#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fq8 s GLY 1 N 0.00 1.64 -0.36 -0.02 0.00 -1.26 -4.73 107.32 102.59 1fq8 s GLY 1 Ca 0.00 -0.87 -0.06 0.00 0.00 0.00 0.00 44.72 43.79 1fq8 s GLY 1 CO 0.00 -0.13 0.14 0.30 0.00 0.00 0.00 173.10 173.41 1fq8 s HIS 2 N -3.33 3.31 -0.02 1.90 0.09 -1.03 -4.90 115.29 111.31 1fq8 s HIS 2 Ca 0.69 -1.60 -0.15 0.00 -0.00 0.00 0.00 55.06 54.00 1fq8 s HIS 2 Cb -0.10 -2.50 -0.06 0.00 -0.00 0.00 0.00 32.58 29.92 1fq8 s HIS 2 CO 0.54 -0.79 0.42 -0.51 -0.00 0.00 0.00 174.74 174.41 1fq8 s ASP 3 N 1.58 6.80 -0.01 1.40 1.01 -1.26 -0.86 116.67 125.32 1fq8 s ASP 3 Ca -0.00 0.95 0.07 0.00 0.71 0.00 0.00 52.55 54.27 1fq8 s ASP 3 Cb -0.21 -2.26 -0.02 0.00 1.01 0.00 0.00 42.92 41.45 1fq8 s ASP 3 CO 0.01 0.27 -0.22 0.68 0.21 0.00 0.00 175.17 176.13 1fq8 s VAL 4 N -0.80 1.74 0.20 -1.27 -7.23 -0.51 -4.81 120.40 107.73 1fq8 s VAL 4 Ca 0.24 -0.96 -0.04 0.00 -1.81 0.00 0.00 61.98 59.41 1fq8 s VAL 4 Cb -0.17 -1.45 -0.05 0.00 0.56 0.00 0.00 36.38 35.27 1fq8 s VAL 4 CO 0.13 0.48 0.44 -2.16 -0.31 0.00 0.00 175.10 173.67 1fq8 s PRO 5 N -0.56 3.61 -0.12 4.82 0.04 -1.26 -1.80 135.00 139.73 1fq8 s PRO 5 Ca 0.08 -0.11 -0.08 0.00 0.04 0.00 0.00 61.00 60.94 1fq8 s PRO 5 Cb -0.09 -2.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.63 1fq8 s PRO 5 CO -0.01 0.37 0.16 -0.51 0.04 0.00 0.00 177.00 177.05 1fq8 s LEU 6 N -3.09 4.38 -0.18 -3.56 1.43 -0.50 -4.49 118.68 112.66 1fq8 s LEU 6 Ca 0.42 0.48 -0.07 0.00 -1.03 0.00 0.00 54.13 53.92 1fq8 s LEU 6 Cb -0.11 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 1fq8 s LEU 6 CO 0.27 0.38 0.06 -0.89 0.23 0.00 0.00 176.35 176.39 1fq8 s THR 7 N -0.87 4.73 -0.18 5.49 2.01 -0.57 -2.35 115.64 123.89 1fq8 s THR 7 Ca 0.15 -0.05 -0.02 0.00 0.31 0.00 0.00 61.69 62.07 1fq8 s THR 7 Cb -0.12 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 69.25 1fq8 s THR 7 CO 0.04 0.46 -0.08 0.21 -0.69 0.00 0.00 174.62 174.56 1fq8 s ASN 8 N 0.38 4.21 -0.40 3.53 3.84 -1.26 -1.04 114.94 124.19 1fq8 s ASN 8 Ca 0.03 -0.36 -0.08 0.00 0.21 0.00 0.00 52.86 52.66 1fq8 s ASN 8 Cb -0.12 -1.69 0.07 0.00 -0.55 0.00 0.00 41.25 38.96 1fq8 s ASN 8 CO 0.00 0.06 0.23 -0.47 -2.79 0.00 0.00 177.10 174.13 1fq8 s TYR 9 N 1.02 3.34 -1.49 0.43 5.04 0.27 -4.74 117.35 121.22 1fq8 s TYR 9 Ca -0.00 -1.57 -0.03 0.00 -2.44 0.00 0.00 57.07 53.03 1fq8 s TYR 9 Cb -0.15 -2.86 0.03 0.00 0.35 0.00 0.00 41.96 39.33 1fq8 s TYR 9 CO -0.01 -0.83 0.38 1.28 -1.34 0.00 0.00 175.55 175.03 1fq8 n LEU 10 N 4.88 -1.87 0.00 6.97 4.32 -1.26 -1.70 117.00 128.34 1fq8 n LEU 10 Ca -0.10 -1.07 0.00 0.00 -0.02 0.00 0.00 56.01 54.82 1fq8 n LEU 10 Cb 0.43 -2.06 0.00 0.00 -1.62 0.00 0.00 43.42 40.17 1fq8 n LEU 10 CO 0.37 0.42 0.00 0.59 -1.22 0.00 0.00 177.39 177.55 1fq8 n ASN 11 N -2.91 -3.08 -0.02 -1.43 4.13 -1.26 -4.75 115.26 105.94 1fq8 n ASN 11 Ca -0.25 0.00 0.04 0.00 1.68 0.00 0.00 54.58 56.05 1fq8 n ASN 11 Cb 0.66 -2.83 -0.10 0.00 -1.54 0.00 0.00 39.78 35.97 1fq8 n ASN 11 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1fq8 n ALA 12 N 0.95 2.34 -3.45 5.41 0.00 -0.69 -4.90 120.51 120.18 1fq8 n ALA 12 Ca 0.00 -0.40 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 1fq8 n ALA 12 Cb 0.26 -0.37 -0.14 0.00 0.00 0.00 0.00 19.45 19.20 1fq8 n ALA 12 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fq8 s GLN 13 N -2.80 0.11 -0.13 0.00 -0.21 -1.13 -4.57 119.66 110.93 1fq8 s GLN 13 Ca -0.05 0.29 0.02 0.00 0.02 0.00 0.00 55.36 55.64 1fq8 s GLN 13 Cb 0.08 -0.08 0.01 0.00 1.00 0.00 0.00 33.01 34.02 1fq8 s GLN 13 CO 0.54 -0.11 -0.18 0.71 -2.12 0.00 0.00 175.29 174.13 1fq8 s TYR 14 N 0.73 2.31 0.12 0.91 2.02 -1.26 -0.57 117.35 121.62 1fq8 s TYR 14 Ca -0.06 -1.15 -0.01 0.00 -0.37 0.00 0.00 57.07 55.49 1fq8 s TYR 14 Cb -0.07 -1.62 -0.04 0.00 -0.40 0.00 0.00 41.96 39.83 1fq8 s TYR 14 CO -0.04 -0.56 0.04 1.52 -1.57 0.00 0.00 175.55 174.95 1fq8 s TYR 15 N 0.94 0.80 0.27 2.71 1.13 -0.21 -4.15 117.35 118.84 1fq8 s TYR 15 Ca -0.06 -1.20 0.03 0.00 -1.41 0.00 0.00 57.07 54.43 1fq8 s TYR 15 Cb -0.15 -0.46 -0.01 0.00 -1.10 0.00 0.00 41.96 40.24 1fq8 s TYR 15 CO -0.02 -0.50 0.10 0.25 -2.51 0.00 0.00 175.55 172.87 1fq8 n THR 16 N -0.06 0.00 -4.14 -3.49 -2.24 -0.89 -1.52 114.28 101.95 1fq8 n THR 16 Ca -0.07 -1.58 -0.31 0.00 -2.27 0.00 0.00 64.05 59.82 1fq8 n THR 16 Cb 0.63 0.56 -0.08 0.00 -2.10 0.00 0.00 70.33 69.35 1fq8 n THR 16 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1fq8 s ASP 17 N -2.67 5.16 0.11 3.42 1.01 -1.26 -1.40 116.67 121.04 1fq8 s ASP 17 Ca 0.14 -0.11 0.03 0.00 0.71 0.00 0.00 52.55 53.32 1fq8 s ASP 17 Cb 0.01 -1.29 -0.04 0.00 1.01 0.00 0.00 42.92 42.61 1fq8 s ASP 17 CO 0.10 0.19 -0.08 0.27 0.21 0.00 0.00 175.17 175.86 1fq8 s ILE 18 N -1.29 0.89 0.09 0.77 -4.36 0.28 -4.27 121.20 113.31 1fq8 s ILE 18 Ca 0.25 -1.88 0.07 0.00 -0.26 0.00 0.00 60.65 58.83 1fq8 s ILE 18 Cb -0.12 -1.63 -0.04 0.00 1.25 0.00 0.00 42.46 41.93 1fq8 s ILE 18 CO 0.18 -0.75 -0.12 0.42 0.24 0.00 0.00 174.94 174.90 1fq8 s THR 19 N -3.21 3.22 -0.23 8.37 -4.23 0.11 -2.21 115.64 117.46 1fq8 s THR 19 Ca 0.11 -1.26 0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1fq8 s THR 19 Cb 0.02 -2.48 -0.19 0.00 1.34 0.00 0.00 72.50 71.20 1fq8 s THR 19 CO -0.02 0.16 -0.11 -0.11 -0.54 0.00 0.00 174.62 174.00 1fq8 n LEU 20 N 0.90 2.65 0.00 4.79 7.94 0.18 -1.77 117.00 131.70 1fq8 n LEU 20 Ca -0.14 -0.07 0.00 0.00 -1.11 0.00 0.00 56.01 54.68 1fq8 n LEU 20 Cb 0.52 -0.80 0.00 0.00 0.53 0.00 0.00 43.42 43.67 1fq8 n LEU 20 CO 0.31 0.88 0.00 0.61 -1.11 0.00 0.00 177.39 178.09 1fq8 n GLY 21 N 2.17 5.66 2.96 -3.96 0.00 -1.26 -3.22 105.19 107.54 1fq8 n GLY 21 Ca -0.43 -1.52 -0.30 0.00 0.00 0.00 0.00 46.02 43.77 1fq8 n GLY 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fq8 s THR 22 N 0.83 1.62 0.72 2.61 2.01 -1.26 -0.91 115.64 121.25 1fq8 s THR 22 Ca 0.00 -1.24 -0.12 0.00 0.31 0.00 0.00 61.69 60.64 1fq8 s THR 22 Cb 0.00 -1.84 0.03 0.00 0.01 0.00 0.00 72.50 70.70 1fq8 s THR 22 CO 0.00 -0.06 1.09 -2.16 -0.69 0.00 0.00 174.62 172.80 1fq8 s PRO 23 N 1.36 2.61 0.54 4.92 0.04 -1.26 0.52 135.00 143.73 1fq8 s PRO 23 Ca -0.06 1.18 -0.18 0.00 0.04 0.00 0.00 61.00 61.98 1fq8 s PRO 23 Cb -0.19 -1.94 -0.11 0.00 0.04 0.00 0.00 34.50 32.31 1fq8 s PRO 23 CO -0.06 -1.38 0.34 -2.30 0.04 0.00 0.00 177.00 173.64 1fq8 n PRO 24 N -3.06 0.36 -5.04 0.56 -0.02 -0.09 -4.92 135.00 122.79 1fq8 n PRO 24 Ca 0.09 0.14 -0.32 0.00 -2.02 0.00 0.00 63.50 61.39 1fq8 n PRO 24 Cb 0.53 -1.48 -0.16 0.00 -0.02 0.00 0.00 33.50 32.36 1fq8 n PRO 24 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1fq8 s GLN 25 N -1.73 3.11 0.05 -0.52 -0.21 -1.26 -4.67 119.66 114.43 1fq8 s GLN 25 Ca 0.65 -0.84 -0.14 0.00 0.02 0.00 0.00 55.36 55.05 1fq8 s GLN 25 Cb -0.47 -2.39 -0.06 0.00 1.00 0.00 0.00 33.01 31.09 1fq8 s GLN 25 CO 0.58 0.15 0.45 -0.80 -2.12 0.00 0.00 175.29 173.55 1fq8 s ASN 26 N 0.42 6.81 0.03 5.90 -0.87 -1.26 -0.64 114.94 125.32 1fq8 s ASN 26 Ca -0.16 0.98 -0.03 0.00 -1.57 0.00 0.00 52.86 52.08 1fq8 s ASN 26 Cb -0.17 -2.25 -0.02 0.00 -0.02 0.00 0.00 41.25 38.79 1fq8 s ASN 26 CO 0.07 0.25 0.04 -0.36 -2.57 0.00 0.00 177.10 174.52 1fq8 s PHE 27 N -1.22 0.25 -0.19 2.20 0.40 -0.94 -4.92 117.98 113.55 1fq8 s PHE 27 Ca 0.29 -0.55 -0.08 0.00 -0.60 0.00 0.00 56.93 55.99 1fq8 s PHE 27 Cb -0.16 -0.18 -0.04 0.00 0.51 0.00 0.00 43.02 