#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fy8 n LYS 15 N 0.00 0.73 -0.76 -1.24 2.85 -1.26 -4.90 118.16 113.58 1fy8 n LYS 15 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1fy8 n LYS 15 Cb 0.00 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 32.88 1fy8 n LYS 15 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1fy8 n GLY 18 N 0.50 0.79 0.42 2.58 0.00 -1.26 -1.55 105.19 106.68 1fy8 n GLY 18 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 1fy8 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fy8 n GLY 19 N -2.25 -0.43 3.18 -0.02 0.00 -1.26 -4.91 105.19 99.50 1fy8 n GLY 19 Ca 0.00 -1.79 -0.14 0.00 0.00 0.00 0.00 46.02 44.09 1fy8 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fy8 s TYR 20 N -0.85 1.07 0.07 1.61 1.13 0.23 -4.90 117.35 115.71 1fy8 s TYR 20 Ca 0.08 -0.65 -0.31 0.00 -1.41 0.00 0.00 57.07 54.78 1fy8 s TYR 20 Cb -0.00 -0.58 -0.08 0.00 -1.10 0.00 0.00 41.96 40.20 1fy8 s TYR 20 CO 0.05 0.00 1.51 0.99 -2.51 0.00 0.00 175.55 175.59 1fy8 s THR 21 N -2.44 3.25 0.65 -3.49 2.01 -1.26 0.69 115.64 115.05 1fy8 s THR 21 Ca 0.06 0.77 -0.17 0.00 0.31 0.00 0.00 61.69 62.66 1fy8 s THR 21 Cb -0.03 -3.49 -0.00 0.00 0.01 0.00 0.00 72.50 68.98 1fy8 s THR 21 CO 0.00 0.02 1.19 0.00 -0.69 0.00 0.00 174.62 175.14 1fy8 s GLN 23 N -3.68 4.34 -0.05 0.00 0.74 -1.26 -4.85 119.66 114.89 1fy8 s GLN 23 Ca 0.74 2.19 -0.39 0.00 0.05 0.00 0.00 55.36 57.95 1fy8 s GLN 23 Cb -0.28 -3.13 -0.17 0.00 1.10 0.00 0.00 33.01 30.53 1fy8 s GLN 23 CO 0.39 -0.30 1.40 -1.91 -0.55 0.00 0.00 175.29 174.32 1fy8 n GLU 24 N 2.07 0.87 -1.98 1.67 2.13 -1.26 -1.20 120.64 122.94 1fy8 n GLU 24 Ca 0.05 0.31 -0.18 0.00 0.66 0.00 0.00 57.16 58.01 1fy8 n GLU 24 Cb 0.42 -1.93 -0.04 0.00 0.27 0.00 0.00 31.44 30.15 1fy8 n GLU 24 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1fy8 n ASN 25 N 3.09 -4.92 -0.05 4.31 4.13 -1.26 -4.86 115.26 115.70 1fy8 n ASN 25 Ca 0.21 0.24 0.14 0.00 1.68 0.00 0.00 54.58 56.86 1fy8 n ASN 25 Cb 0.14 -4.26 0.55 0.00 -1.54 0.00 0.00 39.78 34.67 1fy8 n ASN 25 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1fy8 n SER 26 N -1.49 0.32 -3.40 6.41 3.41 -0.34 -3.96 113.62 114.57 1fy8 n SER 26 Ca -0.19 -0.19 -0.26 0.00 -0.26 0.00 0.00 58.87 57.96 1fy8 n SER 26 Cb 0.62 -0.14 -0.08 0.00 -0.26 0.00 0.00 64.21 64.35 1fy8 n SER 26 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1fy8 n VAL 27 N -1.23 1.16 0.26 -3.33 0.31 -1.26 -4.97 118.33 109.27 1fy8 n VAL 27 Ca 0.11 -4.72 0.14 0.00 -0.01 0.00 0.00 64.34 59.86 1fy8 n VAL 27 Cb 0.30 -2.04 0.70 0.00 -0.91 0.00 0.00 33.84 31.89 1fy8 n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1fy8 h PRO 28 N 4.35 0.00 -0.00 5.55 0.13 -1.79 -2.52 132.00 137.71 1fy8 h PRO 28 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1fy8 h PRO 28 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1fy8 h PRO 28 CO 0.68 0.00 -0.36 2.48 -0.23 0.00 0.00 178.00 180.58 1fy8 n TYR 29 N -2.49 0.00 -2.44 1.56 0.18 -1.19 -2.10 117.16 110.68 1fy8 n TYR 29 Ca -0.01 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.36 1fy8 n TYR 29 Cb 0.11 -0.17 -0.04 0.00 -0.38 0.00 0.00 39.34 38.87 1fy8 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1fy8 s GLN 30 N -2.69 4.51 0.23 -3.48 2.00 -0.95 -1.10 119.66 118.19 1fy8 s GLN 30 Ca 0.19 1.79 0.07 0.00 -2.00 0.00 0.00 55.36 55.41 1fy8 s GLN 30 Cb 0.19 -3.28 -0.05 0.00 0.80 0.00 0.00 33.01 30.66 1fy8 s GLN 30 CO 0.59 -0.07 -0.10 0.14 -0.50 0.00 0.00 175.29 175.35 1fy8 s VAL 31 N 0.16 1.64 -0.12 1.34 -7.23 -0.53 -4.46 120.40 111.20 1fy8 s VAL 31 Ca 0.53 -2.16 0.01 0.00 -1.81 0.00 0.00 61.98 58.55 1fy8 s VAL 31 Cb -0.31 -2.21 -0.01 0.00 0.56 0.00 0.00 36.38 34.41 1fy8 s VAL 31 CO 0.34 -0.47 -0.16 -0.55 -0.31 0.00 0.00 175.10 173.95 1fy8 s SER 32 N -3.36 3.81 -0.20 4.85 0.15 -0.75 -2.37 113.70 115.82 1fy8 s SER 32 Ca 0.25 -0.37 -0.15 0.00 0.70 0.00 0.00 55.95 56.39 1fy8 s SER 32 Cb 0.01 -1.49 -0.04 0.00 -1.71 0.00 0.00 66.02 62.79 1fy8 s SER 32 CO 0.09 0.18 0.33 -0.76 1.20 0.00 0.00 173.24 174.28 1fy8 s LEU 33 N 0.25 4.17 -0.05 3.45 1.43 0.70 -1.05 118.68 127.57 1fy8 s LEU 33 Ca -0.11 0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.46 1fy8 s LEU 33 Cb -0.16 -2.41 0.01 0.00 0.03 0.00 0.00 46.19 43.66 1fy8 s LEU 33 CO 0.06 -0.02 -0.09 0.21 0.23 0.00 0.00 176.35 176.74 1fy8 s ASN 34 N 0.93 1.41 -0.09 2.29 3.84 0.02 -1.94 114.94 121.39 1fy8 s ASN 34 Ca 0.16 -0.22 0.14 0.00 0.21 0.00 0.00 52.86 53.15 1fy8 s ASN 34 Cb -0.14 -0.58 0.29 0.00 -0.55 0.00 0.00 41.25 40.26 1fy8 s ASN 34 CO 0.06 0.02 1.14 -0.24 -2.79 0.00 0.00 177.10 175.29 1fy8 n SER 37 N 3.71 1.30 0.00 -4.21 2.88 -1.26 -0.87 113.62 115.17 1fy8 n SER 37 Ca -0.22 -2.78 0.00 0.00 -1.33 0.00 0.00 58.87 54.53 1fy8 n SER 37 Cb 0.52 -0.37 0.00 0.00 -0.75 0.00 0.00 64.21 63.61 1fy8 n SER 37 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1fy8 n GLY 38 N -0.55 1.31 3.50 0.46 0.00 -1.26 -5.06 105.19 103.59 1fy8 n GLY 38 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 1fy8 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fy8 s TYR 39 N -0.10 -0.29 0.03 1.61 -0.85 -1.26 -5.13 117.35 111.36 1fy8 s TYR 39 Ca 0.00 -0.01 -0.30 0.00 -0.52 0.00 0.00 57.07 56.23 1fy8 s TYR 39 Cb 0.00 0.48 -0.06 0.00 0.38 0.00 0.00 41.96 42.76 1fy8 s TYR 39 CO 0.00 -0.91 1.39 -1.58 -1.52 0.00 0.00 175.55 172.94 1fy8 s HIS 40 N -3.83 2.96 0.00 -3.49 5.65 -1.26 -4.33 115.29 110.99 1fy8 s HIS 40 Ca 0.06 0.86 0.00 0.00 0.25 0.00 0.00 55.06 56.23 1fy8 s HIS 40 Cb -0.01 -3.66 0.00 0.00 -1.18 0.00 0.00 32.58 27.72 1fy8 s HIS 40 CO -0.06 -2.41 0.00 1.97 -0.65 0.00 0.00 174.74 173.59 1fy8 n PHE 41 N 4.98 0.00 -3.55 3.88 -1.74 -0.82 -5.02 117.46 115.19 1fy8 n PHE 41 Ca 0.13 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.91 1fy8 n PHE 41 Cb 0.43 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.41 1fy8 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1fy8 n GLY 43 N -0.39 2.65 3.83 0.00 0.00 0.14 -0.22 105.19 111.20 1fy8 n GLY 43 Ca -0.13 -2.23 0.01 0.00 0.00 0.00 0.00 46.02 43.67 1fy8 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fy8 s GLY 44 N -3.24 -0.18 -0.03 -0.02 0.00 -1.00 -3.80 107.32 99.05 1fy8 s GLY 44 Ca 0.23 0.19 0.03 0.00 0.00 0.00 0.00 44.72 45.16 1fy8 s GLY 44 CO 0.15 2.86 -0.11 -0.56 0.00 0.00 0.00 173.10 175.44 1fy8 s SER 45 N -3.41 1.37 -0.30 1.64 0.01 -0.14 -1.45 113.70 111.42 1fy8 s SER 45 Ca 0.22 -0.21 -0.25 0.00 1.31 0.00 0.00 55.95 57.01 1fy8 s SER 45 Cb 0.01 -0.33 0.01 0.00 0.21 0.00 0.00 66.02 65.91 1fy8 s SER 45 CO -0.00 0.09 0.88 -0.22 0.41 0.00 0.00 173.24 174.40 1fy8 s LEU 46 N 0.09 4.05 -0.01 2.44 2.96 -0.26 -0.42 118.68 127.52 1fy8 s LEU 46 Ca -0.02 0.81 0.18 0.00 -0.22 0.00 0.00 54.13 54.89 1fy8 s LEU 46 Cb -0.08 -3.23 -0.23 0.00 0.50 0.00 0.00 46.19 43.15 1fy8 s LEU 46 CO 0.01 -0.69 0.62 2.30 -1.32 0.00 0.00 176.35 177.27 