#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fyg n HIS 6 N 0.00 -0.45 -0.73 -1.40 -0.00 -1.26 -5.00 115.22 106.38 2fyg n HIS 6 Ca 0.00 0.19 -0.24 0.00 -0.00 0.00 0.00 57.72 57.67 2fyg n HIS 6 Cb 0.00 -0.75 -0.00 0.00 -0.00 0.00 0.00 29.99 29.24 2fyg n HIS 6 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2fyg n HIS 7 N 0.70 -1.17 -4.05 4.41 -0.00 -1.26 -5.00 115.22 108.85 2fyg n HIS 7 Ca -0.01 0.35 -0.12 0.00 -0.00 0.00 0.00 57.72 57.94 2fyg n HIS 7 Cb 0.34 -1.00 -0.11 0.00 -0.00 0.00 0.00 29.99 29.22 2fyg n HIS 7 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2fyg s HIS 8 N -0.94 0.62 -0.14 -1.40 5.65 -1.26 -5.13 115.29 112.69 2fyg s HIS 8 Ca 0.33 -0.52 -0.04 0.00 0.25 0.00 0.00 55.06 55.08 2fyg s HIS 8 Cb -0.36 -0.38 0.06 0.00 -1.18 0.00 0.00 32.58 30.72 2fyg s HIS 8 CO 0.35 -0.10 0.09 -1.58 -0.65 0.00 0.00 174.74 172.85 2fyg s HIS 9 N -1.49 0.12 0.25 3.88 5.65 -1.26 -5.04 115.29 117.41 2fyg s HIS 9 Ca -0.10 -0.12 -0.05 0.00 0.25 0.00 0.00 55.06 55.04 2fyg s HIS 9 Cb -0.09 -0.61 0.32 0.00 -1.18 0.00 0.00 32.58 31.02 2fyg s HIS 9 CO -0.00 -0.44 1.90 -0.97 -0.65 0.00 0.00 174.74 174.58 2fyg h ASN 10 N 8.42 1.08 0.25 9.88 -0.73 -1.98 -2.26 115.58 130.24 2fyg h ASN 10 Ca -0.14 -0.01 -0.04 0.00 1.87 0.00 0.00 56.30 57.97 2fyg h ASN 10 Cb 1.14 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 39.48 2fyg h ASN 10 CO 0.26 0.74 -0.20 0.77 -0.37 0.00 0.00 177.43 178.62 2fyg h SER 11 N 1.25 0.00 -0.19 1.15 4.64 -1.98 -0.44 113.55 117.98 2fyg h SER 11 Ca 0.39 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.71 2fyg h SER 11 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 2fyg h SER 11 CO -0.13 0.20 0.09 0.74 -0.87 0.00 0.00 176.83 176.86 2fyg h THR 12 N 0.00 1.14 -0.14 2.95 2.02 -1.84 0.11 112.91 117.14 2fyg h THR 12 Ca -0.00 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 2fyg h THR 12 Cb 0.38 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 2fyg h THR 12 CO 0.03 0.13 0.01 0.58 0.37 0.00 0.00 175.52 176.64 2fyg h VAL 13 N 0.17 1.24 -0.70 3.16 2.07 -1.36 -1.27 116.25 119.55 2fyg h VAL 13 Ca 0.07 -0.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 2fyg h VAL 13 Cb 0.13 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 2fyg h VAL 13 CO -0.01 0.23 0.27 -0.07 0.02 0.00 0.00 177.57 178.01 2fyg h LEU 14 N 0.00 0.96 0.05 2.57 3.38 -1.04 -1.40 115.31 119.84 2fyg h LEU 14 Ca 0.04 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2fyg h LEU 14 Cb 0.34 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2fyg h LEU 14 CO 0.01 0.86 -0.03 -1.28 0.09 0.00 0.00 178.44 178.09 2fyg h SER 15 N 1.02 -0.06 -0.55 -0.43 0.87 -0.70 0.19 113.55 113.89 2fyg h SER 15 Ca 0.24 -0.06 0.10 0.00 -1.23 0.00 0.00 61.79 60.84 2fyg h SER 15 Cb 0.21 0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 62.10 2fyg h SER 15 CO -0.02 0.02 0.07 0.15 -0.53 0.00 0.00 176.83 176.53 2fyg h PHE 16 N -0.14 0.10 -0.16 2.24 3.57 -0.94 -1.94 116.94 119.68 2fyg h PHE 16 Ca -0.01 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.39 2fyg h PHE 16 Cb 0.12 0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.90 2fyg h PHE 16 CO -0.05 -0.06 -0.43 0.00 -2.23 0.00 0.00 178.31 175.53 2fyg h ALA 18 N 0.55 1.11 -0.02 0.00 0.00 -0.27 -2.27 119.26 118.36 2fyg h ALA 18 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2fyg h ALA 18 Cb 1.