#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 3.04 0.00 1.34 1.01 -1.26 -5.00 121.20 120.33 2f56 s ILE 2 Ca 0.00 -0.63 0.06 0.00 0.00 0.00 0.00 60.65 60.08 2f56 s ILE 2 Cb 0.00 -2.32 0.11 0.00 0.01 0.00 0.00 42.46 40.25 2f56 s ILE 2 CO 0.00 0.48 0.93 -0.46 0.00 0.00 0.00 174.94 175.90 2f56 n ASN 3 N 4.21 0.11 -4.89 3.58 6.94 -1.26 -4.79 115.26 119.16 2f56 n ASN 3 Ca -0.19 -1.78 -0.21 0.00 -0.02 0.00 0.00 54.58 52.38 2f56 n ASN 3 Cb 0.52 -0.11 -0.03 0.00 -2.36 0.00 0.00 39.78 37.79 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 4.54 0.12 5.53 -4.23 -1.26 -0.69 115.64 119.65 2f56 s THR 4 Ca 0.08 -1.22 -0.23 0.00 -1.18 0.00 0.00 61.69 59.14 2f56 s THR 4 Cb 0.10 -3.52 -0.06 0.00 1.34 0.00 0.00 72.50 70.36 2f56 s THR 4 CO -0.04 -0.30 1.68 -0.26 -0.54 0.00 0.00 174.62 175.16 2f56 h PHE 5 N 1.29 -0.31 -0.22 3.99 0.04 -1.98 0.37 116.94 120.11 2f56 h PHE 5 Ca -0.49 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.24 2f56 h PHE 5 Cb 1.24 0.15 -0.01 0.00 2.20 0.00 0.00 35.95 39.53 2f56 h PHE 5 CO 0.50 -0.18 -0.09 -0.44 -0.60 0.00 0.00 178.31 177.50 2f56 h ASP 6 N -0.18 0.47 0.14 2.17 3.32 -1.98 0.27 116.42 120.62 2f56 h ASP 6 Ca 0.06 -0.40 0.01 0.00 0.02 0.00 0.00 57.03 56.72 2f56 h ASP 6 Cb 0.27 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2f56 h ASP 6 CO -0.16 0.76 -0.17 1.23 -1.72 0.00 0.00 179.24 179.17 2f56 h GLY 7 N 0.17 -0.34 1.11 2.75 0.00 -1.96 -0.45 103.07 104.35 2f56 h GLY 7 Ca 0.05 0.20 -0.14 0.00 0.00 0.00 0.00 47.33 47.44 2f56 h GLY 7 CO 0.03 -0.17 -0.26 -2.08 0.00 0.00 0.00 176.54 174.06 2f56 h VAL 8 N -0.35 1.27 -0.38 4.60 2.07 -0.93 -2.21 116.25 120.32 2f56 h VAL 8 Ca 0.01 -1.43 0.05 0.00 0.82 0.00 0.00 66.70 66.16 2f56 h VAL 8 Cb 0.35 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2f56 h VAL 8 CO -0.07 0.49 0.09 0.00 0.02 0.00 0.00 177.57 178.10 2f56 h ALA 9 N 0.84 0.41 -0.17 1.67 0.00 -0.66 -1.41 119.26 119.94 2f56 h ALA 9 Ca 0.10 0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 2f56 h ALA 9 Cb 0.84 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2f56 h ALA 9 CO 0.07 -0.31 -0.62 -0.44 0.00 0.00 0.00 179.25 177.96 2f56 h ASP 10 N 0.23 0.67 -0.36 0.00 3.32 -1.06 -2.43 116.42 116.78 2f56 h ASP 10 Ca 0.18 -0.38 0.02 0.00 0.02 0.00 0.00 57.03 56.86 2f56 h ASP 10 Cb 0.19 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2f56 h ASP 10 CO -0.22 1.12 0.21 0.22 -1.72 0.00 0.00 179.24 178.85 2f56 h TYR 11 N 0.43 0.39 -0.36 4.55 5.03 -1.20 -2.35 116.97 123.46 2f56 h TYR 11 Ca -0.01 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.32 2f56 h TYR 11 Cb 1.19 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 39.33 2f56 h TYR 11 CO 0.05 0.22 0.22 -0.07 -1.32 0.00 0.00 178.16 177.27 2f56 h LEU 12 N 0.42 0.42 -1.35 2.82 3.38 -1.12 0.11 115.31 120.00 2f56 h LEU 12 Ca 0.15 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 2f56 h LEU 12 Cb 0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2f56 h LEU 12 CO -0.07 0.33 -0.32 1.56 0.09 0.00 0.00 178.44 180.03 2f56 h GLN 13 N 0.47 0.00 0.07 1.13 4.20 -1.29 0.11 115.11 119.80 2f56 h GLN 13 Ca 0.13 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.58 2f56 h GLN 13 Cb -0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2f56 h GLN 13 CO -0.03 0.32 -1.38 1.15 -0.67 0.00 0.00 178.83 178.23 2f56 h THR 14 N 0.00 0.98 -0.01 -0.54 2.02 -1.31 -3.41 112.91 110.64 2f56 h THR 14 Ca -0.00 -2.32 0.00 0.00 0.77 0.00 0.00 66.41 64.86 2f56 h THR 14 Cb 0.61 2.57 0.00 0.00 -1.74 0.00 0.00 68.15 