1fy8 n ILE 47 N 5.61 0.00 -3.82 6.68 -5.35 -0.70 -1.40 119.36 120.38 1fy8 n ILE 47 Ca 0.06 -0.22 -0.06 0.00 -0.27 0.00 0.00 62.75 62.27 1fy8 n ILE 47 Cb 0.48 0.62 -0.01 0.00 -1.74 0.00 0.00 39.64 38.99 1fy8 n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1fy8 s ASN 48 N -3.30 -0.17 0.00 7.28 2.20 -1.22 -4.61 114.94 115.12 1fy8 s ASN 48 Ca 0.01 -0.62 0.05 0.00 -0.94 0.00 0.00 52.86 51.37 1fy8 s ASN 48 Cb 0.13 0.64 0.25 0.00 -2.00 0.00 0.00 41.25 40.27 1fy8 s ASN 48 CO 0.76 -1.21 0.99 -0.90 -2.94 0.00 0.00 177.10 173.80 1fy8 n ASP 49 N -0.66 0.00 0.00 3.54 5.75 -1.26 -2.92 116.55 121.00 1fy8 n ASP 49 Ca -0.05 0.21 0.00 0.00 -0.01 0.00 0.00 54.79 54.94 1fy8 n ASP 49 Cb 0.60 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1fy8 n ASP 49 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 1fy8 n GLN 50 N -1.28 0.38 -4.19 0.11 7.27 -1.26 -1.39 117.38 117.01 1fy8 n GLN 50 Ca 0.02 -0.52 -0.16 0.00 0.07 0.00 0.00 57.00 56.41 1fy8 n GLN 50 Cb 0.04 -0.67 -0.14 0.00 2.41 0.00 0.00 30.24 31.88 1fy8 n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1fy8 s TRP 51 N -0.18 0.63 0.03 3.69 0.52 -1.15 -0.35 118.94 122.14 1fy8 s TRP 51 Ca 0.00 -0.21 0.07 0.00 0.02 0.00 0.00 56.10 55.98 1fy8 s TRP 51 Cb 0.00 -0.40 -0.02 0.00 -1.15 0.00 0.00 33.47 31.90 1fy8 s TRP 51 CO 0.00 -0.02 -0.19 0.08 0.02 0.00 0.00 176.95 176.84 1fy8 s VAL 52 N -0.46 1.51 -0.04 4.03 1.01 0.13 -1.72 120.40 124.86 1fy8 s VAL 52 Ca -0.00 -1.09 0.03 0.00 0.00 0.00 0.00 61.98 60.92 1fy8 s VAL 52 Cb -0.04 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1fy8 s VAL 52 CO 0.00 0.19 -0.12 0.54 0.00 0.00 0.00 175.10 175.71 1fy8 s VAL 53 N -0.75 3.22 0.00 2.92 0.11 0.44 -0.65 120.40 125.69 1fy8 s VAL 53 Ca 0.06 -0.70 0.00 0.00 -2.93 0.00 0.00 61.98 58.41 1fy8 s VAL 53 Cb -0.08 -2.29 0.00 0.00 -1.53 0.00 0.00 36.38 32.48 1fy8 s VAL 53 CO 0.01 0.56 0.00 -0.24 -3.33 0.00 0.00 175.10 172.11 1fy8 n SER 54 N 2.19 0.00 -4.87 3.54 2.88 -0.10 -0.96 113.62 116.29 1fy8 n SER 54 Ca -0.17 -0.75 -0.34 0.00 -1.33 0.00 0.00 58.87 56.28 1fy8 n SER 54 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1fy8 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fy8 s ALA 55 N -1.47 3.72 0.40 -1.46 0.00 -1.26 -0.88 121.76 120.81 1fy8 s ALA 55 Ca 0.00 -0.40 0.15 0.00 0.00 0.00 0.00 51.96 51.71 1fy8 s ALA 55 Cb 0.00 -2.26 0.91 0.00 0.00 0.00 0.00 23.12 21.76 1fy8 s ALA 55 CO 0.00 0.58 1.92 0.00 0.00 0.00 0.00 175.76 178.26 1fy8 h ALA 56 N 3.39 1.50 0.00 0.00 0.00 -1.71 -2.23 119.26 120.21 1fy8 h ALA 56 Ca -0.48 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1fy8 h ALA 56 Cb 1.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1fy8 h ALA 56 CO 0.68 0.34 0.00 -2.39 0.00 0.00 0.00 179.25 177.88 1fy8 n HIS 57 N -4.14 0.00 0.80 0.00 1.44 -1.26 -1.99 115.22 110.07 1fy8 n HIS 57 Ca -0.02 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.79 1fy8 n HIS 57 Cb 0.33 -0.10 0.28 0.00 0.12 0.00 0.00 29.99 30.61 1fy8 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1fy8 n TYR 59 N 0.76 2.90 -3.70 0.00 9.36 -0.84 -5.02 117.16 120.62 1fy8 n TYR 59 Ca 0.17 0.36 -0.14 0.00 3.32 0.00 0.00 57.90 61.60 1fy8 n TYR 59 Cb 0.41 -2.56 -0.08 0.00 -0.63 0.00 0.00 39.34 36.48 1fy8 n TYR 59 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1fy8 s LYS 60 N -1.32 0.73 0.35 2.98 1.02 -1.26 -5.06 119.74 117.18 1fy8 s LYS 60 Ca 0.59 0.04 0.07 0.00 0.02 0.00 0.00 55.97 56.68 1fy8 s LYS 60 Cb -0.49 0.33 0.67 0.00 -0.52 0.00 0.00 37.83 37.82 1fy8 s LYS 60 CO 0.56 -0.20 1.86 0.66 -0.92 0.00 0.00 175.35 177.32 1fy8 h SER 61 N 3.92 0.31 -3.18 2.83 4.64 -2.03 -3.41 113.55 116.63 1fy8 h SER 61 Ca -0.29 -0.07 -0.58 0.00 -0.47 0.00 0.00 61.79 60.38 1fy8 h SER 61 Cb 1.17 -0.08 -0.35 0.00 -0.31 0.00 0.00 62.40 62.82 1fy8 h SER 61 CO 0.37 0.49 -0.83 -0.13 -0.87 0.00 0.00 176.83 175.86 1fy8 s ARG 62 N -4.70 2.16 -0.03 4.77 0.52 -1.26 -5.06 118.95 115.36 1fy8 s ARG 62 Ca -0.06 -0.52 0.01 0.00 -0.52 0.00 0.00 55.73 54.64 1fy8 s ARG 62 Cb 0.15 -1.95 0.02 0.00 0.52 0.00 0.00 34.95 33.69 1fy8 s ARG 62 CO 0.75 -0.17 -0.03 0.42 0.02 0.00 0.00 175.30 176.29 1fy8 s ILE 63 N 1.32 0.37 -0.14 1.52 1.01 -1.26 -4.72 121.20 119.30 1fy8 s ILE 63 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.54 1fy8 s ILE 63 Cb -0.14 -0.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.92 1fy8 s ILE 63 CO -0.07 0.16 -0.04 -1.58 0.00 0.00 0.00 174.94 173.41 1fy8 s GLN 64 N 0.62 3.55 -0.18 2.79 0.74 -0.05 -1.10 119.66 126.03 1fy8 s GLN 64 Ca -0.07 -0.52 -0.11 0.00 0.05 0.00 0.00 55.36 54.71 1fy8 s GLN 64 Cb -0.10 -2.87 -0.05 0.00 1.10 0.00 0.00 33.01 31.08 1fy8 s GLN 64 CO -0.01 0.30 0.19 0.08 -0.55 0.00 0.00 175.29 175.30 1fy8 s VAL 66 N 0.19 5.38 -0.24 1.34 1.01 0.13 -0.80 120.40 127.41 1fy8 s VAL 66 Ca -0.02 0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 1fy8 s VAL 66 Cb -0.14 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.74 1fy8 s VAL 66 CO 0.03 0.44 -0.08 -0.13 0.00 0.00 0.00 175.10 175.36 1fy8 s ARG 67 N 0.29 2.92 0.24 2.72 0.52 -0.21 -1.04 118.95 124.38 1fy8 s ARG 67 Ca 0.11 -0.92 0.07 0.00 -0.52 0.00 0.00 55.73 54.48 1fy8 s ARG 67 Cb -0.12 -2.93 -0.04 0.00 0.52 0.00 0.00 34.95 32.38 1fy8 s ARG 67 CO 0.00 -0.35 0.12 -0.51 0.02 0.00 0.00 175.30 174.59 1fy8 s LEU 68 N 1.34 3.62 -0.93 2.53 1.02 0.54 -1.82 118.68 124.98 1fy8 s LEU 68 Ca 0.01 -0.34 0.00 0.00 0.02 0.00 0.00 54.13 53.82 1fy8 s LEU 68 Cb -0.16 -2.17 0.00 0.00 0.02 0.00 0.00 46.19 43.88 1fy8 s LEU 68 CO -0.05 -0.00 0.00 0.61 0.02 0.00 0.00 176.35 176.92 1fy8 n GLY 69 N -0.92 0.78 3.87 -3.19 0.00 -1.26 -0.84 105.19 103.63 1fy8 n GLY 69 Ca -0.08 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 45.05 1fy8 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fy8 s GLU 70 N -3.27 3.86 0.14 1.61 0.41 -1.26 -4.07 118.70 116.12 1fy8 s GLU 70 Ca 0.00 0.45 0.00 0.00 -0.41 0.00 0.00 54.97 55.01 1fy8 s GLU 70 Cb 0.00 -2.51 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 1fy8 s GLU 70 CO 0.00 0.17 0.00 1.58 -0.49 0.00 0.00 175.26 176.52 1fy8 n HIS 71 N -0.54 -1.06 -3.44 1.61 -0.00 -1.26 -4.72 115.22 105.82 1fy8 n HIS 71 Ca 0.02 0.19 -0.43 0.00 -0.00 0.00 0.00 57.72 57.49 1fy8 n HIS 71 Cb 0.53 0.36 -0.09 0.00 -0.00 0.00 0.00 29.99 30.79 1fy8 n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1fy8 s ASN 72 N -4.97 6.10 0.00 0.26 3.84 -1.25 -2.15 114.94 116.78 1fy8 s ASN 72 Ca 0.00 -1.09 0.19 0.00 0.21 0.00 0.00 52.86 52.17 1fy8 s ASN 72 Cb 0.00 -2.16 1.01 0.00 -0.55 0.00 0.00 41.25 39.55 1fy8 s ASN 72 CO 0.00 -0.53 1.58 2.30 -2.79 0.00 0.00 177.10 177.66 1fy8 n ILE 73 N 5.17 0.32 0.85 -5.21 -5.35 0.02 -2.89 119.36 112.27 1fy8 n ILE 73 Ca -0.12 0.08 0.10 0.00 -0.27 0.00 0.00 62.75 62.54 1fy8 n ILE 73 Cb 0.45 -0.77 0.04 0.00 -1.74 0.00 0.00 39.64 37.63 1fy8 n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1fy8 n ASN 74 