43.14 1fq8 s PHE 27 CO 0.16 -0.30 0.09 0.15 0.70 0.00 0.00 175.22 176.02 1fq8 s LYS 28 N -2.24 4.04 0.11 0.44 1.02 -1.26 -0.56 119.74 121.29 1fq8 s LYS 28 Ca -0.08 -0.30 0.06 0.00 0.02 0.00 0.00 55.97 55.67 1fq8 s LYS 28 Cb -0.04 -3.30 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 1fq8 s LYS 28 CO -0.03 0.27 -0.15 0.14 -0.92 0.00 0.00 175.35 174.65 1fq8 s VAL 29 N 0.42 1.37 -0.21 3.17 -7.23 -0.49 -0.03 120.40 117.39 1fq8 s VAL 29 Ca 0.05 -1.59 -0.20 0.00 -1.81 0.00 0.00 61.98 58.43 1fq8 s VAL 29 Cb -0.12 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.36 1fq8 s VAL 29 CO -0.00 -0.30 0.59 -0.63 -0.31 0.00 0.00 175.10 174.45 1fq8 s ILE 30 N -1.74 5.04 -0.71 -0.62 1.01 0.06 -2.08 121.20 122.16 1fq8 s ILE 30 Ca 0.06 1.09 -0.23 0.00 0.00 0.00 0.00 60.65 61.57 1fq8 s ILE 30 Cb -0.07 -3.91 0.07 0.00 0.01 0.00 0.00 42.46 38.56 1fq8 s ILE 30 CO 0.03 0.12 1.06 -0.76 0.00 0.00 0.00 174.94 175.39 1fq8 s LEU 31 N 1.94 4.15 -0.45 2.97 1.43 -1.26 -1.01 118.68 126.45 1fq8 s LEU 31 Ca 0.26 -0.98 -0.20 0.00 -1.03 0.00 0.00 54.13 52.19 1fq8 s LEU 31 Cb -0.16 -2.45 0.03 0.00 0.03 0.00 0.00 46.19 43.64 1fq8 s LEU 31 CO 0.10 -1.50 0.63 -0.62 0.23 0.00 0.00 176.35 175.18 1fq8 s ASP 32 N 3.74 6.29 0.00 2.29 2.15 -1.15 -4.54 116.67 125.46 1fq8 s ASP 32 Ca 0.26 -0.49 0.09 0.00 0.43 0.00 0.00 52.55 52.84 1fq8 s ASP 32 Cb -0.14 -2.31 0.53 0.00 -0.30 0.00 0.00 42.92 40.71 1fq8 s ASP 32 CO 0.09 -0.79 1.28 0.35 -0.17 0.00 0.00 175.17 175.93 1fq8 n THR 33 N 5.77 0.00 0.84 1.71 -2.24 -1.26 -1.25 114.28 117.85 1fq8 n THR 33 Ca -0.03 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.83 1fq8 n THR 33 Cb 0.47 -0.18 -0.09 0.00 -2.10 0.00 0.00 70.33 68.43 1fq8 n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fq8 n GLY 34 N 0.56 -0.61 3.69 3.38 0.00 -1.26 -3.91 105.19 107.04 1fq8 n GLY 34 Ca 0.07 -0.51 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 1fq8 n GLY 34 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fq8 s SER 35 N -2.62 4.85 -0.04 1.61 0.15 -1.24 -4.90 113.70 111.50 1fq8 s SER 35 Ca 0.08 -0.47 0.14 0.00 0.70 0.00 0.00 55.95 56.40 1fq8 s SER 35 Cb 0.14 -1.03 0.26 0.00 -1.71 0.00 0.00 66.02 63.67 1fq8 s SER 35 CO 0.70 0.02 1.11 -1.20 1.20 0.00 0.00 173.24 175.08 1fq8 n SER 36 N -0.69 0.89 -4.30 5.45 7.64 -1.26 -0.99 113.62 120.36 1fq8 n SER 36 Ca -0.08 -2.36 -0.27 0.00 1.01 0.00 0.00 58.87 57.17 1fq8 n SER 36 Cb 0.57 -0.31 -0.14 0.00 -1.01 0.00 0.00 64.21 63.32 1fq8 n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1fq8 s ASN 37 N -1.90 2.77 0.02 6.43 0.02 -1.26 -4.49 114.94 116.53 1fq8 s ASN 37 Ca 0.22 -0.58 -0.00 0.00 -1.02 0.00 0.00 52.86 51.49 1fq8 s ASN 37 Cb 0.24 -0.23 -0.04 0.00 0.02 0.00 0.00 41.25 41.24 1fq8 s ASN 37 CO -0.07 0.19 0.12 -0.22 0.02 0.00 0.00 177.10 177.13 1fq8 s LEU 38 N -1.33 4.04 -0.03 0.60 2.96 -1.26 -1.29 118.68 122.37 1fq8 s LEU 38 Ca 0.09 0.17 -0.29 0.00 -0.22 0.00 0.00 54.13 53.88 1fq8 s LEU 38 Cb -0.09 -2.49 0.11 0.00 0.50 0.00 0.00 46.19 44.21 1fq8 s LEU 38 CO 0.02 0.23 0.91 -1.66 -1.32 0.00 0.00 176.35 174.53 1fq8 s TRP 39 N -1.31 -0.34 0.15 5.38 1.48 -0.95 -2.75 118.94 120.61 1fq8 s TRP 39 Ca 0.27 0.25 -0.18 0.00 -1.06 0.00 0.00 56.10 55.38 1fq8 s TRP 39 Cb -0.12 0.53 0.04 0.00 -1.16 0.00 0.00 33.47 32.76 1fq8 s TRP 39 CO 0.19 -0.51 0.48 0.14 -4.06 0.00 0.00 176.95 173.19 1fq8 s VAL 40 N -2.91 0.04 0.68 -0.66 -7.23 -1.20 -3.37 120.40 105.75 1fq8 s VAL 40 Ca 0.04 -0.51 -0.13 0.00 -1.81 0.00 0.00 61.98 59.58 1fq8 s VAL 40 Cb -0.01 -1.25 0.01 0.00 0.56 0.00 0.00 36.38 35.69 1fq8 s VAL 40 CO -0.08 -0.18 1.08 -2.16 -0.31 0.00 0.00 175.10 173.45 1fq8 s PRO 41 N -3.81 2.80 0.67 4.82 0.04 -1.26 -0.03 135.00 138.23 1fq8 s PRO 41 Ca 0.04 1.18 0.05 0.00 0.04 0.00 0.00 61.00 62.31 1fq8 s PRO 41 Cb 0.00 -1.96 0.12 0.00 0.04 0.00 0.00 34.50 32.70 1fq8 s PRO 41 CO -0.09 -1.22 0.92 0.45 0.04 0.00 0.00 177.00 177.10 1fq8 s SER 42 N -3.15 4.62 0.14 6.66 0.15 0.17 -0.97 113.70 121.32 1fq8 s SER 42 Ca 0.62 -0.67 0.07 0.00 0.70 0.00 0.00 55.95 56.67 1fq8 s SER 42 Cb -0.17 0.28 -0.13 0.00 -1.71 0.00 0.00 66.02 64.29 1fq8 s SER 42 CO 0.48 -1.69 1.33 -0.55 1.20 0.00 0.00 173.24 174.01 1fq8 h ASN 43 N -0.24 0.00 0.00 5.45 7.08 -1.84 -3.23 115.58 122.80 1fq8 h ASN 43 Ca -0.32 -0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.90 1fq8 h ASN 43 Cb 1.28 -0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.51 1fq8 h ASN 43 CO 0.39 0.95 0.00 -0.62 -2.08 0.00 0.00 177.43 176.07 1fq8 n GLU 44 N -3.42 0.54 -3.58 4.14 1.02 -1.26 -4.78 120.64 113.31 1fq8 n GLU 44 Ca -0.00 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.77 1fq8 n GLU 44 Cb 0.89 -1.24 -0.09 0.00 -0.02 0.00 0.00 31.44 30.99 1fq8 n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1fq8 n GLY 46 N 4.08 -1.13 3.73 0.00 0.00 -1.26 -4.54 105.19 106.06 1fq8 n GLY 46 Ca -0.13 -0.46 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 1fq8 n GLY 46 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fq8 s SER 47 N -3.70 4.44 0.30 1.61 0.01 -1.26 -4.73 113.70 110.36 1fq8 s SER 47 Ca 0.04 2.53 0.05 0.00 1.31 0.00 0.00 55.95 59.88 1fq8 s SER 47 Cb 0.15 -2.61 0.75 0.00 0.21 0.00 0.00 66.02 64.53 1fq8 s SER 47 CO 0.82 -2.11 1.71 0.25 0.41 0.00 0.00 173.24 174.33 1fq8 h LEU 48 N 0.24 0.46 -0.03 2.44 5.85 -1.93 -0.87 115.31 121.47 1fq8 h LEU 48 Ca -0.50 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.36 1fq8 h LEU 48 Cb 1.32 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.44 1fq8 h LEU 48 CO 0.52 0.06 0.02 0.00 -0.34 0.00 0.00 178.44 178.69 1fq8 h ALA 49 N 1.70 0.04 0.00 1.25 0.00 -1.87 -0.66 119.26 119.72 1fq8 h ALA 49 Ca 0.58 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.39 1fq8 h ALA 49 Cb 1.06 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1fq8 h ALA 49 CO -0.49 -0.42 -0.23 0.00 0.00 0.00 0.00 179.25 178.11 1fq8 h PHE 51 N 0.00 0.00 0.00 0.00 3.04 -0.81 -3.19 116.94 115.98 1fq8 h PHE 51 Ca -0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1fq8 h PHE 51 Cb 0.46 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.97 1fq8 h PHE 51 CO 0.00 0.52 0.00 1.28 -2.02 0.00 0.00 178.31 178.09 1fq8 n LEU 52 N -3.59 0.33 -4.20 0.59 4.77 0.01 -4.88 117.00 110.03 1fq8 n LEU 52 Ca -0.00 0.55 -0.12 0.00 -0.03 0.00 0.00 56.01 56.41 1fq8 n LEU 52 Cb 0.60 -0.47 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 1fq8 n LEU 52 CO 0.40 -0.21 -0.28 -1.00 -1.33 0.00 0.00 177.39 174.97 1fq8 s HIS 53 N -3.08 1.10 0.09 -1.77 3.76 -1.02 -5.09 115.29 109.28 1fq8 s HIS 53 Ca 0.10 -1.22 -0.37 0.00 -0.15 0.00 0.00 55.06 53.43 1fq8 s HIS 53 Cb 0.13 -0.60 -0.17 0.00 1.11 0.00 0.00 32.58 33.05 1fq8 s HIS 53 CO 0.46 -0.46 1.29 0.43 -0.85 0.00 0.00 174.74 175.61 1fq8 n SER 54 N -0.22 1.41 -4.71 1.40 7.64 -1.26 -4.84 113.62 113.04 1fq8 n SER 54 Ca -0.03 1.13 -0.23 0.00 1.01 0.00 0.00 58.87 60.75 1fq8 n SER 54 Cb 0.64 -1.16 -0.06 0.00 -1.01 0.00 0.00 64.21 62.62 1fq8 n SER 54 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1fq8 s LYS 55 N 0.33 2.43 -0.24 1.43 1.02 -1.26 -4.38 119.74 119.07 1fq8 s LYS 55 Ca 0.84 -1.43 -0.12 0.00 0.02 0.00 0.00 55.97 55.28 1fq8 s LYS 55 Cb -0.98 -2.23 -0.05 0.00 -0.52 0.00 0.00 37.83 34.05 1fq8 s LYS 55 CO 0.49 0.24 0.23 -0.47 -0.92 0.00 0.00 175.35 174.92 1fq8 s TYR 56 N -2.35 3.32 -0.52 3.18 5.04 -0.15 -4.88 