69.59 2f56 h THR 14 CO 0.04 0.61 -0.28 -1.22 0.37 0.00 0.00 175.52 175.05 2f56 n TYR 15 N -4.05 0.00 -2.30 3.16 4.01 0.39 -5.00 117.16 113.37 2f56 n TYR 15 Ca -0.27 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.29 2f56 n TYR 15 Cb 0.83 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.85 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 -0.26 -0.81 -3.70 -0.72 8.25 0.38 -4.97 115.22 113.40 2f56 n HIS 16 Ca 0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.42 2f56 n HIS 16 Cb 0.26 -3.53 -0.03 0.00 1.12 0.00 0.00 29.99 27.81 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 -4.82 1.50 0.56 -0.41 -2.85 -1.26 -5.06 119.74 107.41 2f56 s LYS 17 Ca 0.00 -0.81 -0.15 0.00 -1.00 0.00 0.00 55.97 54.01 2f56 s LYS 17 Cb 0.00 0.57 -0.05 0.00 -2.06 0.00 0.00 37.83 36.28 2f56 s LYS 17 CO 0.00 -0.66 1.02 -0.51 0.10 0.00 0.00 175.35 175.30 2f56 s LEU 18 N -2.86 3.50 1.01 2.77 1.43 -1.26 -4.10 118.68 119.18 2f56 s LEU 18 Ca 0.08 1.63 -0.11 0.00 -1.03 0.00 0.00 54.13 54.70 2f56 s LEU 18 Cb -0.03 -4.51 0.20 0.00 0.03 0.00 0.00 46.19 41.88 2f56 s LEU 18 CO -0.02 -0.86 1.10 -2.84 0.23 0.00 0.00 176.35 173.96 2f56 s PRO 19 N -4.28 0.25 0.15 1.29 0.02 -1.26 -4.89 135.00 126.28 2f56 s PRO 19 Ca 0.60 1.24 0.18 0.00 0.02 0.00 0.00 61.00 63.04 2f56 s PRO 19 Cb -0.12 -1.66 0.79 0.00 0.02 0.00 0.00 34.50 33.53 2f56 s PRO 19 CO 0.37 -3.06 1.56 -0.25 -0.33 0.00 0.00 177.00 175.29 2f56 n ASP 20 N -4.50 0.36 -0.18 2.53 8.00 -1.26 -2.40 116.55 119.10 2f56 n ASP 20 Ca 0.08 0.60 0.07 0.00 0.71 0.00 0.00 54.79 56.25 2f56 n ASP 20 Cb 0.53 -0.68 0.35 0.00 -0.02 0.00 0.00 41.12 41.30 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 -1.92 0.52 -4.81 -2.24 6.94 -1.26 -4.85 115.26 107.64 2f56 n ASN 21 Ca 0.02 -1.67 -0.36 0.00 -0.02 0.00 0.00 54.58 52.55 2f56 n ASN 21 Cb 0.17 -0.04 -0.07 0.00 -2.36 0.00 0.00 39.78 37.47 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 -1.91 3.45 0.02 -2.53 2.02 -1.01 -1.23 117.35 116.16 2f56 s TYR 22 Ca 0.22 0.41 0.02 0.00 -0.37 0.00 0.00 57.07 57.35 2f56 s TYR 22 Cb 0.11 -1.90 -0.01 0.00 -0.40 0.00 0.00 41.96 39.76 2f56 s TYR 22 CO 0.17 0.64 -0.06 0.96 -1.57 0.00 0.00 175.55 175.69 2f56 s ILE 23 N -0.95 0.45 0.84 2.71 -4.36 -0.44 -4.89 121.20 114.56 2f56 s ILE 23 Ca 0.14 -0.57 -0.12 0.00 -0.26 0.00 0.00 60.65 59.84 2f56 s ILE 23 Cb -0.12 -0.44 0.10 0.00 1.25 0.00 0.00 42.46 43.24 2f56 s ILE 23 CO 0.03 -0.10 1.10 0.42 0.24 0.00 0.00 174.94 176.63 2f56 s THR 24 N -0.65 2.86 0.29 8.37 -4.23 -1.16 -0.88 115.64 120.25 2f56 s THR 24 Ca -0.03 0.28 -0.02 0.00 -1.18 0.00 0.00 61.69 60.74 2f56 s THR 24 Cb -0.05 -2.92 0.27 0.00 1.34 0.00 0.00 72.50 71.13 2f56 s THR 24 CO 0.00 -0.37 1.95 0.11 -0.54 0.00 0.00 174.62 175.77 2f56 h LYS 25 N -1.28 1.11 -0.23 3.99 1.57 -1.97 -0.65 116.57 119.11 2f56 h LYS 25 Ca -0.48 -0.07 -0.13 0.00 -1.87 0.00 0.00 60.65 58.10 2f56 h LYS 25 Cb 1.28 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 2f56 h LYS 25 CO 0.57 0.74 -0.41 0.66 -0.57 0.00 0.00 179.45 180.44 2f56 h SER 26 N 1.14 0.59 -0.36 0.86 4.64 -1.99 -0.75 113.55 117.68 2f56 h SER 26 Ca 0.33 -0.26 -0.03 0.00 -0.47 0.00 0.00 61.79 61.36 2f56 h SER 26 Cb -0.07 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.84 2f56 h SER 26 CO -0.08 0.93 0.09 -0.33 -0.87 0.00 0.00 176.83 176.56 2f56 h GLU 27 N 0.46 0.57 -0.20 4.77 5.08 -1.88 -1.93 114.58 121.44 2f56 h GLU 27 Ca 0.04 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2f56 h GLU 27 Cb 0.90 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 