N -1.21 2.24 -4.03 7.28 3.02 -1.26 -4.95 115.26 116.34 1fy8 n ASN 74 Ca 0.10 -1.62 -0.21 0.00 -0.03 0.00 0.00 54.58 52.83 1fy8 n ASN 74 Cb 0.13 0.25 -0.15 0.00 -0.61 0.00 0.00 39.78 39.40 1fy8 n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1fy8 s VAL 75 N -1.95 0.87 -0.54 2.41 1.01 -1.14 -5.09 120.40 115.97 1fy8 s VAL 75 Ca 0.20 -0.43 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 1fy8 s VAL 75 Cb 0.16 -0.76 0.02 0.00 0.00 0.00 0.00 36.38 35.81 1fy8 s VAL 75 CO 0.38 0.26 1.28 -0.22 0.00 0.00 0.00 175.10 176.79 1fy8 s LEU 76 N 0.00 3.48 0.15 3.92 2.96 -1.26 -4.79 118.68 123.14 1fy8 s LEU 76 Ca -0.00 0.30 0.20 0.00 -0.22 0.00 0.00 54.13 54.41 1fy8 s LEU 76 Cb -0.07 -3.24 -0.05 0.00 0.50 0.00 0.00 46.19 43.33 1fy8 s LEU 76 CO 0.00 -1.51 0.97 -0.33 -1.32 0.00 0.00 176.35 174.16 1fy8 h GLU 77 N 10.08 0.00 0.00 1.98 5.08 -1.97 -3.49 114.58 126.26 1fy8 h GLU 77 Ca -0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1fy8 h GLU 77 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1fy8 h GLU 77 CO 1.16 0.11 0.00 0.41 -1.00 0.00 0.00 179.01 179.69 1fy8 n GLY 78 N 1.26 1.77 0.99 -3.84 0.00 -1.26 -4.93 105.19 99.18 1fy8 n GLY 78 Ca -0.04 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1fy8 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fy8 n ASN 79 N 0.00 3.35 -4.81 1.61 4.13 -1.26 -5.02 115.26 113.26 1fy8 n ASN 79 Ca 0.00 -1.96 -0.33 0.00 1.68 0.00 0.00 54.58 53.96 1fy8 n ASN 79 Cb 0.00 -0.32 -0.05 0.00 -1.54 0.00 0.00 39.78 37.87 1fy8 n ASN 79 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1fy8 s GLU 80 N -1.08 3.98 -0.07 3.52 8.01 -1.26 -4.48 118.70 127.32 1fy8 s GLU 80 Ca 0.35 1.23 0.02 0.00 0.01 0.00 0.00 54.97 56.58 1fy8 s GLU 80 Cb 0.19 -2.13 0.02 0.00 -4.31 0.00 0.00 34.13 27.90 1fy8 s GLU 80 CO 0.25 -0.26 -0.10 -0.65 0.01 0.00 0.00 175.26 174.51 1fy8 s GLN 81 N -3.28 1.53 -0.22 1.61 -0.21 -0.02 -4.97 119.66 114.10 1fy8 s GLN 81 Ca 0.64 -0.33 -0.05 0.00 0.02 0.00 0.00 55.36 55.64 1fy8 s GLN 81 Cb -0.13 -1.35 -0.02 0.00 1.00 0.00 0.00 33.01 32.51 1fy8 s GLN 81 CO 0.18 -0.05 -0.01 -0.06 -2.12 0.00 0.00 175.29 173.23 1fy8 s PHE 82 N 0.92 3.00 -0.01 0.91 0.40 -1.26 -0.34 117.98 121.60 1fy8 s PHE 82 Ca -0.10 -0.68 0.00 0.00 -0.60 0.00 0.00 56.93 55.55 1fy8 s PHE 82 Cb -0.15 -2.12 0.02 0.00 0.51 0.00 0.00 43.02 41.28 1fy8 s PHE 82 CO 0.01 -0.41 0.02 0.08 0.70 0.00 0.00 175.22 175.61 1fy8 s VAL 83 N 1.35 -0.01 0.42 -0.44 1.01 -0.21 -4.98 120.40 117.54 1fy8 s VAL 83 Ca 0.04 0.13 -0.22 0.00 0.00 0.00 0.00 61.98 61.94 1fy8 s VAL 83 Cb -0.15 -0.08 -0.11 0.00 0.00 0.00 0.00 36.38 36.05 1fy8 s VAL 83 CO -0.00 0.07 0.96 0.20 0.00 0.00 0.00 175.10 176.33 1fy8 s ASN 84 N 0.72 6.93 0.10 3.32 0.01 -1.26 0.22 114.94 124.98 1fy8 s ASN 84 Ca -0.06 1.74 -0.30 0.00 -0.71 0.00 0.00 52.86 53.53 1fy8 s ASN 84 Cb -0.09 -2.55 -0.06 0.00 0.41 0.00 0.00 41.25 38.96 1fy8 s ASN 84 CO -0.02 -0.36 1.12 0.00 -1.51 0.00 0.00 177.10 176.32 1fy8 s ALA 85 N -2.08 3.34 -0.21 0.60 0.00 -0.26 -0.49 121.76 122.66 1fy8 s ALA 85 Ca 0.61 0.77 0.03 0.00 0.00 0.00 0.00 51.96 53.37 1fy8 s ALA 85 Cb -0.11 -3.39 -0.21 0.00 0.00 0.00 0.00 23.12 19.42 1fy8 s ALA 85 CO 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 175.76 175.61 1fy8 n ALA 86 N 3.31 1.33 -3.41 0.00 0.00 0.12 -4.75 120.51 117.10 1fy8 n ALA 86 Ca 0.06 -1.01 -0.14 0.00 0.00 0.00 0.00 53.44 52.35 1fy8 n ALA 86 Cb 0.47 -0.28 -0.15 0.00 0.00 0.00 0.00 19.45 19.49 1fy8 n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1fy8 s LYS 87 N -2.53 0.06 -0.19 0.00 1.02 -1.07 -4.99 119.74 112.04 1fy8 s LYS 87 Ca -0.27 0.08 0.01 0.00 0.02 0.00 0.00 55.97 55.82 1fy8 s LYS 87 Cb 0.08 -0.22 0.03 0.00 -0.52 0.00 0.00 37.83 37.20 1fy8 s LYS 87 CO 0.68 -0.09 -0.16 0.42 -0.92 0.00 0.00 175.35 175.28 1fy8 s ILE 88 N 0.65 1.94 -0.26 2.17 1.01 -1.26 -0.66 121.20 124.79 1fy8 s ILE 88 Ca -0.06 -1.04 0.02 0.00 0.00 0.00 0.00 60.65 59.57 1fy8 s ILE 88 Cb -0.08 -1.86 0.07 0.00 0.01 0.00 0.00 42.46 40.60 1fy8 s ILE 88 CO -0.02 0.36 -0.04 -0.63 0.00 0.00 0.00 174.94 174.61 1fy8 s ILE 89 N 1.30 1.80 0.43 2.92 1.01 0.67 -4.99 121.20 124.34 1fy8 s ILE 89 Ca 0.01 -1.54 -0.13 0.00 0.00 0.00 0.00 60.65 59.00 1fy8 s ILE 89 Cb -0.15 -2.08 -0.07 0.00 0.01 0.00 0.00 42.46 40.17 1fy8 s ILE 89 CO -0.10 -0.20 0.83 -0.54 0.00 0.00 0.00 174.94 174.93 1fy8 s LYS 90 N 1.24 3.85 0.27 2.79 1.02 -1.26 -0.38 119.74 127.27 1fy8 s LYS 90 Ca -0.03 0.63 -0.31 0.00 0.02 0.00 0.00 55.97 56.28 1fy8 s LYS 90 Cb -0.19 -2.32 -0.12 0.00 -0.52 0.00 0.00 37.83 34.67 1fy8 s LYS 90 CO -0.07 -0.08 1.54 1.58 -0.92 0.00 0.00 175.35 177.39 1fy8 n HIS 91 N -1.28 2.60 0.32 3.18 -0.00 -0.43 -4.83 115.22 114.76 1fy8 n HIS 91 Ca 0.04 0.31 0.21 0.00 -0.00 0.00 0.00 57.72 58.27 1fy8 n HIS 91 Cb 0.54 -2.55 1.12 0.00 -0.00 0.00 0.00 29.99 29.09 1fy8 n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1fy8 h PRO 92 N 4.69 0.00 -0.31 1.57 0.13 -1.93 -2.35 132.00 133.80 1fy8 h PRO 92 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1fy8 h PRO 92 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1fy8 h PRO 92 CO 0.79 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.65 1fy8 n ASN 93 N -2.96 4.11 -4.75 1.44 5.03 -1.26 -5.02 115.26 111.86 1fy8 n ASN 93 Ca -0.03 -2.97 -0.41 0.00 0.87 0.00 0.00 54.58 52.04 1fy8 n ASN 93 Cb 0.09 -0.55 -0.02 0.00 -1.02 0.00 0.00 39.78 38.28 1fy8 n ASN 93 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1fy8 s PHE 94 N -2.75 2.84 -0.23 3.10 5.36 -0.89 -4.67 117.98 120.73 1fy8 s PHE 94 Ca 0.43 0.85 -0.00 0.00 -0.96 0.00 0.00 56.93 57.25 1fy8 s PHE 94 Cb 0.34 -3.99 0.03 0.00 -0.34 0.00 0.00 43.02 39.06 1fy8 s PHE 94 CO 0.10 -3.31 -0.10 0.34 -1.46 0.00 0.00 175.22 170.79 1fy8 s ASP 95 N 0.47 4.06 0.57 6.13 -1.08 -0.83 -4.99 116.67 121.00 1fy8 s ASP 95 Ca 0.62 -0.87 0.35 0.00 -0.52 0.00 0.00 52.55 52.13 1fy8 s ASP 95 Cb -0.46 -1.61 1.70 0.00 -1.46 0.00 0.00 42.92 41.09 1fy8 s ASP 95 CO 0.46 -0.10 2.13 0.03 0.52 0.00 0.00 175.17 178.20 1fy8 h ARG 96 N 7.97 0.00 0.00 4.34 3.08 -1.94 0.43 114.38 128.26 1fy8 h ARG 96 Ca -0.34 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.43 1fy8 h ARG 96 Cb 1.11 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.12 1fy8 h ARG 96 CO 0.57 0.04 -1.54 1.17 -1.07 0.00 0.00 179.97 179.15 1fy8 n LYS 97 N -3.27 0.57 0.11 0.04 4.81 -1.26 -4.50 118.16 114.67 1fy8 n LYS 97 Ca -0.01 0.51 0.07 0.00 -0.87 0.00 0.00 58.31 58.01 1fy8 n LYS 97 Cb 0.22 -1.70 0.01 0.00 0.02 0.00 0.00 35.03 33.58 1fy8 n LYS 97 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1fy8 h THR 98 N -0.97 0.26 -0.20 3.15 1.35 -1.99 -3.48 112.91 111.03 1fy8 h THR 98 Ca -0.42 -1.45 -0.09 0.00 -0.55 0.00 0.00 66.41 63.90 1fy8 h THR 98 Cb 1.39 1.86 -0.03 0.00 -1.73 0.00 0.00 68.15 69.64 1fy8 h THR 98 CO -0.25 0.15 -0.08 0.18 -0.25 0.00 0.00 175.52 175.27 1fy8 n LEU 99 N -2.89 -0.19 -4.77 3.87 4.77 0.15 -5.00 117.00 112.95 1fy8 n LEU 99 Ca -0.02 0.10 -0.41 0.00 -0.03 0.00 0.00 56.01 55.66 1fy8 n LEU 99 Cb 0.65 -1.22 -0.03 0.00 -2.33 0.00 0.00 43.42 40.49 1fy8 n LEU 99 CO 0.40 -0.34 0.92 0.21 -1.33 0.00 0.00 177.39 177.24 1fy8 s ASN 100 N -2.58 6.94 -1.16 -1.43 2.47 -1.24 -2.93 114.94 115.01 1fy8 s ASN 100 Ca 0.00 2.55 -0.07 0.00 0.42 0.00 0.00 52.86 55.75 1fy8 s ASN 100 Cb 0.00 -2.64 0.01 0.00 -1.45 0.00 0.00 41.25 37.17 1fy8 s ASN 100 CO 0.00 -0.41 1.01 0.59 -3.72 0.00 0.00 177.10 174.58 1fy8 n ASN 101 N 0.98 -5.65 -4.54 -4.21 4.13 -1.26 -1.97 115.26 102.74 1fy8 n ASN 101 Ca -0.00 -0.47 -0.40 0.00 1.68 0.00 0.00 54.58 55.39 1fy8 n ASN 101 Cb 0.43 -4.39 -0.01 0.00 -1.54 0.00 0.00 39.78 34.26 1fy8 n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1fy8 n ASP 102 N -2.39 4.49 -3.76 6.41 2.03 -1.15 -4.29 116.55 117.90 1fy8 n ASP 102 Ca -0.00 -2.87 -0.13 0.00 0.52 0.00 0.00 54.79 52.31 1fy8 n ASP 102 Cb 0.55 -1.74 -0.09 0.00 -0.72 0.00 0.00 41.12 39.12 1fy8 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1fy8 s ILE 103 N 5.59 0.04 -0.06 5.18 2.07 -1.26 -3.95 121.20 128.81 1fy8 s ILE 103 Ca 0.57 -0.31 -0.16 0.00 -1.41 0.00 0.00 60.65 59.33 1fy8 s ILE 103 Cb 0.04 -0.57 0.03 0.00 0.13 0.00 0.00 42.46 42.08 1fy8 s ILE 103 CO 0.09 -0.17 0.38 -0.32 -1.91 0.00 0.00 174.94 173.00 1fy8 s MET 104 N -0.82 0.65 -0.03 3.50 -2.45 -0.06 -1.32 119.30 118.77 1fy8 s MET 104 Ca -0.09 0.07 0.03 0.00 -1.25 0.00 0.00 55.69 54.45 1fy8 s MET 104 Cb -0.04 0.30 -0.03 0.00 1.25 0.00 0.00 34.83 36.31 1fy8 s MET 104 CO 0.03 -0.16 -0.09 -0.51 1.05 0.00 0.00 175.02 175.33 1fy8 s LEU 105 N -0.88 3.02 -0.11 4.11 1.43 0.49 -0.93 118.68 125.81 1fy8 s LEU 105 Ca -0.09 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 1fy8 s LEU 105 Cb -0.04 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.52 1fy8 s LEU 105 CO 0.04 0.33 -0.12 -0.63 0.23 0.00 0.00 176.35 176.19 1fy8 s ILE 106 N -0.86 1.34 -0.16 -0.59 1.01 0.18 -0.24 121.20 121.89 1fy8 s ILE 106 Ca 0.14 -0.52 -0.12 0.00 0.00 0.00 0.00 60.65 60.15 1fy8 s ILE 106 Cb -0.11 -1.26 -0.05 0.00 0.01 0.00 0.00 42.46 41.05 1fy8 s ILE 106 CO 0.03 0.41 0.24 -0.75 0.00 0.00 0.00 174.94 174.88 1fy8 s LYS 107 N 1.27 4.13 0.57 2.79 2.20 0.17 -0.69 119.74 130.18 1fy8 s LYS 107 Ca -0.02 0.00 -0.14 0.00 -0.36 0.00 0.00 55.97 55.46 1fy8 s LYS 107 Cb -0.14 -3.39 -0.05 0.00 -1.51 0.00 0.00 37.83 32.74 1fy8 s LYS 107 CO -0.05 0.34 1.01 -0.51 -0.36 0.00 0.00 175.35 175.78 1fy8 s LEU 108 N 0.19 3.43 0.37 5.43 1.43 0.52 0.12 118.68 130.17 1fy8 s LEU 108 Ca 0.14 1.54 0.04 0.00 -1.03 0.00 0.00 54.13 54.83 1fy8 s LEU 108 Cb -0.13 -4.50 0.71 0.00 0.03 0.00 0.00 46.19 42.30 1fy8 s LEU 108 CO 0.03 -0.81 2.00 0.28 0.23 0.00 0.00 176.35 178.08 1fy8 h SER 109 N 0.30 0.59 -5.09 2.29 0.02 -1.08 -3.41 113.55 107.17 1fy8 h SER 109 Ca -0.46 -0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 60.38 1fy8 h SER 109 Cb 1.19 -0.15 -0.15 0.00 0.14 0.00 0.00 62.40 63.43 1fy8 h SER 109 CO 0.61 0.47 -0.25 -0.94 -1.14 0.00 0.00 176.83 175.58 1fy8 s SER 110 N -6.61 -0.06 0.55 3.07 1.04 -1.26 -5.00 113.70 105.43 1fy8 s SER 110 Ca -0.09 -0.38 -0.21 0.00 0.48 0.00 0.00 55.95 55.75 1fy8 s SER 110 Cb 0.17 0.38 -0.05 0.00 0.10 0.00 0.00 66.02 66.62 1fy8 s SER 110 CO 0.75 -0.71 1.24 -2.84 0.98 0.00 0.00 173.24 172.67 1fy8 s PRO 111 N -3.29 3.21 0.49 4.02 0.02 -1.26 -4.87 135.00 133.32 1fy8 s PRO 111 Ca 0.00 1.94 -0.01 0.00 0.02 0.00 0.00 61.00 62.95 1fy8 s PRO 111 Cb 0.02 -2.14 0.00 0.00 0.02 0.00 0.00 34.50 32.40 1fy8 s PRO 111 CO -0.08 -1.04 0.73 0.14 -0.33 0.00 0.00 177.00 176.42 1fy8 s VAL 112 N -1.49 3.81 -0.32 3.83 -7.23 -0.48 -5.02 120.40 113.50 1fy8 s VAL 112 Ca 0.72 -0.39 -0.21 0.00 -1.81 0.00 0.00 61.98 60.30 1fy8 s VAL 112 Cb -0.33 -3.44 -0.01 0.00 0.56 0.00 0.00 36.38 33.17 1fy8 s VAL 112 CO 0.38 -0.34 0.64 -0.54 -0.31 0.00 0.00 175.10 174.93 1fy8 s LYS 113 N -4.67 3.85 0.07 4.82 1.02 -1.26 -4.94 119.74 118.63 1fy8 s LYS 113 Ca 0.50 0.26 -0.26 0.00 0.02 0.00 0.00 55.97 56.49 1fy8 s LYS 113 Cb -0.10 -3.75 -0.06 0.00 -0.52 0.00 0.00 37.83 33.41 1fy8 s LYS 113 CO 0.40 -0.62 0.82 -0.51 -0.92 0.00 0.00 175.35 174.52 1fy8 s LEU 114 N 2.66 4.47 0.00 3.17 1.43 -1.26 -4.79 118.68 124.36 1fy8 s LEU 114 Ca 0.25 1.55 0.00 0.00 -1.03 0.00 0.00 54.13 54.91 1fy8 s LEU 114 Cb -0.15 -3.33 0.00 0.00 0.03 0.00 0.00 46.19 42.74 1fy8 s LEU 114 CO 0.13 0.01 0.00 -0.46 0.23 0.00 0.00 176.35 176.25 1fy8 n ASN 115 N 2.70 0.00 0.19 2.29 0.23 0.05 -4.98 115.26 115.74 1fy8 n ASN 115 Ca -0.01 -0.22 0.04 0.00 -0.53 0.00 0.00 54.58 53.86 1fy8 n ASN 115 Cb 0.50 0.00 0.38 0.00 -2.08 0.00 0.00 39.78 38.57 1fy8 n ASN 115 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1fy8 h ALA 116 N 1.67 1.23 0.00 -2.53 0.00 -2.00 -3.07 119.26 114.56 1fy8 h ALA 116 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1fy8 h ALA 116 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1fy8 h ALA 116 CO 0.00 0.47 -0.95 0.54 0.00 0.00 0.00 179.25 179.31 1fy8 n ARG 117 N -3.86 0.12 -3.77 0.00 1.74 -1.26 -4.76 116.66 104.87 1fy8 n ARG 117 Ca -0.01 -0.01 -0.29 0.00 -0.77 0.00 0.00 57.85 56.76 1fy8 n ARG 117 Cb 0.44 -1.53 -0.16 0.00 -1.02 0.00 0.00 32.46 30.19 1fy8 n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1fy8 s VAL 118 N -3.09 0.85 0.15 1.55 1.01 -1.16 -4.18 120.40 115.54 1fy8 s VAL 118 Ca 0.06 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 1fy8 s VAL 118 Cb 0.16 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 1fy8 s VAL 118 CO 0.81 -0.40 0.08 0.00 0.00 0.00 0.00 175.10 175.59 1fy8 s ALA 119 N 1.67 0.97 0.31 5.51 0.00 -0.89 -0.77 121.76 128.56 1fy8 s ALA 119 Ca 0.03 -1.55 0.03 0.00 0.00 0.00 0.00 51.96 50.47 1fy8 s ALA 119 Cb -0.17 1.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.94 1fy8 s ALA 119 CO -0.15 -0.52 0.48 0.95 0.00 0.00 0.00 175.76 176.52 1fy8 s THR 120 N -4.07 5.06 0.04 0.00 -4.23 -1.26 -3.19 115.64 107.99 1fy8 s THR 120 Ca 0.29 -0.70 0.08 0.00 -1.18 0.00 0.00 61.69 60.17 1fy8 s THR 120 Cb 0.07 -3.82 -0.03 0.00 1.34 0.00 0.00 72.50 70.06 1fy8 s THR 120 CO 0.05 -0.44 -0.21 0.54 -0.54 0.00 0.00 174.62 174.03 1fy8 s VAL 121 N -2.19 2.59 0.38 2.29 0.11 -0.50 -4.84 120.40 118.25 1fy8 s VAL 121 Ca 0.38 -1.25 -0.25 0.00 -2.93 0.00 0.00 61.98 57.93 1fy8 s VAL 121 Cb -0.09 -2.07 -0.09 0.00 -1.53 0.00 0.00 36.38 32.60 1fy8 s VAL 121 CO 0.33 0.34 1.09 0.00 -3.33 0.00 0.00 175.10 173.53 1fy8 s ALA 122 N -0.89 3.14 0.55 1.54 0.00 -1.25 -4.61 121.76 120.24 1fy8 s ALA 122 Ca 0.14 0.80 -0.15 0.00 0.00 0.00 0.00 51.96 52.75 1fy8 s ALA 122 Cb -0.10 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.64 1fy8 s ALA 122 CO 0.04 -0.30 1.00 -0.51 0.00 0.00 0.00 175.76 175.99 1fy8 s LEU 123 N -2.45 3.51 0.44 0.00 1.43 -1.26 -0.50 118.68 119.85 1fy8 s LEU 123 Ca 0.56 1.56 -0.25 0.00 -1.03 0.00 0.00 54.13 