#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fyh n PRO 13 N 0.00 -4.01 -3.95 1.45 -0.02 -1.26 -4.37 135.00 122.85 1fyh n PRO 13 Ca 0.00 -1.17 -0.36 0.00 -2.02 0.00 0.00 63.50 59.94 1fyh n PRO 13 Cb 0.00 -2.01 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 1fyh n PRO 13 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1fyh s THR 14 N -2.22 5.34 0.80 3.45 2.01 -1.26 -4.68 115.64 119.08 1fyh s THR 14 Ca 0.68 0.10 -0.14 0.00 0.31 0.00 0.00 61.69 62.64 1fyh s THR 14 Cb -0.18 -3.34 0.05 0.00 0.01 0.00 0.00 72.50 69.04 1fyh s THR 14 CO 0.60 0.58 0.99 -2.65 -0.69 0.00 0.00 174.62 173.45 1fyh n PRO 15 N 1.87 0.20 -4.37 4.92 -0.02 -1.26 -4.92 135.00 131.41 1fyh n PRO 15 Ca -0.19 0.13 -0.19 0.00 -2.02 0.00 0.00 63.50 61.24 1fyh n PRO 15 Cb 0.55 -2.26 -0.10 0.00 -0.02 0.00 0.00 33.50 31.66 1fyh n PRO 15 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1fyh s THR 16 N -2.07 1.07 -1.33 3.45 -4.23 -0.48 -4.73 115.64 107.31 1fyh s THR 16 Ca 0.71 -2.03 -0.03 0.00 -1.18 0.00 0.00 61.69 59.16 1fyh s THR 16 Cb -0.30 -2.53 -0.00 0.00 1.34 0.00 0.00 72.50 71.01 1fyh s THR 16 CO 0.53 -0.18 0.56 -3.20 -0.54 0.00 0.00 174.62 171.79 1fyh n ASN 17 N -0.52 -1.33 -4.69 3.99 5.15 -1.26 -0.53 115.26 116.08 1fyh n ASN 17 Ca -0.04 -0.95 -0.42 0.00 -0.60 0.00 0.00 54.58 52.57 1fyh n ASN 17 Cb 0.65 -3.41 -0.03 0.00 -0.53 0.00 0.00 39.78 36.46 1fyh n ASN 17 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1fyh s VAL 18 N -3.80 3.70 0.04 3.44 1.01 -1.26 -4.20 120.40 119.34 1fyh s VAL 18 Ca 0.07 1.06 0.01 0.00 0.00 0.00 0.00 61.98 63.13 1fyh s VAL 18 Cb -0.03 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1fyh s VAL 18 CO 0.86 -0.01 -0.05 -0.89 0.00 0.00 0.00 175.10 175.01 1fyh s THR 19 N 2.57 0.34 -0.07 3.92 2.01 0.03 -4.81 115.64 119.63 1fyh s THR 19 Ca 0.64 -1.25 0.02 0.00 0.31 0.00 0.00 61.69 61.41 1fyh s THR 19 Cb -0.31 -0.77 0.02 0.00 0.01 0.00 0.00 72.50 71.44 1fyh s THR 19 CO 0.26 -0.60 -0.10 -0.63 -0.69 0.00 0.00 174.62 172.87 1fyh s ILE 20 N -2.14 0.99 0.03 1.82 1.01 -1.26 -0.79 121.20 120.86 1fyh s ILE 20 Ca -0.06 -0.37 0.06 0.00 0.00 0.00 0.00 60.65 60.28 1fyh s ILE 20 Cb -0.05 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.46 1fyh s ILE 20 CO -0.03 0.33 -0.19 -1.61 0.00 0.00 0.00 174.94 173.45 1fyh s GLU 21 N 0.87 1.31 -0.06 2.79 2.02 -0.75 -4.96 118.70 119.92 1fyh s GLU 21 Ca -0.11 -0.83 -0.02 0.00 0.02 0.00 0.00 54.97 54.03 1fyh s GLU 21 Cb -0.15 -1.36 0.04 0.00 0.10 0.00 0.00 34.13 32.76 1fyh s GLU 21 CO 0.01 0.35 0.13 0.45 0.02 0.00 0.00 175.26 176.22 1fyh s SER 22 N -0.98 0.04 -0.09 -0.19 0.15 -1.26 -0.83 113.70 110.54 1fyh s SER 22 Ca 0.06 0.26 0.01 0.00 0.70 0.00 0.00 55.95 56.98 1fyh s SER 22 Cb -0.08 0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.40 1fyh s SER 22 CO 0.01 -0.16 -0.13 -0.47 1.20 0.00 0.00 173.24 173.70 1fyh s TYR 23 N 1.31 1.69 -1.33 3.44 5.04 -1.26 -1.32 117.35 124.92 1fyh s TYR 23 Ca -0.07 -0.75 -0.03 0.00 -2.44 0.00 0.00 57.07 53.78 1fyh s TYR 23 Cb -0.12 -1.26 0.01 0.00 0.35 0.00 0.00 41.96 40.95 1fyh s TYR 23 CO -0.05 -0.41 0.83 0.09 -1.34 0.00 0.00 175.55 174.66 1fyh n ASN 24 N 4.22 -2.26 -3.74 4.32 3.02 0.10 -3.00 115.26 117.92 1fyh n ASN 24 Ca -0.19 -0.76 -0.23 0.00 -0.03 0.00 0.00 54.58 53.37 1fyh n ASN 24 Cb 0.51 -4.29 0.03 0.00 -0.61 0.00 0.00 39.78 35.42 1fyh n ASN 24 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1fyh n MET 25 N -4.37 -4.93 -3.44 3.52 2.81 -1.26 -4.95 117.12 104.51 1fyh n MET 25 Ca -0.22 0.61 -0.26 0.00 -1.81 0.00 0.00 57.70 56.01 1fyh n MET 25 Cb 0.64 -5.19 -0.09 0.00 -0.71 0.00 0.00 33.22 27.87 1fyh n MET 25 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1fyh n ASN 26 N -3.02 1.43 -4.73 7.83 5.15 -1.16 -4.96 115.26 115.80 1fyh n ASN 26 Ca -0.25 -2.89 -0.42 0.00 -0.60 0.00 0.00 54.58 50.42 1fyh n ASN 26 Cb 0.66 -0.65 -0.03 0.00 -0.53 0.00 0.00 39.78 39.23 1fyh n ASN 26 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1fyh s PRO 27 N -1.24 4.24 -0.02 1.20 0.04 -1.26 -4.21 135.00 133.76 1fyh s PRO 27 Ca 0.34 2.30 0.05 0.00 0.04 0.00 0.00 61.00 63.73 1fyh s PRO 27 Cb 0.09 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.46 1fyh s PRO 27 CO -0.12 -0.53 -0.17 0.42 0.04 0.00 0.00 177.00 176.64 1fyh s ILE 28 N 0.81 1.35 -0.13 0.56 1.01 -0.01 -1.23 121.20 123.57 1fyh s ILE 28 Ca 0.66 -0.72 -0.07 0.00 0.00 0.00 0.00 60.65 60.52 1fyh s ILE 28 Cb -0.42 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 1fyh s ILE 28 CO 0.34 0.38 0.14 -0.69 0.00 0.00 0.00 174.94 175.12 1fyh s VAL 29 N -0.30 5.49 0.10 2.92 1.01 0.18 -1.81 120.40 128.00 1fyh s VAL 29 Ca 0.04 0.21 0.05 0.00 0.00 0.00 0.00 61.98 62.29 1fyh s VAL 29 Cb -0.08 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1fyh s VAL 29 CO -0.00 0.60 -0.13 -0.31 0.00 0.00 0.00 175.10 175.25 1fyh s TYR 30 N -0.85 1.25 0.31 5.22 2.02 0.03 -1.13 117.35 124.22 1fyh s TYR 30 Ca 0.14 -0.54 -0.17 0.00 -0.37 0.00 0.00 57.07 56.13 1fyh s TYR 30 Cb -0.12 -0.68 0.03 0.00 -0.40 0.00 0.00 41.96 40.79 1fyh s TYR 30 CO 0.03 0.08 0.69 1.67 -1.57 0.00 0.00 175.55 176.45 1fyh s TRP 31 N -1.89 0.07 0.16 2.71 -2.14 -1.09 -0.79 118.94 115.98 1fyh s TRP 31 Ca 0.04 -0.57 0.06 0.00 2.66 0.00 0.00 56.10 58.28 1fyh s TRP 31 Cb -0.06 0.62 -0.04 0.00 -3.10 0.00 0.00 33.47 30.89 1fyh s TRP 31 CO 0.02 -1.30 -0.12 -1.21 -2.66 0.00 0.00 176.95 171.68 1fyh s GLU 32 N -3.36 1.14 -0.05 3.25 2.02 0.31 -4.86 118.70 117.14 1fyh s GLU 32 Ca 0.15 -1.48 -0.08 0.00 0.02 0.00 0.00 54.97 53.58 1fyh s GLU 32 Cb -0.05 -0.79 0.02 0.00 0.10 0.00 0.00 34.13 33.41 1fyh s GLU 32 CO 0.10 0.12 0.21 -0.47 0.02 0.00 0.00 175.26 175.23 1fyh s TYR 33 N -3.14 -0.17 0.77 1.61 5.04 -1.26 -1.38 117.35 118.83 1fyh s TYR 33 Ca 0.18 0.38 -0.11 0.00 -2.44 0.00 0.00 57.07 55.07 1fyh s TYR 33 Cb 0.01 0.05 0.06 0.00 0.35 0.00 0.00 41.96 42.43 1fyh s TYR 33 CO 0.03 -0.19 1.09 1.14 -1.34 0.00 0.00 175.55 176.28 1fyh s GLN 34 N -0.40 2.28 0.32 4.97 -2.07 -1.26 -5.01 119.66 118.49 1fyh s GLN 34 Ca -0.05 0.65 -0.29 0.00 -1.82 0.00 0.00 55.36 53.85 1fyh s GLN 34 Cb -0.03 -1.94 -0.10 0.00 -1.09 0.00 0.00 33.01 29.84 1fyh s GLN 34 CO 0.01 -1.49 1.27 0.42 -1.32 0.00 0.00 175.29 174.18 1fyh s ILE 35 N -3.17 2.86 0.26 3.63 1.01 -1.26 -5.04 121.20 119.49 1fyh s ILE 35 Ca 0.60 0.86 0.03 0.00 0.00 0.00 0.00 60.65 62.14 1fyh s ILE 35 Cb -0.14 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.73 1fyh s ILE 35 CO 0.54 0.21 0.05 -0.04 0.00 0.00 0.00 174.94 175.69 1fyh s MET 36 N -1.70 1.43 0.28 2.79 -1.94 -1.26 -5.04 119.30 113.86 1fyh s MET 36 Ca 0.48 -1.76 0.25 0.00 -1.71 0.00 0.00 55.69 52.96 1fyh s MET 36 Cb -0.38 -0.53 0.90 0.00 2.01 0.00 