#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fyh s PRO 13 N 0.00 2.06 0.22 5.55 0.02 -1.26 -4.38 135.00 137.20 1fyh s PRO 13 Ca 0.00 1.60 -0.19 0.00 0.02 0.00 0.00 61.00 62.43 1fyh s PRO 13 Cb 0.00 -1.84 -0.08 0.00 0.02 0.00 0.00 34.50 32.60 1fyh s PRO 13 CO 0.00 -1.86 0.70 0.99 -0.33 0.00 0.00 177.00 176.50 1fyh s THR 14 N -2.26 4.61 0.87 0.99 2.01 -1.26 -4.73 115.64 115.87 1fyh s THR 14 Ca 0.70 1.21 -0.11 0.00 0.31 0.00 0.00 61.69 63.80 1fyh s THR 14 Cb -0.25 -3.83 0.12 0.00 0.01 0.00 0.00 72.50 68.55 1fyh s THR 14 CO 0.48 0.19 1.16 -2.84 -0.69 0.00 0.00 174.62 172.92 1fyh s PRO 15 N -2.03 1.26 0.29 4.92 0.02 -1.26 -4.94 135.00 133.26 1fyh s PRO 15 Ca 0.43 1.60 0.06 0.00 0.02 0.00 0.00 61.00 63.11 1fyh s PRO 15 Cb -0.16 -1.75 -0.06 0.00 0.02 0.00 0.00 34.50 32.55 1fyh s PRO 15 CO 0.21 -2.46 -0.04 0.95 -0.33 0.00 0.00 177.00 175.33 1fyh s THR 16 N -2.51 1.60 -1.35 0.99 -4.23 -0.35 -4.77 115.64 105.02 1fyh s THR 16 Ca 0.68 -2.10 -0.11 0.00 -1.18 0.00 0.00 61.69 58.98 1fyh s THR 16 Cb -0.24 -2.53 0.01 0.00 1.34 0.00 0.00 72.50 71.08 1fyh s THR 16 CO 0.56 -0.24 0.44 -3.20 -0.54 0.00 0.00 174.62 171.64 1fyh n ASN 17 N -0.62 -1.74 -4.63 3.99 5.15 -1.26 -0.65 115.26 115.49 1fyh n ASN 17 Ca -0.05 -1.14 -0.43 0.00 -0.60 0.00 0.00 54.58 52.37 1fyh n ASN 17 Cb 0.64 -2.48 -0.02 0.00 -0.53 0.00 0.00 39.78 37.39 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 -3.88 4.01 0.23 3.44 1.01 -1.26 -4.25 120.40 119.70 1fyh s VAL 18 Ca 0.19 1.15 0.07 0.00 0.00 0.00 0.00 61.98 63.39 1fyh s VAL 18 Cb -0.09 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 1fyh s VAL 18 CO 0.93 -0.39 -0.11 0.42 0.00 0.00 0.00 175.10 175.94 1fyh s THR 19 N 4.55 1.66 -0.05 3.92 -4.23 -0.43 -4.78 115.64 116.27 1fyh s THR 19 Ca 0.61 -2.17 0.02 0.00 -1.18 0.00 0.00 61.69 58.96 1fyh s THR 19 Cb -0.20 -2.18 0.01 0.00 1.34 0.00 0.00 72.50 71.48 1fyh s THR 19 CO 0.24 -0.50 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.10 1fyh s ILE 20 N -3.02 0.88 0.02 2.99 1.01 -1.26 -0.36 121.20 121.47 1fyh s ILE 20 Ca 0.25 -0.35 0.04 0.00 0.00 0.00 0.00 60.65 60.59 1fyh s ILE 20 Cb 0.01 -0.82 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 1fyh s ILE 20 CO 0.08 0.29 -0.13 -1.61 0.00 0.00 0.00 174.94 173.58 1fyh s GLU 21 N 0.61 0.91 -0.06 2.79 2.02 -0.60 -4.97 118.70 119.40 1fyh s GLU 21 Ca -0.11 -0.64 -0.03 0.00 0.02 0.00 0.00 54.97 54.21 1fyh s GLU 21 Cb -0.14 -0.89 0.04 0.00 0.10 0.00 0.00 34.13 33.24 1fyh s GLU 21 CO 0.02 0.23 0.13 0.45 0.02 0.00 0.00 175.26 176.10 1fyh s SER 22 N -0.88 0.35 -0.11 -0.19 0.15 -1.26 -0.87 113.70 110.89 1fyh s SER 22 Ca 0.02 0.25 0.02 0.00 0.70 0.00 0.00 55.95 56.94 1fyh s SER 22 Cb -0.07 0.15 0.01 0.00 -1.71 0.00 0.00 66.02 64.40 1fyh s SER 22 CO 0.01 -0.19 -0.16 -0.47 1.20 0.00 0.00 173.24 173.62 1fyh s TYR 23 N 1.66 2.04 -1.35 3.44 5.04 -1.26 -0.69 117.35 126.24 1fyh s TYR 23 Ca -0.03 -0.93 -0.01 0.00 -2.44 0.00 0.00 57.07 53.66 1fyh s TYR 23 Cb -0.12 -1.45 0.01 0.00 0.35 0.00 0.00 41.96 40.75 1fyh s TYR 23 CO -0.05 -0.46 0.64 0.09 -1.34 0.00 0.00 175.55 174.43 1fyh n ASN 24 N 4.08 -1.12 -3.94 4.32 3.02 0.04 -2.71 115.26 118.96 1fyh n ASN 24 Ca -0.20 -0.87 -0.28 0.00 -0.03 0.00 0.00 54.58 53.21 1fyh n ASN 24 Cb 0.51 -3.78 0.00 0.00 -0.61 0.00 0.00 39.78 35.91 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 -4.33 -4.26 -3.36 3.52 2.81 -1.26 -4.93 117.12 105.31 1fyh n MET 25 Ca -0.28 0.50 -0.26 0.00 -1.81 0.00 0.00 57.70 55.85 1fyh n MET 25 Cb 0.67 -5.05 -0.08 0.00 -0.71 0.00 0.00 33.22 28.05 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 -2.90 2.58 -4.73 7.83 5.15 -1.10 -4.96 115.26 117.12 1fyh n ASN 26 Ca -0.14 -3.19 -0.42 0.00 -0.60 0.00 0.00 54.58 50.23 1fyh n ASN 26 Cb 0.60 -0.66 -0.03 0.00 -0.53 0.00 0.00 39.78 39.17 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 -2.03 4.25 -0.03 1.20 0.04 -1.26 -4.23 135.00 132.95 1fyh s PRO 27 Ca 0.38 2.31 0.04 0.00 0.04 0.00 0.00 61.00 63.76 1fyh s PRO 27 Cb 0.15 -3.13 -0.00 0.00 0.04 0.00 0.00 34.50 31.56 1fyh s PRO 27 CO -0.05 -0.48 -0.13 0.42 0.04 0.00 0.00 177.00 176.81 1fyh s ILE 28 N 0.41 1.07 -0.12 0.56 1.01 -0.05 -1.12 121.20 122.96 1fyh s ILE 28 Ca 0.63 -0.53 -0.10 0.00 0.00 0.00 0.00 60.65 60.64 1fyh s ILE 28 Cb -0.42 -0.92 -0.05 0.00 0.01 0.00 0.00 42.46 41.08 1fyh s ILE 28 CO 0.39 0.32 0.22 -0.69 0.00 0.00 0.00 174.94 175.18 1fyh s VAL 29 N 0.01 5.36 0.14 2.92 1.01 -0.12 -1.56 120.40 128.16 1fyh s VAL 29 Ca -0.01 0.40 0.07 0.00 0.00 0.00 0.00 61.98 62.44 1fyh s VAL 29 Cb -0.09 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 1fyh s VAL 29 CO 0.01 0.53 -0.16 -0.31 0.00 0.00 0.00 175.10 175.17 1fyh s TYR 30 N -0.49 1.63 0.31 5.22 2.02 0.52 -1.03 117.35 125.52 1fyh s TYR 30 Ca 0.16 -0.51 -0.17 0.00 -0.37 0.00 0.00 57.07 56.17 1fyh s TYR 30 Cb -0.13 -0.83 0.02 0.00 -0.40 0.00 0.00 41.96 40.63 1fyh s TYR 30 CO 0.05 0.24 0.69 1.67 -1.57 0.00 0.00 175.55 176.63 1fyh s TRP 31 N -2.10 0.04 0.21 2.71 -2.14 -1.03 -1.32 118.94 115.32 1fyh s TRP 31 Ca 0.13 -0.53 0.08 0.00 2.66 0.00 0.00 56.10 58.43 1fyh s TRP 31 Cb -0.05 0.62 -0.05 0.00 -3.10 0.00 0.00 33.47 30.89 1fyh s TRP 31 CO 0.05 -1.28 -0.14 -1.21 -2.66 0.00 0.00 176.95 171.71 1fyh s GLU 32 N -3.47 1.35 -0.04 3.25 2.02 0.17 -4.82 118.70 117.17 1fyh s GLU 32 Ca 0.15 -1.61 -0.19 0.00 0.02 0.00 0.00 54.97 53.34 1fyh s GLU 32 Cb -0.05 -1.12 0.04 0.00 0.10 0.00 0.00 34.13 33.09 1fyh s GLU 32 CO 0.09 0.17 0.41 -0.47 0.02 0.00 0.00 175.26 175.48 1fyh s TYR 33 N -2.98 -0.33 0.85 1.61 5.04 -1.26 -1.21 117.35 119.08 1fyh s TYR 33 Ca 0.23 0.57 -0.12 0.00 -2.44 0.00 0.00 57.07 55.31 1fyh s TYR 33 Cb -0.00 0.18 0.10 0.00 0.35 0.00 0.00 41.96 42.59 1fyh s TYR 33 CO 0.07 -0.42 1.16 1.14 -1.34 0.00 0.00 175.55 176.16 1fyh s GLN 34 N -1.11 1.61 0.22 4.97 -2.07 -1.26 -5.02 119.66 117.00 1fyh s GLN 34 Ca -0.11 0.21 -0.30 0.00 -1.82 0.00 0.00 55.36 53.34 1fyh s GLN 34 Cb -0.04 -1.90 -0.08 0.00 -1.09 0.00 0.00 33.01 29.90 1fyh s GLN 34 CO 0.05 -1.86 1.07 0.42 -1.32 0.00 0.00 175.29 173.65 1fyh s ILE 35 N -3.43 3.78 0.03 3.63 1.01 -1.26 -5.04 121.20 119.92 1fyh s ILE 35 Ca 0.63 1.66 0.03 0.00 0.00 0.00 0.00 60.65 62.96 1fyh s ILE 35 Cb -0.13 -4.06 -0.02 0.00 0.01 0.00 0.00 42.46 38.27 1fyh s ILE 35 CO 0.51 0.34 -0.08 -0.04 0.00 0.00 0.00 174.94 175.67 1fyh s MET 36 N -0.88 0.58 0.32 2.79 -1.94 -1.26 -5.05 119.30 113.85 1fyh s MET 36 Ca 0.46 -0.63 0.07 0.00 -1.71 0.00 0.00 55.69 53.88 1fyh s MET 36 Cb -0.30 -0.44 0.53 0.00 2.01 0.00 0.00 34.83 36.63 1fyh s MET 36 CO 