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2fyg h ALA 18 CO 0.09 0.06 -0.00 1.19 0.00 0.00 0.00 179.25 180.59 2fyg n PHE 19 N -4.77 0.00 -2.40 0.00 3.72 -0.76 -4.91 117.46 108.35 2fyg n PHE 19 Ca 0.13 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.16 2fyg n PHE 19 Cb 0.27 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.78 2fyg n PHE 19 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fyg s ALA 20 N -2.00 3.05 0.38 4.37 0.00 -0.85 -4.95 121.76 121.75 2fyg s ALA 20 Ca 0.36 0.83 0.15 0.00 0.00 0.00 0.00 51.96 53.31 2fyg s ALA 20 Cb 0.21 -3.33 0.87 0.00 0.00 0.00 0.00 23.12 20.86 2fyg s ALA 20 CO 0.33 -0.43 1.88 -0.39 0.00 0.00 0.00 175.76 177.15 2fyg h VAL 21 N 2.08 1.12 -3.22 0.00 -1.51 -1.91 -3.34 116.25 109.48 2fyg h VAL 21 Ca -0.49 -1.08 -0.63 0.00 -1.23 0.00 0.00 66.70 63.28 2fyg h VAL 21 Cb 1.23 1.60 -0.40 0.00 -2.13 0.00 0.00 31.29 31.58 2fyg h VAL 21 CO 0.61 0.30 -0.69 -0.62 -1.23 0.00 0.00 177.57 175.94 2fyg s ASP 22 N -6.80 4.04 0.31 4.19 -1.08 -1.26 -5.00 116.67 111.06 2fyg s ASP 22 Ca -0.03 -2.72 0.01 0.00 -0.52 0.00 0.00 52.55 49.29 2fyg s ASP 22 Cb 0.14 -1.33 0.49 0.00 -1.46 0.00 0.00 42.92 40.76 2fyg s ASP 22 CO 0.70 -0.27 1.86 1.55 0.52 0.00 0.00 175.17 179.54 2fyg h PRO 23 N 6.75 0.73 -0.40 4.34 0.13 -1.73 -1.52 132.00 140.30 2fyg h PRO 23 Ca -0.05 -0.14 -0.01 0.00 -0.87 0.00 0.00 66.00 64.93 2fyg h PRO 23 Cb 0.92 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.92 2fyg h PRO 23 CO 0.58 0.66 0.19 0.00 -0.23 0.00 0.00 178.00 179.20 2fyg h ALA 24 N 1.43 0.52 -0.59 -0.56 0.00 -1.94 -1.40 119.26 116.71 2fyg h ALA 24 Ca 0.16 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 2fyg h ALA 24 Cb 0.26 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2fyg h ALA 24 CO -0.00 0.08 -0.00 -0.22 0.00 0.00 0.00 179.25 179.10 2fyg h LYS 25 N 0.51 1.04 -0.46 0.00 3.64 -1.94 -1.52 116.57 117.84 2fyg h LYS 25 Ca 0.14 -0.33 0.06 0.00 -1.27 0.00 0.00 60.65 59.25 2fyg h LYS 25 Cb 0.12 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 2fyg h LYS 25 CO -0.02 1.02 0.16 0.00 -2.27 0.00 0.00 179.45 178.34 2fyg h ALA 26 N 1.03 0.55 -0.32 5.00 0.00 -1.08 0.16 119.26 124.60 2fyg h ALA 26 Ca 0.17 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2fyg h ALA 26 Cb 0.55 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2fyg h ALA 26 CO 0.03 -0.23 -0.16 -0.92 0.00 0.00 0.00 179.25 177.97 2fyg h TYR 27 N 0.32 0.78 -0.19 0.00 3.20 -1.10 -0.45 116.97 119.53 2fyg h TYR 27 Ca 0.22 -0.19 0.01 0.00 3.14 0.00 0.00 58.73 61.91 2fyg h TYR 27 Cb 0.22 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 2fyg h TYR 27 CO -0.16 0.89 0.08 -0.22 -1.64 0.00 0.00 178.16 177.11 2fyg h LYS 28 N 0.44 0.18 -0.37 1.82 3.64 -0.92 -0.33 116.57 121.03 2fyg h LYS 28 Ca 0.07 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.35 2fyg h LYS 28 Cb 0.69 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 2fyg h LYS 28 CO 0.05 0.12 -0.16 -0.44 -2.27 0.00 0.00 179.45 176.75 2fyg h ASP 29 N 0.18 0.68 -0.27 4.20 3.32 -0.62 -1.52 116.42 122.39 2fyg h ASP 29 Ca 0.08 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 2fyg h ASP 29 Cb 0.03 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2fyg h ASP 29 CO -0.06 0.85 0.14 0.22 -1.72 0.00 0.00 179.24 178.67 2fyg h TYR 30 N 0.61 0.38 -0.63 4.55 3.20 -0.68 -1.18 116.97 123.23 2fyg h TYR 30 Ca 0.10 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2fyg h TYR 30 Cb 0.62 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.74 2fyg h TYR 30 CO 0.03 0.34 0.37 -0.07 -1.64 0.00 0.00 178.16 177.18 2fyg h LEU 31 N 0.32 0.78 -1.99 2.82 3.38 -0.87 -1.42 115.31 118.32 2fyg h LEU 31 Ca 0.09 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2fyg h LEU 31 Cb 0.09 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2fyg h LEU 31 CO -0.01 0.63 0.01 0.00 0.09 0.00 0.00 178.44 179.15 2fyg h ALA 32 N 1.18 1.99 0.00 1.53 0.00 -1.05 -0.66 119.26 122.26 2fyg h ALA 32 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2fyg h ALA 32 Cb 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2fyg h ALA 32 CO -0.04 0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.09 2fyg n SER 33 N -4.54 0.00 0.00 0.00 3.41 -0.46 -4.87 113.62 107.16 2fyg n SER 33 Ca -0.03 -0.73 0.00 0.00 -0.26 0.00 0.00 58.87 57.85 2fyg n SER 33 Cb 0.09 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 2fyg n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fyg n GLY 