0.00 34.83 36.83 1fyh s MET 36 CO 0.51 -0.19 1.76 -1.35 -0.01 0.00 0.00 175.02 175.73 1fyh h PRO 37 N 2.36 0.00 -5.10 2.03 0.11 -2.08 -3.45 132.00 125.88 1fyh h PRO 37 Ca -0.39 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.20 1fyh h PRO 37 Cb 1.24 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.21 1fyh h PRO 37 CO 0.64 0.00 -0.55 -0.65 -0.21 0.00 0.00 178.00 177.23 1fyh s GLN 38 N -3.25 1.81 -0.40 1.05 1.11 -1.26 -5.12 119.66 113.59 1fyh s GLN 38 Ca 0.07 -2.07 -0.24 0.00 0.01 0.00 0.00 55.36 53.14 1fyh s GLN 38 Cb 0.10 -0.70 0.02 0.00 -1.01 0.00 0.00 33.01 31.42 1fyh s GLN 38 CO 0.51 -0.36 0.81 0.08 0.01 0.00 0.00 175.29 176.33 1fyh s VAL 39 N -3.27 4.67 0.58 1.09 1.01 -1.26 -5.06 120.40 118.16 1fyh s VAL 39 Ca 0.29 0.73 -0.15 0.00 0.00 0.00 0.00 61.98 62.85 1fyh s VAL 39 Cb 0.05 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1fyh s VAL 39 CO 0.14 -0.58 1.03 -2.16 0.00 0.00 0.00 175.10 173.53 1fyh s PRO 40 N 3.26 3.52 0.17 2.72 0.04 -1.26 -4.98 135.00 138.46 1fyh s PRO 40 Ca 0.32 1.04 0.09 0.00 0.04 0.00 0.00 61.00 62.49 1fyh s PRO 40 Cb -0.12 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1fyh s PRO 40 CO 0.20 -0.63 -0.20 0.14 0.04 0.00 0.00 177.00 176.55 1fyh s VAL 41 N -2.67 1.94 0.20 -0.36 -7.23 -1.10 -4.54 120.40 106.64 1fyh s VAL 41 Ca 0.60 -1.91 0.09 0.00 -1.81 0.00 0.00 61.98 58.95 1fyh s VAL 41 Cb -0.13 -1.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 1fyh s VAL 41 CO 0.39 -0.25 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.40 1fyh s PHE 42 N -1.88 1.89 -0.03 2.82 0.08 0.69 -0.77 117.98 120.78 1fyh s PHE 42 Ca 0.16 -0.47 0.03 0.00 0.12 0.00 0.00 56.93 56.77 1fyh s PHE 42 Cb -0.07 -0.90 0.00 0.00 -0.57 0.00 0.00 43.02 41.49 1fyh s PHE 42 CO 0.07 0.41 -0.10 0.99 -0.10 0.00 0.00 175.22 176.49 1fyh s THR 43 N -2.36 0.90 -0.05 0.64 2.01 -0.61 -0.35 115.64 115.82 1fyh s THR 43 Ca 0.20 -0.41 0.04 0.00 0.31 0.00 0.00 61.69 61.82 1fyh s THR 43 Cb -0.04 -0.80 -0.02 0.00 0.01 0.00 0.00 72.50 71.64 1fyh s THR 43 CO 0.08 0.28 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.45 1fyh s VAL 44 N 0.24 2.97 0.05 3.82 1.01 0.16 -2.35 120.40 126.30 1fyh s VAL 44 Ca -0.04 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.23 1fyh s VAL 44 Cb -0.10 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 1fyh s VAL 44 CO 0.01 0.59 -0.13 -1.61 0.00 0.00 0.00 175.10 173.95 1fyh s GLU 45 N -0.64 0.85 -0.02 2.72 2.02 -0.08 -0.44 118.70 123.10 1fyh s GLU 45 Ca 0.10 -0.82 0.05 0.00 0.02 0.00 0.00 54.97 54.31 1fyh s GLU 45 Cb -0.11 -0.84 -0.01 0.00 0.10 0.00 0.00 34.13 33.27 1fyh s GLU 45 CO 0.01 0.20 -0.17 0.08 0.02 0.00 0.00 175.26 175.39 1fyh s VAL 46 N -1.03 1.38 -0.11 2.63 1.01 -0.26 -1.02 120.40 123.00 1fyh s VAL 46 Ca -0.01 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1fyh s VAL 46 Cb -0.09 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.15 1fyh s VAL 46 CO 0.02 0.39 -0.12 -0.75 0.00 0.00 0.00 175.10 174.64 1fyh s LYS 47 N -0.25 1.95 -0.07 2.72 2.20 -0.09 -1.02 119.74 125.18 1fyh s LYS 47 Ca 0.03 -0.45 -0.06 0.00 -0.36 0.00 0.00 55.97 55.13 1fyh s LYS 47 Cb -0.08 -1.76 -0.04 0.00 -1.51 0.00 0.00 37.83 34.43 1fyh s LYS 47 CO 0.00 -0.14 0.18 -0.80 -0.36 0.00 0.00 175.35 174.23 1fyh s ASN 48 N 1.23 6.42 0.13 1.43 -0.87 -1.26 -1.18 114.94 120.83 1fyh s ASN 48 Ca -0.02 0.46 -0.31 0.00 -1.57 0.00 0.00 52.86 51.42 1fyh s ASN 48 Cb -0.14 -2.06 -0.10 0.00 -0.02 0.00 0.00 41.25 38.93 1fyh s ASN 48 CO -0.04 0.34 1.68 -0.47 -2.57 0.00 0.00 177.10 176.04 1fyh s TYR 49 N -1.16 2.61 0.00 2.20 5.04 -0.61 -2.38 117.35 123.05 1fyh s TYR 49 Ca 0.21 0.33 0.00 0.00 -2.44 0.00 0.00 57.07 55.17 1fyh s TYR 49 Cb -0.13 -4.02 0.00 0.00 0.35 0.00 0.00 41.96 38.16 1fyh s TYR 49 CO 0.10 -4.02 0.00 0.41 -1.34 0.00 0.00 175.55 170.71 1fyh n GLY 50 N 3.98 1.11 3.76 8.97 0.00 -1.26 -4.88 105.19 116.87 1fyh n GLY 50 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1fyh n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fyh s VAL 51 N -2.00 2.05 0.10 1.61 1.01 -1.00 -4.95 120.40 117.23 1fyh s VAL 51 Ca 0.00 0.04 -0.28 0.00 0.00 0.00 0.00 61.98 61.75 1fyh s VAL 51 Cb 0.00 -3.03 -0.10 0.00 0.00 0.00 0.00 36.38 33.25 1fyh s VAL 51 CO 0.00 0.00 1.64 0.11 0.00 0.00 0.00 175.10 176.85 1fyh h LYS 52 N 2.01 -0.49 0.00 2.72 1.57 -1.95 -3.45 116.57 116.98 1fyh h LYS 52 Ca -0.51 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1fyh h LYS 52 Cb 1.28 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.70 1fyh h LYS 52 CO 0.60 -0.33 0.00 0.09 -0.57 0.00 0.00 179.45 179.24 1fyh n ASN 53 N -5.38 0.00 -2.81 0.86 3.02 -1.26 -5.06 115.26 104.62 1fyh n ASN 53 Ca -0.08 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.46 1fyh n ASN 53 Cb 0.29 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.51 1fyh n ASN 53 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1fyh n SER 54 N 0.00 1.39 -4.78 6.41 3.41 -1.26 -5.10 113.62 113.69 1fyh n SER 54 Ca 0.00 -2.11 -0.36 0.00 -0.26 0.00 0.00 58.87 56.14 1fyh n SER 54 Cb 0.00 -0.42 -0.08 0.00 -0.26 0.00 0.00 64.21 63.45 1fyh n SER 54 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1fyh s GLU 55 N -3.53 3.36 -0.03 4.33 2.02 -1.26 -5.10 118.70 118.50 1fyh s GLU 55 Ca 0.26 -0.25 -0.14 0.00 0.02 0.00 0.00 54.97 54.86 1fyh s GLU 55 Cb 0.34 -3.06 -0.05 0.00 0.10 0.00 0.00 34.13 31.45 1fyh s GLU 55 CO -0.04 0.69 0.38 -1.58 0.02 0.00 0.00 175.26 174.73 1fyh s TRP 56 N -0.79 3.69 -0.13 1.61 0.52 -1.26 -4.77 118.94 117.81 1fyh s TRP 56 Ca 0.13 0.93 -0.03 0.00 0.02 0.00 0.00 56.10 57.15 1fyh s TRP 56 Cb -0.12 -2.28 -0.03 0.00 -1.15 0.00 0.00 33.47 29.89 1fyh s TRP 56 CO 0.03 0.60 -0.02 0.42 0.02 0.00 0.00 176.95 178.00 1fyh s ILE 57 N -0.89 4.10 0.08 2.03 -1.09 -0.19 -4.88 121.20 120.36 1fyh s ILE 57 Ca 0.23 -0.30 -0.31 0.00 -2.23 0.00 0.00 60.65 58.04 1fyh s ILE 57 Cb -0.16 -2.76 -0.08 0.00 -1.58 0.00 0.00 42.46 37.88 1fyh s ILE 57 CO 0.12 0.54 1.52 -1.81 -1.23 0.00 0.00 174.94 174.07 1fyh s ASP 58 N -0.17 6.71 -0.12 3.58 1.01 -1.26 -1.11 116.67 125.32 1fyh s ASP 58 Ca 0.04 2.38 -0.10 0.00 0.71 0.00 0.00 52.55 55.58 1fyh s ASP 58 Cb -0.13 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.20 1fyh s ASP 58 CO 0.02 -0.78 -0.20 0.00 0.21 0.00 0.00 175.17 174.42 1fyh n ALA 59 N 4.89 0.50 -2.56 5.23 0.00 0.41 -4.91 120.51 124.07 1fyh n ALA 59 Ca 0.14 -0.53 -0.23 0.00 0.00 0.00 0.00 53.44 52.82 1fyh n ALA 59 Cb 0.41 0.02 -0.14 0.00 0.00 0.00 0.00 19.45 19.74 1fyh n ALA 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fyh s ILE 61 N -0.74 1.74 -1.15 0.00 1.01 -1.26 -0.66 121.20 120.13 1fyh s ILE 61 Ca 0.05 -0.76 -0.05 0.00 0.00 0.00 0.00 60.65 59.89 1fyh s