0.37 0.10 1.76 -1.00 -0.01 0.00 0.00 175.02 176.23 1fyh h PRO 37 N 4.91 0.25 -6.15 2.03 0.13 -2.07 -3.43 132.00 127.68 1fyh h PRO 37 Ca -0.34 -0.10 -0.55 0.00 -0.87 0.00 0.00 66.00 64.13 1fyh h PRO 37 Cb 1.20 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 1fyh h PRO 37 CO 0.43 0.56 -0.53 -0.65 -0.23 0.00 0.00 178.00 177.59 1fyh s GLN 38 N -4.31 3.09 -0.29 0.86 -1.52 -1.26 -5.08 119.66 111.15 1fyh s GLN 38 Ca -0.05 -0.79 -0.29 0.00 -1.95 0.00 0.00 55.36 52.28 1fyh s GLN 38 Cb 0.14 -2.75 0.00 0.00 -0.22 0.00 0.00 33.01 30.18 1fyh s GLN 38 CO 0.76 0.49 1.22 0.08 -0.25 0.00 0.00 175.29 177.60 1fyh s VAL 39 N -1.78 4.28 0.42 1.09 1.01 -1.26 -5.04 120.40 119.12 1fyh s VAL 39 Ca 0.32 1.47 -0.17 0.00 0.00 0.00 0.00 61.98 63.60 1fyh s VAL 39 Cb -0.10 -4.22 -0.09 0.00 0.00 0.00 0.00 36.38 31.97 1fyh s VAL 39 CO 0.25 -0.43 0.89 -2.16 0.00 0.00 0.00 175.10 173.65 1fyh s PRO 40 N 3.91 4.05 0.02 2.72 0.04 -1.26 -4.84 135.00 139.64 1fyh s PRO 40 Ca 0.53 0.90 0.06 0.00 0.04 0.00 0.00 61.00 62.52 1fyh s PRO 40 Cb -0.16 -2.25 -0.02 0.00 0.04 0.00 0.00 34.50 32.11 1fyh s PRO 40 CO 0.19 -0.05 -0.17 0.14 0.04 0.00 0.00 177.00 177.16 1fyh s VAL 41 N -2.27 1.35 0.20 -0.36 -7.23 -0.67 -4.57 120.40 106.84 1fyh s VAL 41 Ca 0.58 -0.95 0.08 0.00 -1.81 0.00 0.00 61.98 59.88 1fyh s VAL 41 Cb -0.10 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.63 1fyh s VAL 41 CO 0.21 0.20 -0.02 -0.36 -0.31 0.00 0.00 175.10 174.81 1fyh s PHE 42 N -0.67 2.77 -0.06 2.82 0.08 0.81 -0.51 117.98 123.22 1fyh s PHE 42 Ca 0.05 -0.17 0.02 0.00 0.12 0.00 0.00 56.93 56.94 1fyh s PHE 42 Cb -0.08 -1.32 0.02 0.00 -0.57 0.00 0.00 43.02 41.07 1fyh s PHE 42 CO 0.01 0.54 -0.10 0.99 -0.10 0.00 0.00 175.22 176.55 1fyh s THR 43 N -1.86 0.99 -0.10 0.64 2.01 -0.74 -1.69 115.64 114.89 1fyh s THR 43 Ca 0.28 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.91 1fyh s THR 43 Cb -0.09 -0.93 -0.02 0.00 0.01 0.00 0.00 72.50 71.47 1fyh s THR 43 CO 0.18 0.33 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.61 1fyh s VAL 44 N 0.80 3.05 0.07 3.82 1.01 -0.91 -1.95 120.40 126.29 1fyh s VAL 44 Ca -0.12 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.25 1fyh s VAL 44 Cb -0.15 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 1fyh s VAL 44 CO 0.02 0.55 -0.20 -1.61 0.00 0.00 0.00 175.10 173.86 1fyh s GLU 45 N -0.03 1.23 -0.02 2.72 2.02 -0.39 -0.07 118.70 124.15 1fyh s GLU 45 Ca -0.03 -1.01 0.05 0.00 0.02 0.00 0.00 54.97 54.00 1fyh s GLU 45 Cb -0.14 -1.39 -0.01 0.00 0.10 0.00 0.00 34.13 32.69 1fyh s GLU 45 CO 0.04 0.34 -0.17 0.08 0.02 0.00 0.00 175.26 175.57 1fyh s VAL 46 N -0.96 1.41 -0.09 2.63 1.01 0.41 -1.68 120.40 123.12 1fyh s VAL 46 Ca 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1fyh s VAL 46 Cb -0.09 -1.18 0.01 0.00 0.00 0.00 0.00 36.38 35.12 1fyh s VAL 46 CO 0.03 0.40 -0.14 -0.75 0.00 0.00 0.00 175.10 174.64 1fyh s LYS 47 N -0.26 2.00 -0.06 2.72 2.20 -0.33 -0.86 119.74 125.15 1fyh s LYS 47 Ca 0.03 -0.50 -0.03 0.00 -0.36 0.00 0.00 55.97 55.12 1fyh s LYS 47 Cb -0.08 -1.68 -0.04 0.00 -1.51 0.00 0.00 37.83 34.52 1fyh s LYS 47 CO 0.00 -0.02 0.07 -0.80 -0.36 0.00 0.00 175.35 174.25 1fyh s ASN 48 N 0.84 5.74 0.29 1.43 -0.87 -1.26 -0.80 114.94 120.32 1fyh s ASN 48 Ca -0.10 0.24 -0.30 0.00 -1.57 0.00 0.00 52.86 51.13 1fyh s ASN 48 Cb -0.15 -1.71 -0.11 0.00 -0.02 0.00 0.00 41.25 39.26 1fyh s ASN 48 CO 0.01 0.35 1.50 -0.47 -2.57 0.00 0.00 177.10 175.92 1fyh s TYR 49 N -1.04 2.85 0.00 2.20 5.04 0.33 -2.35 117.35 124.38 1fyh s TYR 49 Ca 0.17 0.98 0.00 0.00 -2.44 0.00 0.00 57.07 55.79 1fyh s TYR 49 Cb -0.12 -3.94 0.00 0.00 0.35 0.00 0.00 41.96 38.26 1fyh s TYR 49 CO 0.07 -3.01 0.00 0.41 -1.34 0.00 0.00 175.55 171.68 1fyh n GLY 50 N 1.80 0.76 3.77 8.97 0.00 -1.26 -4.86 105.19 114.36 1fyh n GLY 50 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1fyh n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fyh s VAL 51 N -2.00 2.13 0.14 1.61 0.11 -0.99 -4.91 120.40 116.48 1fyh s VAL 51 Ca 0.00 0.12 -0.21 0.00 -2.93 0.00 0.00 61.98 58.96 1fyh s VAL 51 Cb 0.00 -3.07 0.00 0.00 -1.53 0.00 0.00 36.38 31.78 1fyh s VAL 51 CO 0.00 0.02 1.67 0.11 -3.33 0.00 0.00 175.10 173.57 1fyh h LYS 52 N 2.53 -0.11 0.00 1.54 1.57 -1.96 -3.45 116.57 116.69 1fyh h LYS 52 Ca -0.51 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1fyh h LYS 52 Cb 1.26 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.59 1fyh h LYS 52 CO 0.62 -0.07 0.00 0.09 -0.57 0.00 0.00 179.45 179.52 1fyh n ASN 53 N -5.28 0.00 -0.75 0.86 3.02 -1.26 -5.07 115.26 106.78 1fyh n ASN 53 Ca -0.02 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.58 1fyh n ASN 53 Cb 0.20 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 39.46 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 1.27 -4.76 6.41 3.41 -1.26 -5.08 113.62 113.60 1fyh n SER 54 Ca 0.00 -2.77 -0.39 0.00 -0.26 0.00 0.00 58.87 55.45 1fyh n SER 54 Cb 0.00 -0.37 -0.06 0.00 -0.26 0.00 0.00 64.21 63.52 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 -1.51 4.34 -0.11 4.33 2.02 -1.26 -5.06 118.70 121.44 1fyh s GLU 55 Ca 0.28 0.79 -0.11 0.00 0.02 0.00 0.00 54.97 55.94 1fyh s GLU 55 Cb 0.28 -3.34 -0.05 0.00 0.10 0.00 0.00 34.13 31.12 1fyh s GLU 55 CO -0.07 0.37 0.26 -1.58 0.02 0.00 0.00 175.26 174.26 1fyh s TRP 56 N -0.21 3.57 -0.11 1.61 0.52 -1.26 -4.77 118.94 118.29 1fyh s TRP 56 Ca 0.32 0.65 -0.02 0.00 0.02 0.00 0.00 56.10 57.07 1fyh s TRP 56 Cb -0.19 -2.18 -0.03 0.00 -1.15 0.00 0.00 33.47 29.92 1fyh s TRP 56 CO 0.18 0.51 -0.01 0.42 0.02 0.00 0.00 176.95 178.07 1fyh s ILE 57 N -0.43 4.15 -0.00 2.03 -1.09 -0.04 -4.86 121.20 120.96 1fyh s ILE 57 Ca 0.17 -0.29 -0.30 0.00 -2.23 0.00 0.00 60.65 57.99 1fyh s ILE 57 Cb -0.13 -2.77 -0.07 0.00 -1.58 0.00 0.00 42.46 37.91 1fyh s ILE 57 CO 0.06 0.56 1.65 -1.81 -1.23 0.00 0.00 174.94 174.17 1fyh s ASP 58 N -0.43 6.65 -0.18 3.58 1.01 -1.26 -0.45 116.67 125.59 1fyh s ASP 58 Ca 0.08 2.34 -0.01 0.00 0.71 0.00 0.00 52.55 55.66 1fyh s ASP 58 Cb -0.12 -2.55 -0.22 0.00 1.01 0.00 0.00 42.92 41.04 1fyh s ASP 58 CO 0.02 -0.90 0.12 0.00 0.21 0.00 0.00 175.17 174.62 1fyh n ALA 59 N 6.49 1.17 -3.10 5.23 0.00 0.90 -4.93 120.51 126.28 1fyh n ALA 59 Ca 0.17 -0.85 -0.12 0.00 0.00 0.00 0.00 53.44 52.64 1fyh n ALA 59 Cb 0.42 -0.43 -0.08 0.00 0.00 0.00 0.00 19.45 19.36 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 -2.08 0.59 -1.46 0.00 1.09 -1.26 -2.14 121.20 115.93 1fyh s ILE 61 Ca -0.08 -0.47 -0.01 0.00 -1.10 0.00 0.00 60.65 58.98 1fyh s ILE 61 Cb -0.02 -0.52 0.00 0.00 -1.06 0.00 