54.96 1fy8 s LEU 123 Cb -0.26 -4.50 -0.08 0.00 0.03 0.00 0.00 46.19 41.38 1fy8 s LEU 123 CO 0.32 -0.71 1.38 -2.16 0.23 0.00 0.00 176.35 175.41 1fy8 s PRO 124 N -4.34 3.75 0.18 1.29 0.04 -1.25 -4.69 135.00 129.98 1fy8 s PRO 124 Ca 0.58 2.32 0.16 0.00 0.04 0.00 0.00 61.00 64.10 1fy8 s PRO 124 Cb -0.11 -2.66 -0.02 0.00 0.04 0.00 0.00 34.50 31.75 1fy8 s PRO 124 CO 0.37 -0.73 1.15 0.77 0.04 0.00 0.00 177.00 178.61 1fy8 h SER 125 N 2.38 0.00 -5.56 6.66 0.02 -1.95 -3.48 113.55 111.62 1fy8 h SER 125 Ca -0.50 0.00 0.24 0.00 -0.84 0.00 0.00 61.79 60.69 1fy8 h SER 125 Cb 1.26 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.73 1fy8 h SER 125 CO 0.61 0.50 0.68 -0.94 -1.14 0.00 0.00 176.83 176.54 1fy8 s SER 127 N -6.10 -0.06 -0.02 3.07 1.04 -1.26 -5.14 113.70 105.23 1fy8 s SER 127 Ca 0.01 -0.38 -0.30 0.00 0.48 0.00 0.00 55.95 55.76 1fy8 s SER 127 Cb 0.08 0.35 -0.03 0.00 0.10 0.00 0.00 66.02 66.52 1fy8 s SER 127 CO 0.78 -0.67 1.09 0.00 0.98 0.00 0.00 173.24 175.41 1fy8 s ALA 129 N 1.50 3.42 0.70 0.00 0.00 -1.26 -5.02 121.76 121.10 1fy8 s ALA 129 Ca 0.54 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 53.32 1fy8 s ALA 129 Cb -0.23 -3.35 0.01 0.00 0.00 0.00 0.00 23.12 19.55 1fy8 s ALA 129 CO 0.25 -0.22 1.07 -1.25 0.00 0.00 0.00 175.76 175.60 1fy8 s PRO 130 N -1.42 2.86 0.51 0.00 0.04 -1.26 -4.97 135.00 130.75 1fy8 s PRO 130 Ca 0.45 1.02 -0.23 0.00 0.04 0.00 0.00 61.00 62.28 1fy8 s PRO 130 Cb -0.33 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.17 1fy8 s PRO 130 CO 0.42 -1.16 1.39 0.00 0.04 0.00 0.00 177.00 177.69 1fy8 n ALA 132 N -3.07 1.78 0.00 8.56 0.00 -1.26 -2.45 120.51 124.06 1fy8 n ALA 132 Ca 0.08 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1fy8 n ALA 132 Cb 0.53 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1fy8 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fy8 n GLY 133 N 0.68 1.78 3.70 0.00 0.00 0.71 -4.97 105.19 107.10 1fy8 n GLY 133 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1fy8 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fy8 s THR 134 N -2.46 3.23 0.11 2.61 2.01 -1.03 -4.71 115.64 115.41 1fy8 s THR 134 Ca 0.00 0.80 -0.30 0.00 0.31 0.00 0.00 61.69 62.50 1fy8 s THR 134 Cb 0.00 -3.51 -0.06 0.00 0.01 0.00 0.00 72.50 68.94 1fy8 s THR 134 CO 0.00 0.03 1.01 -1.58 -0.69 0.00 0.00 174.62 173.40 1fy8 s GLN 135 N 1.75 4.64 0.29 4.92 2.00 -1.26 -1.26 119.66 130.73 1fy8 s GLN 135 Ca 0.67 1.53 0.03 0.00 -2.00 0.00 0.00 55.36 55.59 1fy8 s GLN 135 Cb -0.37 -3.36 -0.06 0.00 0.80 0.00 0.00 33.01 30.02 1fy8 s GLN 135 CO 0.30 0.12 0.06 0.00 -0.50 0.00 0.00 175.29 175.27 1fy8 s LEU 137 N -3.40 2.33 -0.13 0.00 2.96 0.63 -1.00 118.68 120.06 1fy8 s LEU 137 Ca 0.36 -0.58 -0.03 0.00 -0.22 0.00 0.00 54.13 53.66 1fy8 s LEU 137 Cb 0.08 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 45.20 1fy8 s LEU 137 CO 0.14 0.00 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.50 1fy8 s ILE 138 N 1.30 3.94 0.08 6.68 1.01 0.27 -1.26 121.20 133.22 1fy8 s ILE 138 Ca 0.04 -0.36 0.03 0.00 0.00 0.00 0.00 60.65 60.37 1fy8 s ILE 138 Cb -0.13 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.61 1fy8 s ILE 138 CO -0.10 0.53 -0.09 -0.94 0.00 0.00 0.00 174.94 174.34 1fy8 s SER 139 N -0.03 1.20 0.00 3.58 1.04 -1.18 -0.92 113.70 117.38 1fy8 s SER 139 Ca 0.01 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.67 1fy8 s SER 139 Cb -0.13 0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.02 1fy8 s SER 139 CO 0.03 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 174.57 1fy8 n GLY 140 N 0.72 1.37 0.77 7.32 0.00 -0.70 -4.33 105.19 110.34 1fy8 n GLY 140 Ca -0.17 -0.86 0.12 0.00 0.00 0.00 0.00 46.02 45.11 1fy8 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1fy8 n TRP 141 N -0.44 0.20 -0.62 1.61 8.01 -1.26 -0.97 117.44 123.97 1fy8 n TRP 141 Ca 0.00 -0.10 -0.30 0.00 -1.31 0.00 0.00 57.50 55.79 1fy8 n TRP 141 Cb 0.00 0.00 0.19 0.00 -2.01 0.00 0.00 31.31 29.49 1fy8 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1fy8 n GLY 142 N 1.28 -1.21 0.00 6.99 0.00 -1.24 -4.43 105.19 106.57 1fy8 n GLY 142 Ca 0.17 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1fy8 n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1fy8 n ASN 143 N -4.03 0.00 -3.52 1.61 2.85 -0.97 -4.86 115.26 106.33 1fy8 n ASN 143 Ca 0.08 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 54.55 1fy8 n ASN 143 Cb 0.53 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.50 1fy8 n ASN 143 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1fy8 s PRO 152 N 0.00 0.33 0.23 1.20 0.05 -1.26 -3.62 135.00 131.93 1fy8 s PRO 152 Ca 0.00 0.68 0.00 0.00 0.05 0.00 0.00 61.00 61.73 1fy8 s PRO 152 Cb 0.00 0.26 0.00 0.00 0.05 0.00 0.00 34.50 34.81 1fy8 s PRO 152 CO 0.00 -0.09 0.00 -0.40 0.05 0.00 0.00 177.00 176.56 1fy8 n ASP 153 N 4.33 0.08 -4.89 6.66 3.85 -1.26 -4.79 116.55 120.53 1fy8 n ASP 153 Ca -0.14 0.39 -0.35 0.00 -0.71 0.00 0.00 54.79 53.98 1fy8 n ASP 153 Cb 0.55 0.24 -0.05 0.00 -1.35 0.00 0.00 41.12 40.51 1fy8 n ASP 153 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1fy8 s LEU 154 N -6.82 4.38 0.17 -2.12 1.43 -1.26 -0.80 118.68 113.66 1fy8 s LEU 154 Ca 0.00 0.46 -0.32 0.00 -1.03 0.00 0.00 54.13 53.25 1fy8 s LEU 154 Cb 0.00 -2.42 -0.11 0.00 0.03 0.00 0.00 46.19 43.69 1fy8 s LEU 154 CO 0.00 0.32 1.65 -0.22 0.23 0.00 0.00 176.35 178.33 1fy8 s LEU 155 N -1.53 4.37 0.03 1.79 2.96 -0.91 -4.77 118.68 120.62 1fy8 s LEU 155 Ca 0.23 2.70 0.00 0.00 -0.22 0.00 0.00 54.13 56.84 1fy8 s LEU 155 Cb -0.13 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1fy8 s LEU 155 CO 0.12 -0.90 0.12 -1.10 -1.32 0.00 0.00 176.35 173.28 1fy8 s GLN 156 N 1.43 3.14 0.15 1.98 -1.52 -0.14 -1.05 119.66 123.65 1fy8 s GLN 156 Ca 0.73 -0.50 0.09 0.00 -1.95 0.00 0.00 55.36 53.73 1fy8 s GLN 156 Cb -0.46 -2.89 -0.04 0.00 -0.22 0.00 0.00 33.01 29.40 1fy8 s GLN 156 CO 0.32 0.63 -0.20 0.00 -0.25 0.00 0.00 175.29 175.79 1fy8 s LEU 158 N -2.45 -0.12 -0.26 0.00 2.96 -0.10 -0.60 118.68 118.10 1fy8 s LEU 158 Ca 0.14 0.83 -0.13 0.00 -0.22 0.00 0.00 54.13 54.75 1fy8 s LEU 158 Cb -0.07 1.21 -0.04 0.00 0.50 0.00 0.00 46.19 47.79 1fy8 s LEU 158 CO 0.06 -0.20 0.28 -1.81 -1.32 0.00 0.00 176.35 173.37 1fy8 s ASP 159 N 1.65 6.17 -0.01 3.68 1.01 -1.26 -0.56 116.67 127.34 1fy8 s ASP 159 Ca -0.08 0.18 -0.19 0.00 0.71 0.00 0.00 52.55 53.17 1fy8 s ASP 159 Cb -0.10 -2.17 0.04 0.00 1.01 0.00 0.00 42.92 41.71 1fy8 s ASP 159 CO -0.12 -0.10 0.42 0.00 0.21 0.00 0.00 175.17 175.58 1fy8 s ALA 160 N 1.78 -1.06 0.32 5.23 0.00 -0.17 -4.95 121.76 122.89 1fy8 s ALA 160 Ca 0.11 0.54 -0.07 0.00 0.00 0.00 0.00 51.96 52.55 1fy8 s ALA 160 Cb -0.16 0.13 -0.06 0.00 0.00 0.00 0.00 23.12 23.03 1fy8 s ALA 160 CO 0.10 -0.33 0.61 -1.25 0.00 0.00 0.00 175.76 174.88 1fy8 s PRO 161 N -1.59 3.69 0.17 0.00 0.04 -1.26 -0.06 135.00 135.99 1fy8 s PRO 161 Ca -0.11 0.16 -0.30 0.00 