2f56 h GLU 27 CO 0.08 0.61 -0.03 0.00 -1.00 0.00 0.00 179.01 178.67 2f56 h ALA 28 N 0.93 0.28 -0.69 3.43 0.00 -0.86 -2.41 119.26 119.94 2f56 h ALA 28 Ca 0.11 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.85 2f56 h ALA 28 Cb 0.30 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 2f56 h ALA 28 CO 0.00 0.03 0.38 1.96 0.00 0.00 0.00 179.25 181.62 2f56 h GLN 29 N 0.11 0.66 -0.07 0.00 4.20 -1.14 -0.88 115.11 117.99 2f56 h GLN 29 Ca 0.05 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.73 2f56 h GLN 29 Cb 0.46 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 2f56 h GLN 29 CO 0.02 0.44 0.05 0.00 -0.67 0.00 0.00 178.83 178.66 2f56 h ALA 30 N 1.37 2.00 -0.67 3.87 0.00 -1.12 -1.71 119.26 123.00 2f56 h ALA 30 Ca 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2f56 h ALA 30 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2f56 h ALA 30 CO -0.20 -0.01 0.00 1.47 0.00 0.00 0.00 179.25 180.51 2f56 n LEU 31 N -4.52 4.76 0.00 0.00 -0.00 -0.46 -4.92 117.00 111.86 2f56 n LEU 31 Ca -0.02 -2.42 0.00 0.00 -0.00 0.00 0.00 56.01 53.58 2f56 n LEU 31 Cb 0.12 -0.58 0.00 0.00 -0.00 0.00 0.00 43.42 42.96 2f56 n LEU 31 CO 0.34 0.83 0.00 0.61 -0.00 0.00 0.00 177.39 179.18 2f56 n GLY 32 N 1.20 1.08 3.70 1.47 0.00 -0.64 -4.89 105.19 107.11 2f56 n GLY 32 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 2.88 -0.29 1.61 -0.00 -0.47 -4.93 118.94 115.73 2f56 s TRP 33 Ca 0.00 0.73 0.03 0.00 -0.00 0.00 0.00 56.10 56.86 2f56 s TRP 33 Cb 0.00 -3.75 0.08 0.00 -0.00 0.00 0.00 33.47 29.80 2f56 s TRP 33 CO 0.00 -2.80 -0.01 0.08 -0.00 0.00 0.00 176.95 174.22 2f56 s VAL 34 N 2.01 1.96 0.20 5.86 1.01 -1.26 -4.33 120.40 125.85 2f56 s VAL 34 Ca 0.67 -1.84 -0.10 0.00 0.00 0.00 0.00 61.98 60.70 2f56 s VAL 34 Cb -0.36 -2.30 0.13 0.00 0.00 0.00 0.00 36.38 33.86 2f56 s VAL 34 CO 0.29 -0.35 1.74 0.00 0.00 0.00 0.00 175.10 176.78 2f56 h ALA 35 N 7.77 0.72 0.00 5.51 0.00 -1.99 -0.69 119.26 130.59 2f56 h ALA 35 Ca -0.12 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2f56 h ALA 35 Cb 1.03 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2f56 h ALA 35 CO 0.48 -0.21 0.00 0.77 0.00 0.00 0.00 179.25 180.29 2f56 h SER 36 N 0.37 0.00 0.04 0.00 0.02 -2.03 -0.45 113.55 111.50 2f56 h SER 36 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2f56 h SER 36 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2f56 h SER 36 CO -0.30 0.00 -0.65 0.29 -1.14 0.00 0.00 176.83 175.03 2f56 n LYS 37 N -2.38 0.69 -3.51 3.45 5.02 -0.29 -5.00 118.16 116.14 2f56 n LYS 37 Ca 0.00 -0.55 -0.25 0.00 -2.02 0.00 0.00 58.31 55.49 2f56 n LYS 37 Cb 0.14 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.72 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 1.45 -0.53 1.30 0.72 0.00 -0.18 -4.91 105.19 103.03 2f56 n GLY 38 Ca 0.07 0.21 0.05 0.00 0.00 0.00 0.00 46.02 46.35 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 -2.83 4.26 -0.31 1.61 6.94 -1.25 -4.01 115.26 119.68 2f56 n ASN 39 Ca -0.01 -3.12 -0.04 0.00 -0.02 0.00 0.00 54.58 51.39 2f56 n ASN 39 Cb 0.57 -0.62 0.08 0.00 -2.36 0.00 0.00 39.78 37.45 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 2.28 1.00 -1.38 -4.53 5.85 -1.88 -0.84 115.31 115.81 2f56 h LEU 40 Ca 0.07 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2f56 h LEU 40 Cb 1.72 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.50 2f56 h LEU 40 CO 0.38 0.76 0.00 0.00 -0.34 0.00 0.00 178.44 179.24 2f56 h ALA 41 N 1.28 1.00 0.10 1.25 0.00 -1.84 0.16 119.26 121.20 2f56 h