ILE 61 Cb -0.08 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 1fyh s ILE 61 CO 0.01 0.49 0.89 0.59 0.00 0.00 0.00 174.94 176.92 1fyh n ASN 62 N 4.43 -4.20 -4.81 3.58 3.02 0.53 -4.97 115.26 112.85 1fyh n ASN 62 Ca -0.19 -0.73 -0.25 0.00 -0.03 0.00 0.00 54.58 53.37 1fyh n ASN 62 Cb 0.51 -4.80 -0.05 0.00 -0.61 0.00 0.00 39.78 34.83 1fyh n ASN 62 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1fyh s ILE 63 N -3.44 4.50 -0.93 2.41 -4.36 -0.49 -4.72 121.20 114.18 1fyh s ILE 63 Ca 0.25 -1.14 0.17 0.00 -0.26 0.00 0.00 60.65 59.66 1fyh s ILE 63 Cb -0.04 -3.33 -0.16 0.00 1.25 0.00 0.00 42.46 40.18 1fyh s ILE 63 CO 0.76 -0.16 0.76 -1.54 0.24 0.00 0.00 174.94 175.00 1fyh n SER 64 N -0.54 0.94 -4.92 4.36 3.41 -1.26 -0.22 113.62 115.39 1fyh n SER 64 Ca -0.08 -0.97 -0.26 0.00 -0.26 0.00 0.00 58.87 57.30 1fyh n SER 64 Cb 0.55 0.93 0.05 0.00 -0.26 0.00 0.00 64.21 65.48 1fyh n SER 64 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1fyh s HIS 65 N -2.55 3.11 -0.59 7.33 0.00 -1.26 -4.94 115.29 116.39 1fyh s HIS 65 Ca 0.08 0.55 -0.00 0.00 -3.00 0.00 0.00 55.06 52.69 1fyh s HIS 65 Cb 0.13 -2.92 0.45 0.00 -4.00 0.00 0.00 32.58 26.24 1fyh s HIS 65 CO 0.67 -1.06 1.86 0.72 -1.00 0.00 0.00 174.74 175.94 1fyh n HIS 66 N -2.72 3.14 -3.62 0.38 -0.00 -1.26 -4.89 115.22 106.25 1fyh n HIS 66 Ca 0.06 -2.87 -0.10 0.00 -0.00 0.00 0.00 57.72 54.81 1fyh n HIS 66 Cb 0.59 -1.23 -0.04 0.00 -0.00 0.00 0.00 29.99 29.31 1fyh n HIS 66 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 1fyh s TYR 67 N -3.78 -0.25 -0.24 4.41 1.13 -1.26 -2.65 117.35 114.70 1fyh s TYR 67 Ca 0.62 -0.05 -0.09 0.00 -1.41 0.00 0.00 57.07 56.14 1fyh s TYR 67 Cb 0.49 0.38 0.10 0.00 -1.10 0.00 0.00 41.96 41.84 1fyh s TYR 67 CO -0.00 -0.82 0.53 0.00 -2.51 0.00 0.00 175.55 172.75 1fyh s ASN 69 N 2.59 7.01 -0.15 0.00 3.84 -1.26 -0.64 114.94 126.33 1fyh s ASN 69 Ca -0.04 1.68 0.16 0.00 0.21 0.00 0.00 52.86 54.86 1fyh s ASN 69 Cb -0.11 -2.55 0.51 0.00 -0.55 0.00 0.00 41.25 38.55 1fyh s ASN 69 CO -0.16 -0.68 1.41 2.30 -2.79 0.00 0.00 177.10 177.19 1fyh n ILE 70 N 5.08 2.06 -0.34 -5.21 -5.35 -0.36 -4.70 119.36 110.54 1fyh n ILE 70 Ca 0.12 -1.69 0.22 0.00 -0.27 0.00 0.00 62.75 61.14 1fyh n ILE 70 Cb 0.46 -0.11 0.47 0.00 -1.74 0.00 0.00 39.64 38.72 1fyh n ILE 70 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1fyh h SER 71 N 1.98 0.52 0.44 7.28 0.02 -1.92 0.38 113.55 122.24 1fyh h SER 71 Ca 0.00 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1fyh h SER 71 Cb 1.34 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.91 1fyh h SER 71 CO 0.19 0.06 0.00 0.47 -1.14 0.00 0.00 176.83 176.41 1fyh n ASP 72 N -4.75 0.00 -0.78 3.07 8.00 -1.26 -3.04 116.55 117.78 1fyh n ASP 72 Ca 0.27 0.33 0.07 0.00 0.71 0.00 0.00 54.79 56.18 1fyh n ASP 72 Cb 0.88 -0.42 0.22 0.00 -0.02 0.00 0.00 41.12 41.78 1fyh n ASP 72 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1fyh n HIS 73 N -1.42 0.75 -3.32 1.24 8.25 0.13 -4.97 115.22 115.88 1fyh n HIS 73 Ca 0.05 -0.73 -0.38 0.00 -0.26 0.00 0.00 57.72 56.40 1fyh n HIS 73 Cb 0.16 -0.20 -0.06 0.00 1.12 0.00 0.00 29.99 31.00 1fyh n HIS 73 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1fyh s VAL 74 N -2.11 5.19 0.00 1.59 1.01 -1.17 -4.93 120.40 119.98 1fyh s VAL 74 Ca 0.34 0.92 0.00 0.00 0.00 0.00 0.00 61.98 63.25 1fyh s VAL 74 Cb 0.25 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1fyh s VAL 74 CO 0.11 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.14 1fyh n GLY 75 N 3.33 1.45 3.73 4.51 0.00 -1.26 -4.92 105.19 112.03 1fyh n GLY 75 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 1fyh n GLY 75 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fyh s ASP 76 N -1.00 6.99 0.65 1.61 -1.08 -1.26 -4.94 116.67 117.64 1fyh s ASP 76 Ca 0.00 1.19 0.35 0.00 -0.52 0.00 0.00 52.55 53.57 1fyh s ASP 76 Cb 0.00 -2.40 1.92 0.00 -1.46 0.00 0.00 42.92 40.98 1fyh s ASP 76 CO 0.00 -0.06 2.11 1.55 0.52 0.00 0.00 175.17 179.29 1fyh h PRO 77 N 6.48 0.00 0.00 4.34 0.13 -1.98 -1.72 132.00 139.25 1fyh h PRO 77 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1fyh h PRO 77 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1fyh h PRO 77 CO 0.74 0.00 -0.48 0.77 -0.23 0.00 0.00 178.00 178.80 1fyh h SER 78 N 0.00 0.00 -3.57 1.44 0.02 -1.95 -0.49 113.55 108.99 1fyh h SER 78 Ca 0.02 -0.05 -0.52 0.00 -0.84 0.00 0.00 61.79 60.40 1fyh h SER 78 Cb 0.42 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 1fyh h SER 78 CO -0.00 0.03 0.22 0.20 -1.14 0.00 0.00 176.83 176.14 1fyh s ASN 79 N -5.24 7.45 0.62 3.07 -0.87 -0.65 -4.91 114.94 114.41 1fyh s ASN 79 Ca 0.05 1.71 -0.16 0.00 -1.57 0.00 0.00 52.86 52.89 1fyh s ASN 79 Cb 0.09 -2.53 -0.02 0.00 -0.02 0.00 0.00 41.25 38.78 1fyh s ASN 79 CO 0.71 0.18 1.11 -0.44 -2.57 0.00 0.00 177.10 176.10 1fyh s SER 80 N -1.06 5.34 0.09 -1.22 0.01 -1.26 -4.57 113.70 111.03 1fyh s SER 80 Ca 0.37 2.04 -0.07 0.00 1.31 0.00 0.00 55.95 59.60 1fyh s SER 80 Cb -0.24 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.42 1fyh s SER 80 CO 0.28 -1.47 0.16 -1.48 0.41 0.00 0.00 173.24 171.14 1fyh s LEU 81 N -4.51 1.55 0.04 2.44 0.05 0.31 -1.57 118.68 116.99 1fyh s LEU 81 Ca 0.69 -0.75 0.03 0.00 0.05 0.00 0.00 54.13 54.15 1fyh s LEU 81 Cb -0.21 0.90 -0.02 0.00 -2.05 0.00 0.00 46.19 44.80 1fyh s LEU 81 CO 0.37 -0.73 -0.09 0.26 -0.55 0.00 0.00 176.35 175.61 1fyh s TRP 82 N -3.89 0.81 0.07 3.48 0.51 -0.32 -1.20 118.94 118.40 1fyh s TRP 82 Ca 0.07 -0.45 0.06 0.00 -2.12 0.00 0.00 56.10 53.67 1fyh s TRP 82 Cb 0.05 -0.48 -0.03 0.00 -0.81 0.00 0.00 33.47 32.21 1fyh s TRP 82 CO -0.09 -0.04 -0.17 0.08 -0.51 0.00 0.00 176.95 176.22 1fyh s VAL 83 N -1.21 1.36 0.01 4.03 1.01 -1.26 -0.91 120.40 123.43 1fyh s VAL 83 Ca -0.06 -1.29 -0.01 0.00 0.00 0.00 0.00 61.98 60.62 1fyh s VAL 83 Cb -0.09 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 1fyh s VAL 83 CO 0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 175.10 175.04 1fyh s ARG 84 N -1.57 0.22 -0.03 2.72 1.70 -0.19 -1.37 118.95 120.42 1fyh s ARG 84 Ca 0.03 -0.37 0.04 0.00 -0.47 0.00 0.00 55.73 54.96 1fyh s ARG 84 Cb -0.09 0.08 -0.00 0.00 -0.57 0.00 0.00 34.95 34.36 1fyh s ARG 84 CO 0.03 -0.04 -0.15 0.08 -1.08 0.00 0.00 175.30 174.14 1fyh s VAL 85 N -0.93 1.24 0.10 4.99 1.01 -0.61 -0.91 120.40 125.28 1fyh s VAL 85 Ca -0.10 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1fyh s VAL 85 Cb -0.06 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1fyh s VAL 85 CO -0.00 0.36 -0.10 -1.59 0.00 0.00 0.00 175.10 173.76 1fyh s LYS 86 N 0.03 0.84 0.24 2.72 -2.85 -0.99 -0.76 119.74 118.97 1fyh s LYS 86 Ca -0.02 -1.14 0.08 0.00 -1.00 0.00 0.00 55.97 53.88 1fyh s LYS 86 Cb -0.10 -0.56 -0.04 0.00 -2.06 0.00 0.00 37.83 35.08 1fyh s LYS 86 CO 0.01 0.09 0.12 0.00 0.10 0.00 0.00 175.35 175.67 1fyh s ALA 87 N -2.34 3.43 0.01 0.59 0.00 -1.26 -1.57 121.76 120.62 1fyh s ALA 87 Ca 0.05 -1.47 -0.02 0.00 0.00 0.00 0.00 51.96 50.52 1fyh s ALA 87 Cb -0.03 -1.