0.04 0.00 0.00 61.00 60.79 1fy8 s PRO 161 Cb -0.03 -2.58 -0.08 0.00 0.04 0.00 0.00 34.50 31.86 1fy8 s PRO 161 CO 0.04 0.15 1.23 -0.51 0.04 0.00 0.00 177.00 177.95 1fy8 s LEU 162 N -3.57 4.43 0.23 -3.56 1.43 -0.39 -1.82 118.68 115.43 1fy8 s LEU 162 Ca 0.46 2.24 -0.00 0.00 -1.03 0.00 0.00 54.13 55.81 1fy8 s LEU 162 Cb -0.11 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 1fy8 s LEU 162 CO 0.29 -0.42 0.41 -0.76 0.23 0.00 0.00 176.35 176.10 1fy8 s LEU 163 N -0.01 4.20 0.46 1.79 1.43 0.03 -0.21 118.68 126.38 1fy8 s LEU 163 Ca 0.55 0.38 -0.24 0.00 -1.03 0.00 0.00 54.13 53.79 1fy8 s LEU 163 Cb -0.33 -3.17 -0.07 0.00 0.03 0.00 0.00 46.19 42.65 1fy8 s LEU 163 CO 0.36 -0.08 1.30 -2.84 0.23 0.00 0.00 176.35 175.32 1fy8 s PRO 164 N -3.52 3.64 0.27 1.29 0.02 -1.26 -4.58 135.00 130.86 1fy8 s PRO 164 Ca 0.38 2.13 -0.01 0.00 0.02 0.00 0.00 61.00 63.52 1fy8 s PRO 164 Cb -0.11 -2.52 0.49 0.00 0.02 0.00 0.00 34.50 32.39 1fy8 s PRO 164 CO 0.30 -0.75 1.82 1.96 -0.33 0.00 0.00 177.00 179.99 1fy8 h GLN 165 N 2.13 0.84 -0.98 5.54 1.08 -1.97 -1.66 115.11 120.08 1fy8 h GLN 165 Ca -0.50 -0.05 0.10 0.00 -1.45 0.00 0.00 58.65 56.75 1fy8 h GLN 165 Cb 1.26 -0.19 -0.08 0.00 -0.05 0.00 0.00 27.48 28.43 1fy8 h GLN 165 CO 0.60 0.56 0.62 0.00 -0.95 0.00 0.00 178.83 179.66 1fy8 h ALA 166 N 1.51 1.45 -0.35 3.87 0.00 -1.98 0.38 119.26 124.13 1fy8 h ALA 166 Ca 0.46 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.22 1fy8 h ALA 166 Cb 0.47 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1fy8 h ALA 166 CO -0.27 0.27 -0.40 -0.44 0.00 0.00 0.00 179.25 178.41 1fy8 h ASP 167 N 1.02 0.95 -0.46 0.00 3.32 -1.69 -0.97 116.42 118.60 1fy8 h ASP 167 Ca 0.47 -0.48 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 1fy8 h ASP 167 Cb 0.39 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1fy8 h ASP 167 CO -0.24 1.24 0.23 0.00 -1.72 0.00 0.00 179.24 178.75 1fy8 h GLU 169 N 0.61 1.16 -0.08 0.00 5.08 -0.17 -2.25 114.58 118.93 1fy8 h GLU 169 Ca 0.16 -0.22 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 1fy8 h GLU 169 Cb 0.10 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1fy8 h GLU 169 CO -0.02 0.96 -0.35 0.00 -1.00 0.00 0.00 179.01 178.60 1fy8 h ALA 170 N 1.15 1.26 0.00 3.43 0.00 -0.92 -2.72 119.26 121.47 1fy8 h ALA 170 Ca 0.25 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 1fy8 h ALA 170 Cb 0.24 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1fy8 h ALA 170 CO -0.02 0.51 -0.85 0.77 0.00 0.00 0.00 179.25 179.66 1fy8 h SER 171 N 0.15 0.07 -2.22 0.00 0.02 -1.04 -3.37 113.55 107.16 1fy8 h SER 171 Ca 0.02 -0.06 -0.59 0.00 -0.84 0.00 0.00 61.79 60.32 1fy8 h SER 171 Cb 0.69 -0.02 -0.40 0.00 0.14 0.00 0.00 62.40 62.80 1fy8 h SER 171 CO 0.05 0.89 -0.82 -1.22 -1.14 0.00 0.00 176.83 174.59 1fy8 n TYR 172 N -3.57 1.67 -1.68 3.45 4.01 -0.87 -4.82 117.16 115.34 1fy8 n TYR 172 Ca -0.01 -3.87 -0.55 0.00 -0.16 0.00 0.00 57.90 53.31 1fy8 n TYR 172 Cb 0.81 -0.41 -0.06 0.00 -0.31 0.00 0.00 39.34 39.36 1fy8 n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1fy8 n PRO 173 N 1.34 1.36 -0.89 -0.72 -0.02 -1.04 -1.68 135.00 133.35 1fy8 n PRO 173 Ca 0.26 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1fy8 n PRO 173 Cb 0.46 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1fy8 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fy8 n GLY 174 N 3.91 0.40 0.00 -1.23 0.00 -1.26 -4.85 105.19 102.15 1fy8 n GLY 174 Ca 0.24 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.32 1fy8 n GLY 174 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fy8 n LYS 175 N -1.55 2.88 -3.43 1.61 4.76 -0.68 -4.98 118.16 116.77 1fy8 n LYS 175 Ca 0.00 -0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.06 1fy8 n LYS 175 Cb 0.12 -1.09 -0.08 0.00 -1.84 0.00 0.00 35.03 32.15 1fy8 n LYS 175 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1fy8 s ILE 176 N -2.18 5.22 0.46 -0.18 -1.09 -1.25 -5.04 121.20 117.15 1fy8 s ILE 176 Ca 0.04 0.64 0.08 0.00 -2.23 0.00 0.00 60.65 59.18 1fy8 s ILE 176 Cb 0.09 -3.70 0.01 0.00 -1.58 0.00 0.00 42.46 37.28 1fy8 s ILE 176 CO 0.51 0.27 0.46 0.42 -1.23 0.00 0.00 174.94 175.37 1fy8 s THR 177 N 1.22 2.44 -1.33 2.92 -4.23 -1.26 -4.99 115.64 110.40 1fy8 s THR 177 Ca 0.18 -1.28 0.11 0.00 -1.18 0.00 0.00 61.69 59.52 1fy8 s THR 177 Cb -0.14 -2.72 0.18 0.00 1.34 0.00 0.00 72.50 71.15 1fy8 s THR 177 CO 0.07 0.00 1.29 -0.90 -0.54 0.00 0.00 174.62 174.54 1fy8 n ASP 178 N -1.72 0.00 -1.35 3.99 5.68 -1.26 -1.82 116.55 120.07 1fy8 n ASP 178 Ca 0.05 0.21 0.10 0.00 -0.50 0.00 0.00 54.79 54.64 1fy8 n ASP 178 Cb 0.62 -0.33 0.31 0.00 -1.14 0.00 0.00 41.12 40.58 1fy8 n ASP 178 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1fy8 n ASN 179 N -1.33 3.95 -4.30 -1.12 3.02 -1.26 -4.91 115.26 109.31 1fy8 n ASN 179 Ca 0.05 -2.15 -0.21 0.00 -0.03 0.00 0.00 54.58 52.23 1fy8 n ASN 179 Cb 0.10 -0.49 -0.12 0.00 -0.61 0.00 0.00 39.78 38.66 1fy8 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1fy8 s MET 180 N -1.36 1.16 -0.06 3.52 -1.94 -0.75 -0.93 119.30 118.94 1fy8 s MET 180 Ca 0.46 -1.29 -0.06 0.00 -1.71 0.00 0.00 55.69 53.09 1fy8 s MET 180 Cb 0.26 -1.24 0.02 0.00 2.01 0.00 0.00 34.83 35.88 1fy8 s MET 180 CO 0.28 0.26 0.17 0.54 -0.01 0.00 0.00 175.02 176.26 1fy8 s VAL 181 N -1.80 0.01 0.01 -6.03 0.11 -0.11 -4.78 120.40 107.81 1fy8 s VAL 181 Ca 0.11 -0.09 -0.13 0.00 -2.93 0.00 0.00 61.98 58.94 1fy8 s VAL 181 Cb -0.07 -0.28 -0.06 0.00 -1.53 0.00 0.00 36.38 34.45 1fy8 s VAL 181 CO 0.05 -0.05 0.39 0.00 -3.33 0.00 0.00 175.10 172.16 1fy8 s VAL 183 N -1.15 0.36 -1.81 0.00 1.01 -0.91 -0.79 120.40 117.12 1fy8 s VAL 183 Ca 0.25 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1fy8 s VAL 183 Cb -0.16 -0.40 0.00 0.00 0.00 0.00 0.00 36.38 35.82 1fy8 s VAL 183 CO 0.14 0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.02 1fy8 n GLY 184 N 3.93 0.57 2.95 4.51 0.00 -0.75 -3.58 105.19 112.81 1fy8 n GLY 184 Ca -0.25 -1.40 -0.21 0.00 0.00 0.00 0.00 46.02 44.16 1fy8 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fy8 s PHE 184 N -4.00 0.94 -0.29 1.61 0.08 -1.26 -4.39 117.98 110.66 1fy8 s PHE 184 Ca 0.00 -0.27 0.27 0.00 0.12 0.00 0.00 56.93 57.05 1fy8 s PHE 184 Cb 0.00 -0.73 1.11 0.00 -0.57 0.00 0.00 43.02 42.82 1fy8 s PHE 184 CO 0.00 -0.17 1.80 -0.07 -0.10 0.00 0.00 175.22 176.68 1fy8 h LEU 185 N 6.85 0.00 -0.28 -0.37 3.38 -1.97 -1.09 115.31 121.84 1fy8 h LEU 185 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1fy8 h LEU 185 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1fy8 h LEU 185 CO 0.48 0.00 -0.24 -1.84 0.09 0.00 0.00 178.44 176.93 1fy8 n GLU 186 N -2.53 0.57 0.00 1.13 0.00 -1.26 0.01 120.64 118.56 1fy8 n GLU 186 Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 57.16 56.89 1fy8 n GLU 186 Cb 0.26 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.21 1fy8 n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1fy8 