ALA 41 Ca 0.30 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.94 2f56 h ALA 41 Cb -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2f56 h ALA 41 CO -0.06 0.00 -1.28 -0.44 0.00 0.00 0.00 179.25 177.47 2f56 h ASP 42 N 0.00 0.32 0.11 0.00 3.32 -1.51 -3.13 116.42 115.54 2f56 h ASP 42 Ca 0.00 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2f56 h ASP 42 Cb 0.42 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2f56 h ASP 42 CO 0.00 1.30 -1.25 1.33 -1.72 0.00 0.00 179.24 178.90 2f56 n VAL 43 N -3.46 0.04 -2.93 -1.35 0.24 -0.96 -4.64 118.33 105.27 2f56 n VAL 43 Ca -0.09 -0.18 -0.14 0.00 -2.04 0.00 0.00 64.34 61.89 2f56 n VAL 43 Cb 1.01 0.54 -0.00 0.00 -1.47 0.00 0.00 33.84 33.92 2f56 n VAL 43 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2f56 n ALA 44 N -1.77 0.03 -1.66 2.33 0.00 0.52 -4.92 120.51 115.03 2f56 n ALA 44 Ca 0.02 -2.12 -0.46 0.00 0.00 0.00 0.00 53.44 50.88 2f56 n ALA 44 Cb 0.42 -1.15 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 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 1.72 2.00 -0.21 0.00 -0.02 -1.18 -1.80 135.00 135.52 2f56 n PRO 45 Ca 0.15 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 2f56 n PRO 45 Cb 0.58 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 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 2.84 1.70 3.93 -1.23 0.00 -1.26 -5.04 105.19 106.13 2f56 n GLY 46 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.31 3.52 0.07 1.61 -0.14 -0.74 -4.86 119.74 118.89 2f56 s LYS 47 Ca 0.00 -0.31 0.04 0.00 -1.36 0.00 0.00 55.97 54.34 2f56 s LYS 47 Cb 0.00 -2.74 -0.03 0.00 -1.68 0.00 0.00 37.83 33.38 2f56 s LYS 47 CO 0.00 0.27 -0.12 -1.12 -0.76 0.00 0.00 175.35 173.63 2f56 s SER 48 N -3.56 1.40 0.13 2.83 0.01 -0.36 -4.86 113.70 109.28 2f56 s SER 48 Ca 0.40 -0.62 -0.30 0.00 1.31 0.00 0.00 55.95 56.73 2f56 s SER 48 Cb -0.10 -0.02 -0.07 0.00 0.21 0.00 0.00 66.02 66.04 2f56 s SER 48 CO 0.32 -0.14 1.22 -0.63 0.41 0.00 0.00 173.24 174.42 2f56 s ILE 49 N -1.47 3.69 -0.15 1.44 -1.09 -1.26 -1.32 121.20 121.04 2f56 s ILE 49 Ca -0.03 1.32 -0.31 0.00 -2.23 0.00 0.00 60.65 59.40 2f56 s ILE 49 Cb -0.09 -3.84 0.13 0.00 -1.58 0.00 0.00 42.46 37.08 2f56 s ILE 49 CO 0.01 0.16 1.06 -0.83 -1.23 0.00 0.00 174.94 174.12 2f56 s GLY 50 N 0.56 -0.26 0.00 6.18 0.00 -0.06 -0.90 107.32 112.83 2f56 s GLY 50 Ca 0.56 1.86 0.00 0.00 0.00 0.00 0.00 44.72 47.14 2f56 s GLY 50 CO 0.33 0.82 0.00 0.61 0.00 0.00 0.00 173.10 174.86 2f56 n GLY 51 N 0.37 1.25 3.83 0.20 0.00 0.84 -2.99 105.19 108.69 2f56 n GLY 51 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.00 6.87 0.20 1.61 1.01 -1.24 -4.78 116.67 118.35 2f56 s ASP 52 Ca 0.00 1.52 -0.31 0.00 0.71 0.00 0.00 52.55 54.47 2f56 s ASP 52 Cb 0.00 -2.47 -0.10 0.00 1.01 0.00 0.00 42.92 41.36 2f56 s ASP 52 CO 0.00 -0.30 1.53 -0.63 0.21 0.00 0.00 175.17 175.98 2f56 s ILE 53 N -2.10 2.60 -0.16 0.77 -1.09 -1.26 -0.81 121.20 119.15 2f56 s ILE 53 Ca 0.59 0.46 -0.04 0.00 -2.23 0.00 0.00 60.65 59.42 2f56 s ILE 53 Cb -0.09 -3.29 -0.03 0.00 -1.58 0.00 0.00 42.46 37.46 2f56 s ILE 53 CO 0.15 0.05 -0.02 0.12 -1.23 0.00 0.00 174.94 174.01 2f56 s PHE 54 N 0.68 3.06 -0.28 3.97 5.36 0.31 -4.85 117.98 126.24 2f56 s PHE 54 Ca 0.66 -0.24 0.18 0.00 -0.96 0.00 0.00 56.93 56.57 2f56 s PHE 54 Cb -0.43 -1.98 0.19 0.00 -0.34 0.00 0.00 43.02 40.45 2f56 s PHE 54 CO 0.36 -0.01 1.52 0.66 -1.46 0.00 0.00 175.22 176.29 2f56 h SER 55 N 6.71 0.00 -6.02 6.13 4.64 -1.96 -3.38 113.55 119.67 2f56 h SER 55 Ca -0.32 