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.95 1fyh s ALA 87 CO 0.00 0.30 0.03 0.50 0.00 0.00 0.00 175.76 176.59 1fyh s ARG 88 N -3.66 0.36 -0.42 0.00 3.52 0.05 -1.30 118.95 117.51 1fyh s ARG 88 Ca 0.32 -0.53 0.02 0.00 -0.13 0.00 0.00 55.73 55.41 1fyh s ARG 88 Cb -0.08 0.14 0.14 0.00 -1.56 0.00 0.00 34.95 33.59 1fyh s ARG 88 CO 0.23 -0.07 0.24 0.08 -0.81 0.00 0.00 175.30 174.97 1fyh s VAL 89 N -1.41 1.00 0.00 7.11 1.01 -0.16 -2.72 120.40 125.24 1fyh s VAL 89 Ca -0.15 -2.35 0.00 0.00 0.00 0.00 0.00 61.98 59.47 1fyh s VAL 89 Cb -0.09 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.58 1fyh s VAL 89 CO -0.00 -0.95 0.00 0.61 0.00 0.00 0.00 175.10 174.76 1fyh n GLY 90 N 3.61 0.20 0.01 4.51 0.00 -1.26 -1.09 105.19 111.17 1fyh n GLY 90 Ca 0.11 0.70 0.07 0.00 0.00 0.00 0.00 46.02 46.90 1fyh n GLY 90 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fyh n GLN 91 N 0.00 0.77 -3.09 1.61 6.02 -1.26 -4.96 117.38 116.47 1fyh n GLN 91 Ca 0.00 -0.11 -0.41 0.00 -0.01 0.00 0.00 57.00 56.47 1fyh n GLN 91 Cb 0.00 -1.29 -0.06 0.00 1.02 0.00 0.00 30.24 29.90 1fyh n GLN 91 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1fyh s LYS 92 N -2.84 3.89 0.04 -1.09 1.02 -0.25 -5.07 119.74 115.44 1fyh s LYS 92 Ca -0.03 0.32 0.01 0.00 0.02 0.00 0.00 55.97 56.30 1fyh s LYS 92 Cb 0.09 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 33.63 1fyh s LYS 92 CO 0.57 -0.60 0.07 -1.21 -0.92 0.00 0.00 175.35 173.25 1fyh s GLU 93 N 2.67 2.94 0.89 1.68 2.02 -1.26 -0.98 118.70 126.66 1fyh s GLU 93 Ca 0.26 -0.60 -0.14 0.00 0.02 0.00 0.00 54.97 54.51 1fyh s GLU 93 Cb -0.15 -2.77 0.20 0.00 0.10 0.00 0.00 34.13 31.52 1fyh s GLU 93 CO 0.12 0.60 1.22 -1.13 0.02 0.00 0.00 175.26 176.09 1fyh n SER 94 N 0.86 0.17 -4.86 -0.19 3.41 -0.42 -4.35 113.62 108.25 1fyh n SER 94 Ca -0.11 -1.49 -0.31 0.00 -0.26 0.00 0.00 58.87 56.70 1fyh n SER 94 Cb 0.52 -0.92 0.03 0.00 -0.26 0.00 0.00 64.21 63.57 1fyh n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fyh s ALA 95 N -3.92 2.95 0.16 7.33 0.00 -1.26 -4.74 121.76 122.28 1fyh s ALA 95 Ca 0.69 -0.07 -0.30 0.00 0.00 0.00 0.00 51.96 52.28 1fyh s ALA 95 Cb -0.02 -3.10 -0.07 0.00 0.00 0.00 0.00 23.12 19.93 1fyh s ALA 95 CO 0.49 -0.90 0.95 0.71 0.00 0.00 0.00 175.76 177.01 1fyh s TYR 96 N -3.16 3.88 -0.11 0.00 2.02 -1.26 -4.65 117.35 114.06 1fyh s TYR 96 Ca 0.56 1.84 -0.12 0.00 -0.37 0.00 0.00 57.07 58.98 1fyh s TYR 96 Cb -0.12 -3.02 -0.05 0.00 -0.40 0.00 0.00 41.96 38.37 1fyh s TYR 96 CO 0.54 0.30 0.28 0.00 -1.57 0.00 0.00 175.55 175.10 1fyh s ALA 97 N -0.44 3.70 0.05 3.71 0.00 0.06 -4.90 121.76 123.93 1fyh s ALA 97 Ca 0.45 -0.45 0.05 0.00 0.00 0.00 0.00 51.96 52.01 1fyh s ALA 97 Cb -0.24 -2.28 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1fyh s ALA 97 CO 0.31 0.33 -0.06 0.21 0.00 0.00 0.00 175.76 176.55 1fyh s LYS 98 N -0.34 2.45 0.60 0.00 2.20 -1.26 -1.58 119.74 121.81 1fyh s LYS 98 Ca 0.18 -0.82 -0.05 0.00 -0.36 0.00 0.00 55.97 54.91 1fyh s LYS 98 Cb -0.14 -2.46 0.02 0.00 -1.51 0.00 0.00 37.83 33.74 1fyh s LYS 98 CO 0.06 0.56 0.91 -1.54 -0.36 0.00 0.00 175.35 174.98 1fyh s SER 99 N -1.82 5.43 0.76 1.43 1.04 -0.47 -4.84 113.70 115.23 1fyh s SER 99 Ca 0.20 0.61 -0.11 0.00 0.48 0.00 0.00 55.95 57.13 1fyh s SER 99 Cb -0.11 -1.54 0.05 0.00 0.10 0.00 0.00 66.02 64.52 1fyh s SER 99 CO 0.12 -1.16 1.14 -1.61 0.98 0.00 0.00 173.24 172.71 1fyh s GLU 100 N -5.01 2.31 0.35 4.02 0.41 -1.26 -4.69 118.70 114.83 1fyh s GLU 100 Ca 0.55 0.22 -0.29 0.00 -0.41 0.00 0.00 54.97 55.05 1fyh s GLU 100 Cb -0.11 -1.99 -0.11 0.00 -1.78 0.00 0.00 34.13 30.14 1fyh s GLU 100 CO 0.44 -1.37 1.50 -1.91 -0.49 0.00 0.00 175.26 173.44 1fyh n GLU 101 N -3.18 2.65 -4.42 1.61 2.13 -1.26 -4.72 120.64 113.44 1fyh n GLU 101 Ca 0.08 0.93 -0.21 0.00 0.66 0.00 0.00 57.16 58.62 1fyh n GLU 101 Cb 0.60 -2.67 -0.15 0.00 0.27 0.00 0.00 31.44 29.48 1fyh n GLU 101 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 1fyh s PHE 102 N -0.84 1.01 -0.08 4.31 5.36 -0.34 -4.97 117.98 122.42 1fyh s PHE 102 Ca 0.56 -0.25 0.01 0.00 -0.96 0.00 0.00 56.93 56.29 1fyh s PHE 102 Cb -0.49 -0.71 0.02 0.00 -0.34 0.00 0.00 43.02 41.50 1fyh s PHE 102 CO 0.60 -0.10 -0.09 0.00 -1.46 0.00 0.00 175.22 174.17 1fyh s ALA 103 N 0.17 1.19 0.21 11.12 0.00 -1.26 -0.53 121.76 132.65 1fyh s ALA 103 Ca -0.03 -0.41 -0.10 0.00 0.00 0.00 0.00 51.96 51.42 1fyh s ALA 103 Cb -0.09 -0.70 0.28 0.00 0.00 0.00 0.00 23.12 22.62 1fyh s ALA 103 CO 0.01 -0.14 1.72 0.28 0.00 0.00 0.00 175.76 177.62 1fyh h VAL 104 N 6.09 0.69 -0.46 0.00 2.07 -1.76 0.96 116.25 123.85 1fyh h VAL 104 Ca -0.31 -0.10 -0.06 0.00 0.82 0.00 0.00 66.70 67.05 1fyh h VAL 104 Cb 1.16 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1fyh h VAL 104 CO 0.44 0.05 0.05 0.00 0.02 0.00 0.00 177.57 178.13 1fyh h ARG 106 N 0.68 0.39 0.00 0.00 2.43 -1.72 -3.41 114.38 112.76 1fyh h ARG 106 Ca 0.14 -0.67 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1fyh h ARG 106 Cb 0.35 0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1fyh h ARG 106 CO 0.01 1.32 -1.54 -0.25 -1.51 0.00 0.00 179.97 178.00 1fyh n ASP 107 N -3.81 0.54 -4.63 -3.80 8.00 0.30 -4.97 116.55 108.18 1fyh n ASP 107 Ca -0.20 -0.39 -0.24 0.00 0.71 0.00 0.00 54.79 54.67 1fyh n ASP 107 Cb 1.00 1.56 0.12 0.00 -0.02 0.00 0.00 41.12 43.78 1fyh n ASP 107 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1fyh s GLY 108 N -3.78 1.76 0.01 0.44 0.00 0.47 -4.77 107.32 101.45 1fyh s GLY 108 Ca -0.01 -1.75 0.07 0.00 0.00 0.00 0.00 44.72 43.03 1fyh s GLY 108 CO 0.85 -1.15 -0.21 1.25 0.00 0.00 0.00 173.10 173.84 1fyh s LYS 109 N -5.20 1.60 0.01 2.90 2.47 -0.44 -4.92 119.74 116.17 1fyh s LYS 109 Ca 0.67 -0.84 0.03 0.00 -1.56 0.00 0.00 55.97 54.27 1fyh s LYS 109 Cb -0.05 -1.62 -0.03 0.00 -1.46 0.00 0.00 37.83 34.67 1fyh s LYS 109 CO 0.45 0.43 -0.05 0.42 0.16 0.00 0.00 175.35 176.77 1fyh s ILE 110 N -0.62 3.78 1.17 5.43 -1.09 -1.26 -0.72 121.20 127.89 1fyh s ILE 110 Ca 0.08 -0.77 -0.18 0.00 -2.23 0.00 0.00 60.65 57.55 1fyh s ILE 110 Cb -0.08 -2.67 0.27 0.00 -1.58 0.00 0.00 42.46 38.40 1fyh s ILE 110 CO 0.00 0.36 1.11 -0.83 -1.23 0.00 0.00 174.94 174.35 1fyh s GLY 111 N -1.54 1.58 0.64 6.18 0.00 -1.26 -1.36 107.32 111.56 1fyh s GLY 111 Ca 0.18 -0.85 -0.11 0.00 0.00 0.00 0.00 44.72 43.95 1fyh s GLY 111 CO 0.09 -0.01 1.04 2.56 0.00 0.00 0.00 173.10 176.78 1fyh s PRO 112 N -5.32 3.41 0.83 2.90 0.04 -1.25 -3.99 135.00 131.61 1fyh s PRO 112 Ca 0.70 0.81 -0.12 0.00 0.04 0.00 0.00 61.00 62.43 1fyh s PRO 112 Cb -0.11 -2.05 0.09 0.00 0.04 0.00 0.00 34.50 32.46 1fyh s PRO 112 CO 0.56 -0.72 1.13 -1.25 0.04 0.00 0.00 177.00 176.76 1fyh s PRO 113 N -5.12 1.83 -0.15 0.56 0.04 -1.26 -4.34 135.00 126.55 1fyh s PRO 113 Ca 0.56 0.38 -0.02 0.00 0.04 0.00 0.00 61.00 61.96 1fyh s PRO 113 Cb -0.12 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 1fyh s PRO 113 CO 0.54 -1.74 -0.07 0.15 0.04 0.00 0.00 177.00 175.92 1fyh s LYS 114 N -5.31 3.56 0.05 4.56 1.02 -0.32 -4.68 119.74 118.61 1fyh s LYS 114 Ca 0.62 -0.58 0.05 0.00 0.02 0.00 0.00 55.97 56.07 1fyh s LYS 114 Cb -0.13 -2.82 -0.04 0.00 -0.52 0.00 0.00 37.83 34.32 1fyh s LYS 114 CO 0.52 0.22 -0.05 -0.51 -0.92 0.00 0.00 175.35 174.61 1fyh s LEU 115 N 0.40 3.23 -0.02 3.17 1.43 -1.26 -0.37 118.68 125.26 1fyh s LEU 115 Ca -0.06 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 52.86 1fyh s LEU 115 Cb -0.15 -1.93 -0.00 0.00 0.03 0.00 0.00 46.19 44.13 1fyh s LEU 115 CO 0.04 0.23 -0.11 -1.81 0.23 0.00 0.00 176.35 174.93 1fyh s ASP 116 N -1.87 1.33 0.05 2.29 1.01 -0.58 -4.99 116.67 113.90 1fyh s ASP 116 Ca 0.21 -0.21 0.08 0.00 0.71 0.00 0.00 52.55 53.34 1fyh s ASP 116 Cb -0.11 -0.24 -0.03 0.00 1.01 0.00 0.00 42.92 43.55 1fyh s ASP 116 CO 0.12 0.11 -0.23 -0.63 0.21 0.00 0.00 175.17 174.75 1fyh s ILE 117 N -0.08 1.88 0.09 0.77 1.01 -1.26 -1.09 121.20 122.51 1fyh s ILE 117 Ca 0.01 -1.29 -0.07 0.00 0.00 0.00 0.00 60.65 59.30 1fyh s ILE 117 Cb -0.06 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 1fyh s ILE 117 CO 0.00 0.27 0.14 0.00 0.00 0.00 0.00 174.94 175.35 1fyh s ARG 118 N -1.23 0.82 0.06 2.79 1.70 -0.51 -5.00 118.95 117.58 1fyh s ARG 118 Ca 0.09 -1.05 0.09 0.00 -0.47 0.00 0.00 55.73 54.39 1fyh s ARG 118 Cb -0.09 0.31 -0.03 0.00 -0.57 0.00 0.00 34.95 34.57 1fyh s ARG 118 CO 0.02 -0.25 -0.22 -1.59 -1.08 0.00 0.00 175.30 172.18 1fyh s LYS 119 N -3.89 1.86 0.25 3.89 -2.85 -1.26 -0.93 119.74 116.80 1fyh s LYS 119 Ca 0.07 -1.10 0.01 0.00 -1.00 0.00 0.00 55.97 53.95 1fyh s LYS 119 Cb 0.06 -2.06 -0.00 0.00 -2.06 0.00 0.00 37.83 33.76 1fyh s LYS 119 CO -0.09 0.51 0.02 0.39 0.10 0.00 0.00 175.35 176.28 1fyh n GLU 120 N 1.49 1.19 -0.03 1.78 1.02 0.64 -4.96 120.64 121.76 1fyh n GLU 120 Ca -0.17 -1.89 -0.03 0.00 -0.02 0.00 0.00 57.16 55.06 1fyh n GLU 120 Cb 0.52 0.65 -0.02 0.00 -0.02 0.00 0.00 31.44 32.57 1fyh n GLU 120 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1fyh h GLU 121 N 0.00 -0.07 -0.10 3.49 5.08 -2.03 -3.22 114.58 117.73 1fyh h GLU 121 Ca -0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1fyh h GLU 121 Cb 0.65 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1fyh h GLU 121 CO 0.33 -0.05 0.00 1.63 -1.00 0.00 0.00 179.01 179.93 1fyh n LYS 122 N -3.25 2.60 -3.78 2.33 5.02 -1.26 -5.03 118.16 114.80 1fyh n LYS 122 Ca -0.01 -1.99 -0.10 0.00 -2.02 0.00 0.00 58.31 54.20 1fyh n LYS 122 Cb 0.07 -1.25 -0.05 0.00 -0.02 0.00 0.00 35.03 33.77 1fyh n LYS 122 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1fyh s GLN 123 N -1.59 1.18 -0.08 1.97 -2.07 -1.22 -1.71 119.66 116.15 1fyh s GLN 123 Ca 0.16 -0.91 0.00 0.00 -1.82 0.00 0.00 55.36 52.80 1fyh s GLN 123 Cb 0.12 0.45 -0.03 0.00 -1.09 0.00 0.00 33.01 32.46 1fyh s GLN 123 CO 0.05 -0.47 -0.07 0.42 -1.32 0.00 0.00 175.29 173.90 1fyh s ILE 124 N -3.88 3.67 -0.14 3.63 1.01 -0.10 -0.26 121.20 125.13 1fyh s ILE 124 Ca 0.09 -0.48 -0.03 0.00 0.00 0.00 0.00 60.65 60.22 1fyh s ILE 124 Cb 0.01 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 1fyh s ILE 124 CO -0.05 0.58 -0.02 -0.04 0.00 0.00 0.00 174.94 175.40 1fyh s MET 125 N -0.62 3.55 -0.11 2.79 -1.94 -0.11 -0.52 119.30 122.35 1fyh s MET 125 Ca 0.09 -0.49 0.03 0.00 -1.71 0.00 0.00 55.69 53.62 1fyh s MET 125 Cb -0.12 -2.91 0.01 0.00 2.01 0.00 0.00 34.83 33.82 1fyh s MET 125 CO 0.02 0.34 -0.21 0.42 -0.01 0.00 0.00 175.02 175.57 1fyh s ILE 126 N 0.10 1.91 -0.23 2.53 1.01 0.36 -1.42 121.20 125.46 1fyh s ILE 126 Ca 0.00 -0.92 -0.07 0.00 0.00 0.00 0.00 60.65 59.66 1fyh s ILE 126 Cb -0.13 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.63 1fyh s ILE 126 CO 0.02 0.52 0.07 -1.81 0.00 0.00 0.00 174.94 173.75 1fyh s ASP 127 N 0.55 5.31 -0.35 3.58 1.01 -0.25 -1.09 116.67 125.44 1fyh s ASP 127 Ca -0.14 -0.12 -0.05 0.00 0.71 0.00 0.00 52.55 52.95 1fyh s ASP 127 Cb -0.17 -1.94 0.06 0.00 1.01 0.00 0.00 42.92 41.88 1fyh s ASP 127 CO 0.05 0.02 0.11 -0.63 0.21 0.00 0.00 175.17 174.93 1fyh s ILE 128 N 1.27 3.55 -0.07 0.77 1.01 0.62 -1.53 121.20 126.82 1fyh s ILE 128 Ca 0.05 -1.37 -0.23 0.00 0.00 0.00 0.00 60.65 59.09 1fyh s ILE 128 Cb -0.15 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.18 1fyh s ILE 128 CO 0.04 -0.28 0.70 -0.36 0.00 0.00 0.00 174.94 175.04 1fyh s PHE 129 N 1.33 3.57 0.53 3.97 0.40 0.50 -1.09 117.98 127.19 1fyh s PHE 129 Ca -0.01 1.24 -0.22 0.00 -0.60 0.00 0.00 56.93 57.35 1fyh s PHE 129 Cb -0.21 -2.81 -0.06 0.00 0.51 0.00 0.00 43.02 40.46 1fyh s PHE 129 CO 0.01 0.08 1.21 0.72 0.70 0.00 0.00 175.22 177.94 1fyh n HIS 130 N 3.83 1.79 -1.62 0.36 8.25 -1.17 -1.18 115.22 125.49 1fyh n HIS 130 Ca -0.01 0.45 -0.45 0.00 -0.26 0.00 0.00 57.72 57.46 1fyh n HIS 130 Cb 0.51 -2.29 -0.02 0.00 1.12 0.00 0.00 29.99 29.31 1fyh n HIS 130 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1fyh n PRO 131 N -0.78 1.53 -0.38 -0.41 -0.02 -1.26 -4.67 135.00 129.02 1fyh n PRO 131 Ca 0.11 0.54 0.29 0.00 -2.02 0.00 0.00 63.50 62.42 1fyh n PRO 131 Cb 0.44 -1.99 0.57 0.00 -0.02 0.00 0.00 33.50 32.50 1fyh n PRO 131 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1fyh h SER 132 N 2.47 0.36 -0.26 2.55 0.02 -1.90 -0.39 113.55 116.40 1fyh h SER 132 Ca -0.42 0.12 0.07 0.00 -0.84 0.00 0.00 61.79 60.73 1fyh h SER 132 Cb 1.32 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.94 1fyh h SER 132 CO 0.63 -0.07 0.29 -0.37 -1.14 0.00 0.00 176.83 176.18 1fyh h VAL 133 N 0.24 0.42 -0.41 2.27 -1.51 -1.94 -2.14 116.25 113.18 1fyh h VAL 133 Ca 0.71 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 66.18 1fyh h VAL 133 Cb 2.00 0.77 0.00 0.00 -2.13 0.00 0.00 31.29 31.93 1fyh h VAL 133 CO -0.40 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.43 1fyh n PHE 134 N -3.74 0.55 -3.57 5.19 3.72 -0.16 -5.14 117.46 114.32 1fyh n PHE 134 Ca 0.03 -0.28 -0.27 0.00 -0.05 0.00 0.00 57.45 56.89 1fyh n PHE 134 Cb 0.43 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.87 1fyh n PHE 134 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1fyh n VAL 135 N 0.72 1.26 -3.70 -4.37 0.31 -0.81 -5.01 118.33 106.73 1fyh n VAL 135 Ca 0.14 -4.71 -0.34 0.00 -0.01 0.00 0.00 64.34 59.42 1fyh n VAL 135 Cb 0.35 -2.06 -0.08 0.00 -0.91 0.00 0.00 33.84 31.15 1fyh n VAL 135 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1fyh s GLU 147 N -1.62 3.10 0.25 5.55 2.02 -1.26 -5.04 118.70 121.70 1fyh s GLU 147 Ca 0.33 -3.30 0.07 0.00 0.02 0.00 0.00 54.97 52.09 1fyh s GLU 147 Cb 0.07 -3.84 -0.05 0.00 0.10 0.00 0.00 34.13 30.40 1fyh s GLU 147 CO -0.11 -1.27 -0.10 -0.08 0.02 0.00 0.00 175.26 173.72 1fyh s THR 148 N -1.38 1.71 -2.11 3.63 -1.32 -1.26 -5.04 115.64 109.87 1fyh s THR 148 Ca 0.27 -2.17 0.22 0.00 -1.21 0.00 0.00 61.69 58.80 1fyh s THR 148 Cb -0.07 -2.27 0.59 0.00 -1.51 0.00 0.00 72.50 69.24 1fyh s THR 148 CO -0.13 -0.43 1.78 0.35 -2.21 0.00 0.00 174.62 173.98 1fyh n THR 149 N -0.50 0.05 -2.98 5.08 -2.24 -1.26 -4.61 114.28 107.82 1fyh n THR 149 Ca -0.06 -0.10 -0.44 0.00 -2.27 0.00 0.00 64.05 61.18 1fyh n THR 149 Cb 0.62 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 1fyh n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fyh s TYR 151 N 2.51 0.33 -0.23 0.00 -0.85 -1.26 -5.00 117.35 112.85 1fyh s TYR 151 Ca 0.29 -0.68 -0.26 0.00 -0.52 0.00 0.00 57.07 55.89 1fyh s TYR 151 Cb -0.07 0.10 0.00 0.00 0.38 0.00 0.00 41.96 42.37 1fyh s TYR 151 CO -0.07 -0.87 0.92 0.42 -1.52 0.00 0.00 175.55 174.43 1fyh s ILE 152 N -3.98 4.77 -0.06 -3.49 1.01 -1.26 -0.98 121.20 117.21 1fyh s ILE 152 Ca 0.19 1.77 0.02 0.00 0.00 0.00 0.00 60.65 62.63 1fyh s ILE 152 Cb 0.01 -4.20 -0.25 0.00 0.01 0.00 0.00 42.46 38.03 1fyh s ILE 152 CO 0.04 -0.11 0.62 -0.09 0.00 0.00 0.00 174.94 175.40 1fyh h ARG 153 N 7.56 0.15 -3.13 2.79 2.43 -0.94 -3.44 114.38 119.81 1fyh h ARG 153 Ca -0.22 -0.25 -0.13 0.00 -0.81 0.00 0.00 59.98 58.57 1fyh h ARG 153 Cb 1.08 0.09 -0.21 0.00 -0.42 0.00 0.00 29.97 30.52 1fyh h ARG 153 CO 0.92 0.89 -0.33 0.54 -1.51 0.00 0.00 179.97 180.48 1fyh s VAL 154 N -2.59 0.05 -0.16 0.20 0.11 -1.14 -2.03 120.40 114.85 1fyh s VAL 154 Ca -0.12 -0.44 -0.02 0.00 -2.93 0.00 0.00 61.98 58.47 1fyh s VAL 154 Cb 0.07 -0.55 -0.02 0.00 -1.53 0.00 0.00 36.38 34.36 1fyh s VAL 154 CO 0.81 -0.24 -0.09 -0.31 -3.33 0.00 0.00 175.10 171.94 1fyh s TYR 155 N -1.10 2.89 -0.25 1.54 2.02 -0.77 0.19 117.35 121.86 1fyh s TYR 155 Ca -0.12 -0.65 -0.17 0.00 -0.37 0.00 0.00 57.07 55.77 1fyh s TYR 155 Cb -0.05 -1.93 -0.03 0.00 -0.40 0.00 0.00 41.96 39.55 1fyh s TYR 155 CO 0.03 -0.26 0.45 -0.80 -1.57 0.00 0.00 175.55 173.40 1fyh s ASN 156 N 0.61 6.37 -0.21 2.29 0.01 -0.52 -0.78 114.94 122.72 1fyh s ASN 156 Ca -0.06 0.44 -0.04 0.00 -0.71 0.00 0.00 52.86 52.50 1fyh s ASN 156 Cb -0.15 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.25 1fyh s ASN 156 CO 0.03 -0.22 -0.05 -0.69 -1.51 0.00 0.00 177.10 174.66 1fyh s VAL 157 N 2.08 3.36 -0.29 1.60 1.01 0.45 -2.14 120.40 126.47 1fyh s VAL 157 Ca 0.19 -0.50 -0.10 0.00 0.00 0.00 0.00 61.98 61.57 1fyh s VAL 157 Cb -0.16 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 1fyh s VAL 157 CO 0.09 0.44 0.16 -0.31 0.00 0.00 0.00 175.10 175.48 1fyh s TYR 158 N 1.33 3.18 -0.06 5.22 1.51 0.06 -0.19 117.35 128.39 1fyh s TYR 158 Ca 0.04 -0.20 0.05 0.00 -1.01 0.00 0.00 57.07 55.95 1fyh s TYR 158 Cb -0.14 -2.35 -0.02 0.00 -0.11 0.00 0.00 41.96 39.34 1fyh s TYR 158 CO -0.02 -0.29 -0.21 0.08 -1.11 0.00 0.00 175.55 173.99 1fyh s VAL 159 N 1.69 2.43 -0.09 0.71 1.01 -0.21 -1.53 120.40 124.42 1fyh s VAL 159 Ca 0.06 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.14 1fyh s VAL 159 Cb -0.16 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 1fyh s VAL 159 CO 0.08 0.57 -0.23 -0.13 0.00 0.00 0.00 175.10 175.40 1fyh s ARG 160 N -0.35 2.88 -0.14 2.72 0.52 -0.17 -1.01 118.95 123.40 1fyh s ARG 160 Ca 0.02 -0.86 -0.01 0.00 -0.52 0.00 0.00 55.73 54.36 1fyh s ARG 160 Cb -0.12 -2.29 0.04 0.00 0.52 0.00 0.00 34.95 33.09 1fyh s ARG 160 CO 0.02 0.28 -0.03 0.00 0.02 0.00 0.00 175.30 175.58 1fyh s MET 161 N 0.11 1.15 4.32 3.54 0.23 -0.38 -0.84 119.30 127.42 1fyh s MET 161 Ca -0.11 -0.32 0.00 0.00 -1.03 0.00 0.00 55.69 54.23 1fyh s MET 161 Cb -0.16 -1.72 0.00 0.00 -1.53 0.00 0.00 34.83 31.42 1fyh s MET 161 CO 0.06 -0.41 0.00 0.09 -2.03 0.00 0.00 175.02 172.74 1fyh n ASN 162 N 4.97 0.00 -0.89 -1.18 4.13 -0.74 -1.41 115.26 120.15 1fyh n ASN 162 Ca -0.10 0.00 0.08 0.00 1.68 0.00 0.00 54.58 56.24 1fyh n ASN 162 Cb 0.49 0.00 0.22 0.00 -1.54 0.00 0.00 39.78 38.95 1fyh n ASN 162 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1fyh n GLY 163 N 0.00 1.24 3.94 7.41 0.00 -1.26 -4.96 105.19 111.57 1fyh n GLY 163 Ca 0.00 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 1fyh n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fyh s SER 164 N -1.04 5.98 0.00 1.61 0.01 -0.50 -5.14 113.70 114.63 1fyh s SER 164 Ca 0.33 -0.12 -0.01 0.00 1.31 0.00 0.00 55.95 57.46 1fyh s SER 164 Cb 0.17 -1.51 -0.01 0.00 0.21 0.00 0.00 66.02 64.89 1fyh s SER 164 CO 0.23 -0.20 0.01 -1.61 0.41 0.00 0.00 173.24 172.07 1fyh s GLU 165 N -4.02 0.17 0.05 12.44 2.02 -1.26 -1.26 118.70 126.84 1fyh s GLU 165 Ca 0.38 -0.27 -0.11 0.00 0.02 0.00 0.00 54.97 54.99 1fyh s GLU 165 Cb -0.09 0.06 0.01 0.00 0.10 0.00 0.00 34.13 34.22 1fyh s GLU 165 CO 0.29 -0.03 0.23 -1.50 0.02 0.00 0.00 175.26 174.27 1fyh s ILE 166 N -0.70 0.10 -0.04 -1.63 2.07 -0.18 -5.00 121.20 115.82 1fyh s ILE 166 Ca -0.08 -0.85 0.06 0.00 -1.41 0.00 0.00 60.65 58.37 1fyh s ILE 166 Cb -0.05 -0.97 -0.01 0.00 0.13 0.00 0.00 42.46 41.56 1fyh s ILE 166 CO -0.00 -0.47 -0.21 -1.58 -1.91 0.00 0.00 174.94 170.77 1fyh s GLN 167 N -2.72 2.03 0.30 3.50 0.74 -1.26 -1.04 119.66 121.21 1fyh s GLN 167 Ca -0.04 -0.76 0.10 0.00 0.05 0.00 0.00 55.36 54.72 1fyh s GLN 167 Cb -0.00 -1.80 -0.06 0.00 1.10 0.00 0.00 33.01 32.25 1fyh s GLN 167 CO -0.05 0.36 -0.14 0.71 -0.55 0.00 0.00 175.29 175.62 1fyh s TYR 168 N -0.19 2.27 -0.04 1.67 2.02 0.73 -4.96 117.35 118.84 1fyh s TYR 168 Ca -0.00 -0.45 0.03 0.00 -0.37 0.00 0.00 57.07 56.28 1fyh s TYR 168 Cb -0.11 -1.15 0.00 0.00 -0.40 0.00 0.00 41.96 40.31 1fyh s TYR 168 CO 0.02 0.60 -0.12 0.15 -1.57 0.00 0.00 175.55 174.63 1fyh s LYS 169 N -3.58 1.36 -0.20 -0.62 1.02 -1.26 -0.41 119.74 116.05 1fyh s LYS 169 Ca 0.30 -0.41 -0.02 0.00 0.02 0.00 0.00 55.97 55.87 1fyh s LYS 169 Cb -0.01 -1.20 -0.00 0.00 -0.52 0.00 0.00 37.83 36.10 1fyh s LYS 169 CO 0.15 0.12 -0.09 0.42 -0.92 0.00 0.00 175.35 175.02 1fyh s ILE 170 N 0.30 2.99 -0.36 2.17 1.01 0.04 -4.96 121.20 122.39 1fyh s ILE 170 Ca -0.07 -0.63 -0.22 0.00 0.00 0.00 0.00 60.65 59.74 1fyh s ILE 170 Cb -0.11 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 40.03 1fyh s ILE 170 CO 0.02 0.47 0.70 -0.76 0.00 0.00 0.00 174.94 175.36 1fyh s LEU 171 N 1.29 4.22 0.53 2.97 1.43 -1.26 -1.85 118.68 126.01 1fyh s LEU 171 Ca 0.03 0.20 0.32 0.00 -1.03 0.00 