n GLY 187 N 1.36 -0.51 1.33 -1.84 0.00 -0.41 -4.25 105.19 100.87 1fy8 n GLY 187 Ca 0.11 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1fy8 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fy8 n GLY 188 N 0.00 2.60 2.99 -0.02 0.00 -0.28 -4.79 105.19 105.69 1fy8 n GLY 188 Ca 0.00 -0.33 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 1fy8 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fy8 s LYS 188 N 0.00 0.93 -0.02 1.61 1.02 -1.26 -4.12 119.74 117.90 1fy8 s LYS 188 Ca 0.00 -0.29 -0.30 0.00 0.02 0.00 0.00 55.97 55.40 1fy8 s LYS 188 Cb 0.00 -0.87 0.12 0.00 -0.52 0.00 0.00 37.83 36.55 1fy8 s LYS 188 CO 0.00 0.10 1.24 0.34 -0.92 0.00 0.00 175.35 176.11 1fy8 s ASP 189 N 0.23 -0.08 0.44 2.83 -1.08 -0.59 -4.49 116.67 113.92 1fy8 s ASP 189 Ca -0.04 -0.14 -0.04 0.00 -0.52 0.00 0.00 52.55 51.82 1fy8 s ASP 189 Cb -0.09 0.19 -0.04 0.00 -1.46 0.00 0.00 42.92 41.53 1fy8 s ASP 189 CO 0.00 -0.35 0.72 -0.94 0.52 0.00 0.00 175.17 175.12 1fy8 s SER 190 N -2.86 6.28 0.21 -0.34 1.04 -1.26 -4.73 113.70 112.03 1fy8 s SER 190 Ca 0.13 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.37 1fy8 s SER 190 Cb 0.03 -2.19 -0.00 0.00 0.10 0.00 0.00 66.02 63.96 1fy8 s SER 190 CO -0.03 -0.50 0.27 0.00 0.98 0.00 0.00 173.24 173.96 1fy8 n GLN 192 N -0.36 1.84 0.00 0.00 3.00 -1.24 -1.13 117.38 119.49 1fy8 n GLN 192 Ca 0.02 0.67 0.00 0.00 -0.01 0.00 0.00 57.00 57.67 1fy8 n GLN 192 Cb 0.36 -2.41 0.00 0.00 0.00 0.00 0.00 30.24 28.20 1fy8 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1fy8 n GLY 193 N 3.30 1.23 0.05 1.08 0.00 -1.26 -2.30 105.19 107.29 1fy8 n GLY 193 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 1fy8 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fy8 n ASP 194 N 0.00 0.34 -4.50 1.61 8.00 -0.28 -3.70 116.55 118.02 1fy8 n ASP 194 Ca 0.00 0.13 -0.47 0.00 0.71 0.00 0.00 54.79 55.16 1fy8 n ASP 194 Cb 0.00 1.38 -0.03 0.00 -0.02 0.00 0.00 41.12 42.45 1fy8 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1fy8 n SER 195 N -2.43 0.07 0.00 -2.24 7.64 -1.26 -1.40 113.62 114.00 1fy8 n SER 195 Ca -0.03 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.01 1fy8 n SER 195 Cb 0.57 -1.11 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1fy8 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fy8 n GLY 196 N 1.67 2.85 3.66 0.23 0.00 0.02 0.28 105.19 113.90 1fy8 n GLY 196 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1fy8 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fy8 s GLY 197 N -1.79 1.57 0.34 -0.02 0.00 -0.49 -3.36 107.32 103.56 1fy8 s GLY 197 Ca 0.00 -0.32 -0.13 0.00 0.00 0.00 0.00 44.72 44.27 1fy8 s GLY 197 CO 0.00 0.30 0.74 2.56 0.00 0.00 0.00 173.10 176.69 1fy8 s PRO 198 N -4.91 3.93 -0.27 2.90 0.04 -1.26 -1.46 135.00 133.95 1fy8 s PRO 198 Ca 0.66 0.59 0.01 0.00 0.04 0.00 0.00 61.00 62.30 1fy8 s PRO 198 Cb -0.19 -2.43 0.08 0.00 0.04 0.00 0.00 34.50 32.00 1fy8 s PRO 198 CO 0.58 0.11 0.01 0.08 0.04 0.00 0.00 177.00 177.81 1fy8 s VAL 199 N -2.09 1.52 -0.16 -0.36 1.01 -0.57 -3.08 120.40 116.68 1fy8 s VAL 199 Ca 0.53 -1.49 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 1fy8 s VAL 199 Cb -0.10 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 1fy8 s VAL 199 CO 0.22 -0.34 -0.06 -0.69 0.00 0.00 0.00 175.10 174.22 1fy8 s VAL 200 N 1.35 3.61 -0.10 2.92 1.01 -0.39 -1.11 120.40 127.69 1fy8 s VAL 200 Ca 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1fy8 s VAL 200 Cb -0.18 -2.57 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1fy8 s VAL 200 CO -0.11 0.49 -0.09 0.00 0.00 0.00 0.00 175.10 175.40 1fy8 n ASN 202 N 4.66 -2.84 0.00 0.00 3.02 -1.26 -2.02 115.26 116.82 1fy8 n ASN 202 Ca -0.15 -0.81 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 1fy8 n ASN 202 Cb 0.50 -3.92 0.00 0.00 -0.61 0.00 0.00 39.78 35.76 1fy8 n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fy8 n GLY 203 N -1.66 0.56 3.25 7.41 0.00 -1.26 -5.02 105.19 108.48 1fy8 n GLY 203 Ca -0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 1fy8 n GLY 203 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fy8 s GLU 204 N -0.35 1.48 -0.52 1.61 2.02 -0.86 -3.77 118.70 118.31 1fy8 s GLU 204 Ca 0.00 -0.92 -0.28 0.00 0.02 0.00 0.00 54.97 53.79 1fy8 s GLU 204 Cb 0.00 -1.57 0.01 0.00 0.10 0.00 0.00 34.13 32.67 1fy8 s GLU 204 CO 0.00 0.41 1.38 -1.17 0.02 0.00 0.00 175.26 175.90 1fy8 s LEU 209 N -1.05 3.46 -0.02 1.80 2.96 0.34 -1.31 118.68 124.85 1fy8 s LEU 209 Ca 0.08 0.40 0.18 0.00 -0.22 0.00 0.00 54.13 54.58 1fy8 s LEU 209 Cb -0.09 -3.20 -0.28 0.00 0.50 0.00 0.00 46.19 43.13 1fy8 s LEU 209 CO 0.01 -1.61 0.43 0.00 -1.32 0.00 0.00 176.35 173.86 1fy8 n GLN 210 N 8.47 0.60 -3.86 1.98 1.13 -0.27 -3.78 117.38 121.66 1fy8 n GLN 210 Ca 0.13 -0.15 -0.09 0.00 -1.94 0.00 0.00 57.00 54.95 1fy8 n GLN 210 Cb 0.49 -1.42 -0.07 0.00 0.11 0.00 0.00 30.24 29.34 1fy8 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1fy8 s GLY 211 N -3.97 0.12 -0.09 1.08 0.00 -0.98 -1.98 107.32 101.50 1fy8 s GLY 211 Ca -0.06 -0.62 0.02 0.00 0.00 0.00 0.00 44.72 44.06 1fy8 s GLY 211 CO 0.75 -0.78 -0.14 -0.42 0.00 0.00 0.00 173.10 172.52 1fy8 s ILE 212 N -3.87 1.33 0.07 0.90 1.01 -0.92 -1.51 121.20 118.21 1fy8 s ILE 212 Ca 0.06 -0.56 -0.32 0.00 0.00 0.00 0.00 60.65 59.83 1fy8 s ILE 212 Cb 0.04 -1.21 -0.12 0.00 0.01 0.00 0.00 42.46 41.19 1fy8 s ILE 212 CO -0.10 0.40 1.80 0.52 0.00 0.00 0.00 174.94 177.57 1fy8 n VAL 213 N 4.01 0.37 0.00 2.92 0.31 -0.54 -1.17 118.33 124.23 1fy8 n VAL 213 Ca -0.20 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1fy8 n VAL 213 Cb 0.52 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.50 1fy8 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1fy8 n SER 214 N 5.55 0.00 -3.15 4.52 2.88 -1.13 -0.80 113.62 121.50 1fy8 n SER 214 Ca 0.19 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.60 1fy8 n SER 214 Cb 0.34 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.77 1fy8 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1fy8 s TRP 215 N -0.77 0.84 0.00 0.66 1.48 -0.97 -4.90 118.94 115.27 1fy8 s TRP 215 Ca 0.00 -1.18 0.00 0.00 -1.06 0.00 0.00 56.10 53.86 1fy8 s TRP 215 Cb 0.00 0.15 0.00 0.00 -1.16 0.00 0.00 33.47 32.46 1fy8 s TRP 215 CO 0.00 -1.25 0.00 0.41 -4.06 0.00 0.00 176.95 172.05 1fy8 n GLY 216 N -0.56 0.87 3.44 3.67 0.00 -1.26 -0.17 105.19 111.18 1fy8 n GLY 216 Ca -0.01 -0.75 -0.44 0.00 0.00 0.00 0.00 46.02 44.82 1fy8 n GLY 216 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fy8 s TYR 217 N -2.00 3.04 0.00 1.61 2.02 -1.26 -4.89 117.35 115.86 1fy8 s TYR 217 Ca 0.00 -0.58 0.00 0.00 -0.37 0.00 0.00 57.07 56.12 1fy8 s TYR 217 Cb 0.00 -3.60 0.00 0.00 -0.40 0.00 0.00 41.96 37.96 1fy8 s TYR 217 CO 0.00 -1.07 0.00 0.41 -1.57 0.00 0.00 175.55 173.32 1fy8 n GLY 219 N 5.18 -1.00 2.85 0.71 0.00 -1.26 -4.71 105.19 106.97 1fy8 n GLY 219 Ca -0.07 -1.20 -0.14 0.00 