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.57 2f56 h SER 55 Cb 1.19 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.35 2f56 h SER 55 CO 0.64 0.29 -0.72 -3.20 -0.87 0.00 0.00 176.83 172.97 2f56 n ASN 56 N -3.17 -5.42 -0.32 4.97 5.15 -1.26 -4.88 115.26 110.32 2f56 n ASN 56 Ca 0.03 -0.64 0.03 0.00 -0.60 0.00 0.00 54.58 53.40 2f56 n ASN 56 Cb 0.65 -4.58 0.18 0.00 -0.53 0.00 0.00 39.78 35.50 2f56 n ASN 56 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 2f56 h ARG 57 N -2.42 0.91 -0.01 1.20 2.43 -2.00 -1.92 114.38 112.58 2f56 h ARG 57 Ca -0.58 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.54 2f56 h ARG 57 Cb 1.37 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2f56 h ARG 57 CO 0.60 0.60 0.00 0.39 -1.51 0.00 0.00 179.97 180.05 2f56 n GLU 58 N -4.65 1.15 -2.31 0.20 4.71 -1.26 -4.91 120.64 113.57 2f56 n GLU 58 Ca 0.15 -0.22 -0.20 0.00 -0.01 0.00 0.00 57.16 56.87 2f56 n GLU 58 Cb 0.25 -1.49 -0.02 0.00 -1.01 0.00 0.00 31.44 29.18 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 -0.26 0.17 0.62 0.00 -0.72 -4.90 105.19 101.13 2f56 n GLY 59 Ca 0.22 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.25 2f56 n GLY 59 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f56 h LYS 60 N 0.00 0.00 -6.00 1.61 1.57 -1.91 -3.44 116.57 108.41 2f56 h LYS 60 Ca -0.47 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 57.70 2f56 h LYS 60 Cb 1.35 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.62 2f56 h LYS 60 CO 0.57 0.43 -0.41 -0.51 -0.57 0.00 0.00 179.45 178.96 2f56 s LEU 61 N -6.74 4.33 0.15 2.94 1.43 -1.26 -4.96 118.68 114.57 2f56 s LEU 61 Ca 0.02 0.44 -0.31 0.00 -1.03 0.00 0.00 54.13 53.25 2f56 s LEU 61 Cb 0.09 -3.01 -0.10 0.00 0.03 0.00 0.00 46.19 43.20 2f56 s LEU 61 CO 0.71 0.15 1.65 -2.16 0.23 0.00 0.00 176.35 176.93 2f56 s PRO 62 N -2.39 4.18 0.09 1.29 0.04 -1.26 -4.98 135.00 131.97 2f56 s PRO 62 Ca 0.35 2.44 -0.03 0.00 0.04 0.00 0.00 61.00 63.80 2f56 s PRO 62 Cb -0.13 -3.27 -0.05 0.00 0.04 0.00 0.00 34.50 31.09 2f56 s PRO 62 CO 0.24 -0.69 0.29 0.20 0.04 0.00 0.00 177.00 177.08 2f56 s GLY 63 N 1.57 2.22 -0.16 0.56 0.00 -1.26 -5.10 107.32 105.15 2f56 s GLY 63 Ca 0.73 -0.68 -0.17 0.00 0.00 0.00 0.00 44.72 44.60 2f56 s GLY 63 CO 0.32 -0.61 0.47 1.25 0.00 0.00 0.00 173.10 174.53 2f56 s LYS 64 N -2.45 0.58 0.22 2.90 2.20 -1.26 -5.07 119.74 116.85 2f56 s LYS 64 Ca 0.36 0.59 -0.31 0.00 -0.36 0.00 0.00 55.97 56.26 2f56 s LYS 64 Cb -0.13 0.28 -0.11 0.00 -1.51 0.00 0.00 37.83 36.37 2f56 s LYS 64 CO 0.25 -0.08 1.57 -1.54 -0.36 0.00 0.00 175.35 175.19 2f56 s SER 65 N 0.10 6.52 0.00 1.43 1.04 -1.26 -1.42 113.70 120.11 2f56 s SER 65 Ca -0.01 2.74 0.00 0.00 0.48 0.00 0.00 55.95 59.16 2f56 s SER 65 Cb -0.03 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.48 2f56 s SER 65 CO 0.01 -0.84 0.00 0.61 0.98 0.00 0.00 173.24 174.00 2f56 n GLY 66 N 3.16 1.44 3.65 7.32 0.00 -1.26 -5.03 105.19 114.48 2f56 n GLY 66 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.44 4.21 -0.17 1.61 3.52 -0.51 -4.96 118.95 122.22 2f56 s ARG 67 Ca 0.00 0.74 -0.07 0.00 -0.13 0.00 0.00 55.73 56.27 2f56 s ARG 67 Cb 0.00 -3.60 -0.04 0.00 -1.56 0.00 0.00 34.95 29.75 2f56 s ARG 67 CO 0.00 -0.33 0.06 0.99 -0.81 0.00 0.00 175.30 175.21 2f56 s THR 68 N 2.20 4.82 -0.08 4.11 2.01 -1.26 -4.73 115.64 122.71 2f56 s THR 68 Ca 0.31 -0.03 -0.02 0.00 0.31 0.00 0.00 61.69 62.27 2f56 s THR 68 Cb -0.16 -3.16 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 2f56 s THR 68 CO 0.10 0.48 0.00 0.26 -0.69 0.00 0.00 174.62 