117.35 121.00 1fq8 s TYR 56 Ca 0.35 0.32 -0.17 0.00 -2.44 0.00 0.00 57.07 55.13 1fq8 s TYR 56 Cb -0.05 -2.36 0.09 0.00 0.35 0.00 0.00 41.96 40.00 1fq8 s TYR 56 CO 0.22 0.01 0.52 0.34 -1.34 0.00 0.00 175.55 175.30 1fq8 s ASP 57 N 1.14 6.18 0.31 4.32 -1.08 -1.26 -3.31 116.67 122.98 1fq8 s ASP 57 Ca 0.11 -1.43 0.15 0.00 -0.52 0.00 0.00 52.55 50.86 1fq8 s ASP 57 Cb -0.14 -2.23 0.43 0.00 -1.46 0.00 0.00 42.92 39.52 1fq8 s ASP 57 CO 0.06 -0.84 1.62 1.12 0.52 0.00 0.00 175.17 177.65 1fq8 h HIS 58 N 8.91 0.00 0.00 -5.34 2.07 -1.96 -2.77 115.15 116.06 1fq8 h HIS 58 Ca -0.29 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.23 1fq8 h HIS 58 Cb 1.10 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.08 1fq8 h HIS 58 CO 0.72 0.50 0.00 -0.85 -3.07 0.00 0.00 177.93 175.23 1fq8 n GLU 59 N -3.52 0.48 -0.00 5.12 0.28 -1.26 -1.56 120.64 120.18 1fq8 n GLU 59 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1fq8 n GLU 59 Cb 0.61 -1.30 0.00 0.00 1.43 0.00 0.00 31.44 32.18 1fq8 n GLU 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1fq8 n ALA 60 N -0.80 2.20 -3.03 -1.84 0.00 -1.05 -4.99 120.51 111.01 1fq8 n ALA 60 Ca 0.07 -0.80 -0.35 0.00 0.00 0.00 0.00 53.44 52.36 1fq8 n ALA 60 Cb 0.03 -0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.36 1fq8 n ALA 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1fq8 s SER 61 N -0.61 4.95 0.27 0.00 0.15 -0.60 -4.22 113.70 113.62 1fq8 s SER 61 Ca 0.00 -0.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.49 1fq8 s SER 61 Cb 0.00 -1.84 0.49 0.00 -1.71 0.00 0.00 66.02 62.96 1fq8 s SER 61 CO 0.00 0.09 1.82 0.28 1.20 0.00 0.00 173.24 176.64 1fq8 h SER 62 N 7.29 0.82 -0.71 5.45 0.02 -0.23 -2.89 113.55 123.30 1fq8 h SER 62 Ca -0.35 0.05 0.13 0.00 -0.84 0.00 0.00 61.79 60.78 1fq8 h SER 62 Cb 1.18 -0.11 -0.13 0.00 0.14 0.00 0.00 62.40 63.47 1fq8 h SER 62 CO 0.62 0.45 -0.28 0.77 -1.14 0.00 0.00 176.83 177.25 1fq8 h SER 63 N 0.91 -1.00 -0.64 3.07 4.64 -1.93 -3.46 113.55 115.14 1fq8 h SER 63 Ca 0.46 0.24 -0.53 0.00 -0.47 0.00 0.00 61.79 61.49 1fq8 h SER 63 Cb 0.45 0.55 0.02 0.00 -0.31 0.00 0.00 62.40 63.11 1fq8 h SER 63 CO -0.26 -0.28 0.17 0.00 -0.87 0.00 0.00 176.83 175.59 1fq8 n TYR 64 N -5.47 0.64 -3.45 4.77 9.36 -1.09 -4.49 117.16 117.43 1fq8 n TYR 64 Ca 0.08 0.70 -0.24 0.00 3.32 0.00 0.00 57.90 61.76 1fq8 n TYR 64 Cb 0.38 -1.38 -0.12 0.00 -0.63 0.00 0.00 39.34 37.59 1fq8 n TYR 64 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1fq8 s LYS 65 N 0.62 0.38 0.69 2.98 2.47 -1.09 -4.98 119.74 120.80 1fq8 s LYS 65 Ca 0.62 -0.64 -0.17 0.00 -1.56 0.00 0.00 55.97 54.22 1fq8 s LYS 65 Cb -0.87 -0.97 -0.09 0.00 -1.46 0.00 0.00 37.83 34.45 1fq8 s LYS 65 CO 0.42 -1.09 0.16 0.00 0.16 0.00 0.00 175.35 175.00 1fq8 n ALA 66 N 4.85 -2.47 0.20 3.13 0.00 -1.26 -1.70 120.51 123.25 1fq8 n ALA 66 Ca 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1fq8 n ALA 66 Cb 0.43 -1.63 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1fq8 n ALA 66 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1fq8 n ASN 67 N 1.08 -2.85 0.00 0.00 2.85 -1.26 -4.81 115.26 110.27 1fq8 n ASN 67 Ca 0.08 0.74 0.00 0.00 -0.11 0.00 0.00 54.58 55.29 1fq8 n ASN 67 Cb 0.50 2.73 0.00 0.00 1.24 0.00 0.00 39.78 44.25 1fq8 n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1fq8 n GLY 68 N -0.56 0.60 3.66 8.20 0.00 -0.61 -4.90 105.19 111.58 1fq8 n GLY 68 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1fq8 n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1fq8 n THR 69 N -2.10 2.63 -2.21 2.61 -1.04 -1.26 -4.56 114.28 108.36 1fq8 n THR 69 Ca 0.00 -0.50 -0.40 0.00 -2.04 0.00 0.00 64.05 61.11 1fq8 n THR 69 Cb 0.03 -1.36 -0.02 0.00 -1.82 0.00 0.00 70.33 67.15 1fq8 n THR 69 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1fq8 s GLU 70 N -2.18 4.25 -0.12 -2.82 2.12 -1.26 -1.77 118.70 116.92 1fq8 s GLU 70 Ca 0.63 2.05 0.01 0.00 0.36 0.00 0.00 54.97 58.02 1fq8 s GLU 70 Cb -0.52 -2.93 0.02 0.00 0.26 0.00 0.00 34.13 30.96 1fq8 s GLU 70 CO 0.56 -0.21 -0.12 0.12 -0.54 0.00 0.00 175.26 175.07 1fq8 s PHE 71 N -1.23 1.84 -0.11 5.30 5.36 0.45 -4.83 117.98 124.76 1fq8 s PHE 71 Ca 0.52 -0.92 -0.04 0.00 -0.96 0.00 0.00 56.93 55.53 1fq8 s PHE 71 Cb -0.36 -1.38 0.05 0.00 -0.34 0.00 0.00 43.02 40.99 1fq8 s PHE 71 CO 0.47 -0.52 0.22 0.00 -1.46 0.00 0.00 175.22 173.93 1fq8 s ALA 72 N 1.29 -0.42 0.02 11.12 0.00 -1.26 -0.66 121.76 131.86 1fq8 s ALA 72 Ca -0.01 0.82 0.04 0.00 0.00 0.00 0.00 51.96 52.81 1fq8 s ALA 72 Cb -0.14 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.13 1fq8 s ALA 72 CO -0.05 -0.49 -0.11 -1.50 0.00 0.00 0.00 175.76 173.61 1fq8 s ILE 73 N 2.04 0.87 -0.12 0.00 2.07 -1.13 -5.01 121.20 119.93 1fq8 s ILE 73 Ca -0.01 -0.80 -0.03 0.00 -1.41 0.00 0.00 60.65 58.39 1fq8 s ILE 73 Cb -0.12 -0.79 0.04 0.00 0.13 0.00 0.00 42.46 41.72 1fq8 s ILE 73 CO -0.08 0.00 0.05 0.00 -1.91 0.00 0.00 174.94 173.01 1fq8 s GLN 74 N -0.90 0.27 0.08 3.50 1.03 -1.26 -1.01 119.66 121.37 1fq8 s GLN 74 Ca 0.00 0.02 -0.00 0.00 0.04 0.00 0.00 55.36 55.41 1fq8 s GLN 74 Cb -0.07 -1.34 0.02 0.00 0.03 0.00 0.00 33.01 31.65 1fq8 s GLN 74 CO 0.01 -0.49 0.11 0.66 -2.54 0.00 0.00 175.29 173.04 1fq8 n TYR 75 N 5.21 -3.48 0.08 9.60 4.01 0.19 -4.97 117.16 127.80 1fq8 n TYR 75 Ca -0.06 -0.17 -0.06 0.00 -0.16 0.00 0.00 57.90 57.45 1fq8 n TYR 75 Cb 0.49 -0.08 0.10 0.00 -0.31 0.00 0.00 39.34 39.54 1fq8 n TYR 75 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1fq8 h GLY 76 N -0.09 0.27 -7.17 2.72 0.00 -2.01 -3.38 103.07 93.41 1fq8 h GLY 76 Ca -0.04 -0.35 -0.61 0.00 0.00 0.00 0.00 47.33 46.33 1fq8 h GLY 76 CO 0.04 0.31 -0.72 -0.51 0.00 0.00 0.00 176.54 175.65 1fq8 s THR 77 N -3.69 1.56 0.00 4.70 -4.23 -1.26 -5.09 115.64 107.62 1fq8 s THR 77 Ca -0.04 -2.37 0.00 0.00 -1.18 0.00 0.00 61.69 58.11 1fq8 s THR 77 Cb 0.12 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.84 1fq8 s THR 77 CO 0.80 -0.79 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 1fq8 n GLY 78 N 3.88 3.05 3.19 3.99 0.00 -1.26 -4.96 105.19 113.08 1fq8 n GLY 78 Ca 0.05 -1.57 -0.18 0.00 0.00 0.00 0.00 46.02 44.32 1fq8 n GLY 78 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fq8 s SER 79 N 0.00 1.76 0.28 1.61 0.15 -1.26 0.54 113.70 116.78 1fq8 s SER 79 Ca 0.00 -0.68 -0.10 0.00 0.70 0.00 0.00 55.95 55.87 1fq8 s SER 79 Cb 0.00 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 1fq8 s SER 79 CO 0.00 -0.10 0.49 -1.48 1.20 0.00 0.00 173.24 173.34 1fq8 s LEU 80 N -1.98 0.50 -0.17 3.45 2.34 -0.18 -4.41 118.68 118.24 1fq8 s LEU 80 Ca 0.02 -1.11 -0.10 0.00 0.06 0.00 0.00 54.13 52.99 1fq8 s LEU 80 Cb -0.08 1.72 0.06 0.00 -0.56 0.00 0.00 46.19 47.32 1fq8 s LEU 80 CO 0.02 -1.21 0.42 -1.61 -1.06 0.00 0.00 176.35 172.92 1fq8 s GLU 81 N -3.65 0.42 0.00 1.48 2.02 -1.14 -2.83 118.70 115.01 1fq8 s GLU 81 Ca 0.25 0.77 0.00 0.00 0.02 0.00 0.00 54.97 56.01 1fq8 s GLU 81 Cb -0.01 0.03 0.00 0.00 0.10 0.00 0.00 34.13 34.25 1fq8 s GLU 81 CO 0.12 -0.14 0.00 0.41 0.02 0.00 0.00 175.26 175.67 1fq8 n GLY 82 N 4.02 3.06 3.32 -1.39 0.00 0.16 -0.66 105.19 113.71 1fq8 n GLY 82 Ca -0.21 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.24 1fq8 n GLY 82 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fq8 s TYR 83 N -1.04 -0.26 0.68 1.61 -0.85 -0.97 -0.41 117.35 116.12 1fq8 s TYR 83 Ca 0.00 0.17 -0.17 0.00 -0.52 0.00 