34 N 0.86 0.89 3.76 5.00 0.00 -0.25 -5.08 105.19 110.36 2fyg n GLY 34 Ca 0.20 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2fyg n GLY 34 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fyg s GLY 35 N -2.03 2.54 -0.03 -0.02 0.00 -0.60 -4.98 107.32 102.20 2fyg s GLY 35 Ca 0.00 0.84 -0.30 0.00 0.00 0.00 0.00 44.72 45.26 2fyg s GLY 35 CO 0.00 1.22 1.29 1.20 0.00 0.00 0.00 173.10 176.81 2fyg s GLN 36 N -3.55 4.32 0.84 2.90 -0.21 -1.26 -4.65 119.66 118.05 2fyg s GLN 36 Ca 0.73 1.80 -0.13 0.00 0.02 0.00 0.00 55.36 57.79 2fyg s GLN 36 Cb -0.26 -3.57 0.06 0.00 1.00 0.00 0.00 33.01 30.24 2fyg s GLN 36 CO 0.34 -0.51 0.86 -2.30 -2.12 0.00 0.00 175.29 171.57 2fyg n PRO 37 N 5.29 0.00 -1.88 2.91 -0.02 -1.26 -4.89 135.00 135.15 2fyg n PRO 37 Ca 0.12 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 61.25 2fyg n PRO 37 Cb 0.45 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 2fyg n PRO 37 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2fyg s ILE 38 N -2.21 2.43 0.15 4.25 1.01 -1.26 -4.99 121.20 120.57 2fyg s ILE 38 Ca 0.67 0.32 0.01 0.00 0.00 0.00 0.00 60.65 61.65 2fyg s ILE 38 Cb -0.27 -3.20 0.01 0.00 0.01 0.00 0.00 42.46 39.00 2fyg s ILE 38 CO 0.57 0.03 0.10 0.35 0.00 0.00 0.00 174.94 175.99 2fyg n THR 39 N 3.59 0.00 -1.30 2.92 -2.24 -1.26 -4.74 114.28 111.25 2fyg n THR 39 Ca 0.13 -0.60 -0.10 0.00 -2.27 0.00 0.00 64.05 61.21 2fyg n THR 39 Cb 0.38 -0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 68.25 2fyg n THR 39 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2fyg n ASN 40 N -1.85 -4.43 -4.74 3.42 5.03 -1.26 -4.99 115.26 106.44 2fyg n ASN 40 Ca -0.01 0.25 -0.37 0.00 0.87 0.00 0.00 54.58 55.32 2fyg n ASN 40 Cb 0.17 -2.83 0.06 0.00 -1.02 0.00 0.00 39.78 36.16 2fyg n ASN 40 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2fyg s VAL 42 N -1.37 4.79 -0.03 0.00 1.01 -1.26 -4.99 120.40 118.53 2fyg s VAL 42 Ca 0.80 -0.10 -0.21 0.00 0.00 0.00 0.00 61.98 62.47 2fyg s VAL 42 Cb -0.38 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.67 2fyg s VAL 42 CO 0.42 -0.75 0.61 -0.75 0.00 0.00 0.00 175.10 174.63 2fyg s LYS 43 N 2.90 4.36 0.18 2.72 2.20 -1.26 -0.71 119.74 130.12 2fyg s LYS 43 Ca 0.21 0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 56.45 2fyg s LYS 43 Cb -0.16 -3.38 -0.07 0.00 -1.51 0.00 0.00 37.83 32.71 2fyg s LYS 43 CO 0.16 0.26 0.52 -1.64 -0.36 0.00 0.00 175.35 174.29 2fyg s MET 44 N 0.18 3.84 -0.06 4.03 -1.94 0.18 -4.95 119.30 120.58 2fyg s MET 44 Ca 0.32 0.30 -0.30 0.00 -1.71 0.00 0.00 55.69 54.31 2fyg s MET 44 Cb -0.18 -2.79 -0.04 0.00 2.01 0.00 0.00 34.83 33.84 2fyg s MET 44 CO 0.17 0.40 1.29 -1.17 -0.01 0.00 0.00 175.02 175.70 2fyg s LEU 45 N -2.44 4.27 0.19 -0.03 2.96 -1.26 -4.70 118.68 117.68 2fyg s LEU 45 Ca 0.42 1.90 -0.14 0.00 -0.22 0.00 0.00 54.13 56.09 2fyg s LEU 45 Cb -0.13 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 43.02 2fyg s LEU 45 CO 0.20 -0.67 0.44 0.00 -1.32 0.00 0.00 176.35 175.00 2fyg h THR 47 N 2.32 0.31 -2.73 0.00 1.35 -1.94 -3.47 112.91 108.75 2fyg h THR 47 Ca -0.29 -1.05 -0.40 0.00 -0.55 0.00 0.00 66.41 64.11 2fyg h THR 47 Cb 1.25 1.83 -0.03 0.00 -1.73 0.00 0.00 68.15 69.46 2fyg h THR 47 CO 0.40 0.14 -0.51 1.41 -0.25 0.00 0.00 175.52 176.72 2fyg n HIS 48 N -3.22 -0.88 -1.67 4.73 8.25 -1.25 -4.89 115.22 116.29 2fyg n HIS 48 Ca 0.01 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.53 2fyg n HIS 48 Cb 0.45 -3.84 0.16 0.00 1.12 0.00 0.00 29.99 27.88 2fyg n HIS 48 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2fyg n THR 49 N -3.89 1.70 -1.67 1.59 -2.24 -1.11 -2.13 114.28 106.54 2fyg n THR 49 Ca -0.24 -2.57 -0.08 0.00 -2.27 0.00 0.00 64.05 58.89 2fyg n THR 49 Cb 0.68 -0.01 0.05 0.00 -2.10 0.00 0.00 70.33 68.96 2fyg n THR 49 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fyg n GLY 50 N -0.86 -0.51 0.22 3.38 0.00 -0.17 -4.95 105.19 102.30 2fyg n GLY 50 Ca 0.16 -1.79 0.09 0.00 0.00 0.00 0.00 46.02 44.48 2fyg n GLY 50 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2fyg h THR 51 N -0.93 0.66 0.00 2.61 1.35 -1.80 -3.38 112.91 111.42 2fyg h THR 51 Ca -0.11 -1.08 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 2fyg h THR 51 Cb 0.34 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 2fyg h THR 51 CO 0.09 0.24 0.00 0.61 -0.25 0.00 0.00 175.52 176.21 2fyg n GLY 52 N -0.05 0.74 3.72 5.82 0.00 0.09 -4.90 105.19 110.61 2fyg n GLY 52 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2fyg n GLY 52 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fyg s GLN 53 N -0.01 2.21 0.01 1.61 -0.21 -1.26 -4.73 119.66 117.28 2fyg s GLN 53 Ca 0.00 1.85 -0.25 0.00 0.02 0.00 0.00 55.36 56.98 2fyg s GLN 53 Cb 0.00 -1.83 -0.17 0.00 1.00 0.00 0.00 33.01 32.01 2fyg s GLN 53 CO 0.00 -1.81 1.32 0.00 -2.12 0.00 0.00 175.29 172.68 2fyg h ALA 54 N -0.10 -0.25 -3.24 6.09 0.00 -1.16 -3.40 119.26 117.20 2fyg h ALA 54 Ca -0.48 -0.18 -0.49 0.00 0.00 0.00 0.00 54.91 53.76 2fyg h ALA 54 Cb 1.31 0.10 -0.38 0.00 0.00 0.00 0.00 17.79 18.82 2fyg h ALA 54 CO 0.50 -0.48 -0.78 0.42 0.00 0.00 0.00 179.25 178.92 2fyg s ILE 55 N -4.78 0.67 0.17 0.00 1.01 -1.26 -0.75 121.20 116.26 2fyg s ILE 55 Ca -0.15 -0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.35 2fyg s ILE 55 Cb 0.03 -0.83 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 2fyg s ILE 55 CO 0.60 0.23 0.03 0.42 0.00 0.00 0.00 174.94 176.21 2fyg s THR 56 N 1.84 0.46 0.23 2.92 -4.23 0.10 -4.95 115.64 112.01 2fyg s THR 56 Ca 0.04 -1.96 0.07 0.00 -1.18 0.00 0.00 61.69 58.66 2fyg s THR 56 Cb -0.13 -2.15 -0.07 0.00 1.34 0.00 0.00 72.50 71.49 2fyg s THR 56 CO -0.07 -0.42 1.53 0.58 -0.54 0.00 0.00 174.62 175.70 2fyg h VAL 57 N 2.72 1.46 -3.37 2.29 2.07 -1.94 -0.35 116.25 119.14 2fyg h VAL 57 Ca -0.36 -2.27 -0.36 0.00 0.82 0.00 0.00 66.70 64.52 2fyg h VAL 57 Cb 1.21 2.21 -0.14 0.00 -1.52 0.00 0.00 31.29 33.05 2fyg h VAL 57 CO 0.61 0.66 -0.67 0.42 0.02 0.00 0.00 177.57 178.61 2fyg s THR 58 N -3.51 1.03 0.26 2.57 -4.23 -1.26 -4.65 115.64 105.85 2fyg s THR 58 Ca -0.02 -2.03 -0.31 0.00 -1.18 0.00 0.00 61.69 58.15 2fyg s THR 58 Cb 0.12 -2.25 -0.13 0.00 1.34 0.00 0.00 72.50 71.58 2fyg s THR 58 CO 0.79 -0.40 1.48 -2.65 -0.54 0.00 0.00 174.62 173.29 2fyg n PRO 59 N -0.37 2.28 -0.80 3.99 -0.02 -1.26 -4.77 135.00 134.05 2fyg n PRO 59 Ca -0.06 0.81 0.04 0.00 -2.02 0.00 0.00 63.50 62.27 2fyg n PRO 59 Cb 0.63 -2.51 0.07 0.00 -0.02 0.00 0.00 33.50 31.67 2fyg n PRO 59 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2fyg n GLU 60 N 2.06 0.51 -1.68 -0.52 -0.58 -1.26 -4.91 120.64 114.26 2fyg n GLU 60 Ca 0.10 -2.04 -0.44 0.00 -0.42 0.00 0.00 57.16 54.36 2fyg n GLU 60 Cb 0.33 -0.70 -0.02 0.00 -0.57 0.00 0.00 31.44 30.49 2fyg n GLU 60 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2fyg n ALA 61 N -0.27 1.15 -1.72 0.62 0.00 -1.26 -0.73 120.51 118.30 2fyg n ALA 61 Ca 0.08 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2fyg n ALA 61 Cb 0.85 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2fyg n ALA 61 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2fyg n ASN 62 N 1.79 0.00 0.30 0.00 0.23 -1.26 -1.00 115.26 115.32 2fyg n ASN 62 Ca 0.10 -0.72 0.18 0.00 -0.53 0.00 0.00 54.58 53.60 2fyg n ASN 62 Cb 0.33 0.00 0.96 0.00 -2.08 0.00 0.00 39.78 38.98 2fyg n ASN 62 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2fyg h MET 63 N 0.00 0.00 -0.32 -3.83 -0.00 -1.77 -2.91 114.93 106.10 2fyg h MET 63 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2fyg h MET 63 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 2fyg h MET 63 CO 0.00 0.03 0.00 -0.25 -0.00 0.00 0.00 176.91 176.69 2fyg n ASP 64 N -3.42 4.17 -4.22 -0.10 8.00 -1.26 -5.00 116.55 114.73 2fyg n ASP 64 Ca -0.02 -2.95 -0.13 0.00 0.71 0.00 0.00 54.79 52.40 2fyg n ASP 64 Cb 0.15 -0.56 -0.10 0.00 -0.02 0.00 0.00 41.12 40.59 2fyg n