0.00 54.13 53.65 1fyh s LEU 171 Cb -0.14 -2.88 1.29 0.00 0.03 0.00 0.00 46.19 44.49 1fyh s LEU 171 CO -0.05 -0.66 1.96 0.71 0.23 0.00 0.00 176.35 178.54 1fyh h THR 172 N 5.72 0.12 0.02 5.49 1.35 -1.70 -3.33 112.91 120.58 1fyh h THR 172 Ca -0.26 -0.62 -0.31 0.00 -0.55 0.00 0.00 66.41 64.67 1fyh h THR 172 Cb 1.10 1.55 -0.04 0.00 -1.73 0.00 0.00 68.15 69.04 1fyh h THR 172 CO 0.87 0.04 -1.71 0.00 -0.25 0.00 0.00 175.52 174.48 1fyh n GLN 173 N -3.16 0.60 -1.46 4.72 1.13 -1.26 -4.30 117.38 113.65 1fyh n GLN 173 Ca 0.00 0.44 -0.33 0.00 -1.94 0.00 0.00 57.00 55.18 1fyh n GLN 173 Cb 0.33 -1.68 -0.05 0.00 0.11 0.00 0.00 30.24 28.95 1fyh n GLN 173 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1fyh n LYS 174 N -4.19 3.47 -3.64 -1.09 5.02 -1.25 -4.82 118.16 111.65 1fyh n LYS 174 Ca -0.38 -2.34 -0.04 0.00 -2.02 0.00 0.00 58.31 53.54 1fyh n LYS 174 Cb 0.80 -2.52 -0.07 0.00 -0.02 0.00 0.00 35.03 33.22 1fyh n LYS 174 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1fyh s GLU 175 N 0.56 0.44 0.13 1.97 2.02 -1.25 -4.90 118.70 117.66 1fyh s GLU 175 Ca 0.64 0.74 0.18 0.00 0.02 0.00 0.00 54.97 56.54 1fyh s GLU 175 Cb 0.23 0.10 0.77 0.00 0.10 0.00 0.00 34.13 35.33 1fyh s GLU 175 CO -0.08 -0.09 1.55 -0.25 0.02 0.00 0.00 175.26 176.42 1fyh n ASP 176 N 3.66 0.32 0.19 -0.19 8.00 -1.26 -3.12 116.55 124.15 1fyh n ASP 176 Ca -0.18 0.59 0.03 0.00 0.71 0.00 0.00 54.79 55.94 1fyh n ASP 176 Cb 0.58 -0.65 0.38 0.00 -0.02 0.00 0.00 41.12 41.40 1fyh n ASP 176 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1fyh h ASP 177 N 0.00 0.00 -3.65 -2.24 3.32 -1.93 -3.45 116.42 108.47 1fyh h ASP 177 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 1fyh h ASP 177 Cb 0.27 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.65 1fyh h ASP 177 CO 0.00 0.35 -0.77 0.00 -1.72 0.00 0.00 179.24 177.10 1fyh n ASP 179 N 0.80 0.00 0.28 0.00 5.68 -0.45 -4.99 116.55 117.86 1fyh n ASP 179 Ca -0.15 -0.25 0.16 0.00 -0.50 0.00 0.00 54.79 54.06 1fyh n ASP 179 Cb 0.52 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.24 1fyh n ASP 179 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1fyh h GLU 180 N 0.00 0.00 0.00 0.11 3.07 -2.00 -3.31 114.58 112.45 1fyh h GLU 180 Ca 0.00 0.00 -0.35 0.00 -0.50 0.00 0.00 59.36 58.51 1fyh h GLU 180 Cb 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.85 1fyh h GLU 180 CO 0.00 0.05 -2.33 -0.89 -1.40 0.00 0.00 179.01 174.45 1fyh n ILE 181 N -3.21 1.33 -3.78 3.13 5.41 -1.26 -4.83 119.36 116.15 1fyh n ILE 181 Ca -0.00 -0.58 -0.04 0.00 1.00 0.00 0.00 62.75 63.13 1fyh n ILE 181 Cb 0.28 -1.15 -0.01 0.00 -0.71 0.00 0.00 39.64 38.05 1fyh n ILE 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1fyh s GLN 182 N -2.47 1.32 0.18 0.38 -2.07 -1.25 -3.06 119.66 112.70 1fyh s GLN 182 Ca -0.27 -0.75 0.11 0.00 -1.82 0.00 0.00 55.36 52.63 1fyh s GLN 182 Cb 0.08 0.43 -0.04 0.00 -1.09 0.00 0.00 33.01 32.39 1fyh s GLN 182 CO 0.59 -0.61 -0.24 0.00 -1.32 0.00 0.00 175.29 173.72 1fyh s GLN 184 N -2.57 1.02 -0.06 0.00 -0.21 -1.02 -0.27 119.66 116.55 1fyh s GLN 184 Ca 0.20 -1.06 -0.04 0.00 0.02 0.00 0.00 55.36 54.47 1fyh s GLN 184 Cb -0.08 -1.18 0.02 0.00 1.00 0.00 0.00 33.01 32.77 1fyh s GLN 184 CO 0.09 0.27 0.16 -1.17 -2.12 0.00 0.00 175.29 172.53 1fyh s LEU 185 N -1.78 1.12 -0.17 2.90 2.96 -0.25 -4.87 118.68 118.59 1fyh s LEU 185 Ca 0.03 0.32 -0.04 0.00 -0.22 0.00 0.00 54.13 54.23 1fyh s LEU 185 Cb -0.10 0.49 -0.02 0.00 0.50 0.00 0.00 46.19 47.05 1fyh s LEU 185 CO 0.03 -0.09 -0.04 0.00 -1.32 0.00 0.00 176.35 174.93 1fyh s ALA 186 N 0.52 2.96 -0.08 5.97 0.00 -1.26 -0.49 121.76 129.38 1fyh s ALA 186 Ca -0.04 -0.89 0.03 0.00 0.00 0.00 0.00 51.96 51.06 1fyh s ALA 186 Cb -0.05 -1.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.47 1fyh s ALA 186 CO -0.02 0.08 -0.17 0.42 0.00 0.00 0.00 175.76 176.06 1fyh s ILE 187 N 0.60 2.74 0.25 0.00 1.01 0.32 -4.95 121.20 121.17 1fyh s ILE 187 Ca -0.03 -0.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.52 1fyh s ILE 187 Cb -0.14 -2.09 -0.09 0.00 0.01 0.00 0.00 42.46 40.15 1fyh s ILE 187 CO 0.02 0.56 0.99 -2.16 0.00 0.00 0.00 174.94 174.35 1fyh s PRO 188 N -0.12 4.79 0.01 2.79 0.05 -1.26 -0.92 135.00 140.33 1fyh s PRO 188 Ca -0.03 1.58 -0.20 0.00 0.05 0.00 0.00 61.00 62.40 1fyh s PRO 188 Cb -0.14 -3.26 -0.06 0.00 0.05 0.00 0.00 34.50 31.10 1fyh s PRO 188 CO 0.04 0.42 0.59 0.08 0.05 0.00 0.00 177.00 178.18 1fyh s VAL 189 N -1.14 4.88 0.26 -0.36 1.01 -0.69 -4.90 120.40 119.46 1fyh s VAL 189 Ca 0.42 1.24 -0.20 0.00 0.00 0.00 0.00 61.98 63.44 1fyh s VAL 189 Cb -0.28 -3.92 0.07 0.00 0.00 0.00 0.00 36.38 32.25 1fyh s VAL 189 CO 0.35 0.44 0.94 -0.94 0.00 0.00 0.00 175.10 175.88 1fyh s SER 190 N -0.35 -0.02 -1.34 3.32 1.04 -1.26 -4.89 113.70 110.21 1fyh s SER 190 Ca 0.31 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1fyh s SER 190 Cb -0.18 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1fyh s SER 190 CO 0.17 -1.25 0.00 -1.20 0.98 0.00 0.00 173.24 171.94 1fyh n SER 191 N -1.22 -4.06 -0.91 7.02 7.64 -1.26 -1.96 113.62 118.88 1fyh n SER 191 Ca -0.05 0.24 -0.12 0.00 1.01 0.00 0.00 58.87 59.95 1fyh n SER 191 Cb 0.60 -3.56 -0.05 0.00 -1.01 0.00 0.00 64.21 60.18 1fyh n SER 191 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1fyh n LEU 192 N -2.44 -0.73 -4.77 -3.43 4.77 -1.26 -4.98 117.00 104.16 1fyh n LEU 192 Ca -0.16 0.29 -0.39 0.00 -0.03 0.00 0.00 56.01 55.73 1fyh n LEU 192 Cb 0.55 -2.11 -0.02 0.00 -2.33 0.00 0.00 43.42 39.52 1fyh n LEU 192 CO 0.20 -0.75 0.89 0.20 -1.33 0.00 0.00 177.39 176.60 1fyh s ASN 193 N -2.68 6.57 -0.00 -1.43 0.01 -0.83 -4.95 114.94 111.62 1fyh s ASN 193 Ca 0.00 2.46 0.02 0.00 -0.71 0.00 0.00 52.86 54.63 1fyh s ASN 193 Cb 0.00 -2.63 -0.03 0.00 0.41 0.00 0.00 41.25 39.01 1fyh s ASN 193 CO 0.00 -0.65 0.04 -0.24 -1.51 0.00 0.00 177.10 174.74 1fyh n SER 194 N 0.29 4.58 -4.14 -1.22 2.88 -1.26 -4.82 113.62 109.93 1fyh n SER 194 Ca 0.03 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.25 1fyh n SER 194 Cb 0.45 1.03 -0.16 0.00 -0.75 0.00 0.00 64.21 64.78 1fyh n SER 194 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1fyh s GLN 195 N -2.12 2.88 -0.16 -1.46 0.74 -1.26 0.54 119.66 118.82 1fyh s GLN 195 Ca -0.01 -0.80 0.00 0.00 0.05 0.00 0.00 55.36 54.61 1fyh s GLN 195 Cb 0.01 -2.39 0.00 0.00 1.10 0.00 0.00 33.01 31.73 1fyh s GLN 195 CO 0.08 -0.08 -0.16 0.71 -0.55 0.00 0.00 175.29 175.28 1fyh s TYR 196 N 1.00 2.77 -0.11 1.67 1.51 -0.83 -1.79 117.35 121.57 1fyh s TYR 196 Ca -0.03 -1.10 0.03 0.00 -1.01 0.00 0.00 57.07 54.96 1fyh s TYR 196 Cb -0.15 -1.89 -0.00 0.00 -0.11 0.00 0.00 41.96 39.81 1fyh s TYR 196 CO -0.05 -0.51 -0.21 0.00 -1.11 0.00 0.00 175.55 173.67 