0.00 57.07 56.55 1fq8 s TYR 83 Cb 0.00 0.22 -0.02 0.00 0.38 0.00 0.00 41.96 42.55 1fq8 s TYR 83 CO 0.00 -0.59 0.93 -0.89 -1.52 0.00 0.00 175.55 173.48 1fq8 n ILE 84 N 0.39 3.15 -3.83 -3.49 -0.00 -0.73 -0.80 119.36 114.04 1fq8 n ILE 84 Ca -0.18 -0.43 -0.09 0.00 -0.00 0.00 0.00 62.75 62.05 1fq8 n ILE 84 Cb 0.60 -1.09 -0.04 0.00 -0.00 0.00 0.00 39.64 39.11 1fq8 n ILE 84 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.55 176.11 1fq8 s SER 85 N -1.48 -0.19 0.06 4.38 0.01 -0.79 -1.57 113.70 114.13 1fq8 s SER 85 Ca 0.74 -0.63 0.05 0.00 1.31 0.00 0.00 55.95 57.42 1fq8 s SER 85 Cb -0.37 0.58 -0.03 0.00 0.21 0.00 0.00 66.02 66.41 1fq8 s SER 85 CO 0.49 -1.09 -0.15 -1.58 0.41 0.00 0.00 173.24 171.32 1fq8 s GLN 86 N -3.92 0.89 0.00 12.44 0.74 -0.69 -2.43 119.66 126.68 1fq8 s GLN 86 Ca 0.13 -0.91 0.00 0.00 0.05 0.00 0.00 55.36 54.63 1fq8 s GLN 86 Cb -0.01 -0.92 0.00 0.00 1.10 0.00 0.00 33.01 33.18 1fq8 s GLN 86 CO 0.01 0.21 0.00 -3.47 -0.55 0.00 0.00 175.29 171.49 1fq8 n ASP 87 N 1.46 0.00 -4.67 6.67 -0.08 -1.24 -2.68 116.55 116.01 1fq8 n ASP 87 Ca -0.20 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.73 1fq8 n ASP 87 Cb 0.54 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.91 1fq8 n ASP 87 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1fq8 s THR 88 N -2.53 4.80 -0.04 5.18 2.01 -1.20 -1.29 115.64 122.58 1fq8 s THR 88 Ca 0.00 -0.04 -0.02 0.00 0.31 0.00 0.00 61.69 61.94 1fq8 s THR 88 Cb 0.00 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 1fq8 s THR 88 CO 0.00 0.50 0.11 -0.22 -0.69 0.00 0.00 174.62 174.32 1fq8 s LEU 89 N 0.02 4.06 -0.10 4.42 2.96 0.12 -4.10 118.68 126.07 1fq8 s LEU 89 Ca 0.06 0.26 -0.00 0.00 -0.22 0.00 0.00 54.13 54.22 1fq8 s LEU 89 Cb -0.12 -2.25 0.02 0.00 0.50 0.00 0.00 46.19 44.34 1fq8 s LEU 89 CO 0.01 0.31 -0.07 -0.55 -1.32 0.00 0.00 176.35 174.73 1fq8 s SER 90 N -1.54 1.96 -0.49 3.68 0.15 -0.73 0.48 113.70 117.23 1fq8 s SER 90 Ca 0.21 -0.26 -0.09 0.00 0.70 0.00 0.00 55.95 56.52 1fq8 s SER 90 Cb -0.12 -0.75 0.13 0.00 -1.71 0.00 0.00 66.02 63.56 1fq8 s SER 90 CO 0.12 -0.11 0.36 -0.63 1.20 0.00 0.00 173.24 174.18 1fq8 s ILE 91 N 1.59 4.19 0.00 6.45 1.01 -0.56 -0.72 121.20 133.16 1fq8 s ILE 91 Ca 0.02 -1.89 0.00 0.00 0.00 0.00 0.00 60.65 58.77 1fq8 s ILE 91 Cb -0.13 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.58 1fq8 s ILE 91 CO -0.06 -0.79 0.00 0.61 0.00 0.00 0.00 174.94 174.70 1fq8 n GLY 92 N 4.78 3.83 0.34 6.18 0.00 -1.26 -2.10 105.19 116.96 1fq8 n GLY 92 Ca -0.06 0.19 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 1fq8 n GLY 92 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1fq8 h ASP 93 N 0.00 0.99 -3.53 1.61 3.58 -1.94 -3.45 116.42 113.68 1fq8 h ASP 93 Ca 0.00 -0.10 -0.62 0.00 0.42 0.00 0.00 57.03 56.73 1fq8 h ASP 93 Cb 0.00 -0.25 -0.15 0.00 1.72 0.00 0.00 39.33 40.65 1fq8 h ASP 93 CO 0.00 0.82 -0.52 -0.76 -2.88 0.00 0.00 179.24 175.89 1fq8 s LEU 94 N -9.75 4.02 0.03 2.28 1.43 -0.89 -5.10 118.68 110.70 1fq8 s LEU 94 Ca -0.12 0.09 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 1fq8 s LEU 94 Cb 0.17 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.27 1fq8 s LEU 94 CO 0.81 0.08 0.25 -0.89 0.23 0.00 0.00 176.35 176.83 1fq8 s THR 95 N 0.96 5.34 -0.32 5.49 2.01 -1.26 -1.50 115.64 126.35 1fq8 s THR 95 Ca 0.07 -0.06 0.02 0.00 0.31 0.00 0.00 61.69 62.03 1fq8 s THR 95 Cb -0.13 -3.58 0.10 0.00 0.01 0.00 0.00 72.50 68.89 1fq8 s THR 95 CO 0.03 0.26 0.06 -0.51 -0.69 0.00 0.00 174.62 173.78 1fq8 s ILE 96 N -1.40 1.71 0.35 1.82 2.07 0.18 -4.97 121.20 120.96 1fq8 s ILE 96 Ca 0.31 -1.93 -0.05 0.00 -1.41 0.00 0.00 60.65 57.57 1fq8 s ILE 96 Cb -0.13 -2.26 -0.05 0.00 0.13 0.00 0.00 42.46 40.16 1fq8 s ILE 96 CO 0.20 -0.60 0.63 -2.84 -1.91 0.00 0.00 174.94 170.42 1fq8 s PRO 97 N 1.20 3.62 -0.40 3.50 0.02 -1.26 0.15 135.00 141.83 1fq8 s PRO 97 Ca 0.10 0.07 -0.00 0.00 0.02 0.00 0.00 61.00 61.18 1fq8 s PRO 97 Cb -0.18 -2.56 -0.00 0.00 0.02 0.00 0.00 34.50 31.78 1fq8 s PRO 97 CO -0.14 0.09 0.34 1.63 -0.33 0.00 0.00 177.00 178.58 1fq8 n LYS 98 N -1.34 -2.08 -3.38 5.54 5.02 -0.96 -4.91 118.16 116.06 1fq8 n LYS 98 Ca -0.01 0.29 -0.44 0.00 -2.02 0.00 0.00 58.31 56.13 1fq8 n LYS 98 Cb 0.54 -3.56 -0.08 0.00 -0.02 0.00 0.00 35.03 31.91 1fq8 n LYS 98 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1fq8 s GLN 99 N -4.35 2.99 0.18 1.97 2.00 -0.42 -4.90 119.66 117.14 1fq8 s GLN 99 Ca 0.02 -1.28 -0.30 0.00 -2.00 0.00 0.00 55.36 51.80 1fq8 s GLN 99 Cb -0.00 -4.11 -0.08 0.00 0.80 0.00 0.00 33.01 29.62 1fq8 s GLN 99 CO 0.25 -1.02 1.07 -0.51 -0.50 0.00 0.00 175.29 174.58 1fq8 s ASP 100 N 2.52 7.33 0.00 6.67 1.01 -1.26 -3.68 116.67 129.25 1fq8 s ASP 100 Ca 0.05 2.05 0.00 0.00 0.71 0.00 0.00 52.55 55.36 1fq8 s ASP 100 Cb -0.23 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.09 1fq8 s ASP 100 CO 0.07 -0.17 0.00 2.22 0.21 0.00 0.00 175.17 177.51 1fq8 n PHE 101 N 2.31 0.00 -4.01 4.23 1.16 -1.02 -4.80 117.46 115.32 1fq8 n PHE 101 Ca 0.02 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.34 1fq8 n PHE 101 Cb 0.47 0.00 -0.17 0.00 -1.61 0.00 0.00 39.48 38.17 1fq8 n PHE 101 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1fq8 s ALA 102 N -2.00 1.26 -0.07 1.98 0.00 -1.11 -1.89 121.76 119.93 1fq8 s ALA 102 Ca 0.00 -0.49 -0.27 0.00 0.00 0.00 0.00 51.96 51.21 1fq8 s ALA 102 Cb 0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.26 1fq8 s ALA 102 CO 0.00 -0.32 0.85 -1.83 0.00 0.00 0.00 175.76 174.46 1fq8 s GLU 103 N 1.53 4.45 0.06 0.00 -1.05 0.02 -3.25 118.70 120.46 1fq8 s GLU 103 Ca 0.01 1.13 -0.30 0.00 -0.15 0.00 0.00 54.97 55.66 1fq8 s GLU 103 Cb -0.13 -3.49 -0.05 0.00 -0.44 0.00 0.00 34.13 30.02 1fq8 s GLU 103 CO -0.06 -0.09 1.17 0.00 0.95 0.00 0.00 175.26 177.23 1fq8 s ALA 104 N 1.26 3.36 -0.18 -0.84 0.00 0.95 -2.29 121.76 124.03 1fq8 s ALA 104 Ca 0.43 0.81 0.13 0.00 0.00 0.00 0.00 51.96 53.34 1fq8 s ALA 104 Cb -0.19 -3.43 -0.23 0.00 0.00 0.00 0.00 23.12 19.27 1fq8 s ALA 104 CO 0.20 -0.40 0.15 0.25 0.00 0.00 0.00 175.76 175.97 1fq8 n THR 105 N 3.82 1.47 -4.43 0.00 -2.24 0.17 0.43 114.28 113.49 1fq8 n THR 105 Ca 0.08 -0.79 -0.23 0.00 -2.27 0.00 0.00 64.05 60.84 1fq8 n THR 105 Cb 0.47 -0.78 -0.16 0.00 -2.10 0.00 0.00 70.33 67.76 1fq8 n THR 105 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1fq8 s SER 106 N -5.84 1.47 -0.45 3.42 1.04 -0.62 -4.14 113.70 108.57 1fq8 s SER 106 Ca -0.13 -0.24 0.05 0.00 0.48 0.00 0.00 55.95 56.11 1fq8 s SER 106 Cb 0.07 -0.69 0.19 0.00 0.10 0.00 0.00 66.02 65.69 1fq8 s SER 106 CO 0.79 0.00 0.42 -0.62 0.98 0.00 0.00 173.24 174.81 1fq8 n GLU 107 N 3.89 0.60 -1.45 4.02 1.02 -1.26 -2.88 120.64 124.59 1fq8 n GLU 107 Ca -0.24 -3.41 -0.29 0.00 -0.02 0.00 0.00 57.16 53.21 1fq8 n GLU 107 Cb 0.51 -1.67 0.16 0.00 -0.02 0.00 0.00 31.44 30.43 1fq8 n GLU 107 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1fq8 s PRO 108 N -0.52 0.67 0.86 3.49 0.04 -1.26 -4.42 135.00 133.86 1fq8 s PRO 108 Ca 0.33 0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.59 1fq8 s PRO 108 Cb 0.06 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.81 1fq8 s PRO 108 CO -0.17 -2.50 0.00 0.41 0.04 0.00 0.00 177.00 174.78 1fq8 n GLY 109 N -1.99 -2.04 0.07 0.56 0.00 -1.26 -4.76 105.19 95.76 1fq8 n GLY 109 Ca 0.08 -1.52 -0.05 0.00 0.00 0.00 0.00 46.02 44.53 1fq8 n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fq8 n LEU 110 N 0.00 0.00 -0.13 0.99 7.99 -1.26 -4.62 117.00 119.97 1fq8 n LEU 110 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 56.01 55.96 1fq8 n LEU 110 Cb 0.00 0.33 -0.03 0.00 -0.11 0.00 0.00 43.42 43.61 1fq8 n LEU 110 CO 0.00 0.33 0.23 0.41 -1.51 0.00 0.00 177.39 176.86 1fq8 n THR 111 N -2.52 -0.22 0.21 -5.08 -1.04 -1.26 0.44 114.28 104.81 1fq8 n THR 111 Ca -0.22 1.02 0.10 0.00 -2.04 0.00 0.00 64.05 62.90 1fq8 n THR 111 Cb 0.93 -1.28 0.32 0.00 -1.82 0.00 0.00 70.33 68.48 1fq8 n THR 111 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 1fq8 h PHE 112 N 0.00 0.00 0.47 -1.42 0.04 -1.88 -2.46 116.94 111.69 1fq8 h PHE 112 Ca 0.05 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 1fq8 h PHE 112 Cb 0.