ASP 64 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2fyg s GLN 65 N -2.72 1.12 0.16 -1.24 -0.21 -1.10 -0.97 119.66 114.70 2fyg s GLN 65 Ca 0.44 -1.56 0.10 0.00 0.02 0.00 0.00 55.36 54.36 2fyg s GLN 65 Cb 0.34 -0.06 -0.04 0.00 1.00 0.00 0.00 33.01 34.25 2fyg s GLN 65 CO 0.11 -0.22 -0.20 -1.21 -2.12 0.00 0.00 175.29 171.65 2fyg s GLU 66 N -4.00 1.69 -0.11 2.91 0.41 -0.13 -4.65 118.70 114.82 2fyg s GLU 66 Ca 0.28 -1.33 -0.01 0.00 -0.41 0.00 0.00 54.97 53.49 2fyg s GLU 66 Cb 0.07 -2.00 -0.03 0.00 -1.78 0.00 0.00 34.13 30.39 2fyg s GLU 66 CO 0.06 0.44 -0.05 -1.12 -0.49 0.00 0.00 175.26 174.10 2fyg s SER 67 N -2.43 4.73 0.15 -0.19 0.01 -1.26 -0.85 113.70 113.86 2fyg s SER 67 Ca 0.20 -0.07 0.07 0.00 1.31 0.00 0.00 55.95 57.45 2fyg s SER 67 Cb -0.09 -1.49 -0.04 0.00 0.21 0.00 0.00 66.02 64.61 2fyg s SER 67 CO 0.10 0.27 -0.14 -0.36 0.41 0.00 0.00 173.24 173.52 2fyg s PHE 68 N -0.25 1.52 0.22 2.43 0.08 -0.17 -0.65 117.98 121.17 2fyg s PHE 68 Ca 0.04 -0.58 -0.31 0.00 0.12 0.00 0.00 56.93 56.20 2fyg s PHE 68 Cb -0.13 -0.76 -0.11 0.00 -0.57 0.00 0.00 43.02 41.45 2fyg s PHE 68 CO 0.02 0.22 1.64 0.20 -0.10 0.00 0.00 175.22 177.20 2fyg s GLY 69 N -2.80 1.57 0.09 4.36 0.00 0.11 -1.01 107.32 109.64 2fyg s GLY 69 Ca 0.14 1.52 -0.24 0.00 0.00 0.00 0.00 44.72 46.15 2fyg s GLY 69 CO 0.04 2.71 1.72 -1.33 0.00 0.00 0.00 173.10 176.24 2fyg h GLY 70 N 6.23 -0.11 1.54 0.20 0.00 -1.05 -2.69 103.07 107.18 2fyg h GLY 70 Ca -0.44 0.06 0.04 0.00 0.00 0.00 0.00 47.33 46.99 2fyg h GLY 70 CO 0.90 -0.06 0.22 0.00 0.00 0.00 0.00 176.54 177.60 2fyg h ALA 71 N 0.81 1.98 0.00 3.60 0.00 -1.80 -0.93 119.26 122.93 2fyg h ALA 71 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fyg h ALA 71 Cb 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2fyg h ALA 71 CO -0.01 -0.03 0.00 0.66 0.00 0.00 0.00 179.25 179.87 2fyg h SER 72 N 0.26 0.00 -0.57 0.00 4.64 -1.86 -2.32 113.55 113.70 2fyg h SER 72 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2fyg h SER 72 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2fyg h SER 72 CO -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.93 2fyg h LEU 75 N 8.05 1.09 -0.27 0.00 5.85 -1.87 -0.57 115.31 127.60 2fyg h LEU 75 Ca -0.39 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.19 2fyg h LEU 75 Cb 1.17 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 2fyg h LEU 75 CO 0.59 0.74 -0.38 1.88 -0.34 0.00 0.00 178.44 180.93 2fyg h TYR 76 N 1.26 0.89 -0.39 1.25 0.05 -1.93 0.10 116.97 118.20 2fyg h TYR 76 Ca 0.41 -0.30 -0.01 0.00 0.05 0.00 0.00 58.73 58.88 2fyg h TYR 76 Cb 0.03 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.58 2fyg h TYR 76 CO -0.00 1.07 0.20 0.00 -1.05 0.00 0.00 178.16 178.38 2fyg h ARG 78 N 0.50 0.16 0.00 0.00 2.47 -0.93 -2.38 114.38 114.20 2fyg h ARG 78 Ca 0.14 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2fyg h ARG 78 Cb 0.08 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 2fyg h ARG 78 CO -0.02 0.46 -0.29 0.00 0.56 0.00 0.00 179.97 180.68 2fyg n HIS 80 N -1.54 -2.52 -4.53 0.00 8.25 -0.49 -4.86 115.22 109.53 2fyg n HIS 80 Ca 0.06 0.91 -0.26 0.00 -0.26 0.00 0.00 57.72 58.18 2fyg n HIS 80 Cb 0.34 -4.69 -0.10 0.00 1.12 0.00 0.00 29.99 26.65 2fyg n HIS 80 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2fyg s ILE 81 N -3.30 2.18 0.56 1.59 -4.36 -0.72 -5.06 121.20 112.10 2fyg s ILE 81 Ca 0.44 -2.20 -0.20 0.00 -0.26 0.00 0.00 60.65 58.43 2fyg s ILE 81 Cb -0.19 -2.63 -0.05 0.00 1.25 0.00 0.00 42.46 40.83 2fyg s ILE 81 CO 0.66 -0.21 1.22 -1.81 0.24 0.00 0.00 174.94 175.04 2fyg s ASP 82 N -3.59 5.43 0.33 4.36 1.01 -1.26 -4.59 116.67 118.37 2fyg s ASP 82 Ca 0.32 2.41 -0.17 0.00 0.71 0.00 0.00 52.55 55.82 2fyg s ASP 82 Cb 0.03 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 41.26 2fyg s ASP 82 CO 0.16 -1.43 0.79 -1.00 0.21 0.00 0.00 175.17 173.90 2fyg s HIS 83 N -1.55 3.40 -1.56 4.23 3.76 -1.26 -4.96 115.29 117.35 2fyg s HIS 83 Ca 0.74 1.34 -0.09 0.00 -0.15 0.00 0.00 55.06 56.90 2fyg s HIS 83 Cb -0.31 -2.63 -0.05 0.00 1.11 0.00 0.00 32.58 30.70 2fyg s HIS 83 CO 0.35 0.08 2.87 -0.35 -0.85 0.00 0.00 174.74 176.85 2fyg n PRO 84 N -0.26 3.85 -3.63 8.40 -0.04 -1.26 -4.45 135.00 137.60 2fyg n PRO 84 Ca 0.04 -2.41 -0.15 0.00 -0.04 0.00 0.00 63.50 60.93 2fyg n PRO 84 Cb 0.53 -2.76 -0.07 0.00 -0.04 0.00 0.00 33.50 31.16 2fyg n PRO 84 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2fyg s ASN 85 N 1.85 -0.43 0.39 3.54 2.20 -1.26 -5.04 114.94 116.19 2fyg s ASN 85 Ca 0.67 0.38 0.19 0.00 -0.94 0.00 0.00 52.86 53.16 2fyg s ASN 85 Cb 0.18 0.43 1.14 0.00 -2.00 0.00 0.00 41.25 41.00 2fyg s ASN 85 CO -0.07 -0.55 1.73 -0.65 -2.94 0.00 0.00 177.10 174.62 2fyg h PRO 86 N 3.36 0.34 0.00 3.55 0.11 -1.99 0.28 132.00 137.64 2fyg h PRO 86 Ca -0.29 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 2fyg h PRO 86 Cb 1.16 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2fyg h PRO 86 CO 0.40 0.23 -0.04 0.87 -0.21 0.00 0.00 178.00 179.24 2fyg h LYS 87 N 0.35 0.00 -1.18 1.05 1.79 -1.97 -3.47 116.57 113.13 2fyg h LYS 87 Ca 0.65 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.94 2fyg h LYS 87 Cb 1.69 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.32 2fyg h LYS 87 CO -0.37 0.04 -0.23 0.41 -1.08 0.00 0.00 179.45 178.23 2fyg n GLY 88 N 0.86 0.18 3.75 3.86 0.00 0.09 -5.00 105.19 108.93 2fyg n GLY 88 Ca 0.03 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.15 2fyg n GLY 88 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2fyg s PHE 89 N -2.45 3.66 -0.21 1.61 5.36 -1.26 -4.60 117.98 120.09 2fyg s PHE 89 Ca 0.00 1.20 -0.06 0.00 -0.96 0.00 0.00 56.93 57.11 2fyg s PHE 89 Cb 0.00 -2.64 -0.03 0.00 -0.34 0.00 0.00 43.02 40.02 2fyg s PHE 89 CO 0.00 0.31 0.02 0.00 -1.46 0.00 0.00 175.22 174.09 2fyg h ASP 91 N 7.68 0.00 0.01 0.00 3.32 -2.01 -3.33 116.42 122.08 2fyg h ASP 91 Ca -0.37 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.30 2fyg h ASP 91 Cb 1.18 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.66 2fyg h ASP 91 CO 0.61 0.00 -2.44 0.18 -1.72 0.00 0.00 179.24 175.86 2fyg n LEU 92 N -2.35 2.16 -4.70 1.55 4.77 -1.26 -4.86 117.00 112.31 2fyg n LEU 92 Ca 0.03 -0.09 -0.43 0.00 -0.03 0.00 0.00 56.01 55.48 2fyg n LEU 92 Cb 0.30 -0.53 -0.03 0.00 -2.33 0.00 0.00 43.42 40.83 2fyg n LEU 92 CO 0.24 0.82 1.31 1.17 -1.33 0.00 0.00 177.39 179.59 2fyg n LYS 93 N -3.12 2.57 -0.37 3.23 4.81 -1.25 -1.56 118.16 122.46 2fyg n LYS 93 Ca -0.42 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 2fyg n LYS 93 Cb 1.04 -2.74 0.00 0.00 0.02 0.00 0.00 35.03 33.34 2fyg n LYS 93 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2fyg n GLY 94 N 3.73 1.84 2.41 3.14 0.00 -1.26 -4.89 105.19 110.15 2fyg n GLY 94 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 2fyg n GLY 94 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fyg n LYS 95 N -2.00 1.04 -5.12 1.61 5.02 -0.60 -4.98 118.16 113.13 2fyg n LYS 95 Ca 0.00 -2.26 -0.29 0.00 -2.02 0.00 0.00 58.31 53.74 2fyg n LYS 95 Cb 0.00 0.36 -0.16 0.00 -0.02 0.00 0.00 35.03 35.21 2fyg n LYS 95 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2fyg s TYR 96 N -1.88 2.14 -0.10 2.13 2.02 -0.14 -0.68 117.35 120.83 2fyg s TYR 96 Ca 0.14 -0.56 0.01 0.00 -0.37 0.00 0.00 57.07 56.28 2fyg s TYR 96 Cb -0.01 -1.40 -0.02 0.00 -0.40 0.00 0.00 41.96 40.13 2fyg s TYR 96 CO 0.09 -0.15 -0.12 0.54 -1.57 0.00 0.00 175.55 174.33 2fyg s VAL 97 N -0.23 3.15 -0.18 0.71 0.11 -0.18 -0.72 120.40 123.06 2fyg s VAL 97 Ca 0.00 -0.65 -0.16 0.00 -2.93 0.00 0.00 61.98 58.25 2fyg s VAL 97 Cb -0.12 -2.30 -0.04 0.00 -1.53 0.00 0.00 36.38 32.39 2fyg s VAL 97 CO 0.02 0.55 0.38 -1.10 -3.33 0.00 0.00 175.10 171.62 2fyg s GLN 98 N -0.07 4.22 -0.09 1.54 1.11 0.07 -0.99 119.66 125.45 2fyg s GLN 98 Ca -0.02 0.21 0.04 0.00 0.01 0.00 0.00 55.36 55.60 2fyg s GLN 