0.00 42.46 40.85 1fyh s ILE 61 CO -0.00 0.06 0.24 0.59 -0.10 0.00 0.00 174.94 175.72 1fyh n ASN 62 N 2.60 0.09 -4.90 3.58 3.02 -0.68 -4.97 115.26 114.00 1fyh n ASN 62 Ca -0.15 -1.14 -0.27 0.00 -0.03 0.00 0.00 54.58 52.99 1fyh n ASN 62 Cb 0.57 -2.36 -0.04 0.00 -0.61 0.00 0.00 39.78 37.35 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 -4.14 5.12 -0.97 2.41 -4.36 -1.04 -4.78 121.20 113.43 1fyh s ILE 63 Ca 0.02 -0.75 0.15 0.00 -0.26 0.00 0.00 60.65 59.82 1fyh s ILE 63 Cb -0.01 -3.61 -0.10 0.00 1.25 0.00 0.00 42.46 39.98 1fyh s ILE 63 CO 0.94 -0.06 0.71 -1.54 0.24 0.00 0.00 174.94 175.23 1fyh n SER 64 N -0.38 1.03 -4.75 4.36 3.41 -1.26 -0.13 113.62 115.90 1fyh n SER 64 Ca -0.07 -1.02 -0.25 0.00 -0.26 0.00 0.00 58.87 57.27 1fyh n SER 64 Cb 0.54 0.81 0.09 0.00 -0.26 0.00 0.00 64.21 65.39 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 -2.21 2.38 -0.51 7.33 0.00 -1.26 -4.95 115.29 116.08 1fyh s HIS 65 Ca 0.08 0.19 0.03 0.00 -3.00 0.00 0.00 55.06 52.36 1fyh s HIS 65 Cb 0.12 -3.23 0.44 0.00 -4.00 0.00 0.00 32.58 25.90 1fyh s HIS 65 CO 0.53 -1.61 1.55 0.72 -1.00 0.00 0.00 174.74 174.94 1fyh n HIS 66 N -2.96 3.04 -3.66 0.38 -0.00 -1.26 -4.87 115.22 105.90 1fyh n HIS 66 Ca 0.11 -2.64 -0.10 0.00 -0.00 0.00 0.00 57.72 55.09 1fyh n HIS 66 Cb 0.60 -0.75 -0.05 0.00 -0.00 0.00 0.00 29.99 29.79 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 -3.72 -0.18 -0.20 4.41 -0.85 -1.26 -2.47 117.35 113.08 1fyh s TYR 67 Ca 0.55 -0.13 -0.06 0.00 -0.52 0.00 0.00 57.07 56.90 1fyh s TYR 67 Cb 0.44 0.23 0.09 0.00 0.38 0.00 0.00 41.96 43.10 1fyh s TYR 67 CO -0.08 -0.68 0.41 0.00 -1.52 0.00 0.00 175.55 173.69 1fyh s ASN 69 N 2.60 7.04 -0.19 0.00 3.84 -1.26 -0.94 114.94 126.02 1fyh s ASN 69 Ca -0.00 1.70 0.16 0.00 0.21 0.00 0.00 52.86 54.92 1fyh s ASN 69 Cb -0.12 -2.55 0.51 0.00 -0.55 0.00 0.00 41.25 38.53 1fyh s ASN 69 CO -0.13 -0.64 1.41 2.30 -2.79 0.00 0.00 177.10 177.25 1fyh n ILE 70 N 4.95 2.30 -0.35 -5.21 -5.35 -0.28 -4.75 119.36 110.67 1fyh n ILE 70 Ca 0.12 -2.05 0.22 0.00 -0.27 0.00 0.00 62.75 60.78 1fyh n ILE 70 Cb 0.46 -0.27 0.46 0.00 -1.74 0.00 0.00 39.64 38.56 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 1.51 0.54 0.00 7.28 0.02 -1.91 -0.30 113.55 120.69 1fyh h SER 71 Ca 0.04 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1fyh h SER 71 Cb 1.45 0.06 0.00 0.00 0.14 0.00 0.00 62.40 64.05 1fyh h SER 71 CO 0.23 0.01 0.00 0.47 -1.14 0.00 0.00 176.83 176.41 1fyh n ASP 72 N -4.84 0.00 -0.58 3.07 9.92 -1.26 -3.32 116.55 119.54 1fyh n ASP 72 Ca 0.29 -0.99 0.06 0.00 -0.53 0.00 0.00 54.79 53.62 1fyh n ASP 72 Cb 0.90 0.00 0.16 0.00 -0.64 0.00 0.00 41.12 41.54 1fyh n ASP 72 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1fyh n HIS 73 N -0.94 0.00 -0.06 1.24 8.25 -0.12 -4.85 115.22 118.75 1fyh n HIS 73 Ca 0.18 -1.18 -0.03 0.00 -0.26 0.00 0.00 57.72 56.44 1fyh n HIS 73 Cb 0.08 -0.20 -0.01 0.00 1.12 0.00 0.00 29.99 30.98 1fyh n HIS 73 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1fyh h VAL 74 N 1.83 0.00 0.00 1.59 2.07 -1.63 -3.47 116.25 116.64 1fyh h VAL 74 Ca -0.03 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1fyh h VAL 74 Cb 1.13 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1fyh h VAL 74 CO 0.01 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.21 1fyh n GLY 75 N 1.67 0.42 3.68 2.17 0.00 -1.26 -4.75 105.19 107.11 1fyh n GLY 75 Ca -0.05 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 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 -4.00 7.06 0.56 1.61 -1.08 -1.26 -4.91 116.67 114.65 1fyh s ASP 76 Ca 0.00 1.70 0.37 0.00 -0.52 0.00 0.00 52.55 54.10 1fyh s ASP 76 Cb 0.00 -2.55 1.99 0.00 -1.46 0.00 0.00 42.92 40.90 1fyh s ASP 76 CO 0.00 -0.61 2.14 1.55 0.52 0.00 0.00 175.17 178.77 1fyh h PRO 77 N 7.57 0.00 0.00 4.34 0.13 -1.98 -2.07 132.00 139.98 1fyh h PRO 77 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1fyh h PRO 77 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1fyh h PRO 77 CO 0.91 0.00 -0.49 0.43 -0.23 0.00 0.00 178.00 178.62 1fyh n SER 78 N -2.83 0.71 -4.79 1.44 7.64 -1.26 -1.32 113.62 113.21 1fyh n SER 78 Ca -0.02 0.20 -0.39 0.00 1.01 0.00 0.00 58.87 59.68 1fyh n SER 78 Cb 0.08 -0.04 -0.06 0.00 -1.01 0.00 0.00 64.21 63.18 1fyh n SER 78 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1fyh s ASN 79 N -4.24 7.29 0.61 6.43 0.01 -0.78 -4.93 114.94 119.33 1fyh s ASN 79 Ca 0.07 1.56 -0.15 0.00 -0.71 0.00 0.00 52.86 53.63 1fyh s ASN 79 Cb 0.13 -2.47 -0.03 0.00 0.41 0.00 0.00 41.25 39.30 1fyh s ASN 79 CO 0.69 0.18 1.06 -0.44 -1.51 0.00 0.00 177.10 177.08 1fyh s SER 80 N -1.24 5.70 0.04 -1.22 0.01 -1.26 -4.64 113.70 111.09 1fyh s SER 80 Ca 0.36 1.77 -0.08 0.00 1.31 0.00 0.00 55.95 59.32 1fyh s SER 80 Cb -0.21 -2.52 -0.00 0.00 0.21 0.00 0.00 66.02 63.49 1fyh s SER 80 CO 0.24 -1.22 0.16 -1.48 0.41 0.00 0.00 173.24 171.35 1fyh s LEU 81 N -4.72 1.52 0.14 2.44 0.05 -0.20 -0.51 118.68 117.41 1fyh s LEU 81 Ca 0.62 -0.45 0.06 0.00 0.05 0.00 0.00 54.13 54.41 1fyh s LEU 81 Cb -0.15 0.84 -0.04 0.00 -2.05 0.00 0.00 46.19 44.79 1fyh s LEU 81 CO 0.41 -0.56 -0.14 0.26 -0.55 0.00 0.00 176.35 175.77 1fyh s TRP 82 N -2.70 1.46 0.05 3.48 0.51 0.02 -1.23 118.94 120.54 1fyh s TRP 82 Ca -0.04 -0.57 0.04 0.00 -2.12 0.00 0.00 56.10 53.41 1fyh s TRP 82 Cb -0.01 -0.75 -0.03 0.00 -0.81 0.00 0.00 33.47 31.88 1fyh s TRP 82 CO -0.05 0.18 -0.11 0.08 -0.51 0.00 0.00 176.95 176.54 1fyh s VAL 83 N -2.31 0.81 -0.01 4.03 1.01 -1.26 -1.18 120.40 121.48 1fyh s VAL 83 Ca 0.12 -1.17 -0.04 0.00 0.00 0.00 0.00 61.98 60.88 1fyh s VAL 83 Cb -0.04 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.52 1fyh s VAL 83 CO 0.03 -0.30 0.09 0.00 0.00 0.00 0.00 175.10 174.93 1fyh s ARG 84 N -1.63 0.30 -0.02 2.72 1.70 -0.68 -0.90 118.95 120.45 1fyh s ARG 84 Ca -0.06 -0.21 0.03 0.00 -0.47 0.00 0.00 55.73 55.02 1fyh s ARG 84 Cb -0.10 0.13 -0.00 0.00 -0.57 0.00 0.00 34.95 34.41 1fyh s ARG 84 CO 0.01 -0.06 -0.10 0.08 -1.08 0.00 0.00 175.30 174.15 1fyh s VAL 85 N -0.80 0.82 0.15 4.99 1.01 0.04 -1.27 120.40 125.34 1fyh s VAL 85 Ca -0.09 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.52 1fyh s VAL 85 Cb -0.05 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1fyh s VAL 85 CO 0.00 0.25 -0.09 -1.59 0.00 0.00 0.00 175.10 173.67 1fyh s LYS 86 N -0.01 1.08 0.20 2.72 -2.85 -0.83 -0.33 119.74 119.72 1fyh s LYS 86 Ca 0.00 -1.47 0.10 0.00 -1.00 0.00 0.00 55.97 53.60 1fyh s LYS 86 Cb -0.07 -0.62 -0.04 0.00 -2.06 0.00 0.00 37.83 35.04 1fyh s LYS 86 CO 0.00 0.06 -0.12 0.00 0.10 