174.77 2f56 s TRP 69 N 0.22 3.16 0.19 4.92 0.52 -1.26 -1.37 118.94 125.32 2f56 s TRP 69 Ca 0.04 0.19 0.07 0.00 0.02 0.00 0.00 56.10 56.42 2f56 s TRP 69 Cb -0.12 -1.78 -0.05 0.00 -1.15 0.00 0.00 33.47 30.37 2f56 s TRP 69 CO 0.00 0.47 -0.12 1.03 0.02 0.00 0.00 176.95 178.35 2f56 s ARG 70 N -0.93 1.24 0.19 4.98 0.52 -0.41 -0.53 118.95 124.02 2f56 s ARG 70 Ca 0.14 -1.55 0.08 0.00 -0.52 0.00 0.00 55.73 53.88 2f56 s ARG 70 Cb -0.11 -0.94 -0.04 0.00 0.52 0.00 0.00 34.95 34.37 2f56 s ARG 70 CO 0.03 0.14 -0.16 -1.83 0.02 0.00 0.00 175.30 173.50 2f56 s GLU 71 N -3.69 1.32 -0.03 3.54 -1.05 0.01 -1.00 118.70 117.82 2f56 s GLU 71 Ca 0.21 -1.52 -0.04 0.00 -0.15 0.00 0.00 54.97 53.47 2f56 s GLU 71 Cb 0.01 -1.23 0.01 0.00 -0.44 0.00 0.00 34.13 32.47 2f56 s GLU 71 CO 0.05 0.23 0.09 0.00 0.95 0.00 0.00 175.26 176.58 2f56 s ALA 72 N -2.57 -0.23 0.25 -0.84 0.00 -0.64 -0.11 121.76 117.62 2f56 s ALA 72 Ca 0.20 0.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 2f56 s ALA 72 Cb -0.03 -0.10 -0.09 0.00 0.00 0.00 0.00 23.12 22.90 2f56 s ALA 72 CO 0.07 -0.08 1.16 -0.51 0.00 0.00 0.00 175.76 176.40 2f56 s ASP 73 N -0.27 7.14 0.08 0.00 1.11 -0.08 -0.89 116.67 123.75 2f56 s ASP 73 Ca -0.03 2.31 0.09 0.00 0.18 0.00 0.00 52.55 55.09 2f56 s ASP 73 Cb -0.02 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.31 2f56 s ASP 73 CO 0.00 -0.27 -0.21 -0.63 1.18 0.00 0.00 175.17 175.23 2f56 s ILE 74 N -0.76 2.58 -1.47 0.77 -1.09 -0.97 -4.71 121.20 115.54 2f56 s ILE 74 Ca 0.48 -1.42 0.00 0.00 -2.23 0.00 0.00 60.65 57.48 2f56 s ILE 74 Cb -0.33 -2.11 0.00 0.00 -1.58 0.00 0.00 42.46 38.44 2f56 s ILE 74 CO 0.41 0.23 0.00 0.59 -1.23 0.00 0.00 174.94 174.94 2f56 n ASN 75 N 1.27 -4.90 -4.72 3.58 3.02 0.13 -4.59 115.26 109.06 2f56 n ASN 75 Ca -0.16 0.34 -0.42 0.00 -0.03 0.00 0.00 54.58 54.31 2f56 n ASN 75 Cb 0.52 -3.62 -0.03 0.00 -0.61 0.00 0.00 39.78 36.04 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 -2.44 3.62 0.05 3.10 5.04 -1.26 -4.92 117.35 120.54 2f56 s TYR 76 Ca 0.00 1.60 -0.00 0.00 -2.44 0.00 0.00 57.07 56.23 2f56 s TYR 76 Cb 0.00 -3.20 -0.00 0.00 0.35 0.00 0.00 41.96 39.11 2f56 s TYR 76 CO 0.00 -0.36 -0.01 0.25 -1.34 0.00 0.00 175.55 174.09 2f56 n THR 77 N 3.55 0.66 -3.64 4.34 -2.24 -1.26 -4.95 114.28 110.74 2f56 n THR 77 Ca 0.06 0.21 -0.07 0.00 -2.27 0.00 0.00 64.05 61.98 2f56 n THR 77 Cb 0.49 -1.56 -0.02 0.00 -2.10 0.00 0.00 70.33 67.15 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 -5.54 -0.31 0.00 3.42 1.04 -1.26 -4.76 113.70 106.28 2f56 s SER 78 Ca -0.00 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.18 2f56 s SER 78 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2f56 s SER 78 CO 0.01 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 173.95 2f56 n GLY 79 N -0.38 -0.59 3.76 7.32 0.00 -1.26 -4.88 105.19 109.17 2f56 n GLY 79 Ca -0.08 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.07 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 2.53 0.57 1.61 0.08 -1.26 -4.40 117.98 117.11 2f56 s PHE 80 Ca 0.00 1.54 -0.21 0.00 0.12 0.00 0.00 56.93 58.38 2f56 s PHE 80 Cb 0.00 -3.34 -0.05 0.00 -0.57 0.00 0.00 43.02 39.06 2f56 s PHE 80 CO 0.00 -1.87 1.24 0.54 -0.10 0.00 0.00 175.22 175.03 2f56 n ARG 81 N -1.70 1.40 -0.29 0.44 1.74 -1.26 -5.02 116.66 111.97 2f56 n ARG 81 Ca 0.12 0.52 0.00 0.00 -0.77 0.00 0.00 57.85 57.72 2f56 n ARG 81 Cb 0.51 -2.44 0.00 0.00 -1.02 0.00 0.00 32.46 29.51 2f56 n ARG 81 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2f56 n ASN 82 N -0.99 0.00 -0.94 