98 Cb -0.14 -3.49 -0.00 0.00 -1.01 0.00 0.00 33.01 28.37 2fyg s GLN 98 CO 0.04 0.07 -0.23 0.42 0.01 0.00 0.00 175.29 175.59 2fyg s ILE 99 N 0.96 1.98 0.40 1.08 -1.09 -0.03 -4.85 121.20 119.67 2fyg s ILE 99 Ca 0.19 -0.99 -0.26 0.00 -2.23 0.00 0.00 60.65 57.36 2fyg s ILE 99 Cb -0.14 -1.71 -0.10 0.00 -1.58 0.00 0.00 42.46 38.92 2fyg s ILE 99 CO 0.07 0.55 1.32 -2.65 -1.23 0.00 0.00 174.94 173.00 2fyg n PRO 100 N 3.43 2.11 -0.21 2.79 -0.02 -1.26 -0.96 135.00 140.88 2fyg n PRO 100 Ca -0.19 0.75 0.07 0.00 -2.02 0.00 0.00 63.50 62.11 2fyg n PRO 100 Cb 0.53 -2.44 0.34 0.00 -0.02 0.00 0.00 33.50 31.91 2fyg n PRO 100 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2fyg h THR 101 N 2.33 1.00 0.00 3.45 2.02 -1.36 0.52 112.91 120.88 2fyg h THR 101 Ca -0.48 -0.27 -0.00 0.00 0.77 0.00 0.00 66.41 66.43 2fyg h THR 101 Cb 1.28 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.84 2fyg h THR 101 CO 0.61 0.14 -0.00 0.71 0.37 0.00 0.00 175.52 177.35 2fyg h THR 102 N 0.78 0.09 -0.13 3.16 1.35 -1.89 -2.42 112.91 113.86 2fyg h THR 102 Ca 0.34 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 2fyg h THR 102 Cb 0.31 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 2fyg h THR 102 CO -0.12 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.15 2fyg n ALA 104 N 0.32 1.73 0.30 0.00 0.00 -0.87 -1.43 120.51 120.55 2fyg n ALA 104 Ca 0.06 -0.02 0.18 0.00 0.00 0.00 0.00 53.44 53.66 2fyg n ALA 104 Cb 0.29 -1.29 0.86 0.00 0.00 0.00 0.00 19.45 19.30 2fyg n ALA 104 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 2fyg h ASN 105 N 0.00 0.00 -1.36 0.00 -1.07 -1.84 -3.36 115.58 107.95 2fyg h ASN 105 Ca 0.00 0.00 -0.44 0.00 0.07 0.00 0.00 56.30 55.93 2fyg h ASN 105 Cb 0.31 0.00 -0.31 0.00 -2.07 0.00 0.00 38.32 36.25 2fyg h ASN 105 CO 0.00 0.00 -0.92 -0.67 0.07 0.00 0.00 177.43 175.91 2fyg n ASP 106 N -2.82 -0.65 -0.15 6.14 2.03 -0.52 -4.79 116.55 115.79 2fyg n ASP 106 Ca -0.01 -2.97 0.02 0.00 0.52 0.00 0.00 54.79 52.34 2fyg n ASP 106 Cb 0.15 0.16 0.30 0.00 -0.72 0.00 0.00 41.12 41.01 2fyg n ASP 106 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2fyg h PRO 107 N 3.75 0.85 -0.25 -0.67 0.11 -1.72 -0.46 132.00 133.62 2fyg h PRO 107 Ca 0.01 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 2fyg h PRO 107 Cb 0.95 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 2fyg h PRO 107 CO 0.41 0.56 0.02 0.28 -0.21 0.00 0.00 178.00 179.07 2fyg h VAL 108 N 0.87 1.24 -0.92 3.15 2.07 -1.88 -1.47 116.25 119.31 2fyg h VAL 108 Ca 0.24 -0.83 0.01 0.00 0.82 0.00 0.00 66.70 66.94 2fyg h VAL 108 Cb -0.10 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 2fyg h VAL 108 CO -0.05 0.26 0.61 1.23 0.02 0.00 0.00 177.57 179.64 2fyg h GLY 109 N 0.22 1.30 0.93 2.17 0.00 -1.83 -2.33 103.07 103.54 2fyg h GLY 109 Ca 0.07 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 2fyg h GLY 109 CO 0.01 0.47 0.02 -2.75 0.00 0.00 0.00 176.54 174.29 2fyg h PHE 110 N 1.25 0.05 -0.20 5.60 3.57 -0.74 -0.62 116.94 125.85 2fyg h PHE 110 Ca 0.34 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 2fyg h PHE 110 Cb -0.14 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 2fyg h PHE 110 CO -0.00 0.10 -0.16 1.79 -2.23 0.00 0.00 178.31 177.82 2fyg h THR 111 N -0.01 1.21 -0.42 4.41 1.35 -1.18 -2.39 112.91 115.88 2fyg h THR 111 Ca 0.01 -0.95 -0.09 0.00 -0.55 0.00 0.00 66.41 64.83 2fyg h THR 111 Cb 0.07 1.24 -0.01 0.00 -1.73 0.00 0.00 68.15 67.71 2fyg h THR 111 CO -0.00 0.30 -0.08 -0.07 -0.25 0.00 0.00 175.52 175.42 2fyg h LEU 112 N 0.31 0.80 0.00 3.87 3.38 -1.03 -3.28 115.31 119.36 2fyg h LEU 112 Ca 0.06 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 2fyg h LEU 112 Cb 0.47 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2fyg h LEU 112 CO 0.03 0.97 -0.26 0.03 0.09 0.00 0.00 178.44 179.29 2fyg h ARG 113 N 0.63 0.00 -6.02 1.13 3.08 -0.92 -3.48 114.38 108.80 2fyg h ARG 113 Ca 0.11 