 57 Ca -0.59 -0.06 0.00 0.00 -0.00 0.00 0.00 59.98 59.33 2f56 h ARG 57 Cb 1.36 -0.22 0.00 0.00 -0.00 0.00 0.00 29.97 31.11 2f56 h ARG 57 CO 0.58 0.64 0.00 0.39 -0.00 0.00 0.00 179.97 181.59 2f56 n GLU 58 N -4.60 0.90 -2.97 0.08 4.71 -1.26 -4.89 120.64 112.61 2f56 n GLU 58 Ca 0.12 0.00 -0.20 0.00 -0.01 0.00 0.00 57.16 57.07 2f56 n GLU 58 Cb 0.14 -1.50 0.01 0.00 -1.01 0.00 0.00 31.44 29.08 2f56 n GLU 58 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2f56 n GLY 59 N 1.03 -0.50 0.09 0.62 0.00 -0.50 -4.85 105.19 101.08 2f56 n GLY 59 Ca 0.22 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.45 2f56 n GLY 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2f56 n LYS 60 N -3.54 0.24 -4.07 1.61 5.02 -1.26 -4.76 118.16 111.40 2f56 n LYS 60 Ca -0.09 0.18 -0.33 0.00 -2.02 0.00 0.00 58.31 56.05 2f56 n LYS 60 Cb 0.59 -1.77 -0.07 0.00 -0.02 0.00 0.00 35.03 33.77 2f56 n LYS 60 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2f56 s LEU 61 N -4.36 4.00 0.16 -0.35 1.43 -1.26 -4.95 118.68 113.35 2f56 s LEU 61 Ca 0.10 0.20 -0.31 0.00 -1.03 0.00 0.00 54.13 53.10 2f56 s LEU 61 Cb 0.13 -2.29 -0.10 0.00 0.03 0.00 0.00 46.19 43.96 2f56 s LEU 61 CO 0.61 0.29 1.51 -2.16 0.23 0.00 0.00 176.35 176.82 2f56 s PRO 62 N -1.68 4.25 0.25 1.29 0.04 -1.26 -5.00 135.00 132.88 2f56 s PRO 62 Ca 0.23 2.29 -0.02 0.00 0.04 0.00 0.00 61.00 63.54 2f56 s PRO 62 Cb -0.12 -3.17 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 2f56 s PRO 62 CO 0.13 -0.54 0.46 0.20 0.04 0.00 0.00 177.00 177.29 2f56 s GLY 63 N 1.03 1.75 0.04 0.56 0.00 -1.26 -5.08 107.32 104.35 2f56 s GLY 63 Ca 0.67 -0.76 -0.21 0.00 0.00 0.00 0.00 44.72 44.43 2f56 s GLY 63 CO 0.33 -0.69 0.47 1.25 0.00 0.00 0.00 173.10 174.46 2f56 s LYS 64 N -3.53 0.97 0.22 2.90 2.20 -1.26 -5.08 119.74 116.17 2f56 s LYS 64 Ca 0.40 -0.26 -0.31 0.00 -0.36 0.00 0.00 55.97 55.45 2f56 s LYS 64 Cb -0.11 0.44 -0.10 0.00 -1.51 0.00 0.00 37.83 36.55 2f56 s LYS 64 CO 0.30 -0.34 1.49 0.45 -0.36 0.00 0.00 175.35 176.90 2f56 s SER 65 N -1.91 6.61 -0.84 1.43 0.15 -1.26 -1.42 113.70 116.46 2f56 s SER 65 Ca -0.06 2.66 0.00 0.00 0.70 0.00 0.00 55.95 59.25 2f56 s SER 65 Cb -0.01 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2f56 s SER 65 CO -0.01 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.28 2f56 n GLY 66 N 2.76 0.91 3.69 9.45 0.00 -1.26 -5.00 105.19 115.73 2f56 n GLY 66 Ca 0.09 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 2f56 n GLY 66 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2f56 s ARG 67 N -2.38 4.21 0.18 1.61 3.52 -0.51 -4.96 118.95 120.61 2f56 s ARG 67 Ca 0.00 0.20 0.10 0.00 -0.13 0.00 0.00 55.73 55.90 2f56 s ARG 67 Cb 0.00 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 2f56 s ARG 67 CO 0.00 0.03 -0.15 0.95 -0.81 0.00 0.00 175.30 