0.55 0.23 -1.26 -5.03 115.26 107.83 2f56 n ASN 82 Ca 0.12 -0.47 0.09 0.00 -0.53 0.00 0.00 54.58 53.79 2f56 n ASN 82 Cb 0.45 0.00 0.19 0.00 -2.08 0.00 0.00 39.78 38.35 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 -1.41 3.19 -4.72 0.53 3.41 -1.26 -4.95 113.62 108.41 2f56 n SER 83 Ca 0.00 -1.92 -0.36 0.00 -0.26 0.00 0.00 58.87 56.33 2f56 n SER 83 Cb 0.00 -0.26 -0.08 0.00 -0.26 0.00 0.00 64.21 63.62 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 -1.16 6.32 0.00 4.04 1.01 -1.26 -2.16 116.67 123.46 2f56 s ASP 84 Ca 0.32 0.36 -0.03 0.00 0.71 0.00 0.00 52.55 53.92 2f56 s ASP 84 Cb 0.18 -2.14 -0.01 0.00 1.01 0.00 0.00 42.92 41.96 2f56 s ASP 84 CO 0.25 0.11 0.04 -0.13 0.21 0.00 0.00 175.17 175.65 2f56 s ARG 85 N 0.55 0.28 -0.14 8.23 1.81 0.15 -2.29 118.95 127.55 2f56 s ARG 85 Ca 0.13 -0.32 -0.07 0.00 -1.72 0.00 0.00 55.73 53.74 2f56 s ARG 85 Cb -0.12 0.11 -0.04 0.00 -0.45 0.00 0.00 34.95 34.44 2f56 s ARG 85 CO 0.02 -0.05 0.13 -1.50 -0.68 0.00 0.00 175.30 173.22 2f56 s ILE 86 N -0.94 5.41 -0.17 1.52 2.07 -0.07 -1.29 121.20 127.74 2f56 s ILE 86 Ca -0.10 0.18 -0.03 0.00 -1.41 0.00 0.00 60.65 59.29 2f56 s ILE 86 Cb -0.06 -3.38 -0.02 0.00 0.13 0.00 0.00 42.46 39.13 2f56 s ILE 86 CO 0.00 0.58 -0.07 -0.76 -1.91 0.00 0.00 174.94 172.78 2f56 s LEU 87 N -0.72 2.96 -0.01 8.50 2.01 0.11 -1.62 118.68 129.90 2f56 s LEU 87 Ca 0.13 -0.28 0.03 0.00 0.01 0.00 0.00 54.13 54.03 2f56 s LEU 87 Cb -0.12 -1.71 -0.01 0.00 0.01 0.00 0.00 46.19 44.36 2f56 s LEU 87 CO 0.03 0.11 -0.11 -0.72 1.01 0.00 0.00 176.35 176.66 2f56 s TYR 88 N 0.70 1.05 0.45 0.29 1.13 -0.17 -0.75 117.35 120.05 2f56 s TYR 88 Ca -0.04 -0.21 0.08 0.00 -1.41 0.00 0.00 57.07 55.50 2f56 s TYR 88 Cb -0.15 -0.68 0.02 0.00 -1.10 0.00 0.00 41.96 40.05 2f56 s TYR 88 CO 0.02 -0.03 0.56 -1.54 -2.51 0.00 0.00 175.55 172.05 2f56 s SER 89 N -0.21 5.41 0.43 -0.18 1.04 -0.42 -1.29 113.70 118.48 2f56 s SER 89 Ca 0.03 -0.59 0.30 0.00 0.48 0.00 0.00 55.95 56.18 2f56 s SER 89 Cb -0.05 -0.44 1.43 0.00 0.10 0.00 0.00 66.02 67.06 2f56 s SER 89 CO -0.00 -0.85 1.91 0.77 0.98 0.00 0.00 173.24 176.04 2f56 h SER 90 N 0.64 0.00 -0.33 7.02 4.64 -1.57 -0.92 113.55 123.03 2f56 h SER 90 Ca -0.38 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.93 2f56 h SER 90 Cb 1.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2f56 h SER 90 CO 0.47 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.54 2f56 n ASP 91 N -2.64 4.21 -1.75 4.97 5.75 -1.26 -4.99 116.55 120.84 2f56 n ASP 91 Ca -0.00 -3.03 -0.14 0.00 -0.01 0.00 0.00 54.79 51.61 2f56 n ASP 91 Cb 0.17 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.69 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 -0.32 -0.87 -2.31 2.11 7.02 -0.35 -5.02 117.44 117.69 2f56 n TRP 92 Ca 0.23 0.11 -0.41 0.00 -1.02 0.00 0.00 57.50 56.41 2f56 n TRP 92 Cb 0.96 -3.11 -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 -4.22 4.43 -0.13 -0.99 1.43 -1.26 -4.85 118.68 113.09 2f56 s LEU 93 Ca 0.06 2.28 0.02 0.00 -1.03 0.00 0.00 54.13 55.47 2f56 s LEU 93 Cb -0.03 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.60 2f56 s LEU 93 CO 0.08 -0.44 -0.20 -0.63 0.23 0.00 0.00 176.35 175.39 2f56 s ILE 94 N 0.10 1.86 0.17 -0.59 -1.09 -1.26 -1.31 121.20 119.08 2f56 s ILE 94 Ca 0.55 -0.86 0.09 0.00 -2.23 0.00 0.00 60.65 58.20 2f56 s ILE 94 Cb -0.34 -1.66 -0.04 0.00 -1.58 0.00 0.00 42.46 38.84 2f56 s ILE 94 CO 0.37 0.51 -0.19 -0.31 -1.23 0.00 0.00 174.94 174.09 2f56 s TYR 95 N 0.88 1.86 0.20 3.97 1.51 0.07 -0.84 117.35 125.00 2f56 