0.00 0.00 175.35 175.39 1fyh s ALA 87 N -3.33 2.87 -0.01 0.59 0.00 -1.26 -1.79 121.76 118.83 1fyh s ALA 87 Ca 0.17 -1.55 0.01 0.00 0.00 0.00 0.00 51.96 50.60 1fyh s ALA 87 Cb 0.03 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.52 1fyh s ALA 87 CO 0.01 0.43 -0.04 0.50 0.00 0.00 0.00 175.76 176.65 1fyh s ARG 88 N -2.92 0.49 -0.22 0.00 3.52 0.33 -0.86 118.95 119.29 1fyh s ARG 88 Ca 0.25 -0.14 -0.02 0.00 -0.13 0.00 0.00 55.73 55.69 1fyh s ARG 88 Cb -0.08 -0.51 0.07 0.00 -1.56 0.00 0.00 34.95 32.87 1fyh s ARG 88 CO 0.15 0.04 0.04 0.08 -0.81 0.00 0.00 175.30 174.80 1fyh s VAL 89 N 0.23 0.65 0.00 7.11 1.01 -0.42 -1.67 120.40 127.31 1fyh s VAL 89 Ca -0.02 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1fyh s VAL 89 Cb -0.06 -1.22 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1fyh s VAL 89 CO -0.00 -0.32 0.00 0.61 0.00 0.00 0.00 175.10 175.39 1fyh n GLY 90 N 4.99 2.89 0.80 4.51 0.00 -1.26 -1.95 105.19 115.17 1fyh n GLY 90 Ca -0.08 -0.27 0.10 0.00 0.00 0.00 0.00 46.02 45.77 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 12.64 1.77 -3.64 1.61 6.02 -1.26 -4.96 117.38 129.56 1fyh n GLN 91 Ca 0.00 -1.71 -0.37 0.00 -0.01 0.00 0.00 57.00 54.92 1fyh n GLN 91 Cb 0.00 -1.38 -0.07 0.00 1.02 0.00 0.00 30.24 29.81 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 -1.61 3.98 0.07 -1.09 1.02 -0.82 -5.09 119.74 116.20 1fyh s LYS 92 Ca 0.24 0.06 0.07 0.00 0.02 0.00 0.00 55.97 56.36 1fyh s LYS 92 Cb 0.17 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 34.11 1fyh s LYS 92 CO 0.25 0.47 -0.15 -1.21 -0.92 0.00 0.00 175.35 173.78 1fyh s GLU 93 N -0.21 2.05 0.79 1.68 2.02 -1.26 -1.31 118.70 122.47 1fyh s GLU 93 Ca 0.16 -1.02 -0.09 0.00 0.02 0.00 0.00 54.97 54.05 1fyh s GLU 93 Cb -0.13 -2.22 0.12 0.00 0.10 0.00 0.00 34.13 31.99 1fyh s GLU 93 CO 0.05 0.52 1.12 -1.54 0.02 0.00 0.00 175.26 175.43 1fyh s SER 94 N -1.79 4.17 0.84 -0.19 1.04 -0.04 -4.78 113.70 112.95 1fyh s SER 94 Ca 0.17 0.25 -0.12 0.00 0.48 0.00 0.00 55.95 56.73 1fyh s SER 94 Cb -0.11 -0.64 0.10 0.00 0.10 0.00 0.00 66.02 65.47 1fyh s SER 94 CO 0.09 -2.03 1.17 0.00 0.98 0.00 0.00 173.24 173.45 1fyh s ALA 95 N -3.45 2.40 0.19 5.32 0.00 -1.26 -4.65 121.76 120.32 1fyh s ALA 95 Ca 0.66 -0.61 -0.26 0.00 0.00 0.00 0.00 51.96 51.75 1fyh s ALA 95 Cb -0.07 -2.98 -0.08 0.00 0.00 0.00 0.00 23.12 19.98 1fyh s ALA 95 CO 0.47 -1.85 0.82 0.71 0.00 0.00 0.00 175.76 175.92 1fyh s TYR 96 N -3.49 3.91 -0.23 0.00 2.02 -1.26 -4.61 117.35 113.68 1fyh s TYR 96 Ca 0.62 1.70 -0.10 0.00 -0.37 0.00 0.00 57.07 58.92 1fyh s TYR 96 Cb -0.12 -2.82 -0.05 0.00 -0.40 0.00 0.00 41.96 38.57 1fyh s TYR 96 CO 0.50 0.48 0.15 0.00 -1.57 0.00 0.00 175.55 175.11 1fyh s ALA 97 N -1.20 3.61 -0.16 3.71 0.00 0.55 -4.90 121.76 123.37 1fyh s ALA 97 Ca 0.38 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.43 1fyh s ALA 97 Cb -0.23 -2.28 -0.03 0.00 0.00 0.00 0.00 23.12 20.57 1fyh s ALA 97 CO 0.27 -0.14 0.01 0.15 0.00 0.00 0.00 175.76 176.05 1fyh s LYS 98 N 0.95 3.72 0.97 0.00 1.02 -1.26 -0.78 119.74 124.35 1fyh s LYS 98 Ca 0.07 -0.44 -0.14 0.00 0.02 0.00 0.00 55.97 55.48 1fyh s LYS 98 Cb -0.13 -3.02 0.18 0.00 -0.52 0.00 0.00 37.83 34.34 1fyh s LYS 98 CO 0.03 0.31 1.18 -1.54 -0.92 0.00 0.00 175.35 174.41 1fyh s SER 99 N 0.22 2.98 0.69 2.83 1.04 -0.08 -4.96 113.70 116.41 1fyh s SER 99 Ca 0.01 0.72 -0.05 0.00 0.48 0.00 0.00 55.95 57.11 1fyh s SER 99 Cb -0.13 -1.09 0.07 0.00 0.10 0.00 0.00 66.02 64.97 1fyh s SER 99 CO 0.02 -2.85 0.98 -1.61 0.98 0.00 0.00 173.24 170.75 1fyh s GLU 100 N -5.47 2.10 0.36 4.02 0.41 -1.26 -4.75 118.70 114.11 1fyh s GLU 100 Ca 0.67 -0.51 -0.28 0.00 -0.41 0.00 0.00 54.97 54.44 1fyh s GLU 100 Cb -0.11 -2.25 -0.11 0.00 -1.78 0.00 0.00 34.13 29.89 1fyh s GLU 100 CO 0.53 -1.22 1.43 -2.00 -0.49 0.00 0.00 175.26 173.51 1fyh s GLU 101 N -5.16 4.19 -0.02 1.61 2.12 -1.26 -4.69 118.70 115.49 1fyh s GLU 101 Ca 0.61 2.46 0.03 0.00 0.36 0.00 0.00 54.97 58.42 1fyh s GLU 101 Cb -0.09 -3.00 0.00 0.00 0.26 0.00 0.00 34.13 31.29 1fyh s GLU 101 CO 0.44 -0.42 -0.09 0.12 -0.54 0.00 0.00 175.26 174.76 1fyh s PHE 102 N -1.10 0.92 -0.08 5.30 5.36 -0.37 -4.97 117.98 123.05 1fyh s PHE 102 Ca 0.52 -0.21 -0.01 0.00 -0.96 0.00 0.00 56.93 56.26 1fyh s PHE 102 Cb -0.44 -0.64 0.03 0.00 -0.34 0.00 0.00 43.02 41.63 1fyh s PHE 102 CO 0.59 -0.08 0.00 0.00 -1.46 0.00 0.00 175.22 174.28 1fyh s ALA 103 N 0.08 0.72 0.26 11.12 0.00 -1.26 -1.03 121.76 131.65 1fyh s ALA 103 Ca -0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 51.96 51.75 1fyh s ALA 103 Cb -0.07 -0.77 0.52 0.00 0.00 0.00 0.00 23.12 22.80 1fyh s ALA 103 CO 0.00 -0.50 1.69 0.28 0.00 0.00 0.00 175.76 177.23 1fyh h VAL 104 N 6.34 0.50 0.00 0.00 2.07 -1.79 0.12 116.25 123.48 1fyh h VAL 104 Ca -0.20 -0.10 -0.08 0.00 0.82 0.00 0.00 66.70 67.14 1fyh h VAL 104 Cb 1.12 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1fyh h VAL 104 CO 0.27 0.06 -0.37 0.00 0.02 0.00 0.00 177.57 177.55 1fyh n ARG 106 N -4.00 0.73 -0.01 0.00 0.63 -0.73 -4.65 116.66 108.63 1fyh n ARG 106 Ca -0.02 0.29 0.11 0.00 -0.92 0.00 0.00 57.85 57.31 1fyh n ARG 106 Cb 0.41 -1.70 -0.15 0.00 0.45 0.00 0.00 32.46 31.48 1fyh n ARG 106 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1fyh n ASP 107 N -3.58 0.36 -4.82 6.15 8.00 0.32 -4.98 116.55 118.00 1fyh n ASP 107 Ca -0.33 -0.34 -0.22 0.00 0.71 0.00 0.00 54.79 54.60 1fyh n ASP 107 Cb 1.00 1.65 0.08 0.00 -0.02 0.00 0.00 41.12 43.83 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 -3.98 1.78 0.06 0.44 0.00 -0.40 -4.73 107.32 100.49 1fyh s GLY 108 Ca -0.02 -1.64 0.08 0.00 0.00 0.00 0.00 44.72 43.14 1fyh s GLY 108 CO 0.89 -1.19 -0.20 0.54 0.00 0.00 0.00 173.10 173.14 1fyh s LYS 109 N -4.95 1.94 0.01 2.90 1.02 0.14 -4.92 119.74 115.88 1fyh s LYS 109 Ca 0.62 -1.05 0.07 0.00 0.02 0.00 0.00 55.97 55.63 1fyh s LYS 109 Cb -0.07 -2.12 -0.03 0.00 -0.52 0.00 0.00 37.83 35.09 1fyh s LYS 109 CO 0.41 0.52 -0.20 0.42 -0.92 0.00 0.00 175.35 175.59 1fyh s ILE 110 N -0.94 2.64 1.19 2.17 -1.09 -1.26 -0.78 121.20 123.14 1fyh s ILE 110 Ca 0.14 -1.08 -0.18 0.00 -2.23 0.00 0.00 60.65 57.30 1fyh s ILE 110 Cb -0.10 -2.05 0.28 0.00 -1.58 0.00 0.00 42.46 39.00 1fyh s ILE 110 CO 0.05 0.45 1.09 -0.83 -1.23 0.00 0.00 174.94 174.47 1fyh s GLY 111 N -1.09 1.56 0.63 6.18 0.00 -1.26 -0.97 107.32 112.36 1fyh s GLY 111 Ca 0.13 -0.82 -0.11 0.00 0.00 0.00 0.00 44.72 43.91 1fyh s GLY 111 CO 0.03 0.03 1.03 2.56 0.00 0.00 0.00 173.10 176.75 1fyh s PRO 112 N -5.27 3.46 0.77 2.90 0.04 -1.25 -3.86 135.00 131.79 1fyh s PRO 112 