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 1fq8 h PHE 112 CO -0.48 0.21 -0.23 0.00 -0.60 0.00 0.00 178.31 177.21 1fq8 h ALA 113 N 1.79 -0.63 0.00 2.45 0.00 -0.28 -0.71 119.26 121.89 1fq8 h ALA 113 Ca -0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1fq8 h ALA 113 Cb 0.93 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1fq8 h ALA 113 CO 0.03 -0.83 -0.00 0.74 0.00 0.00 0.00 179.25 179.18 1fq8 h PHE 114 N -0.68 0.00 -4.14 0.00 0.04 -1.38 -3.43 116.94 107.35 1fq8 h PHE 114 Ca -0.06 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.19 1fq8 h PHE 114 Cb 0.51 0.00 0.10 0.00 2.20 0.00 0.00 35.95 38.76 1fq8 h PHE 114 CO -0.03 0.00 0.42 0.20 -0.60 0.00 0.00 178.31 178.30 1fq8 s GLY 115 N -4.15 2.47 0.00 -1.45 0.00 -0.27 -4.91 107.32 99.01 1fq8 s GLY 115 Ca -0.04 0.79 0.17 0.00 0.00 0.00 0.00 44.72 45.63 1fq8 s GLY 115 CO 0.44 1.16 0.99 0.28 0.00 0.00 0.00 173.10 175.98 1fq8 n LYS 116 N -1.90 1.41 -4.00 2.90 5.02 -1.26 -4.98 118.16 115.34 1fq8 n LYS 116 Ca 0.12 -1.35 -0.34 0.00 -2.02 0.00 0.00 58.31 54.72 1fq8 n LYS 116 Cb 0.51 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 34.15 1fq8 n LYS 116 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1fq8 s PHE 117 N -1.50 3.44 0.01 2.13 -0.12 -1.26 -4.95 117.98 115.73 1fq8 s PHE 117 Ca 0.18 0.33 0.10 0.00 -0.05 0.00 0.00 56.93 57.49 1fq8 s PHE 117 Cb 0.14 -1.82 -0.14 0.00 -0.63 0.00 0.00 43.02 40.57 1fq8 s PHE 117 CO 0.25 0.62 1.20 -0.44 -0.05 0.00 0.00 175.22 176.80 1fq8 h ASP 118 N 4.25 0.00 -0.43 1.98 3.32 -0.82 -3.48 116.42 121.23 1fq8 h ASP 118 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1fq8 h ASP 118 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1fq8 h ASP 118 CO 0.63 0.84 0.00 0.61 -1.72 0.00 0.00 179.24 179.61 1fq8 n GLY 119 N 1.35 2.50 3.18 2.75 0.00 -1.12 -4.15 105.19 109.70 1fq8 n GLY 119 Ca -0.03 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.91 1fq8 n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fq8 s ILE 120 N -2.97 1.29 -0.28 -0.61 1.01 -1.22 -0.76 121.20 117.67 1fq8 s ILE 120 Ca 0.00 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.60 1fq8 s ILE 120 Cb 0.00 -1.15 0.08 0.00 0.01 0.00 0.00 42.46 41.39 1fq8 s ILE 120 CO 0.00 0.07 -0.02 -0.22 0.00 0.00 0.00 174.94 174.77 1fq8 s LEU 121 N -1.16 3.25 0.56 2.97 2.96 -0.18 -2.23 118.68 124.85 1fq8 s LEU 121 Ca 0.03 -1.53 -0.18 0.00 -0.22 0.00 0.00 54.13 52.24 1fq8 s LEU 121 Cb -0.08 -1.32 -0.05 0.00 0.50 0.00 0.00 46.19 45.24 1fq8 s LEU 121 CO 0.01 -0.29 1.09 -0.83 -1.32 0.00 0.00 176.35 175.02 1fq8 s GLY 122 N 1.24 2.41 -0.03 7.98 0.00 -0.41 -2.91 107.32 115.60 1fq8 s GLY 122 Ca -0.00 0.64 0.05 0.00 0.00 0.00 0.00 44.72 45.40 1fq8 s GLY 122 CO -0.09 0.98 0.94 1.04 0.00 0.00 0.00 173.10 175.97 1fq8 n LEU 123 N -1.59 1.50 -4.94 0.66 4.77 -0.38 -4.57 117.00 112.45 1fq8 n LEU 123 Ca 0.10 -1.78 -0.29 0.00 -0.03 0.00 0.00 56.01 54.02 1fq8 n LEU 123 Cb 0.52 -0.10 0.18 0.00 -2.33 0.00 0.00 43.42 41.69 1fq8 n LEU 123 CO 0.44 0.43 0.84 -0.83 -1.33 0.00 0.00 177.39 176.93 1fq8 s GLY 124 N -1.26 1.79 0.80 -0.72 0.00 -0.16 -4.81 107.32 102.96 1fq8 s GLY 124 Ca 0.08 -1.31 -0.11 0.00 0.00 0.00 0.00 44.72 43.38 1fq8 s GLY 124 CO 0.01 -0.55 1.11 -0.19 0.00 0.00 0.00 173.10 173.48 1fq8 s TYR 125 N -3.80 2.32 0.23 1.90 1.51 -1.16 -4.76 117.35 113.60 1fq8 s TYR 125 Ca 0.74 1.62 -0.07 0.00 -1.01 0.00 0.00 57.07 58.34 1fq8 s TYR 125 Cb -0.04 -3.14 0.32 0.00 -0.11 0.00 0.00 41.96 38.99 1fq8 s TYR 125 CO 0.52 -2.07 1.81 0.38 -1.11 0.00 0.00 175.55 175.08 1fq8 h ASP 126 N -1.22 0.60 -0.06 2.29 3.04 -1.89 -3.12 116.42 116.07 1fq8 h ASP 126 Ca -0.44 0.04 0.02 0.00 -3.24 0.00 0.00 57.03 53.41 1fq8 h ASP 126 Cb 1.24 -0.08 -0.00 0.00 -1.04 0.00 0.00 39.33 39.45 1fq8 h ASP 126 CO 0.49 0.37 0.97 0.41 -2.04 0.00 0.00 179.24 179.44 1fq8 n THR 127 N -4.77 0.00 -1.80 1.15 -1.04 -1.26 -1.04 114.28 105.52 1fq8 n THR 127 Ca 0.11 0.97 0.02 0.00 -2.04 0.00 0.00 64.05 63.11 1fq8 n THR 127 Cb 0.22 -1.93 0.03 0.00 -1.82 0.00 0.00 70.33 66.83 1fq8 n THR 127 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1fq8 n ILE 128 N -2.46 0.35 -2.53 12.58 3.06 -1.18 -5.02 119.36 124.17 1fq8 n ILE 128 Ca 0.01 -0.42 -0.43 0.00 -2.50 0.00 0.00 62.75 59.42 1fq8 n ILE 128 Cb 0.99 0.38 -0.02 0.00 0.54 0.00 0.00 39.64 41.52 1fq8 n ILE 128 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 1fq8 s SER 129 N -1.32 7.08 0.35 9.51 0.15 -0.21 -4.50 113.70 124.76 1fq8 s SER 129 Ca 0.06 1.68 -0.28 0.00 0.70 0.00 0.00 55.95 58.10 1fq8 s SER 129 Cb 0.05 -2.55 -0.11 0.00 -1.71 0.00 0.00 66.02 61.70 1fq8 s SER 129 CO 0.01 -0.60 1.40 -0.69 1.20 0.00 0.00 173.24 174.55 1fq8 s VAL 130 N 2.55 2.37 -1.59 4.45 1.01 -1.26 -1.96 120.40 125.97 1fq8 s VAL 130 Ca 0.53 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.88 1fq8 s VAL 130 Cb -0.21 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1fq8 s VAL 130 CO 0.18 0.09 0.00 0.47 0.00 0.00 0.00 175.10 175.84 1fq8 n ASP 131 N 0.63 -4.33 -2.91 3.32 8.00 -1.26 -2.14 116.55 117.86 1fq8 n ASP 131 Ca 0.01 0.37 -0.17 0.00 0.71 0.00 0.00 54.79 55.71 1fq8 n ASP 131 Cb 0.40 -3.82 -0.00 0.00 -0.02 0.00 0.00 41.12 37.68 1fq8 n ASP 131 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1fq8 n LYS 132 N -1.85 -2.89 -1.86 -1.24 5.02 -0.83 -4.93 118.16 109.58 1fq8 n LYS 132 Ca -0.15 0.48 -0.39 0.00 -2.02 0.00 0.00 58.31 56.23 1fq8 n LYS 132 Cb 0.52 -5.13 0.02 0.00 -0.02 0.00 0.00 35.03 30.42 1fq8 n LYS 132 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1fq8 s VAL 133 N -2.72 2.23 -0.04 -0.18 1.01 -0.91 -4.93 120.40 114.85 1fq8 s VAL 133 Ca 0.20 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 62.07 1fq8 s VAL 133 Cb -0.11 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 1fq8 s VAL 133 CO 0.25 0.02 1.10 -0.69 0.00 0.00 0.00 175.10 175.77 1fq8 s VAL 134 N -1.27 4.51 0.44 2.92 1.01 -1.26 -4.88 120.40 121.87 1fq8 s VAL 134 Ca 0.64 1.80 -0.24 0.00 0.00 0.00 0.00 61.98 64.19 1fq8 s VAL 134 Cb -0.41 -4.16 -0.08 0.00 0.00 0.00 0.00 36.38 31.74 1fq8 s VAL 134 CO 0.51 0.05 1.16 -2.84 0.00 0.00 0.00 175.10 173.98 1fq8 s PRO 135 N 1.72 3.86 0.18 2.72 0.02 -1.26 -4.67 135.00 137.56 1fq8 s PRO 135 Ca 0.53 1.78 -0.25 0.00 0.02 0.00 0.00 61.00 63.08 1fq8 s PRO 135 Cb -0.23 -2.48 0.06 0.00 0.02 0.00 0.00 34.50 31.87 1fq8 s PRO 135 CO 0.23 -0.47 1.56 -1.35 -0.33 0.00 0.00 177.00 176.64 1fq8 h PRO 136 N 2.23 -0.11 -0.28 5.54 0.11 -1.89 0.83 132.00 138.43 1fq8 h PRO 136 Ca -0.49 0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.71 1fq8 h PRO 136 