175.32 2f56 s THR 68 N 1.08 2.90 0.05 4.11 -4.23 -1.26 -4.78 115.64 113.51 2f56 s THR 68 Ca 0.19 -1.75 0.09 0.00 -1.18 0.00 0.00 61.69 59.04 2f56 s THR 68 Cb -0.14 -2.41 -0.03 0.00 1.34 0.00 0.00 72.50 71.25 2f56 s THR 68 CO 0.07 -0.09 -0.25 0.26 -0.54 0.00 0.00 174.62 174.07 2f56 s TRP 69 N -1.63 2.35 0.26 3.99 0.52 -1.26 -1.39 118.94 121.78 2f56 s TRP 69 Ca 0.23 -0.39 0.03 0.00 0.02 0.00 0.00 56.10 55.99 2f56 s TRP 69 Cb -0.09 -1.39 -0.05 0.00 -1.15 0.00 0.00 33.47 30.78 2f56 s TRP 69 CO 0.13 0.15 0.03 1.03 0.02 0.00 0.00 176.95 178.32 2f56 s ARG 70 N -1.31 1.43 0.11 4.98 0.52 -0.38 -0.88 118.95 123.43 2f56 s ARG 70 Ca 0.12 -1.75 0.02 0.00 -0.52 0.00 0.00 55.73 53.60 2f56 s ARG 70 Cb -0.10 -0.59 -0.04 0.00 0.52 0.00 0.00 34.95 34.73 2f56 s ARG 70 CO 0.03 -0.16 -0.07 -1.83 0.02 0.00 0.00 175.30 173.28 2f56 s GLU 71 N -3.91 0.88 -0.06 3.54 -1.05 -0.47 -1.05 118.70 116.58 2f56 s GLU 71 Ca 0.33 -1.35 -0.13 0.00 -0.15 0.00 0.00 54.97 53.67 2f56 s GLU 71 Cb 0.07 -0.29 0.02 0.00 -0.44 0.00 0.00 34.13 33.50 2f56 s GLU 71 CO 0.11 0.00 0.30 0.00 0.95 0.00 0.00 175.26 176.63 2f56 s ALA 72 N -3.54 -0.75 0.36 -0.84 0.00 -0.63 -0.14 121.76 116.22 2f56 s ALA 72 Ca 0.13 0.54 -0.26 0.00 0.00 0.00 0.00 51.96 52.37 2f56 s ALA 72 Cb 0.05 -0.19 -0.09 0.00 0.00 0.00 0.00 23.12 22.89 2f56 s ALA 72 CO -0.04 -0.21 1.09 -0.51 0.00 0.00 0.00 175.76 176.09 2f56 s ASP 73 N -0.67 6.86 0.10 0.00 1.11 0.59 -1.44 116.67 123.22 2f56 s ASP 73 Ca -0.08 2.17 0.10 0.00 0.18 0.00 0.00 52.55 54.92 2f56 s ASP 73 Cb -0.04 -2.60 -0.04 0.00 1.07 0.00 0.00 42.92 41.31 2f56 s ASP 73 CO 0.02 -0.42 -0.25 -0.63 1.18 0.00 0.00 175.17 175.07 2f56 s ILE 74 N -1.46 2.04 -1.74 0.77 -1.09 -0.84 -4.75 121.20 114.14 2f56 s ILE 74 Ca 0.54 -1.59 0.00 0.00 -2.23 0.00 0.00 60.65 57.36 2f56 s ILE 74 Cb -0.27 -1.81 0.00 0.00 -1.58 0.00 0.00 42.46 38.81 2f56 s ILE 74 CO 0.34 0.11 0.00 0.59 -1.23 0.00 0.00 174.94 174.75 2f56 n ASN 75 N 1.19 -4.99 -4.70 3.58 3.02 -0.63 -4.52 115.26 108.20 2f56 n ASN 75 Ca -0.18 0.39 -0.41 0.00 -0.03 0.00 0.00 54.58 54.35 2f56 n ASN 75 Cb 0.53 -3.95 -0.04 0.00 -0.61 0.00 0.00 39.78 35.71 2f56 n ASN 75 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2f56 s TYR 76 N -2.62 3.58 0.00 3.10 5.04 -1.26 -4.93 117.35 120.26 2f56 s TYR 76 Ca 0.00 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 56.13 2f56 s TYR 76 Cb 0.00 -3.02 0.00 0.00 0.35 0.00 0.00 41.96 39.29 2f56 s TYR 76 CO 0.00 -0.04 0.00 0.25 -1.34 0.00 0.00 175.55 174.42 2f56 n THR 77 N 4.06 0.00 -3.76 4.34 -2.24 -1.26 -4.96 114.28 110.46 2f56 n THR 77 Ca 0.04 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.75 2f56 n THR 77 Cb 0.50 -0.61 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 2f56 n THR 77 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2f56 