Ca 0.70 0.83 -0.12 0.00 0.04 0.00 0.00 61.00 62.45 1fyh s PRO 112 Cb -0.12 -2.06 0.06 0.00 0.04 0.00 0.00 34.50 32.41 1fyh s PRO 112 CO 0.57 -0.68 1.13 -1.25 0.04 0.00 0.00 177.00 176.81 1fyh s PRO 113 N -5.03 2.29 -0.13 0.56 0.04 -1.26 -4.35 135.00 127.12 1fyh s PRO 113 Ca 0.56 0.34 -0.02 0.00 0.04 0.00 0.00 61.00 61.93 1fyh s PRO 113 Cb -0.12 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 1fyh s PRO 113 CO 0.52 -1.41 -0.08 0.15 0.04 0.00 0.00 177.00 176.22 1fyh s LYS 114 N -5.41 3.38 0.12 4.56 1.02 -0.68 -4.60 119.74 118.13 1fyh s LYS 114 Ca 0.60 -0.58 0.08 0.00 0.02 0.00 0.00 55.97 56.10 1fyh s LYS 114 Cb -0.12 -2.75 -0.04 0.00 -0.52 0.00 0.00 37.83 34.40 1fyh s LYS 114 CO 0.51 0.32 -0.15 -0.51 -0.92 0.00 0.00 175.35 174.61 1fyh s LEU 115 N 0.11 2.83 -0.11 3.17 1.43 -1.26 -1.11 118.68 123.74 1fyh s LEU 115 Ca -0.03 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 1fyh s LEU 115 Cb -0.14 -1.64 0.02 0.00 0.03 0.00 0.00 46.19 44.46 1fyh s LEU 115 CO 0.03 0.17 -0.11 -1.81 0.23 0.00 0.00 176.35 174.86 1fyh s ASP 116 N -2.25 2.21 -0.08 2.29 1.01 -0.88 -4.98 116.67 113.98 1fyh s ASP 116 Ca 0.20 -0.36 0.02 0.00 0.71 0.00 0.00 52.55 53.12 1fyh s ASP 116 Cb -0.10 -0.94 -0.02 0.00 1.01 0.00 0.00 42.92 42.86 1fyh s ASP 116 CO 0.12 -0.04 -0.14 -0.51 0.21 0.00 0.00 175.17 174.81 1fyh s ILE 117 N 1.26 3.06 0.04 0.77 2.07 -1.26 -1.29 121.20 125.85 1fyh s ILE 117 Ca -0.02 -0.70 -0.05 0.00 -1.41 0.00 0.00 60.65 58.47 1fyh s ILE 117 Cb -0.14 -2.23 -0.01 0.00 0.13 0.00 0.00 42.46 40.20 1fyh s ILE 117 CO -0.04 0.56 0.08 0.00 -1.91 0.00 0.00 174.94 173.63 1fyh s ARG 118 N -0.28 0.58 -0.42 3.50 1.70 -0.33 -4.97 118.95 118.73 1fyh s ARG 118 Ca 0.02 -0.80 -0.22 0.00 -0.47 0.00 0.00 55.73 54.26 1fyh s ARG 118 Cb -0.13 0.22 0.02 0.00 -0.57 0.00 0.00 34.95 34.50 1fyh s ARG 118 CO 0.03 -0.14 0.74 -1.59 -1.08 0.00 0.00 175.30 173.25 1fyh s LYS 119 N -2.72 3.47 0.00 3.89 -2.85 -1.26 -0.15 119.74 120.12 1fyh s LYS 119 Ca -0.04 -0.07 0.00 0.00 -1.00 0.00 0.00 55.97 54.86 1fyh s LYS 119 Cb -0.01 -3.90 0.00 0.00 -2.06 0.00 0.00 37.83 31.86 1fyh s LYS 119 CO -0.05 -1.00 0.00 0.39 0.10 0.00 0.00 175.35 174.79 1fyh n GLU 120 N 6.49 2.81 0.04 1.78 -0.58 0.10 -4.94 120.64 126.35 1fyh n GLU 120 Ca 0.01 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.65 1fyh n GLU 120 Cb 0.48 0.00 -0.08 0.00 -0.57 0.00 0.00 31.44 31.27 1fyh n GLU 120 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1fyh h GLU 121 N 0.00 -0.19 0.00 3.49 4.39 -2.02 -3.39 114.58 116.87 1fyh h GLU 121 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1fyh h GLU 121 Cb 0.00 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1fyh h GLU 121 CO 0.00 0.26 -0.10 1.63 -1.16 0.00 0.00 179.01 179.64 1fyh n LYS 122 N -4.90 1.10 -4.13 2.33 5.02 -1.26 -5.05 118.16 111.28 1fyh n LYS 122 Ca -0.08 -2.20 -0.09 0.00 -2.02 0.00 0.00 58.31 53.92 1fyh n LYS 122 Cb 0.27 -1.27 -0.10 0.00 -0.02 0.00 0.00 35.03 33.90 1fyh n LYS 122 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1fyh s GLN 123 N -2.20 0.88 -0.17 1.97 -0.21 -1.26 -3.97 119.66 114.69 1fyh s GLN 123 Ca 0.24 -1.38 -0.07 0.00 0.02 0.00 0.00 55.36 54.17 1fyh s GLN 123 Cb 0.21 0.24 -0.04 0.00 1.00 0.00 0.00 33.01 34.42 1fyh s GLN 123 CO 0.02 -0.24 0.06 0.42 -2.12 0.00 0.00 175.29 173.43 1fyh s ILE 124 N -4.02 4.75 -0.23 1.08 1.09 0.13 -0.72 121.20 123.29 1fyh s ILE 124 Ca 0.21 -0.05 -0.04 0.00 -1.10 0.00 0.00 60.65 59.66 1fyh s ILE 124 Cb 0.07 -3.12 -0.01 0.00 -1.06 0.00 0.00 42.46 38.34 1fyh s ILE 124 CO -0.01 0.49 -0.02 -0.04 -0.10 0.00 0.00 174.94 175.26 1fyh s MET 125 N 0.16 3.42 -0.21 2.79 -1.94 0.79 0.27 119.30 124.58 1fyh s MET 125 Ca 0.04 -0.60 -0.05 0.00 -1.71 0.00 0.00 55.69 53.37 1fyh s MET 125 Cb -0.12 -3.06 -0.02 0.00 2.01 0.00 0.00 34.83 33.64 1fyh s MET 125 CO 0.01 -0.20 -0.00 0.42 -0.01 0.00 0.00 175.02 175.24 1fyh s ILE 126 N 1.50 3.87 -0.21 2.53 1.01 0.12 -1.19 121.20 128.84 1fyh s ILE 126 Ca 0.06 -0.34 -0.07 0.00 0.00 0.00 0.00 60.65 60.30 1fyh s ILE 126 Cb -0.14 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.53 1fyh s ILE 126 CO -0.02 0.42 0.06 -1.81 0.00 0.00 0.00 174.94 173.59 1fyh s ASP 127 N 1.14 5.39 -0.49 3.58 1.01 -0.41 -0.79 116.67 126.10 1fyh s ASP 127 Ca 0.03 -0.05 -0.07 0.00 0.71 0.00 0.00 52.55 53.16 1fyh s ASP 127 Cb -0.14 -1.94 0.13 0.00 1.01 0.00 0.00 42.92 41.97 1fyh s ASP 127 CO 0.01 0.08 0.34 -0.63 0.21 0.00 0.00 175.17 175.18 1fyh s ILE 128 N 0.94 4.02 0.10 0.77 1.01 -0.17 -2.08 121.20 125.78 1fyh s ILE 128 Ca 0.04 -1.99 -0.27 0.00 0.00 0.00 0.00 60.65 58.43 1fyh s ILE 128 Cb -0.14 -3.66 -0.06 0.00 0.01 0.00 0.00 42.46 38.61 1fyh s ILE 128 CO 0.03 -0.78 0.84 -0.36 0.00 0.00 0.00 174.94 174.66 1fyh s PHE 129 N 1.13 3.81 0.59 3.97 0.08 -0.26 -1.18 117.98 126.11 1fyh s PHE 129 Ca 0.08 1.63 -0.20 0.00 0.12 0.00 0.00 56.93 58.56 1fyh s PHE 129 Cb -0.24 -2.89 -0.03 0.00 -0.57 0.00 0.00 43.02 39.28 1fyh s PHE 129 CO -0.02 0.31 1.30 -1.01 -0.10 0.00 0.00 175.22 175.70 1fyh s HIS 130 N -0.32 2.26 0.32 0.36 3.76 -1.03 -1.68 115.29 118.95 1fyh s HIS 130 Ca 0.41 1.45 -0.26 0.00 -0.15 0.00 0.00 55.06 56.50 1fyh s HIS 130 Cb -0.22 -3.68 -0.14 0.00 1.11 0.00 0.00 32.58 29.64 1fyh s HIS 130 CO 0.26 -2.71 0.77 -2.30 -0.85 0.00 0.00 174.74 169.91 1fyh n PRO 131 N -1.41 0.85 -0.28 8.40 -0.02 -1.26 -4.70 135.00 136.58 1fyh n PRO 131 Ca 0.13 0.30 0.16 0.00 -2.02 0.00 0.00 63.50 62.07 1fyh n PRO 131 Cb 0.47 -1.59 0.44 0.00 -0.02 0.00 0.00 33.50 32.80 1fyh n PRO 131 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1fyh h SER 132 N 1.40 0.56 -0.27 2.55 4.64 -1.92 -1.29 113.55 119.21 1fyh h SER 132 Ca -0.38 0.06 0.08 0.00 -0.47 0.00 0.00 61.79 61.08 1fyh h SER 132 Cb 1.38 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 1fyh h SER 132 CO 0.57 0.23 0.41 -0.37 -0.87 0.00 0.00 176.83 176.79 1fyh h VAL 133 N 0.56 0.25 -0.01 0.95 -1.51 -1.94 0.51 116.25 115.06 1fyh h VAL 133 Ca 0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.97 1fyh h VAL 133 Cb 1.02 0.65 0.00 0.00 -2.13 0.00 0.00 31.29 30.83 1fyh h VAL 133 CO -0.24 0.00 -0.14 0.49 -1.23 0.00 0.00 177.57 176.45 1fyh n PHE 134 N -3.43 0.00 -3.41 5.19 3.72 -0.49 -5.14 117.46 113.90 1fyh n PHE 134 Ca 0.04 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.14 1fyh n PHE 134 Cb 0.54 -0.05 -0.07 0.00 -0.94 0.00 0.00 39.48 38.96 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 -0.14 2.78 -3.58 -4.37 0.31 0.17 -5.03 118.33 108.48 1fyh n VAL 135 Ca 0.15 -5.30 -0.10 0.00 -0.01 0.00 0.00 64.34 59.08 