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.58 2fyg h ARG 113 Cb 0.61 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.55 2fyg h ARG 113 CO 0.04 0.02 -0.60 -0.80 -1.07 0.00 0.00 179.97 177.55 2fyg s ASN 114 N -6.01 4.24 0.05 7.04 0.01 -0.92 -5.10 114.94 114.25 2fyg s ASN 114 Ca 0.05 -0.97 0.03 0.00 -0.71 0.00 0.00 52.86 51.26 2fyg s ASN 114 Cb 0.06 -0.55 -0.02 0.00 0.41 0.00 0.00 41.25 41.14 2fyg s ASN 114 CO 0.70 -0.26 -0.10 0.42 -1.51 0.00 0.00 177.10 176.36 2fyg s THR 115 N -2.51 0.70 -0.15 1.60 -4.23 -1.26 -4.90 115.64 104.89 2fyg s THR 115 Ca 0.35 -1.12 -0.15 0.00 -1.18 0.00 0.00 61.69 59.60 2fyg s THR 115 Cb -0.00 -0.73 -0.04 0.00 1.34 0.00 0.00 72.50 73.06 2fyg s THR 115 CO 0.20 -0.32 0.34 -0.69 -0.54 0.00 0.00 174.62 173.61 2fyg s VAL 116 N -1.31 5.28 -0.13 2.29 1.01 -1.26 -0.50 120.40 125.78 2fyg s VAL 116 Ca -0.07 0.65 -0.33 0.00 0.00 0.00 0.00 61.98 62.23 2fyg s VAL 116 Cb -0.10 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.50 2fyg s VAL 116 CO 0.01 0.37 1.99 0.00 0.00 0.00 0.00 175.10 177.47 2fyg h THR 118 N 5.97 0.00 0.00 0.00 1.35 -1.96 0.11 112.91 118.37 2fyg h THR 118 Ca -0.45 -0.33 -0.05 0.00 -0.55 0.00 0.00 66.41 65.03 2fyg h THR 118 Cb 1.27 1.26 -0.01 0.00 -1.73 0.00 0.00 68.15 68.94 2fyg h THR 118 CO 0.96 0.00 -0.33 0.58 -0.25 0.00 0.00 175.52 176.47 2fyg h VAL 119 N 0.00 1.04 0.00 6.82 2.07 -1.97 -3.40 116.25 120.81 2fyg h VAL 119 Ca 0.00 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.63 2fyg h VAL 119 Cb 0.35 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 2fyg h VAL 119 CO 0.00 0.35 -1.15 0.00 0.02 0.00 0.00 177.57 176.79 2fyg n GLY 121 N 1.43 0.51 3.92 0.00 0.00 0.36 -4.94 105.19 106.48 2fyg n GLY 121 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 2fyg n GLY 121 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fyg s MET 122 N -0.44 3.49 0.15 1.61 1.00 -1.26 -0.58 119.30 123.28 2fyg s MET 122 Ca 0.00 -0.03 -0.31 0.00 0.00 0.00 0.00 55.69 55.35 2fyg s MET 122 Cb 0.00 -2.49 -0.08 0.00 0.00 0.00 0.00 34.83 32.26 2fyg s MET 122 CO 0.00 -0.08 1.38 -1.58 0.00 0.00 0.00 175.02 174.74 2fyg s TRP 123 N -2.57 3.23 0.19 -0.03 0.52 -1.26 -0.80 118.94 118.21 2fyg s TRP 123 Ca 0.45 1.01 -0.32 0.00 0.02 0.00 0.00 56.10 57.25 2fyg s TRP 123 Cb -0.10 -3.68 -0.12 0.00 -1.15 0.00 0.00 33.47 28.42 2fyg s TRP 123 CO 0.41 -2.32 1.73 1.63 0.02 0.00 0.00 176.95 178.41 2fyg n LYS 124 N 3.52 2.70 0.00 4.98 5.02 0.34 -1.58 118.16 133.15 2fyg n LYS 124 Ca 0.10 0.98 0.00 0.00 -2.02 0.00 0.00 58.31 57.37 2fyg n LYS 124 Cb 0.42 -2.82 0.00 0.00 -0.02 0.00 0.00 35.03 32.61 2fyg n LYS 124 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fyg n GLY 125 N 3.95 2.60 2.62 0.72 0.00 -1.26 -4.75 105.19 109.06 2fyg n GLY 125 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 2fyg n GLY 125 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2fyg n TYR 126 N -2.00 1.69 0.00 1.61 4.01 -0.62 -4.93 117.16 116.93 2fyg n TYR 126 Ca 0.00 -2.85 0.00 0.00 -0.16 0.00 0.00 57.90 54.89 2fyg n TYR 126 Cb 0.00 -0.31 0.00 0.00 -0.31 0.00 0.00 39.34 38.72 2fyg n TYR 126 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fyg n GLY 127 N -0.18 3.43 3.69 2.72 0.00 -1.13 -4.20 105.19 109.53 2fyg n GLY 127 Ca 0.16 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2fyg n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fyg n SER 129 N 5.62 2.04 -4.74 0.00 3.41 -1.26 -4.71 113.62 113.99 2fyg n SER 129 Ca 0.16 -3.32 -0.37 0.00 -0.26 0.00 0.00 58.87 55.09 2fyg n SER 129 Cb 0.40 -0.46 0.05 0.00 -0.26 0.00 0.00 64.21 63.95 2fyg n SER 129 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fyg s ASP 131 N -1.47 6.31 0.00 0.00 1.01 -1.26 -5.20 116.67 116.07 2fyg s ASP 131 Ca 0.80 2.67 0.20 0.00 0.71 0.00 0.00 52.55 56.94 2fyg s ASP 131 Cb -0.35 -2.64 0.16 0.00 1.01 0.00 0.00 42.92 41.10 2fyg s ASP 131 CO 0.37 -0.85 1.14 0.00 0.21 0.00 0.00 175.17 176.04