s SER 78 N -3.55 -0.28 0.00 3.42 1.04 -1.26 -4.78 113.70 108.29 2f56 s SER 78 Ca 0.00 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.98 2f56 s SER 78 Cb 0.00 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.76 2f56 s SER 78 CO 0.00 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.67 2f56 n GLY 79 N -0.44 -1.03 3.77 7.32 0.00 -1.24 -4.85 105.19 108.71 2f56 n GLY 79 Ca -0.06 -1.38 -0.37 0.00 0.00 0.00 0.00 46.02 44.21 2f56 n GLY 79 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2f56 s PHE 80 N 0.00 2.71 0.57 1.61 0.08 -1.26 -4.44 117.98 117.25 2f56 s PHE 80 Ca 0.00 1.51 -0.21 0.00 0.12 0.00 0.00 56.93 58.36 2f56 s PHE 80 Cb 0.00 -3.43 -0.04 0.00 -0.57 0.00 0.00 43.02 38.98 2f56 s PHE 80 CO 0.00 -1.77 1.31 1.03 -0.10 0.00 0.00 175.22 175.69 2f56 s ARG 81 N -2.90 3.04 0.00 0.44 0.52 -1.26 -5.02 118.95 113.77 2f56 s ARG 81 Ca 0.68 2.12 0.00 0.00 -0.52 0.00 0.00 55.73 58.00 2f56 s ARG 81 Cb -0.29 -2.14 0.00 0.00 0.52 0.00 0.00 34.95 33.03 2f56 s ARG 81 CO 0.35 -1.23 0.00 0.27 0.02 0.00 0.00 175.30 174.71 2f56 n ASN 82 N -1.24 0.00 -1.25 0.23 0.23 -1.26 -5.01 115.26 106.96 2f56 n ASN 82 Ca 0.12 -0.37 0.11 0.00 -0.53 0.00 0.00 54.58 53.92 2f56 n ASN 82 Cb 0.46 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.44 2f56 n ASN 82 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2f56 n SER 83 N -1.10 3.75 -4.69 0.53 3.41 -1.26 -4.92 113.62 109.33 2f56 n SER 83 Ca 0.00 -1.99 -0.36 0.00 -0.26 0.00 0.00 58.87 56.26 2f56 n SER 83 Cb 0.00 -0.40 -0.08 0.00 -0.26 0.00 0.00 64.21 63.47 2f56 n SER 83 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2f56 s ASP 84 N -1.15 6.22 0.03 4.04 1.01 -1.26 -2.34 116.67 123.22 2f56 s ASP 84 Ca 0.44 0.24 0.01 0.00 0.71 0.00 0.00 52.55 53.95 2f56 s ASP 84 Cb 0.24 -2.12 -0.02 0.00 1.01 0.00 0.00 42.92 42.02 2f56 s ASP 84 CO 0.32 0.09 -0.05 -0.13 0.21 0.00 0.00 175.17 175.61 2f56 s ARG 85 N 0.80 0.39 -0.13 8.23 1.81 -0.45 -1.98 118.95 127.62 2f56 s ARG 85 Ca 0.10 -0.65 -0.06 0.00 -1.72 0.00 0.00 55.73 53.40 2f56 s ARG 85 Cb -0.13 -0.05 -0.04 0.00 -0.45 0.00 0.00 34.95 34.28 2f56 s ARG 85 CO 0.03 -0.01 0.09 -1.50 -0.68 0.00 0.00 175.30 173.23 2f56 s ILE 86 N -1.38 5.05 -0.15 1.52 2.07 -0.52 -0.41 121.20 127.37 2f56 s ILE 86 Ca -0.13 0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.15 2f56 s ILE 86 Cb -0.10 -3.21 -0.00 0.00 0.13 0.00 0.00 42.46 39.28 2f56 s ILE 86 CO -0.00 0.56 -0.15 -0.76 -1.91 0.00 0.00 174.94 172.68 2f56 s LEU 87 N -0.52 2.51 -0.02 8.50 2.01 -0.00 -1.61 118.68 129.55 2f56 s LEU 87 Ca 0.11 -0.45 0.03 0.00 0.01 0.00 0.00 54.13 53.83 2f56 s LEU 87 Cb -0.12 -1.57 -0.00 0.00 0.01 0.00 0.00 46.19 44.51 2f56 s LEU 87 CO 0.02 0.09 -0.10 -0.72 1.01 0.00 0.00 176.35 176.65 2f56 s TYR 88 N 0.80 1.02 0.44 