1fyh n VAL 135 Cb 0.37 -2.12 -0.05 0.00 -0.91 0.00 0.00 33.84 31.14 1fyh n VAL 135 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1fyh s PRO 146 N -2.41 0.58 0.00 5.55 0.04 -1.26 -4.97 135.00 132.53 1fyh s PRO 146 Ca 0.37 0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.55 1fyh s PRO 146 Cb 0.11 0.27 0.00 0.00 0.04 0.00 0.00 34.50 34.92 1fyh s PRO 146 CO -0.01 -0.18 0.00 0.39 0.04 0.00 0.00 177.00 177.24 1fyh n GLU 147 N 0.73 0.00 -3.51 4.56 1.02 -1.26 -5.07 120.64 117.11 1fyh n GLU 147 Ca -0.10 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.81 1fyh n GLU 147 Cb 0.58 -0.27 -0.01 0.00 -0.02 0.00 0.00 31.44 31.72 1fyh n GLU 147 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1fyh s THR 148 N -2.40 5.14 -2.09 2.62 -1.32 -1.26 -4.97 115.64 111.37 1fyh s THR 148 Ca 0.00 -0.56 0.29 0.00 -1.21 0.00 0.00 61.69 60.21 1fyh s THR 148 Cb 0.00 -3.86 0.57 0.00 -1.51 0.00 0.00 72.50 67.71 1fyh s THR 148 CO 0.00 -0.50 1.86 0.35 -2.21 0.00 0.00 174.62 174.13 1fyh n THR 149 N -1.66 0.00 -2.78 5.08 -2.24 -1.26 -4.60 114.28 106.82 1fyh n THR 149 Ca -0.06 -0.13 -0.43 0.00 -2.27 0.00 0.00 64.05 61.16 1fyh n THR 149 Cb 0.56 0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.90 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 3.09 0.54 -0.10 0.00 -0.85 -1.26 -5.00 117.35 113.77 1fyh s TYR 151 Ca 0.44 -0.91 -0.30 0.00 -0.52 0.00 0.00 57.07 55.78 1fyh s TYR 151 Cb -0.01 -0.19 -0.02 0.00 0.38 0.00 0.00 41.96 42.12 1fyh s TYR 151 CO -0.01 -0.66 1.20 0.42 -1.52 0.00 0.00 175.55 174.98 1fyh s ILE 152 N -3.99 4.32 -0.16 -3.49 1.01 -1.26 -1.40 121.20 116.23 1fyh s ILE 152 Ca 0.19 1.62 -0.15 0.00 0.00 0.00 0.00 60.65 62.31 1fyh s ILE 152 Cb 0.05 -4.04 -0.23 0.00 0.01 0.00 0.00 42.46 38.24 1fyh s ILE 152 CO 0.01 -0.05 0.34 -0.09 0.00 0.00 0.00 174.94 175.15 1fyh h ARG 153 N 7.67 0.14 -3.95 2.79 2.43 -0.47 -3.44 114.38 119.55 1fyh h ARG 153 Ca -0.31 -0.24 -0.17 0.00 -0.81 0.00 0.00 59.98 58.45 1fyh h ARG 153 Cb 1.14 0.09 -0.21 0.00 -0.42 0.00 0.00 29.97 30.56 1fyh h ARG 153 CO 0.91 1.12 -0.69 0.54 -1.51 0.00 0.00 179.97 180.33 1fyh s VAL 154 N -2.45 0.10 -0.20 0.20 0.11 -1.01 -1.96 120.40 115.20 1fyh s VAL 154 Ca -0.25 -0.85 -0.05 0.00 -2.93 0.00 0.00 61.98 57.91 1fyh s VAL 154 Cb 0.06 -0.25 -0.02 0.00 -1.53 0.00 0.00 36.38 34.63 1fyh s VAL 154 CO 0.69 -0.46 -0.00 -0.31 -3.33 0.00 0.00 175.10 171.68 1fyh s TYR 155 N -1.37 3.04 -0.40 1.54 2.02 0.30 -0.10 117.35 122.39 1fyh s TYR 155 Ca -0.15 -0.44 -0.20 0.00 -0.37 0.00 0.00 57.07 55.91 1fyh s TYR 155 Cb -0.09 -2.07 0.01 0.00 -0.40 0.00 0.00 41.96 39.41 1fyh s TYR 155 CO -0.01 -0.22 0.61 -0.80 -1.57 0.00 0.00 175.55 173.57 1fyh s ASN 156 N 0.93 6.35 -0.22 2.29 0.01 -0.55 -0.84 114.94 122.91 1fyh s ASN 156 Ca 0.01 -0.16 -0.08 0.00 -0.71 0.00 0.00 52.86 51.92 1fyh s ASN 156 Cb -0.14 -2.31 -0.04 0.00 0.41 0.00 0.00 41.25 39.17 1fyh s ASN 156 CO 0.02 -0.67 0.09 -0.69 -1.51 0.00 0.00 177.10 174.34 1fyh s VAL 157 N 2.70 4.77 -0.30 1.60 1.01 0.05 -2.37 120.40 127.85 1fyh s VAL 157 Ca 0.22 -0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 1fyh s VAL 157 Cb -0.15 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.01 1fyh s VAL 157 CO 0.17 0.38 0.16 -0.31 0.00 0.00 0.00 175.10 175.49 1fyh s TYR 158 N 1.05 3.18 -0.09 5.22 2.02 0.46 -0.64 117.35 128.54 1fyh s TYR 158 Ca 0.05 -0.36 0.03 0.00 -0.37 0.00 0.00 57.07 56.41 1fyh s TYR 158 Cb -0.14 -2.36 -0.01 0.00 -0.40 0.00 0.00 41.96 39.05 1fyh s TYR 158 CO 0.03 -0.37 -0.17 0.08 -1.57 0.00 0.00 175.55 173.55 1fyh s VAL 159 N 1.66 2.71 -0.14 0.71 1.01 -0.27 -1.40 120.40 124.67 1fyh s VAL 159 Ca 0.06 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1fyh s VAL 159 Cb -0.17 -2.07 -0.00 0.00 0.00 0.00 0.00 36.38 34.14 1fyh s VAL 159 CO 0.07 0.56 -0.17 -0.13 0.00 0.00 0.00 175.10 175.43 1fyh s ARG 160 N -0.04 3.19 -0.24 2.72 0.52 0.53 -0.58 118.95 125.05 1fyh s ARG 160 Ca -0.05 -0.77 0.02 0.00 -0.52 0.00 0.00 55.73 54.41 1fyh s ARG 160 Cb -0.14 -2.56 0.05 0.00 0.52 0.00 0.00 34.95 32.82 1fyh s ARG 160 CO 0.04 0.06 -0.13 0.00 0.02 0.00 0.00 175.30 175.29 1fyh s MET 161 N 0.70 2.35 4.34 3.54 0.23 0.78 -0.31 119.30 130.93 1fyh s MET 161 Ca -0.08 -1.17 0.00 0.00 -1.03 0.00 0.00 55.69 53.41 1fyh s MET 161 Cb -0.16 -2.76 0.00 0.00 -1.53 0.00 0.00 34.83 30.38 1fyh s MET 161 CO 0.02 -0.48 0.00 0.09 -2.03 0.00 0.00 175.02 172.61 1fyh n ASN 162 N 4.51 0.00 -1.79 -1.18 4.13 -0.76 -0.28 115.26 119.88 1fyh n ASN 162 Ca -0.15 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.10 1fyh n ASN 162 Cb 0.44 0.00 0.31 0.00 -1.54 0.00 0.00 39.78 38.99 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 3.11 3.54 7.41 0.00 -1.26 -4.95 105.19 113.04 1fyh n GLY 163 Ca 0.00 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.74 4.31 0.02 1.61 0.01 0.61 -5.14 113.70 114.38 1fyh s SER 164 Ca 0.48 -0.22 0.07 0.00 1.31 0.00 0.00 55.95 57.59 1fyh s SER 164 Cb 0.37 -0.93 -0.03 0.00 0.21 0.00 0.00 66.02 65.65 1fyh s SER 164 CO 0.13 0.29 -0.20 -1.61 0.41 0.00 0.00 173.24 172.26 1fyh s GLU 165 N -1.27 2.10 -0.19 12.44 2.02 -1.26 -0.16 118.70 132.39 1fyh s GLU 165 Ca 0.15 -0.95 -0.15 0.00 0.02 0.00 0.00 54.97 54.04 1fyh s GLU 165 Cb -0.11 -2.16 0.05 0.00 0.10 0.00 0.00 34.13 32.01 1fyh s GLU 165 CO 0.05 0.55 0.48 -1.50 0.02 0.00 0.00 175.26 174.87 1fyh s ILE 166 N -0.82 -0.01 -0.16 -1.63 2.07 0.25 -5.01 121.20 115.89 1fyh s ILE 166 Ca 0.13 0.02 -0.07 0.00 -1.41 0.00 0.00 60.65 59.31 1fyh s ILE 166 Cb -0.10 -0.69 -0.04 0.00 0.13 0.00 0.00 42.46 41.76 1fyh s ILE 166 CO 0.03 0.01 0.09 -1.58 -1.91 0.00 0.00 174.94 171.58 1fyh s GLN 167 N 0.60 3.80 0.22 3.50 0.74 -1.26 -1.12 119.66 126.14 1fyh s GLN 167 Ca -0.03 -0.27 0.11 0.00 0.05 0.00 0.00 55.36 55.22 1fyh s GLN 167 Cb -0.05 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 1fyh s GLN 167 CO -0.04 0.45 -0.17 0.71 -0.55 0.00 0.00 175.29 175.69 1fyh s TYR 168 N -0.10 2.43 -0.19 1.67 2.02 0.18 -4.96 117.35 118.39 1fyh s TYR 168 Ca 0.08 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.49 1fyh s TYR 168 Cb -0.12 -1.15 0.04 0.00 -0.40 0.00 0.00 41.96 40.33 1fyh s TYR 168 CO 0.01 0.56 -0.12 0.21 -1.57 0.00 0.00 175.55 174.64 1fyh s LYS 169 N -3.00 2.17 -0.22 -0.62 2.20 -1.26 -0.77 119.74 118.25 1fyh s LYS 169 Ca 0.25 -0.84 -0.11 0.00 -0.36 0.00 0.00 55.97 54.92 1fyh s LYS 169 Cb -0.07 -2.42 -0.05 0.00 -1.51 0.00 0.00 37.83 33.78 1fyh s LYS 169 CO 0.13 -0.39 0.16 0.42 -0.36 0.00 0.00 175.35 175.31 1fyh s ILE 170 N 1.38 5.38 -0.31 5.43 1.01 -0.02 -4.95 121.20 