Cb 1.24 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1fq8 h PRO 136 CO 0.61 -0.07 0.33 0.35 -0.21 0.00 0.00 178.00 179.00 1fq8 h PHE 137 N -0.12 0.00 0.17 0.65 3.57 -1.93 -1.65 116.94 117.63 1fq8 h PHE 137 Ca 0.22 0.00 -0.27 0.00 3.53 0.00 0.00 57.97 61.44 1fq8 h PHE 137 Cb 0.54 0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.31 1fq8 h PHE 137 CO -0.84 0.00 -1.17 1.88 -2.23 0.00 0.00 178.31 175.95 1fq8 h TYR 138 N 0.00 0.85 -0.01 0.41 -1.99 0.33 -3.08 116.97 113.47 1fq8 h TYR 138 Ca 0.13 -0.58 0.03 0.00 2.00 0.00 0.00 58.73 60.31 1fq8 h TYR 138 Cb 0.78 -0.05 -0.05 0.00 2.00 0.00 0.00 36.73 39.41 1fq8 h TYR 138 CO 0.00 1.44 -0.36 -0.91 -0.00 0.00 0.00 178.16 178.33 1fq8 h ASN 139 N 0.02 -1.08 -0.46 3.88 4.21 -0.73 -1.86 115.58 119.56 1fq8 h ASN 139 Ca -0.19 0.14 0.13 0.00 1.21 0.00 0.00 56.30 57.59 1fq8 h ASN 139 Cb 1.90 0.43 -0.02 0.00 -1.12 0.00 0.00 38.32 39.51 1fq8 h ASN 139 CO 0.22 -0.41 0.59 0.00 -1.29 0.00 0.00 177.43 176.54 1fq8 h ALA 140 N 0.16 2.17 0.14 -0.83 0.00 -1.59 0.47 119.26 119.77 1fq8 h ALA 140 Ca 0.06 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.62 1fq8 h ALA 140 Cb 0.60 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1fq8 h ALA 140 CO -0.30 -0.82 -1.74 0.82 0.00 0.00 0.00 179.25 177.21 1fq8 h ILE 141 N 0.00 0.83 -0.69 0.00 2.04 -1.30 -2.61 117.51 115.77 1fq8 h ILE 141 Ca 0.22 -2.40 0.15 0.00 1.00 0.00 0.00 64.86 63.83 1fq8 h ILE 141 Cb 1.39 2.62 -0.11 0.00 -0.74 0.00 0.00 36.82 39.98 1fq8 h ILE 141 CO -0.00 0.81 0.11 -0.61 0.00 0.00 0.00 178.15 178.45 1fq8 h GLN 142 N -0.07 0.20 -0.91 2.37 4.15 0.28 0.11 115.11 121.24 1fq8 h GLN 142 Ca -0.37 -0.01 -0.17 0.00 0.77 0.00 0.00 58.65 58.87 1fq8 h GLN 142 Cb 1.95 -0.05 -0.10 0.00 0.21 0.00 0.00 27.48 29.49 1fq8 h GLN 142 CO 0.09 0.13 0.21 1.04 -1.93 0.00 0.00 178.83 178.38 1fq8 n GLN 143 N -5.21 2.24 -3.02 1.69 6.02 0.13 -4.91 117.38 114.32 1fq8 n GLN 143 Ca 0.12 -1.64 -0.12 0.00 -0.01 0.00 0.00 57.00 55.36 1fq8 n GLN 143 Cb 0.42 -1.74 -0.02 0.00 1.02 0.00 0.00 30.24 29.92 1fq8 n GLN 143 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1fq8 n ASP 144 N -0.09 -1.47 0.20 1.08 8.00 0.39 -4.85 116.55 119.82 1fq8 n ASP 144 Ca 0.25 0.03 0.07 0.00 0.71 0.00 0.00 54.79 55.85 1fq8 n ASP 144 Cb 0.98 -1.35 0.42 0.00 -0.02 0.00 0.00 41.12 41.15 1fq8 n ASP 144 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1fq8 h LEU 145 N -0.25 0.00 -8.74 0.64 3.38 -1.67 -3.45 115.31 105.22 1fq8 h LEU 145 Ca -0.18 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.13 1fq8 h LEU 145 Cb 1.12 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.62 1fq8 h LEU 145 CO 0.25 0.31 -0.87 -0.76 0.09 0.00 0.00 178.44 177.47 1fq8 s LEU 146 N -7.15 2.21 0.12 1.67 1.43 -1.20 -5.04 118.68 110.72 1fq8 s LEU 146 Ca -0.01 -0.62 -0.01 0.00 -1.03 0.00 0.00 54.13 52.46 1fq8 s LEU 146 Cb 0.11 -1.18 -0.13 0.00 0.03 0.00 0.00 46.19 45.02 1fq8 s LEU 146 CO 0.67 0.21 1.28 0.44 0.23 0.00 0.00 176.35 179.17 1fq8 h ASP 147 N 4.55 0.36 -4.13 2.29 3.32 -1.88 -3.46 116.42 117.46 1fq8 h ASP 147 Ca -0.47 -0.32 -0.38 0.00 0.02 0.00 0.00 57.03 55.88 1fq8 h ASP 147 Cb 1.15 -0.11 -0.27 0.00 0.22 0.00 0.00 39.33 40.32 1fq8 h ASP 147 CO 0.42 1.17 -0.77 -1.61 -1.72 0.00 0.00 179.24 176.73 1fq8 s GLU 148 N -3.01 0.71 -1.33 3.56 2.02 -1.20 -5.05 118.70 114.40 1fq8 s GLU 148 Ca -0.04 -0.41 -0.14 0.00 0.02 0.00 0.00 54.97 54.40 1fq8 s GLU 148 Cb 0.09 -0.67 0.10 0.00 0.10 0.00 0.00 34.13 33.74 1fq8 s GLU 148 CO 0.85 0.18 1.86 1.63 0.02 0.00 0.00 175.26 179.81 1fq8 n LYS 149 N 2.60 3.20 -3.45 1.61 5.02 -1.26 -4.37 118.16 121.52 1fq8 n LYS 149 Ca -0.15 -3.22 -0.13 0.00 -2.02 0.00 0.00 58.31 52.79 1fq8 n LYS 149 Cb 0.56 -3.25 -0.03 0.00 -0.02 0.00 0.00 35.03 32.30 1fq8 n LYS 149 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1fq8 s ARG 150 N 2.72 1.21 0.36 1.97 1.70 -1.26 0.23 118.95 125.88 1fq8 s ARG 150 Ca 0.47 -0.29 0.03 0.00 -0.47 0.00 0.00 55.73 55.47 1fq8 s ARG 150 Cb 0.07 0.56 -0.04 0.00 -0.57 0.00 0.00 34.95 34.97 1fq8 s ARG 150 CO -0.00 -0.50 0.10 -0.59 -1.08 0.00 0.00 175.30 173.23 1fq8 s PHE 151 N -3.13 1.82 0.05 5.89 -0.71 -0.83 0.73 117.98 121.80 1fq8 s PHE 151 Ca -0.02 -1.15 -0.22 0.00 -1.04 0.00 0.00 56.93 54.50 1fq8 s PHE 151 Cb -0.01 -1.18 0.05 0.00 -1.21 0.00 0.00 43.02 40.68 1fq8 s PHE 151 CO -0.08 -0.19 0.51 0.00 -1.34 0.00 0.00 175.22 174.13 1fq8 s ALA 152 N -3.31 -1.31 -0.02 1.99 0.00 0.13 -2.52 121.76 116.72 1fq8 s ALA 152 Ca 0.30 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.86 1fq8 s ALA 152 Cb 0.05 0.40 -0.00 0.00 0.00 0.00 0.00 23.12 23.58 1fq8 s ALA 152 CO 0.15 -0.51 -0.12 -0.06 0.00 0.00 0.00 175.76 175.21 1fq8 s PHE 153 N -2.52 1.21 -0.22 0.00 0.40 0.28 -1.49 117.98 115.64 1fq8 s PHE 153 Ca -0.05 -0.29 0.01 0.00 -0.60 0.00 0.00 56.93 56.00 1fq8 s PHE 153 Cb -0.01 -0.82 0.05 0.00 0.51 0.00 0.00 43.02 42.75 1fq8 s PHE 153 CO -0.02 -0.09 -0.11 -0.47 0.70 0.00 0.00 175.22 175.23 1fq8 s TYR 154 N -0.01 2.66 -0.16 0.36 5.04 -0.42 -1.84 117.35 122.98 1fq8 s TYR 154 Ca -0.01 -1.80 -0.06 0.00 -2.44 0.00 0.00 57.07 52.76 1fq8 s TYR 154 Cb -0.08 -1.73 -0.04 0.00 0.35 0.00 0.00 41.96 40.46 1fq8 s TYR 154 CO 0.01 -0.79 0.06 -0.51 -1.34 0.00 0.00 175.55 172.98 1fq8 s LEU 155 N 1.31 3.84 0.73 6.97 1.43 -1.26 -0.53 118.68 131.17 1fq8 s LEU 155 Ca -0.03 0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 53.14 1fq8 s LEU 155 Cb -0.17 -1.95 0.09 0.00 0.03 0.00 0.00 46.19 44.19 1fq8 s LEU 155 CO -0.08 0.23 1.04 -0.83 0.23 0.00 0.00 176.35 176.95 1fq8 s GLY 156 N 0.01 1.72 -0.05 -3.19 0.00 -0.66 -4.62 107.32 100.52 1fq8 s GLY 156 Ca 0.06 -1.13 0.01 0.00 0.00 0.00 0.00 44.72 43.65 1fq8 s GLY 156 CO 0.01 -0.66 -0.06 -0.35 0.00 0.00 0.00 173.10 172.04 1fq8 s ASP 157 N -4.60 4.71 0.48 1.64 -1.08 -1.26 -4.91 116.67 111.65 1fq8 s ASP 157 Ca 0.63 -0.03 0.23 0.00 -0.52 0.00 0.00 52.55 52.87 1fq8 s ASP 157 Cb -0.09 -1.18 1.23 0.00 -1.46 0.00 0.00 42.92 41.41 1fq8 s ASP 157 CO 0.45 0.35 2.00 0.71 0.52 0.00 0.00 175.17 179.20 1fq8 h THR 158 N 4.13 0.73 0.00 1.71 1.35 -1.95 -2.13 112.91 116.74 1fq8 h THR 158 Ca -0.49 -0.73 -0.00 0.00 -0.55 0.00 0.00 66.41 64.64 1fq8 h THR 158 Cb 1.17 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 1fq8 h THR 158 CO 0.53 0.17 -0.00 0.28 -0.25 0.00 0.00 175.52 176.25 1fq8 h SER 159 N 0.00 -0.00 -0.43 5.36 0.02 -1.98 -3.40 113.55 113.12 1fq8 h SER 159 Ca -0.00 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1fq8 h SER 159 Cb 0.44 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.92 1fq8 h SER 159 CO 0.02 0.00 -0.28 0.50 -1.14 0.00 0.00 176.83 175.94 1fq8 h LYS 159 N -0.01 -0.04 -5.84 3.45 3.64 -1.97 -3.42 116.57 112.39 1fq8 h LYS 159 Ca -0.00 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.80 1fq8 h LYS 159 Cb 0.00 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 31.74 1fq8 h LYS 159 CO 0.00 -0.02 -0.51 0.16 -2.27 0.00 0.00 179.45 176.81 1fq8 s ASP 159 N -4.13 4.33 0.03 4.20 -4.77 -0.81 -5.02 116.67 110.51 1fq8 s ASP 159 Ca -0.06 -1.15 -0.03 0.00 -3.30 0.00 0.00 52.55 48.00 1fq8 s ASP 159 Cb 0.05 -0.40 -0.01 0.00 -1.09 0.00 0.00 42.92 41.47 1fq8 s ASP 159 CO 0.30 -0.56 -0.07 0.35 0.70 0.00 0.00 175.17 175.89 1fq8 n THR 159 N -1.21 1.13 0.03 2.11 -2.24 -1.26 -4.16 114.28 108.67 1fq8 n THR 159 Ca -0.02 0.28 -0.18 0.00 -2.27 0.00 0.00 64.05 61.86 1fq8 n THR 159 Cb 0.65 -1.71 -0.08 0.00 -2.10 0.00 0.00 70.33 67.08 1fq8 n THR 159 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1fq8 h GLU 160 N -0.20 0.68 -0.69 -0.78 5.08 -1.95 -3.37 114.58 113.36 1fq8 h GLU 160 Ca -0.02 -0.67 0.06 0.00 -1.00 0.00 0.00 59.36 57.72 1fq8 h GLU 160 Cb 0.35 0.18 -0.08 0.00 0.50 0.00 0.00 28.75 29.69 1fq8 h GLU 160 CO -0.01 1.27 -0.42 -0.97 -1.00 0.00 0.00 179.01 177.88 1fq8 h ASN 161 N 0.41 -1.53 0.00 1.42 -0.00 -1.92 -3.45 115.58 110.51 1fq8 h ASN 161 Ca -0.10 0.23 0.00 0.00 -0.00 0.00 0.00 56.30 56.43 1fq8 h ASN 161 Cb 1.59 0.67 0.00 0.00 -0.00 0.00 0.00 38.32 40.58 1fq8 h ASN 161 CO 0.19 -0.17 0.00 0.61 -0.00 0.00 0.00 177.43 178.06 1fq8 n GLY 162 N -1.18 1.04 0.00 1.57 0.00 -1.26 -4.59 105.19 100.77 1fq8 n GLY 162 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1fq8 n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fq8 n GLY 163 N 0.00 0.61 3.53 -0.02 0.00 -0.99 -1.66 105.19 106.66 1fq8 n GLY 163 Ca 0.00 -1.76 -0.04 0.00 0.00 0.00 0.00 46.02 44.22 1fq8 n GLY 163 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fq8 s GLU 164 N -1.34 0.53 0.02 1.61 2.12 0.31 -1.41 118.70 120.54 1fq8 s GLU 164 Ca 0.00 1.28 -0.02 0.00 0.36 0.00 0.00 54.97 56.59 1fq8 s GLU 164 Cb 0.00 0.57 -0.04 0.00 0.26 0.00 0.00 34.13 34.92 1fq8 s GLU 164 CO 0.00 -0.20 0.20 0.00 -0.54 0.00 0.00 175.26 174.72 1fq8 s ALA 165 N 2.54 3.97 -0.14 6.30 0.00 -0.74 -1.29 121.76 132.40 1fq8 s ALA 165 Ca -0.06 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 1fq8 s ALA 165 Cb -0.11 -1.87 0.04 0.00 0.00 0.00 0.00 23.12 21.18 1fq8 s ALA 165 CO -0.17 0.78 -0.05 0.99 0.00 0.00 0.00 175.76 177.30 1fq8 s THR 166 N -1.40 0.99 -0.38 0.00 2.01 -0.56 -1.43 115.64 114.88 1fq8 s THR 166 Ca 0.31 -0.44 -0.12 0.00 0.31 0.00 0.00 61.69 61.74 1fq8 s THR 166 Cb -0.13 -1.12 0.02 0.00 0.01 0.00 0.00 72.50 71.28 1fq8 s THR 166 CO 0.22 0.21 0.23 -0.36 -0.69 0.00 0.00 174.62 174.23 1fq8 s PHE 167 N 1.70 3.23 0.00 4.92 0.08 -0.04 0.21 117.98 128.09 1fq8 s PHE 167 Ca 0.03 -0.75 0.00 0.00 0.12 0.00 0.00 56.93 56.33 1fq8 s PHE 167 Cb -0.14 -2.48 0.00 0.00 -0.57 0.00 0.00 43.02 39.83 1fq8 s PHE 167 CO -0.08 -0.59 0.00 0.41 -0.10 0.00 0.00 175.22 174.87 1fq8 n GLY 168 N 5.05 1.39 0.00 4.36 0.00 0.22 -2.46 105.19 113.76 1fq8 n GLY 168 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1fq8 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fq8 n GLY 169 N -0.95 3.39 3.20 -0.02 0.00 -1.25 -3.23 105.19 106.32 1fq8 n GLY 169 Ca 0.00 -0.92 -0.15 0.00 0.00 0.00 0.00 46.02 44.95 1fq8 n GLY 169 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1fq8 s ILE 170 N -2.60 1.05 -0.26 -0.61 -4.36 -1.26 -4.43 121.20 108.73 1fq8 s ILE 170 Ca 0.00 -1.70 -0.11 0.00 -0.26 0.00 0.00 60.65 58.58 1fq8 s ILE 170 Cb 0.00 -1.45 -0.05 0.00 1.25 0.00 0.00 42.46 42.21 1fq8 s ILE 170 CO 0.00 -0.55 0.17 -0.62 0.24 0.00 0.00 174.94 174.18 1fq8 s ASP 171 N -2.52 6.05 0.09 4.36 -1.08 -1.26 -4.81 116.67 117.49 1fq8 s ASP 171 Ca 0.07 0.05 0.26 0.00 -0.52 0.00 0.00 52.55 52.42 1fq8 s ASP 171 Cb -0.03 -2.11 0.80 0.00 -1.46 0.00 0.00 42.92 40.13 1fq8 s ASP 171 CO 0.01 0.02 1.67 -0.62 0.52 0.00 0.00 175.17 176.77 1fq8 n GLU 172 N 4.61 0.14 -0.10 4.34 1.02 -1.26 -3.37 120.64 126.02 1fq8 n GLU 172 Ca -0.15 0.08 0.07 0.00 -0.02 0.00 0.00 57.16 57.14 1fq8 n GLU 172 Cb 0.52 -1.63 0.25 0.00 -0.02 0.00 0.00 31.44 30.56 1fq8 n GLU 172 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1fq8 n SER 173 N -1.85 1.27 -0.23 1.62 3.41 -1.26 -3.98 113.62 112.59 1fq8 n SER 173 Ca 0.06 -1.83 0.04 0.00 -0.26 0.00 0.00 58.87 56.87 1fq8 n SER 173 Cb 0.39 -0.13 0.01 0.00 -0.26 0.00 0.00 64.21 64.22 1fq8 n SER 173 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fq8 n LYS 174 N 0.13 1.67 -4.17 4.33 4.76 -1.22 -4.93 118.16 118.73 1fq8 n LYS 174 Ca 0.12 -0.67 -0.11 0.00 -2.87 0.00 0.00 58.31 54.78 1fq8 n LYS 174 Cb 0.23 -1.06 -0.10 0.00 -1.84 0.00 0.00 35.03 32.26 1fq8 n LYS 174 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 1fq8 s PHE 175 N -1.06 1.04 -0.00 2.13 -0.71 -1.26 -1.90 117.98 116.22 1fq8 s PHE 175 Ca 0.08 -1.30 -0.02 0.00 -1.04 0.00 0.00 56.93 54.65 1fq8 s PHE 175 Cb 0.07 -0.49 -0.00 0.00 -1.21 0.00 0.00 43.02 41.39 1fq8 s PHE 175 CO 0.18 -0.64 0.03 -1.59 -1.34 0.00 0.00 175.22 171.86 1fq8 s LYS 176 N -4.13 0.20 0.89 1.99 -2.85 -0.48 -4.81 119.74 110.56 1fq8 s LYS 176 Ca 0.35 -0.23 0.00 0.00 -1.00 0.00 0.00 55.97 55.09 1fq8 s LYS 176 Cb 0.07 0.08 0.00 0.00 -2.06 0.00 0.00 37.83 35.91 1fq8 s LYS 176 CO 0.10 -0.04 0.00 0.41 0.10 0.00 0.00 175.35 175.92 1fq8 n GLY 177 N 2.34 -1.75 3.88 0.59 0.00 -1.26 -3.68 105.19 105.31 1fq8 n GLY 177 Ca -0.18 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 1fq8 n GLY 177 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fq8 s ASP 178 N -4.00 6.61 0.12 1.61 1.01 -1.26 -4.99 116.67 115.77 1fq8 s ASP 178 Ca 0.00 0.90 -0.21 0.00 0.71 0.00 0.00 52.55 53.95 1fq8 s ASP 178 Cb 0.00 -2.22 -0.07 0.00 1.01 0.00 0.00 42.92 41.64 1fq8 s ASP 178 CO 0.00 -0.08 0.65 -0.63 0.21 0.00 0.00 175.17 175.32 1fq8 s ILE 179 N -1.83 4.60 -0.22 0.77 1.01 -1.26 -4.65 121.20 119.63 1fq8 s ILE 179 Ca 0.47 1.37 -0.05 0.00 0.00 0.00 0.00 60.65 62.44 1fq8 s ILE 179 Cb -0.11 -3.97 -0.02 0.00 0.01 0.00 0.00 42.46 38.37 1fq8 s ILE 179 CO 0.22 0.50 -0.01 -0.89 0.00 0.00 0.00 174.94 174.76 1fq8 s THR 180 N -1.17 3.77 -0.09 2.92 2.01 0.10 -4.89 115.64 118.29 1fq8 s THR 180 Ca 0.33 -0.37 -0.22 0.00 0.31 0.00 0.00 61.69 61.74 1fq8 s THR 180 Cb -0.20 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 1fq8 s THR 180 CO 0.22 0.41 0.65 0.26 -0.69 0.00 0.00 174.62 175.46 1fq8 s TRP 181 N 1.28 3.54 -0.21 4.92 0.52 -1.26 -0.04 118.94 127.69 1fq8 s TRP 181 Ca 0.04 1.14 -0.01 0.00 0.02 0.00 0.00 56.10 57.28 1fq8 s TRP 181 Cb -0.15 -2.75 0.01 0.00 -1.15 0.00 0.00 33.47 29.44 1fq8 s TRP 181 CO 0.00 0.08 -0.11 -0.51 0.02 0.00 0.00 176.95 176.43 1fq8 s LEU 182 N 0.89 2.69 -0.00 2.99 1.43 0.91 -4.98 118.68 122.61 1fq8 s LEU 182 Ca 0.34 -0.63 -0.30 0.00 -1.03 0.00 0.00 54.13 52.51 1fq8 s LEU 182 Cb -0.17 -1.62 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 1fq8 s LEU 182 CO 0.15 -0.04 1.36 -2.16 0.23 0.00 0.00 176.35 175.90 1fq8 s PRO 183 N 1.36 4.30 0.05 1.29 0.04 -1.26 -1.48 135.00 139.29 1fq8 s PRO 183 Ca 0.04 1.92 -0.35 0.00 0.04 0.00 0.00 61.00 62.64 1fq8 s PRO 183 Cb -0.14 -3.56 -0.14 0.00 0.04 0.00 0.00 34.50 30.70 1fq8 s PRO 183 CO -0.07 -0.54 1.61 0.28 0.04 0.00 0.00 177.00 178.32 1fq8 n VAL 184 N 4.62 0.16 0.08 -0.36 0.31 -0.51 -4.60 118.33 118.04 1fq8 n VAL 184 Ca 0.13 -0.03 -0.22 0.00 -0.01 0.00 0.00 64.34 64.20 1fq8 n VAL 184 Cb 0.44 -1.44 -0.15 0.00 -0.91 0.00 0.00 33.84 31.78 1fq8 n VAL 184 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1fq8 h ARG 185 N 6.53 0.38 -3.39 5.55 2.43 -1.23 -3.46 114.38 121.19 1fq8 h ARG 185 Ca -0.46 -0.66 -0.35 0.00 -0.81 0.00 0.00 59.98 57.70 1fq8 h ARG 185 Cb 1.28 0.24 -0.37 0.00 -0.42 0.00 0.00 29.97 30.70 1fq8 h ARG 185 CO 0.89 1.31 -0.74 0.50 -1.51 0.00 0.00 179.97 180.42 1fq8 s ARG 186 N -2.51 -0.05 -0.71 0.20 3.52 -1.26 -5.07 118.95 113.08 1fq8 s ARG 186 Ca -0.13 0.31 -0.15 0.00 -0.13 0.00 0.00 55.73 55.63 1fq8 s ARG 186 Cb 0.03 -0.43 -0.12 0.00 -1.56 0.00 0.00 34.95 32.87 1fq8 s ARG 186 