0.29 1.13 -0.21 -1.10 117.35 119.72 2f56 s TYR 88 Ca -0.05 -0.24 0.06 0.00 -1.41 0.00 0.00 57.07 55.43 2f56 s TYR 88 Cb -0.15 -0.70 0.01 0.00 -1.10 0.00 0.00 41.96 40.02 2f56 s TYR 88 CO 0.00 -0.08 0.61 -1.54 -2.51 0.00 0.00 175.55 172.04 2f56 s SER 89 N 0.04 5.60 0.32 -0.18 1.04 -0.27 -1.24 113.70 119.00 2f56 s SER 89 Ca -0.01 -0.28 0.25 0.00 0.48 0.00 0.00 55.95 56.39 2f56 s SER 89 Cb -0.07 -0.79 1.13 0.00 0.10 0.00 0.00 66.02 66.39 2f56 s SER 89 CO 0.00 -0.82 1.74 0.77 0.98 0.00 0.00 173.24 175.92 2f56 h SER 90 N 0.52 0.00 -0.16 7.02 4.64 -1.57 -1.53 113.55 122.48 2f56 h SER 90 Ca -0.41 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.90 2f56 h SER 90 Cb 1.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2f56 h SER 90 CO 0.48 0.00 -0.00 -0.90 -0.87 0.00 0.00 176.83 175.53 2f56 n ASP 91 N -2.35 3.24 -1.72 4.97 5.75 -1.26 -5.00 116.55 120.18 2f56 n ASP 91 Ca 0.01 -3.07 -0.13 0.00 -0.01 0.00 0.00 54.79 51.59 2f56 n ASP 91 Cb 0.16 -0.50 0.01 0.00 -1.03 0.00 0.00 41.12 39.77 2f56 n ASP 91 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2f56 n TRP 92 N -0.90 -0.99 -2.17 2.11 7.02 -0.58 -5.02 117.44 116.91 2f56 n TRP 92 Ca 0.19 0.23 -0.42 0.00 -1.02 0.00 0.00 57.50 56.48 2f56 n TRP 92 Cb 0.80 -2.94 -0.03 0.00 -2.42 0.00 0.00 31.31 26.71 2f56 n TRP 92 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2f56 s LEU 93 N -3.89 4.38 -0.11 -0.99 1.43 -1.26 -4.87 118.68 113.37 2f56 s LEU 93 Ca 0.13 2.37 0.02 0.00 -1.03 0.00 0.00 54.13 55.62 2f56 s LEU 93 Cb -0.06 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.58 2f56 s LEU 93 CO 0.16 -0.62 -0.18 -0.63 0.23 0.00 0.00 176.35 175.31 2f56 s ILE 94 N 0.77 1.71 0.21 -0.59 -1.09 -1.26 -1.11 121.20 119.83 2f56 s ILE 94 Ca 0.62 -0.78 0.10 0.00 -2.23 0.00 0.00 60.65 58.36 2f56 s ILE 94 Cb -0.37 -1.53 -0.04 0.00 -1.58 0.00 0.00 42.46 38.94 2f56 s ILE 94 CO 0.33 0.48 -0.19 -0.31 -1.23 0.00 0.00 174.94 174.02 2f56 s TYR 95 N 0.80 2.01 0.17 3.97 1.51 -0.26 -0.23 117.35 125.32 2f56 s TYR 95 Ca -0.10 -0.43 0.09 0.00 -1.01 0.00 0.00 57.07 55.62 2f56 s TYR 95 Cb -0.16 -0.95 -0.04 0.00 -0.11 0.00 0.00 41.96 40.70 2f56 s TYR 95 CO 0.01 0.46 -0.18 -1.59 -1.11 0.00 0.00 175.55 173.14 2f56 s LYS 96 N -3.09 1.29 0.02 -0.62 -2.85 0.43 -0.82 119.74 114.10 2f56 s LYS 96 Ca 0.21 -1.42 0.03 0.00 -1.00 0.00 0.00 55.97 53.79 2f56 s LYS 96 Cb -0.05 -1.35 -0.01 0.00 -2.06 0.00 0.00 37.83 34.35 2f56 s LYS 96 CO 0.09 0.27 -0.08 -0.08 0.10 0.00 0.00 175.35 175.65 2f56 s THR 97 N -2.05 0.64 -0.07 3.79 -1.32 0.46 -1.41 115.64 115.68 2f56 s THR 97 Ca 0.16 -0.68 0.10 0.00 -1.21 0.00 0.00 61.69 60.07 2f56 s THR 97 Cb -0.06 -0.60 0.16 0.00 -1.51 0.00 0.00 72.50 70.49 2f56 s THR 97 CO 0.07 -0.05 1.06 0.35 -2.21 0.00 0.00 174.62 173.83 2f56 n THR 98 N 2.25 1.36 -2.65 5.08 -2.24 -1.26 -1.34 114.28 115.48 2f56 n THR 98 Ca -0.17 -1.56 -0.07 0.00 -2.27 0.00 0.00 64.05 59.98 2f56 n THR 98 Cb 0.56 0.12 0.04 0.00 -2.10 0.00 0.00 70.33 68.95 2f56 n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2f56 n ASP 99 N -0.95 2.27 -3.56 3.42 5.68 -1.17 -4.60 116.55 117.64 2f56 n ASP 99 Ca 0.09 -2.50 -0.19 0.00 -0.50 0.00 0.00 54.79 51.68 2f56 n ASP 99 Cb 0.51 -0.46 0.06 0.00 -1.14 0.00 0.00 41.12 40.09 2f56 n ASP 99 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2f56 n HIS 100 N -0.53 -2.06 -1.56 2.11 8.25 -0.99 -2.87 115.22 117.57 2f56 n HIS 100 Ca 0.15 0.87 -0.12 0.00 -0.26 0.00 0.00 57.72 58.36 2f56 n HIS 100 Cb 0.83 -4.62 -0.04 0.00 1.12 0.00 0.00 29.99 27.27 2f56 n HIS 100 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2f56 n TYR 101 N -4.14 -0.14 0.01 4.41 4.02 -1.26 -4.89 117.16 115.17 2f56 n TYR 101 Ca -0.27 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.40 2f56 n TYR 101 Cb 0.67 -2.31 -0.14 0.00 -0.02 0.00 0.00 39.34 37.54 2f56 n TYR 101 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2f56 h GLN 102 N 0.00 0.26 -5.63 -0.72 4.20 -1.94 -3.47 115.11 107.82 2f56 h GLN 102 Ca -0.25 -0.45 -0.46 0.00 0.06 0.00 0.00 58.65 57.55 2f56 h GLN 102 Cb 0.88 0.17 -0.20 0.00 0.30 0.00 0.00 27.48 28.63 2f56 h GLN 102 CO 0.35 1.21 -0.78 0.95 -0.67 0.00 0.00 178.83 179.89 2f56 s THR 103 N -2.53 1.42 0.05 -0.54 -4.23 -1.26 -5.11 115.64 103.44 2f56 s THR 103 Ca -0.21 -1.60 0.06 0.00 -1.18 0.00 0.00 61.69 58.75 2f56 s THR 103 Cb 0.06 -1.46 -0.02 0.00 1.34 0.00 0.00 72.50 72.41 2f56 s THR 103 CO 0.77 -0.28 -0.16 -0.36 -0.54 0.00 0.00 174.62 174.05 2f56 s PHE 104 N -1.70 1.39 -0.06 3.99 0.08 -1.26 -4.37 117.98 116.05 2f56 s PHE 104 Ca 0.06 -0.37 0.02 0.00 0.12 0.00 0.00 56.93 56.76 2f56 s PHE 104 Cb -0.07 -0.81 0.01 0.00 -0.57 0.00 0.00 43.02 41.58 2f56 s PHE 104 CO 0.04 0.06 -0.11 0.99 -0.10 0.00 0.00 175.22 176.10 2f56 s THR 105 N -0.91 1.03 0.11 0.64 2.01 -0.50 -4.96 115.64 113.07 2f56 s THR 105 Ca 0.03 -0.42 -0.30 0.00 0.31 0.00 0.00 61.69 61.30 2f56 s THR 105 Cb -0.08 -0.95 -0.06 0.00 0.01 0.00 0.00 72.50 71.42 2f56 s THR 105 CO 0.02 0.33 1.08 -0.75 -0.69 0.00 0.00 174.62 174.61 2f56 s LYS 106 N 0.65 4.56 0.00 4.92 2.20 -1.26 -0.43 119.74 130.38 2f56 s LYS 106 Ca -0.13 1.64 0.00 0.00 -0.36 0.00 0.00 55.97 57.12 2f56 s LYS 106 Cb -0.15 -3.34 0.00 0.00 -1.51 0.00 0.00 37.83 32.83 2f56 s LYS 106 CO 0.03 -0.01 0.00 0.44 -0.36 0.00 0.00 175.35 175.45 2f56 n ILE 107 N 3.10 0.00 -1.45 5.43 -5.35 0.68 -4.93 119.36 116.84 2f56 n ILE 107 Ca 0.05 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.18 2f56 n ILE 107 Cb 0.48 0.97 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 2f56 n ILE 107 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33