129.12 1fyh s ILE 170 Ca -0.00 0.21 -0.14 0.00 0.00 0.00 0.00 60.65 60.72 1fyh s ILE 170 Cb -0.16 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.79 1fyh s ILE 170 CO -0.09 0.39 0.30 -0.22 0.00 0.00 0.00 174.94 175.32 1fyh s LEU 171 N 0.73 4.26 0.44 2.97 2.96 -1.26 -0.54 118.68 128.24 1fyh s LEU 171 Ca 0.08 -0.09 0.21 0.00 -0.22 0.00 0.00 54.13 54.11 1fyh s LEU 171 Cb -0.12 -2.26 1.01 0.00 0.50 0.00 0.00 46.19 45.32 1fyh s LEU 171 CO 0.02 -0.21 1.90 0.71 -1.32 0.00 0.00 176.35 177.44 1fyh h THR 172 N 5.45 0.80 0.00 3.68 1.35 -1.68 -3.32 112.91 119.19 1fyh h THR 172 Ca -0.32 -1.03 -0.34 0.00 -0.55 0.00 0.00 66.41 64.17 1fyh h THR 172 Cb 1.16 1.63 -0.06 0.00 -1.73 0.00 0.00 68.15 69.15 1fyh h THR 172 CO 0.63 0.25 -2.23 0.00 -0.25 0.00 0.00 175.52 173.92 1fyh n GLN 173 N -3.68 0.51 -0.43 4.72 6.02 -1.26 -4.54 117.38 118.72 1fyh n GLN 173 Ca -0.01 0.16 -0.04 0.00 -0.01 0.00 0.00 57.00 57.10 1fyh n GLN 173 Cb 0.37 -1.37 0.02 0.00 1.02 0.00 0.00 30.24 30.27 1fyh n GLN 173 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1fyh n LYS 174 N -3.50 1.21 -3.65 -1.09 5.02 -1.26 -4.72 118.16 110.19 1fyh n LYS 174 Ca -0.41 -0.45 -0.03 0.00 -2.02 0.00 0.00 58.31 55.41 1fyh n LYS 174 Cb 0.86 -1.18 -0.07 0.00 -0.02 0.00 0.00 35.03 34.63 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 -0.51 0.17 0.00 1.97 2.02 -1.25 -4.96 118.70 116.14 1fyh s GLU 175 Ca 0.09 0.23 0.00 0.00 0.02 0.00 0.00 54.97 55.31 1fyh s GLU 175 Cb 0.07 0.07 0.00 0.00 0.10 0.00 0.00 34.13 34.37 1fyh s GLU 175 CO 0.01 -0.03 0.63 -0.25 0.02 0.00 0.00 175.26 175.64 1fyh n ASP 176 N 2.33 0.69 0.19 -0.19 8.00 -1.26 -3.82 116.55 122.48 1fyh n ASP 176 Ca -0.13 -1.95 0.14 0.00 0.71 0.00 0.00 54.79 53.55 1fyh n ASP 176 Cb 0.57 -0.34 0.48 0.00 -0.02 0.00 0.00 41.12 41.80 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 0.02 0.00 -4.36 -2.24 3.32 -1.89 -3.44 116.42 107.83 1fyh h ASP 177 Ca 0.00 0.00 -0.70 0.00 0.02 0.00 0.00 57.03 56.35 1fyh h ASP 177 Cb 0.34 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 39.62 1fyh h ASP 177 CO 0.00 0.00 -0.85 0.00 -1.72 0.00 0.00 179.24 176.67 1fyh n ASP 179 N 2.24 0.70 -0.03 0.00 8.00 0.29 -4.99 116.55 122.75 1fyh n ASP 179 Ca -0.16 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.17 1fyh n ASP 179 Cb 0.52 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.54 1fyh n ASP 179 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1fyh h GLU 180 N 0.00 0.65 0.02 -1.24 5.08 -2.00 -3.36 114.58 113.72 1fyh h GLU 180 Ca 0.00 -0.52 -0.36 0.00 -1.00 0.00 0.00 59.36 57.47 1fyh h GLU 180 Cb 0.00 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.30 1fyh h GLU 180 CO 0.00 1.14 -2.26 -0.89 -1.00 0.00 0.00 179.01 176.00 1fyh n ILE 181 N -4.10 1.52 -3.98 3.13 5.41 -1.26 -4.89 119.36 115.18 1fyh n ILE 181 Ca -0.08 -0.72 -0.12 0.00 1.00 0.00 0.00 62.75 62.84 1fyh n ILE 181 Cb 0.66 -1.08 -0.02 0.00 -0.71 0.00 0.00 39.64 38.49 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 -2.53 1.98 0.24 0.38 -2.07 -1.26 -2.48 119.66 113.92 1fyh s GLN 182 Ca -0.20 -1.58 0.09 0.00 -1.82 0.00 0.00 55.36 51.85 1fyh s GLN 182 Cb 0.07 0.51 -0.05 0.00 -1.09 0.00 0.00 33.01 32.46 1fyh s GLN 182 CO 0.74 -0.86 -0.15 0.00 -1.32 0.00 0.00 175.29 173.70 1fyh s GLN 184 N -3.61 0.41 -0.05 0.00 -0.44 -0.77 -1.00 119.66 114.20 1fyh s GLN 184 Ca 0.26 -0.38 -0.03 0.00 -2.50 0.00 0.00 55.36 52.70 1fyh s GLN 184 Cb -0.01 -0.30 0.03 0.00 -1.64 0.00 0.00 33.01 31.08 1fyh s GLN 184 CO 0.10 0.07 0.13 -1.17 0.50 0.00 0.00 175.29 174.92 1fyh s LEU 185 N -0.66 1.12 -0.12 3.68 2.96 0.03 -4.90 118.68 120.78 1fyh s LEU 185 Ca -0.03 0.26 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 1fyh s LEU 185 Cb -0.05 0.36 -0.01 0.00 0.50 0.00 0.00 46.19 47.00 1fyh s LEU 185 CO -0.00 -0.10 -0.16 0.00 -1.32 0.00 0.00 176.35 174.77 1fyh s ALA 186 N 0.66 2.49 0.01 5.97 0.00 -1.26 0.16 121.76 129.78 1fyh s ALA 186 Ca -0.05 -0.92 0.07 0.00 0.00 0.00 0.00 51.96 51.06 1fyh s ALA 186 Cb -0.07 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.93 1fyh s ALA 186 CO -0.03 0.25 -0.20 0.42 0.00 0.00 0.00 175.76 176.19 1fyh s ILE 187 N 0.37 2.59 -0.10 0.00 1.01 0.14 -4.93 121.20 120.27 1fyh s ILE 187 Ca -0.13 -1.12 -0.24 0.00 0.00 0.00 0.00 60.65 59.16 1fyh s ILE 187 Cb -0.16 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 1fyh s ILE 187 CO 0.06 0.44 0.75 -2.16 0.00 0.00 0.00 174.94 174.03 1fyh s PRO 188 N -1.12 4.39 -1.00 2.79 0.04 -1.26 0.21 135.00 139.05 1fyh s PRO 188 Ca 0.13 0.94 -0.23 0.00 0.04 0.00 0.00 61.00 61.87 1fyh s PRO 188 Cb -0.10 -3.50 0.06 0.00 0.04 0.00 0.00 34.50 31.00 1fyh s PRO 188 CO 0.03 -0.08 1.41 0.08 0.04 0.00 0.00 177.00 178.47 1fyh s VAL 189 N 1.30 3.99 0.00 -0.36 1.01 -1.25 -4.93 120.40 120.16 1fyh s VAL 189 Ca 0.38 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1fyh s VAL 189 Cb -0.17 -5.03 0.00 0.00 0.00 0.00 0.00 36.38 31.18 1fyh s VAL 189 CO 0.17 -1.89 0.00 -1.20 0.00 0.00 0.00 175.10 172.17 1fyh n SER 190 N 8.69 1.33 -0.33 3.32 7.64 -1.26 -4.86 113.62 128.15 1fyh n SER 190 Ca 0.31 -0.60 -0.03 0.00 1.01 0.00 0.00 58.87 59.56 1fyh n SER 190 Cb 0.51 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.70 1fyh n SER 190 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1fyh n SER 191 N -1.00 -2.79 -1.36 6.43 7.64 -1.26 -1.37 113.62 119.92 1fyh n SER 191 Ca 0.00 0.06 -0.11 0.00 1.01 0.00 0.00 58.87 59.83 1fyh n SER 191 Cb 0.00 -2.09 0.00 0.00 -1.01 0.00 0.00 64.21 61.11 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 -0.43 -1.67 -4.79 -3.43 4.77 -1.26 -5.01 117.00 105.18 1fyh n LEU 192 Ca -0.03 -0.05 -0.36 0.00 -0.03 0.00 0.00 56.01 55.54 1fyh n LEU 192 Cb 0.26 -1.77 -0.06 0.00 -2.33 0.00 0.00 43.42 39.51 1fyh n LEU 192 CO 0.04 -0.05 0.58 0.20 -1.33 0.00 0.00 177.39 176.83 1fyh s ASN 193 N -2.60 7.22 -0.02 -1.43 0.01 -0.47 -4.98 114.94 112.66 1fyh s ASN 193 Ca 0.04 1.69 0.03 0.00 -0.71 0.00 0.00 52.86 53.92 1fyh s ASN 193 Cb -0.02 -2.53 -0.05 0.00 0.41 0.00 0.00 41.25 39.07 1fyh s ASN 193 CO 0.05 -0.06 0.05 -1.20 -1.51 0.00 0.00 177.10 174.42 1fyh n SER 194 N 0.49 4.16 -4.43 -1.22 7.64 -1.26 -4.81 113.62 114.20 1fyh n SER 194 Ca 0.01 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.55 1fyh n SER 194 Cb 0.51 0.87 -0.13 0.00 -1.01 0.00 0.00 64.21 64.45 1fyh n SER 194 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1fyh s GLN 195 N -2.17 3.55 -0.14 1.43 0.74 -1.26 0.34 119.66 122.15 1fyh s GLN 195 Ca -0.02 -0.58 0.02 0.00 0.05 0.00 0.00 55.36 54.84 1fyh s GLN 195 Cb 0.02 -2.88 