s TYR 95 Ca -0.07 -0.46 0.07 0.00 -1.01 0.00 0.00 57.07 55.61 2f56 s TYR 95 Cb -0.15 -0.93 -0.05 0.00 -0.11 0.00 0.00 41.96 40.72 2f56 s TYR 95 CO -0.02 0.35 -0.14 -1.59 -1.11 0.00 0.00 175.55 173.04 2f56 s LYS 96 N -2.79 1.30 -0.01 -0.62 -2.85 0.36 0.05 119.74 115.19 2f56 s LYS 96 Ca 0.16 -1.58 -0.00 0.00 -1.00 0.00 0.00 55.97 53.55 2f56 s LYS 96 Cb -0.06 -1.07 0.00 0.00 -2.06 0.00 0.00 37.83 34.64 2f56 s LYS 96 CO 0.07 0.17 0.01 -0.08 0.10 0.00 0.00 175.35 175.63 2f56 s THR 97 N -3.01 -0.00 -0.03 3.79 -1.32 -0.41 -1.13 115.64 113.53 2f56 s THR 97 Ca 0.22 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.75 2f56 s THR 97 Cb -0.00 -0.03 0.07 0.00 -1.51 0.00 0.00 72.50 71.03 2f56 s THR 97 CO 0.06 0.00 1.02 0.35 -2.21 0.00 0.00 174.62 173.84 2f56 n THR 98 N 3.09 1.16 -2.64 5.08 -2.24 -1.26 -0.67 114.28 116.81 2f56 n THR 98 Ca -0.12 -1.26 -0.05 0.00 -2.27 0.00 0.00 64.05 60.35 2f56 n THR 98 Cb 0.60 0.34 0.04 0.00 -2.10 0.00 0.00 70.33 69.21 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 -0.70 2.25 -3.44 3.42 5.68 -1.16 -4.60 116.55 118.00 2f56 n ASP 99 Ca 0.04 -2.41 -0.18 0.00 -0.50 0.00 0.00 54.79 51.74 2f56 n ASP 99 Cb 0.36 -0.44 0.07 0.00 -1.14 0.00 0.00 41.12 39.97 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 -0.58 -2.20 -1.11 2.11 8.25 -0.92 -2.88 115.22 117.89 2f56 n HIS 100 Ca 0.15 0.87 -0.04 0.00 -0.26 0.00 0.00 57.72 58.44 2f56 n HIS 100 Cb 0.85 -4.57 -0.02 0.00 1.12 0.00 0.00 29.99 27.37 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 -3.90 0.00 -0.02 4.41 4.01 -1.26 -4.87 117.16 115.52 2f56 n TYR 101 Ca -0.22 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.37 2f56 n TYR 101 Cb 0.65 -1.43 -0.12 0.00 -0.31 0.00 0.00 39.34 38.13 2f56 n TYR 101 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2f56 h GLN 102 N 0.30 0.17 -5.92 -0.72 4.20 -1.94 -3.46 115.11 107.74 2f56 h GLN 102 Ca -0.08 -0.19 -0.52 0.00 0.06 0.00 0.00 58.65 57.92 2f56 h GLN 102 Cb 0.61 0.06 -0.19 0.00 0.30 0.00 0.00 27.48 28.26 2f56 h GLN 102 CO 0.12 0.96 -0.79 0.95 -0.67 0.00 0.00 178.83 179.40 2f56 s THR 103 N -2.97 1.74 0.03 -0.54 -4.23 -1.26 -5.11 115.64 103.30 2f56 s THR 103 Ca -0.16 -1.83 0.04 0.00 -1.18 0.00 0.00 61.69 58.57 2f56 s THR 103 Cb 0.00 -1.75 -0.02 0.00 1.34 0.00 0.00 72.50 72.07 2f56 s THR 103 CO 0.74 -0.28 -0.13 -0.36 -0.54 0.00 0.00 174.62 174.06 2f56 s PHE 104 N -1.90 1.10 -0.06 3.99 0.08 -1.26 -4.43 117.98 115.50 2f56 s PHE 104 Ca 0.13 -0.33 0.03 0.00 0.12 0.00 0.00 56.93 56.88 2f56 s PHE 104 Cb -0.06 -0.66 0.01 0.00 -0.57 0.00 0.00 43.02 41.73 2f56 s PHE 104 CO 0.06 0.01 -0.14 0.99 -0.10 0.00 0.00 175.22 176.04 2f56 s THR 105 N -0.77 1.26 0.18 0.64 2.01 -0.28 -4.94 115.64 113.73 2f56 s THR 105 Ca 0.01 -0.57 -0.31 0.00 0.31 0.00 0.00 61.69 61.13 2f56 s THR 105 Cb -0.07 -1.12 -0.09 0.00 0.01 0.00 0.00 72.50 71.22 2f56 s THR 105 CO 0.01 0.38 1.47 -0.75 -0.69 0.00 0.00 174.62 175.04 2f56 s LYS 106 N 0.48 4.26 0.00 4.92 2.20 -1.26 -0.49 119.74 129.85 2f56 s LYS 106 Ca -0.12 2.26 0.00 0.00 -0.36 0.00 0.00 55.97 57.75 2f56 s LYS 106 Cb -0.15 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.01 2f56 s LYS 106 CO 0.04 -0.49 0.00 0.44 -0.36 0.00 0.00 175.35 174.97 2f56 n ILE 107 N 3.41 0.00 -1.20 5.43 -5.35 -0.02 -4.91 119.36 116.73 2f56 n ILE 107 Ca 0.11 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 2f56 n ILE 107 Cb 0.40 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.06 2f56 n ILE 107 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33