0.00 0.00 0.00 46.02 44.61 1fy8 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fy8 n ALA 221 N 4.02 -0.37 -2.11 0.00 0.00 -1.26 -4.93 120.51 115.87 1fy8 n ALA 221 Ca -0.25 0.25 -0.39 0.00 0.00 0.00 0.00 53.44 53.04 1fy8 n ALA 221 Cb 0.52 -1.90 -0.06 0.00 0.00 0.00 0.00 19.45 18.01 1fy8 n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fy8 s LEU 221 N -4.53 4.56 0.42 0.00 1.43 -1.26 -1.12 118.68 118.18 1fy8 s LEU 221 Ca 0.00 1.52 -0.26 0.00 -1.03 0.00 0.00 54.13 54.36 1fy8 s LEU 221 Cb 0.00 -3.19 -0.09 0.00 0.03 0.00 0.00 46.19 42.94 1fy8 s LEU 221 CO 0.00 0.20 1.39 -2.84 0.23 0.00 0.00 176.35 175.32 1fy8 s PRO 222 N -0.97 3.87 -0.60 1.29 0.02 -1.26 -2.25 135.00 135.11 1fy8 s PRO 222 Ca 0.34 2.34 0.00 0.00 0.02 0.00 0.00 61.00 63.70 1fy8 s PRO 222 Cb -0.22 -2.75 0.00 0.00 0.02 0.00 0.00 34.50 31.55 1fy8 s PRO 222 CO 0.24 -0.64 0.00 -3.47 -0.33 0.00 0.00 177.00 172.80 1fy8 n ASP 223 N 0.05 -4.48 -3.04 2.53 2.03 0.10 -4.91 116.55 108.83 1fy8 n ASP 223 Ca 0.04 0.14 -0.18 0.00 0.52 0.00 0.00 54.79 55.31 1fy8 n ASP 223 Cb 0.42 -2.48 -0.02 0.00 -0.72 0.00 0.00 41.12 38.32 1fy8 n ASP 223 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1fy8 n ASN 224 N -0.18 -0.80 -4.79 1.67 3.02 -0.95 -4.62 115.26 108.60 1fy8 n ASN 224 Ca -0.06 -2.95 -0.31 0.00 -0.03 0.00 0.00 54.58 51.24 1fy8 n ASN 224 Cb 0.32 0.22 0.08 0.00 -0.61 0.00 0.00 39.78 39.79 1fy8 n ASN 224 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1fy8 s PRO 225 N -0.66 2.44 0.57 3.52 0.04 -1.26 -4.32 135.00 135.32 1fy8 s PRO 225 Ca 0.34 0.98 -0.20 0.00 0.04 0.00 0.00 61.00 62.16 1fy8 s PRO 225 Cb 0.21 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.78 1fy8 s PRO 225 CO -0.15 -1.46 1.27 0.20 0.04 0.00 0.00 177.00 176.90 1fy8 s GLY 226 N -3.63 2.82 -0.09 0.56 0.00 -1.23 -4.78 107.32 100.97 1fy8 s GLY 226 Ca 0.60 1.16 -0.01 0.00 0.00 0.00 0.00 44.72 46.47 1fy8 s GLY 226 CO 0.55 1.61 -0.05 0.14 0.00 0.00 0.00 173.10 175.36 1fy8 s VAL 227 N -1.44 3.87 0.08 1.40 1.01 0.77 -2.13 120.40 123.95 1fy8 s VAL 227 Ca 0.74 -0.41 0.05 0.00 0.00 0.00 0.00 61.98 62.37 1fy8 s VAL 227 Cb -0.35 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 1fy8 s VAL 227 CO 0.40 0.58 -0.15 -0.31 0.00 0.00 0.00 175.10 175.62 1fy8 s TYR 228 N -0.61 1.28 0.10 5.22 2.02 0.11 -2.30 117.35 123.16 1fy8 s TYR 228 Ca 0.09 -0.46 -0.31 0.00 -0.37 0.00 0.00 57.07 56.02 1fy8 s TYR 228 Cb -0.12 -0.71 -0.07 0.00 -0.40 0.00 0.00 41.96 40.66 1fy8 s TYR 228 CO 0.02 0.07 1.32 0.99 -1.57 0.00 0.00 175.55 176.38 1fy8 s THR 229 N -1.32 3.57 -0.83 -0.71 2.01 -0.32 -0.93 115.64 117.11 1fy8 s THR 229 Ca -0.01 1.13 -0.24 0.00 0.31 0.00 0.00 61.69 62.89 1fy8 s THR 229 Cb -0.10 -3.73 0.05 0.00 0.01 0.00 0.00 72.50 68.74 1fy8 s THR 229 CO 0.02 0.09 1.25 -0.75 -0.69 0.00 0.00 174.62 174.55 1fy8 s LYS 230 N 1.04 3.34 0.49 4.92 2.20 -0.11 -2.16 119.74 129.45 1fy8 s LYS 230 Ca 0.62 -0.77 0.19 0.00 -0.36 0.00 0.00 55.97 55.65 1fy8 s LYS 230 Cb -0.34 -4.61 1.22 0.00 -1.51 0.00 0.00 37.83 32.58 1fy8 s LYS 230 CO 0.30 -2.07 2.02 0.28 -0.36 0.00 0.00 175.35 175.53 1fy8 h VAL 231 N 6.23 0.86 0.00 4.02 2.07 -1.69 -2.77 116.25 124.96 1fy8 h VAL 231 Ca -0.09 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 1fy8 h VAL 231 Cb 1.04 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1fy8 h VAL 231 CO 1.29 0.03 -0.00 0.00 0.02 0.00 0.00 177.57 178.91 1fy8 n ASN 233 N -3.11 0.05 0.00 0.00 4.13 -1.04 -3.92 115.26 111.37 1fy8 n ASN 233 Ca -0.03 0.16 0.00 0.00 1.68 0.00 0.00 54.58 56.39 1fy8 n ASN 233 Cb 0.10 -0.36 0.00 0.00 -1.54 0.00 0.00 39.78 37.98 1fy8 n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1fy8 n TYR 234 N -1.39 0.00 -0.22 3.10 4.01 -0.28 -4.79 117.16 117.58 1fy8 n TYR 234 Ca 0.10 -0.48 -0.01 0.00 -0.16 0.00 0.00 57.90 57.36 1fy8 n TYR 234 Cb 0.30 -0.05 0.11 0.00 -0.31 0.00 0.00 39.34 39.39 1fy8 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1fy8 h VAL 235 N 0.04 0.90 -0.49 -0.72 2.07 -1.67 -0.01 116.25 116.38 1fy8 h VAL 235 Ca 0.00 -0.21 -0.13 0.00 0.82 0.00 0.00 66.70 67.18 1fy8 h VAL 235 Cb 0.49 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1fy8 h VAL 235 CO 0.00 0.11 -0.22 0.44 0.02 0.00 0.00 177.57 177.92 1fy8 h ASP 236 N 0.60 1.03 -0.64 0.57 3.32 -1.89 -1.45 116.42 117.97 1fy8 h ASP 236 Ca 0.31 -0.39 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1fy8 h ASP 236 Cb 0.26 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1fy8 h ASP 236 CO -0.22 1.20 0.38 -0.25 -1.72 0.00 0.00 179.24 178.63 1fy8 h TRP 237 N 0.87 0.84 0.27 4.55 7.01 -1.75 0.13 115.95 127.87 1fy8 h TRP 237 Ca 0.11 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1fy8 h TRP 237 Cb 0.80 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.59 1fy8 h TRP 237 CO 0.05 0.58 -0.13 0.82 -2.79 0.00 0.00 178.44 176.97 1fy8 h ILE 238 N 0.87 0.75 -0.79 2.65 2.04 -0.82 -0.27 117.51 121.94 1fy8 h ILE 238 Ca 0.23 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 1fy8 h ILE 238 Cb -0.02 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 1fy8 h ILE 238 CO -0.04 0.03 0.45 1.56 0.00 0.00 0.00 178.15 180.15 1fy8 h GLN 239 N -0.43 1.08 -0.57 2.37 4.20 -1.09 -0.96 115.11 119.71 1fy8 h GLN 239 Ca -0.04 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.51 1fy8 h GLN 239 Cb 0.33 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 1fy8 h GLN 239 CO 0.06 0.78 0.16 -0.44 -0.67 0.00 0.00 178.83 178.72 1fy8 h ASP 240 N 1.08 0.85 -0.55 1.46 3.32 -0.63 -2.12 116.42 119.83 1fy8 h ASP 240 Ca 0.28 -0.22 -0.11 0.00 0.02 0.00 0.00 57.03 57.00 1fy8 h ASP 240 Cb -0.01 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1fy8 h ASP 240 CO -0.05 0.85 -0.07 0.74 -1.72 0.00 0.00 179.24 178.99 1fy8 h THR 241 N 0.81 1.27 -0.32 0.35 2.02 -0.68 -2.55 112.91 113.81 1fy8 h THR 241 Ca 0.18 -1.22 -0.07 0.00 0.77 0.00 0.00 66.41 66.08 1fy8 h THR 241 Cb 0.32 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1fy8 h THR 241 CO -0.00 0.43 -0.06 0.40 0.37 0.00 0.00 175.52 176.66 1fy8 h ILE 242 N 0.92 1.27 -0.12 3.11 2.04 -1.08 -2.43 117.51 121.22 1fy8 h ILE 242 Ca 0.15 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 64.90 1fy8 h ILE 242 Cb 0.62 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1fy8 h ILE 242 CO 0.04 0.35 -0.06 0.00 0.00 0.00 0.00 178.15 178.48 1fy8 h ALA 243 N 0.81 1.67 -0.00 1.87 0.00 -1.34 -2.65 119.26 119.63 1fy8 h ALA 243 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1fy8 h ALA 243 Cb 0.54 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1fy8 h ALA 243 CO 0.03 0.24 -0.39 0.00 0.00 0.00 0.00 179.25 179.13 1fy8 n ALA 244 N -2.50 3.28 -0.33 0.00 0.00 -0.97 -5.11 120.51 114.89 1fy8 n ALA 244 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1fy8 n ALA 244 Cb 0.20 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1fy8 n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59