0.01 0.00 1.10 0.00 0.00 33.01 31.26 1fyh s GLN 195 CO 0.15 0.14 -0.21 0.71 -0.55 0.00 0.00 175.29 175.53 1fyh s TYR 196 N 0.62 2.60 -0.04 1.67 1.51 0.14 -1.84 117.35 122.01 1fyh s TYR 196 Ca -0.04 -1.36 0.06 0.00 -1.01 0.00 0.00 57.07 54.73 1fyh s TYR 196 Cb -0.15 -1.78 -0.02 0.00 -0.11 0.00 0.00 41.96 39.90 1fyh s TYR 196 CO 0.03 -0.64 -0.23 0.00 -1.11 0.00 0.00 175.55 173.59 1fyh s VAL 198 N -0.42 0.12 0.19 0.00 1.01 0.14 -0.34 120.40 121.09 1fyh s VAL 198 Ca 0.04 -0.19 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 1fyh s VAL 198 Cb -0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 36.38 36.11 1fyh s VAL 198 CO 0.01 -0.04 0.25 -0.94 0.00 0.00 0.00 175.10 174.38 1fyh s SER 199 N -0.24 0.08 0.10 3.32 1.04 -0.49 -1.26 113.70 116.26 1fyh s SER 199 Ca -0.02 -1.08 -0.25 0.00 0.48 0.00 0.00 55.95 55.09 1fyh s SER 199 Cb -0.02 0.43 0.08 0.00 0.10 0.00 0.00 66.02 66.61 1fyh s SER 199 CO -0.00 -0.91 0.68 0.00 0.98 0.00 0.00 173.24 173.99 1fyh s ALA 200 N -4.04 -1.67 0.03 5.32 0.00 -1.26 -0.40 121.76 119.74 1fyh s ALA 200 Ca 0.25 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.90 1fyh s ALA 200 Cb 0.04 0.70 -0.02 0.00 0.00 0.00 0.00 23.12 23.84 1fyh s ALA 200 CO 0.05 -0.72 -0.05 -1.83 0.00 0.00 0.00 175.76 173.22 1fyh s GLU 201 N -3.40 0.41 0.24 0.00 -1.05 -1.00 -1.59 118.70 112.31 1fyh s GLU 201 Ca 0.01 -0.68 -0.01 0.00 -0.15 0.00 0.00 54.97 54.14 1fyh s GLU 201 Cb -0.01 -0.07 -0.04 0.00 -0.44 0.00 0.00 34.13 33.57 1fyh s GLU 201 CO -0.10 -0.01 0.44 0.20 0.95 0.00 0.00 175.26 176.74 1fyh s GLY 202 N -1.52 1.72 -0.16 -3.83 0.00 -1.26 -1.48 107.32 100.78 1fyh s GLY 202 Ca -0.13 -0.81 0.01 0.00 0.00 0.00 0.00 44.72 43.79 1fyh s GLY 202 CO -0.00 -0.75 -0.18 0.14 0.00 0.00 0.00 173.10 172.31 1fyh s VAL 203 N -1.98 1.86 0.46 1.40 1.01 0.85 -1.02 120.40 122.98 1fyh s VAL 203 Ca 0.39 -0.82 -0.21 0.00 0.00 0.00 0.00 61.98 61.35 1fyh s VAL 203 Cb -0.11 -1.69 -0.09 0.00 0.00 0.00 0.00 36.38 34.49 1fyh s VAL 203 CO 0.30 0.51 1.01 -0.76 0.00 0.00 0.00 175.10 176.16 1fyh s LEU 204 N 1.28 3.90 0.87 3.92 1.43 -0.19 0.26 118.68 130.15 1fyh s LEU 204 Ca 0.03 1.86 -0.12 0.00 -1.03 0.00 0.00 54.13 54.87 1fyh s LEU 204 Cb -0.13 -4.53 0.11 0.00 0.03 0.00 0.00 46.19 41.67 1fyh s LEU 204 CO -0.10 -0.62 1.11 -2.28 0.23 0.00 0.00 176.35 174.68 1fyh s HIS 205 N -2.02 2.57 0.00 0.29 5.65 -0.49 -1.98 115.29 119.30 1fyh s HIS 205 Ca 0.65 1.07 0.00 0.00 0.25 0.00 0.00 55.06 57.03 1fyh s HIS 205 Cb -0.14 -3.22 0.00 0.00 -1.18 0.00 0.00 32.58 28.04 1fyh s HIS 205 CO 0.18 -2.17 0.00 0.28 -0.65 0.00 0.00 174.74 172.38 1fyh n VAL 206 N -3.69 0.00 1.00 0.89 0.31 -1.26 -3.99 118.33 111.59 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 0.57 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 33.55 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 -2.37 3.52 8.01 -1.26 -4.99 117.44 120.35 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 -0.11 0.00 0.00 -2.01 0.00 0.00 31.31 29.19 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 1.50 -0.10 3.77 6.99 0.00 -0.84 -5.00 105.19 111.51 1fyh n GLY 208 Ca 0.05 -0.34 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.69 3.97 0.11 1.61 1.01 -1.26 -4.71 120.40 118.44 1fyh s VAL 209 Ca 0.05 1.76 -0.03 0.00 0.00 0.00 0.00 61.98 63.76 1fyh s VAL 209 Cb -0.02 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 1fyh s VAL 209 CO 0.06 0.25 0.32 0.42 0.00 0.00 0.00 175.10 176.15 1fyh s THR 210 N -1.43 5.25 0.96 3.92 -4.23 -1.26 -1.02 115.64 117.82 1fyh s THR 210 Ca 0.48 -0.12 -0.15 0.00 -1.18 0.00 0.00 61.69 60.72 1fyh s THR 210 Cb -0.23 -3.63 0.21 0.00 1.34 0.00 0.00 72.50 70.19 1fyh s THR 210 CO 0.29 0.08 1.32 0.42 -0.54 0.00 0.00 174.62 176.19 1fyh s THR 211 N -1.60 2.00 0.61 3.99 -4.23 -0.19 -4.68 115.64 111.55 1fyh s THR 211 Ca 0.39 -0.04 -0.16 0.00 -1.18 0.00 0.00 61.69 60.70 1fyh s THR 211 Cb -0.12 -2.97 -0.03 0.00 1.34 0.00 0.00 72.50 70.72 1fyh s THR 211 CO 0.26 0.00 1.08 -1.61 -0.54 0.00 0.00 174.62 173.81 1fyh s GLU 212 N -5.88 3.14 -0.02 3.99 2.02 -0.15 -4.64 118.70 117.15 1fyh s GLU 212 Ca 0.75 1.30 -0.25 0.00 0.02 0.00 0.00 54.97 56.79 1fyh s GLU 212 Cb -0.03 -2.00 -0.04 0.00 0.10 0.00 0.00 34.13 32.16 1fyh s GLU 212 CO 0.53 -0.97 0.78 0.21 0.02 0.00 0.00 175.26 175.83 1fyh s LYS 213 N -4.02 4.48 0.83 1.61 2.20 -1.26 -3.91 119.74 119.67 1fyh s LYS 213 Ca 0.65 1.05 -0.11 0.00 -0.36 0.00 0.00 55.97 57.20 1fyh s LYS 213 Cb -0.18 -3.43 0.09 0.00 -1.51 0.00 0.00 37.83 32.80 1fyh s LYS 213 CO 0.38 0.09 1.12 -1.54 -0.36 0.00 0.00 175.35 175.04 1fyh s SER 214 N 0.63 3.81 0.16 1.43 1.04 -0.62 -4.85 113.70 115.29 1fyh s SER 214 Ca 0.41 2.01 -0.30 0.00 0.48 0.00 0.00 55.95 58.55 1fyh s SER 214 Cb -0.19 -2.55 -0.07 0.00 0.10 0.00 0.00 66.02 63.31 1fyh s SER 214 CO 0.22 -2.50 1.01 -0.54 0.98 0.00 0.00 173.24 172.40 1fyh s LYS 215 N -4.73 4.68 0.25 4.02 1.02 -1.26 -4.54 119.74 119.19 1fyh s LYS 215 Ca 0.64 1.56 -0.30 0.00 0.02 0.00 0.00 55.97 57.90 1fyh s LYS 215 Cb -0.20 -3.32 -0.14 0.00 -0.52 0.00 0.00 37.83 33.64 1fyh s LYS 215 CO 0.56 0.20 1.11 -1.91 -0.92 0.00 0.00 175.35 174.39 1fyh n GLU 216 N 2.44 1.41 -5.16 1.68 2.13 -1.26 -4.85 120.64 117.04 1fyh n GLU 216 Ca 0.02 0.50 -0.31 0.00 0.66 0.00 0.00 57.16 58.02 1fyh n GLU 216 Cb 0.48 -1.95 -0.15 0.00 0.27 0.00 0.00 31.44 30.09 1fyh n GLU 216 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1fyh s VAL 217 N -0.69 2.32 0.16 6.31 -7.23 -0.39 -4.91 120.40 115.97 1fyh s VAL 217 Ca 0.64 -1.05 0.06 0.00 -1.81 0.00 0.00 61.98 59.82 1fyh s VAL 217 Cb -0.73 -1.84 -0.04 0.00 0.56 0.00 0.00 36.38 34.32 1fyh s VAL 217 CO 0.57 0.56 -0.12 0.00 -0.31 0.00 0.00 175.10 175.79 1fyh s ILE 219 N -3.05 0.10 -0.11 0.00 2.07 -0.49 -5.00 121.20 114.73 1fyh s ILE 219 Ca 0.17 -0.23 0.02 0.00 -1.41 0.00 0.00 60.65 59.21 1fyh s ILE 219 Cb 0.00 -0.13 -0.01 0.00 0.13 0.00 0.00 42.46 42.46 1fyh s ILE 219 CO 0.03 -0.08 -0.19 0.42 -1.91 0.00 0.00 174.94 173.21 1fyh s THR 220 N -0.32 2.53 0.00 4.00 -4.23 -1.26 -0.68 115.64 115.69 1fyh s THR 220 Ca -0.03 -0.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 1fyh s THR 220 Cb -0.02 -2.02 0.00 0.00 1.34 0.00 0.00 72.50 71.80 1fyh s THR 220 CO -0.00 0.54 0.00 -0.38 -0.54 0.00 0.00 174.62 174.24 1fyh n ILE 221 N 3.50 0.00 -0.90 2.99 5.41 0.15 -5.00 119.36 125.52 1fyh n ILE 221 Ca -0.19 0.31 0.00 0.00 1.00 0.00 0.00 62.75 63.88 1fyh n ILE 221 Cb 0.53 -1.23 0.00 0.00 -0.71 0.00 0.00 39.64 38.23 1fyh n ILE 221 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04