1fyh s VAL 198 N 0.33 1.28 0.09 0.00 1.01 -0.07 -1.00 120.40 122.04 1fyh s VAL 198 Ca -0.16 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1fyh s VAL 198 Cb -0.17 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 1fyh s VAL 198 CO 0.08 0.37 -0.04 -0.94 0.00 0.00 0.00 175.10 174.57 1fyh s SER 199 N -0.12 0.86 0.06 3.32 1.04 -0.58 -1.83 113.70 116.45 1fyh s SER 199 Ca 0.01 -1.03 -0.14 0.00 0.48 0.00 0.00 55.95 55.26 1fyh s SER 199 Cb -0.09 0.15 0.02 0.00 0.10 0.00 0.00 66.02 66.20 1fyh s SER 199 CO 0.01 -0.54 0.33 0.00 0.98 0.00 0.00 173.24 174.02 1fyh s ALA 200 N -3.76 -0.74 0.02 5.32 0.00 -1.26 -0.76 121.76 120.57 1fyh s ALA 200 Ca 0.12 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.07 1fyh s ALA 200 Cb 0.06 0.42 -0.01 0.00 0.00 0.00 0.00 23.12 23.59 1fyh s ALA 200 CO -0.05 -0.48 -0.04 -1.83 0.00 0.00 0.00 175.76 173.36 1fyh s GLU 201 N -2.93 0.30 0.33 0.00 -1.05 -0.91 -1.68 118.70 112.76 1fyh s GLU 201 Ca -0.02 -0.43 0.00 0.00 -0.15 0.00 0.00 54.97 54.37 1fyh s GLU 201 Cb 0.00 -0.08 -0.03 0.00 -0.44 0.00 0.00 34.13 33.58 1fyh s GLU 201 CO -0.06 0.01 0.54 0.20 0.95 0.00 0.00 175.26 176.90 1fyh s GLY 202 N -0.92 1.40 -0.16 -3.83 0.00 -1.26 -1.43 107.32 101.12 1fyh s GLY 202 Ca -0.08 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.76 1fyh s GLY 202 CO -0.00 -0.82 -0.14 0.14 0.00 0.00 0.00 173.10 172.28 1fyh s VAL 203 N -2.27 1.59 0.46 1.40 1.01 0.13 -1.62 120.40 121.10 1fyh s VAL 203 Ca 0.40 -0.70 -0.22 0.00 0.00 0.00 0.00 61.98 61.46 1fyh s VAL 203 Cb -0.10 -1.52 -0.08 0.00 0.00 0.00 0.00 36.38 34.68 1fyh s VAL 203 CO 0.35 0.41 1.10 -0.76 0.00 0.00 0.00 175.10 176.20 1fyh s LEU 204 N 1.47 3.99 0.89 3.92 1.43 0.49 -0.30 118.68 130.56 1fyh s LEU 204 Ca 0.04 2.13 -0.11 0.00 -1.03 0.00 0.00 54.13 55.15 1fyh s LEU 204 Cb -0.13 -4.33 0.12 0.00 0.03 0.00 0.00 46.19 41.88 1fyh s LEU 204 CO -0.10 -0.79 1.09 -2.28 0.23 0.00 0.00 176.35 174.50 1fyh s HIS 205 N -1.70 2.34 0.00 0.29 5.65 -0.15 -2.20 115.29 119.52 1fyh s HIS 205 Ca 0.64 1.26 0.00 0.00 0.25 0.00 0.00 55.06 57.20 1fyh s HIS 205 Cb -0.23 -3.16 0.00 0.00 -1.18 0.00 0.00 32.58 28.01 1fyh s HIS 205 CO 0.28 -2.36 0.00 0.28 -0.65 0.00 0.00 174.74 172.29 1fyh n VAL 206 N -3.86 0.00 1.04 0.89 0.31 -1.26 -4.07 118.33 111.38 1fyh n VAL 206 Ca 0.07 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.51 1fyh n VAL 206 Cb 0.55 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 33.53 1fyh n VAL 206 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1fyh n TRP 207 N 0.00 0.00 -1.84 3.52 8.01 -1.26 -4.98 117.44 120.89 1fyh n TRP 207 Ca 0.00 0.00 -0.12 0.00 -1.31 0.00 0.00 57.50 56.07 1fyh n TRP 207 Cb 0.00 -0.05 -0.03 0.00 -2.01 0.00 0.00 31.31 29.23 1fyh n TRP 207 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1fyh n GLY 208 N 1.44 0.51 3.77 6.99 0.00 -0.94 -4.99 105.19 111.97 1fyh n GLY 208 Ca 0.08 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 1fyh n GLY 208 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fyh s VAL 209 N -2.54 3.38 0.12 1.61 1.01 -1.26 -4.62 120.40 118.11 1fyh s VAL 209 Ca 0.00 1.25 -0.04 0.00 0.00 0.00 0.00 61.98 63.19 1fyh s VAL 209 Cb 0.00 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 1fyh s VAL 209 CO 0.00 0.19 0.34 0.42 0.00 0.00 0.00 175.10 176.05 1fyh s THR 210 N -1.34 5.21 0.89 3.92 -4.23 -1.26 -0.38 115.64 118.44 1fyh s THR 210 Ca 0.51 -0.03 -0.12 0.00 -1.18 0.00 0.00 61.69 60.87 1fyh s THR 210 Cb -0.30 -3.62 0.17 0.00 1.34 0.00 0.00 72.50 70.08 1fyh s THR 210 CO 0.38 0.07 1.23 0.42 -0.54 0.00 0.00 174.62 176.18 1fyh s THR 211 N -1.62 2.04 0.61 3.99 -4.23 -0.64 -4.65 115.64 111.15 1fyh s THR 211 Ca 0.39 -0.13 -0.17 0.00 -1.18 0.00 0.00 61.69 60.61 1fyh s THR 211 Cb -0.12 -2.91 -0.03 0.00 1.34 0.00 0.00 72.50 70.78 1fyh s THR 211 CO 0.25 0.00 1.10 -1.61 -0.54 0.00 0.00 174.62 173.82 1fyh s GLU 212 N -5.68 3.11 -0.02 3.99 2.02 -0.46 -4.62 118.70 117.04 1fyh s GLU 212 Ca 0.71 1.40 -0.21 0.00 0.02 0.00 0.00 54.97 56.88 1fyh s GLU 212 Cb -0.05 -1.99 -0.05 0.00 0.10 0.00 0.00 34.13 32.14 1fyh s GLU 212 CO 0.50 -1.00 0.62 0.21 0.02 0.00 0.00 175.26 175.61 1fyh s LYS 213 N -3.84 4.35 0.56 1.61 2.20 -1.26 -3.96 119.74 119.40 1fyh s LYS 213 Ca 0.68 0.76 -0.20 0.00 -0.36 0.00 0.00 55.97 56.85 1fyh s LYS 213 Cb -0.20 -3.37 -0.05 0.00 -1.51 0.00 0.00 37.83 32.70 1fyh s LYS 213 CO 0.36 0.29 1.19 -1.54 -0.36 0.00 0.00 175.35 175.29 1fyh s SER 214 N 0.05 5.46 0.37 1.43 1.04 -0.68 -4.89 113.70 116.49 1fyh s SER 214 Ca 0.32 2.36 -0.27 0.00 0.48 0.00 0.00 55.95 58.83 1fyh s SER 214 Cb -0.18 -2.60 -0.10 0.00 0.10 0.00 0.00 66.02 63.25 1fyh s SER 214 CO 0.17 -1.41 1.32 -0.54 0.98 0.00 0.00 173.24 173.77 1fyh s LYS 215 N -3.20 4.16 0.29 4.02 1.02 -1.26 -4.47 119.74 120.31 1fyh s LYS 215 Ca 0.74 2.22 -0.29 0.00 0.02 0.00 0.00 55.97 58.66 1fyh s LYS 215 Cb -0.29 -2.92 -0.10 0.00 -0.52 0.00 0.00 37.83 34.00 1fyh s LYS 215 CO 0.33 -0.35 1.32 -2.00 -0.92 0.00 0.00 175.35 173.72 1fyh s GLU 216 N -2.02 4.37 -0.06 1.68 2.12 -1.26 -4.83 118.70 118.69 1fyh s GLU 216 Ca 0.53 2.17 0.03 0.00 0.36 0.00 0.00 54.97 58.06 1fyh s GLU 216 Cb -0.40 -3.11 -0.03 0.00 0.26 0.00 0.00 34.13 30.86 1fyh s GLU 216 CO 0.52 -0.21 -0.13 0.14 -0.54 0.00 0.00 175.26 175.04 1fyh s VAL 217 N -0.70 3.15 0.25 3.70 -7.23 -0.76 -4.91 120.40 113.89 1fyh s VAL 217 Ca 0.52 -0.69 0.11 0.00 -1.81 0.00 0.00 61.98 60.12 1fyh s VAL 217 Cb -0.39 -2.25 -0.05 0.00 0.56 0.00 0.00 36.38 34.26 1fyh s VAL 217 CO 0.48 0.59 -0.18 0.00 -0.31 0.00 0.00 175.10 175.67 1fyh s ILE 219 N -2.23 0.08 -0.15 0.00 2.07 -0.60 -5.01 121.20 115.36 1fyh s ILE 219 Ca 0.28 -0.64 -0.03 0.00 -1.41 0.00 0.00 60.65 58.84 1fyh s ILE 219 Cb -0.06 -0.26 -0.03 0.00 0.13 0.00 0.00 42.46 42.25 1fyh s ILE 219 CO 0.14 -0.35 -0.04 -0.89 -1.91 0.00 0.00 174.94 171.89 1fyh s THR 220 N -1.09 3.88 -0.18 4.00 2.01 -1.26 -1.96 115.64 121.04 1fyh s THR 220 Ca -0.12 -0.37 -0.05 0.00 0.31 0.00 0.00 61.69 61.46 1fyh s THR 220 Cb -0.07 -2.69 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 1fyh s THR 220 CO -0.00 0.50 0.01 -0.63 -0.69 0.00 0.00 174.62 173.81 1fyh s ILE 221 N 0.28 4.22 -0.26 1.82 -1.09 0.19 -5.01 121.20 121.35 1fyh s ILE 221 Ca -0.03 -0.23 -0.17 0.00 -2.23 0.00 0.00 60.65 57.98 1fyh s ILE 221 Cb -0.14 -2.89 -0.03 0.00 -1.58 0.00 0.00 42.46 37.82 1fyh s ILE 221 CO 0.03 0.46 0.49 -0.36 -1.23 0.00 0.00 174.94 174.33 1fyh s PHE 222 N 0.59 3.27 -2.00 3.97 0.08 -1.26 -4.59 117.98 118.03 1fyh s PHE 222 Ca -0.00 0.61 0.23 0.00 0.12 0.00 0.00 56.93 57.89 1fyh s PHE 222 Cb -0.14 -2.69 1.36 0.00 -0.57 0.00 0.00 43.02 40.98 1fyh s PHE 222 CO 0.02 -0.26 1.73 0.09 -0.10 0.00 0.00 175.22 176.70