CO 0.86 -0.27 1.90 1.63 -0.81 0.00 0.00 175.30 178.61 1fq8 n LYS 187 N 4.91 1.50 0.00 5.12 5.02 -1.26 -3.88 118.16 129.57 1fq8 n LYS 187 Ca -0.12 -1.53 0.00 0.00 -2.02 0.00 0.00 58.31 54.64 1fq8 n LYS 187 Cb 0.50 -2.64 0.00 0.00 -0.02 0.00 0.00 35.03 32.87 1fq8 n LYS 187 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fq8 n ALA 188 N 6.15 2.51 0.02 7.82 0.00 -1.26 -4.71 120.51 131.04 1fq8 n ALA 188 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1fq8 n ALA 188 Cb 0.27 0.31 -0.00 0.00 0.00 0.00 0.00 19.45 20.03 1fq8 n ALA 188 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1fq8 n TYR 189 N -2.48 0.00 -1.51 0.00 4.01 -1.25 -2.96 117.16 112.96 1fq8 n TYR 189 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1fq8 n TYR 189 Cb 0.31 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 1fq8 n TYR 189 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1fq8 n TRP 190 N -1.23 0.00 -3.08 -0.72 5.03 -1.26 -4.53 117.44 111.66 1fq8 n TRP 190 Ca 0.00 0.00 -0.41 0.00 3.03 0.00 0.00 57.50 60.12 1fq8 n TRP 190 Cb 0.01 -0.64 -0.06 0.00 -1.03 0.00 0.00 31.31 29.59 1fq8 n TRP 190 CO 0.00 0.00 0.00 -2.00 -0.03 0.00 0.00 177.69 175.66 1fq8 s GLU 191 N -3.14 4.11 0.45 -0.99 2.12 -1.26 -1.39 118.70 118.60 1fq8 s GLU 191 Ca 0.00 0.58 0.07 0.00 0.36 0.00 0.00 54.97 55.99 1fq8 s GLU 191 Cb 0.00 -3.65 -0.00 0.00 0.26 0.00 0.00 34.13 30.73 1fq8 s GLU 191 CO 0.00 -0.44 0.42 0.14 -0.54 0.00 0.00 175.26 174.84 1fq8 s VAL 192 N 2.56 2.45 -0.04 3.70 -7.23 0.14 -0.67 120.40 121.31 1fq8 s VAL 192 Ca 0.27 -1.33 -0.30 0.00 -1.81 0.00 0.00 61.98 58.81 1fq8 s VAL 192 Cb -0.15 -2.78 -0.03 0.00 0.56 0.00 0.00 36.38 33.97 1fq8 s VAL 192 CO 0.09 0.00 1.06 -0.75 -0.31 0.00 0.00 175.10 175.18 1fq8 s LYS 193 N -4.20 4.46 -0.46 4.82 2.20 -1.26 -1.77 119.74 123.53 1fq8 s LYS 193 Ca 0.47 1.50 -0.15 0.00 -0.36 0.00 0.00 55.97 57.44 1fq8 s LYS 193 Cb -0.03 -3.49 0.07 0.00 -1.51 0.00 0.00 37.83 32.86 1fq8 s LYS 193 CO 0.28 -0.24 0.36 0.12 -0.36 0.00 0.00 175.35 175.51 1fq8 s PHE 194 N 1.58 3.25 -0.20 4.03 5.36 -0.17 0.19 117.98 132.03 1fq8 s PHE 194 Ca 0.52 -0.96 0.17 0.00 -0.96 0.00 0.00 56.93 55.70 1fq8 s PHE 194 Cb -0.22 -3.06 -0.24 0.00 -0.34 0.00 0.00 43.02 39.16 1fq8 s PHE 194 CO 0.24 -0.77 0.07 0.39 -1.46 0.00 0.00 175.22 173.68 1fq8 n GLU 195 N 5.16 0.69 -3.56 10.12 1.02 -0.48 -4.18 120.64 129.40 1fq8 n GLU 195 Ca -0.12 0.01 -0.17 0.00 -0.02 0.00 0.00 57.16 56.86 1fq8 n GLU 195 Cb 0.44 -1.53 -0.06 0.00 -0.02 0.00 0.00 31.44 30.27 1fq8 n GLU 195 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1fq8 s GLY 196 N -5.55 -0.52 -0.11 0.62 0.00 -1.17 0.11 107.32 100.70 1fq8 s GLY 196 Ca -0.12 1.20 -0.04 0.00 0.00 0.00 0.00 44.72 45.76 1fq8 s GLY 196 CO 0.81 0.86 0.23 -1.50 0.00 0.00 0.00 173.10 173.51 1fq8 s ILE 197 N -1.17 -0.30 0.02 0.90 2.07 -0.84 -0.82 121.20 121.06 1fq8 s ILE 197 Ca -0.11 0.27 -0.22 0.00 -1.41 0.00 0.00 60.65 59.18 1fq8 s ILE 197 Cb -0.01 -0.39 0.05 0.00 0.13 0.00 0.00 42.46 42.24 1fq8 s ILE 197 CO 0.09 0.11 0.50 -0.83 -1.91 0.00 0.00 174.94 172.90 1fq8 s GLY 198 N 2.15 -0.39 -0.02 1.50 0.00 -0.92 -1.52 107.32 108.13 1fq8 s GLY 198 Ca -0.00 0.63 -0.05 0.00 0.00 0.00 0.00 44.72 45.29 1fq8 s GLY 198 CO -0.08 0.34 0.12 -2.27 0.00 0.00 0.00 173.10 171.21 1fq8 s LEU 199 N -1.76 1.60 0.00 0.66 0.20 -0.87 -1.46 118.68 117.06 1fq8 s LEU 199 Ca -0.07 -0.01 0.00 0.00 0.69 0.00 0.00 54.13 54.74 1fq8 s LEU 199 Cb -0.01 0.50 0.00 0.00 -0.43 0.00 0.00 46.19 46.25 1fq8 s LEU 199 CO 0.01 -0.20 0.00 0.61 -0.29 0.00 0.00 176.35 176.48 1fq8 n GLY 200 N 2.24 4.17 0.90 7.98 0.00 -1.26 -2.67 105.19 116.55 1fq8 n GLY 200 Ca -0.18 0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1fq8 n GLY 200 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fq8 n ASP 201 N 8.16 2.66 -3.67 1.61 8.00 -1.26 -4.87 116.55 127.18 1fq8 n ASP 201 Ca 0.00 -1.89 -0.19 0.00 0.71 0.00 0.00 54.79 53.42 1fq8 n ASP 201 Cb 0.00 -0.22 -0.17 0.00 -0.02 0.00 0.00 41.12 40.71 1fq8 n ASP 201 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1fq8 s GLU 202 N -1.57 -0.04 -0.21 -1.24 2.02 -1.09 -5.12 118.70 111.46 1fq8 s GLU 202 Ca 0.35 0.43 -0.01 0.00 0.02 0.00 0.00 54.97 55.77 1fq8 s GLU 202 Cb 0.20 -0.41 0.01 0.00 0.10 0.00 0.00 34.13 34.03 1fq8 s GLU 202 CO 0.28 -0.31 -0.12 -0.47 0.02 0.00 0.00 175.26 174.66 1fq8 s TYR 203 N 2.15 2.91 0.03 1.61 5.04 -1.26 -2.05 117.35 125.79 1fq8 s TYR 203 Ca 0.04 -1.45 -0.22 0.00 -2.44 0.00 0.00 57.07 53.00 1fq8 s TYR 203 Cb -0.12 -2.00 -0.06 0.00 0.35 0.00 0.00 41.96 40.13 1fq8 s TYR 203 CO -0.04 -0.72 0.66 0.00 -1.34 0.00 0.00 175.55 174.11 1fq8 s ALA 204 N 1.35 3.46 -0.13 3.97 0.00 -0.57 -4.98 121.76 124.85 1fq8 s ALA 204 Ca 0.04 0.14 -0.06 0.00 0.00 0.00 0.00 51.96 52.07 1fq8 s ALA 204 Cb -0.14 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 20.11 1fq8 s ALA 204 CO -0.08 0.17 0.10 -1.21 0.00 0.00 0.00 175.76 174.74 1fq8 s GLU 205 N -0.33 3.46 -0.00 0.00 2.02 -1.26 -1.99 118.70 120.60 1fq8 s GLU 205 Ca 0.34 -0.22 0.07 0.00 0.02 0.00 0.00 54.97 55.18 1fq8 s GLU 205 Cb -0.19 -3.13 -0.02 0.00 0.10 0.00 0.00 34.13 30.89 1fq8 s GLU 205 CO 0.20 0.67 -0.22 -0.51 0.02 0.00 0.00 175.26 175.43 1fq8 s LEU 206 N -0.74 2.07 -0.04 1.80 1.43 0.12 -4.95 118.68 118.36 1fq8 s LEU 206 Ca 0.13 -0.43 0.07 0.00 -1.03 0.00 0.00 54.13 52.87 1fq8 s LEU 206 Cb -0.12 -1.10 -0.01 0.00 0.03 0.00 0.00 46.19 44.99 1fq8 s LEU 206 CO 0.03 0.25 -0.25 -1.61 0.23 0.00 0.00 176.35 174.99 1fq8 s GLU 207 N -0.67 2.38 -1.35 1.70 2.02 -1.26 -4.63 118.70 116.89 1fq8 s GLU 207 Ca 0.08 -0.91 -0.06 0.00 0.02 0.00 0.00 54.97 54.10 1fq8 s GLU 207 Cb -0.08 -2.11 0.02 0.00 0.10 0.00 0.00 34.13 32.06 1fq8 s GLU 207 CO -0.00 0.44 1.02 0.43 0.02 0.00 0.00 175.26 177.18 1fq8 n SER 208 N 2.77 -4.19 -4.44 -0.19 7.64 -1.26 -5.02 113.62 108.93 1fq8 n SER 208 Ca -0.17 -0.65 -0.33 0.00 1.01 0.00 0.00 58.87 58.73 1fq8 n SER 208 Cb 0.52 -4.67 -0.14 0.00 -1.01 0.00 0.00 64.21 58.91 1fq8 n SER 208 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1fq8 s HIS 209 N -3.38 2.71 0.34 1.43 3.76 -1.26 -4.21 115.29 114.68 1fq8 s HIS 209 Ca 0.37 -0.30 0.09 0.00 -0.15 0.00 0.00 55.06 55.06 1fq8 s HIS 209 Cb -0.17 -1.68 -0.07 0.00 1.11 0.00 0.00 32.58 31.78 1fq8 s HIS 209 CO 0.76 0.07 -0.08 0.20 -0.85 0.00 0.00 174.74 174.85 1fq8 s GLY 210 N -0.45 2.18 -0.08 -2.22 0.00 -0.84 -0.99 107.32 104.91 1fq8 s GLY 210 Ca 0.05 -2.09 0.03 0.00 0.00 0.00 0.00 44.72 42.71 1fq8 s GLY 210 CO 0.02 -2.01 -0.16 0.00 0.00 0.00 0.00 173.10 170.94 1fq8 s ALA 212 N -2.68 1.61 -0.36 3.20 0.00 -0.73 0.60 121.76 123.41 1fq8 s ALA 212 Ca 0.32 -0.64 -0.22 0.00 0.00 0.00 0.00 51.96 51.43 1fq8 s ALA 212 Cb 0.03 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 22.47 1fq8 s ALA 212 CO 0.16 0.14 0.70 0.00 0.00 0.00 0.00 175.76 176.76 1fq8 s ALA 213 N 0.62 3.44 -0.72 0.00 0.00 0.15 0.25 121.76 125.50 1fq8 s ALA 213 Ca -0.15 -0.77 -0.24 0.00 0.00 0.00 0.00 51.96 50.80 1fq8 s ALA 213 Cb -0.16 -3.26 0.06 0.00 0.00 0.00 0.00 23.12 19.75 1fq8 s ALA 213 CO 0.05 -1.41 1.12 0.42 0.00 0.00 0.00 175.76 175.93 1fq8 s ILE 214 N 2.88 4.09 -0.31 0.00 -1.09 -0.49 -1.97 121.20 124.31 1fq8 s ILE 214 Ca 0.27 -0.15 0.01 0.00 -2.23 0.00 0.00 60.65 58.55 1fq8 s ILE 214 Cb -0.14 -4.80 0.07 0.00 -1.58 0.00 0.00 42.46 36.01 1fq8 s ILE 214 CO 0.16 -1.64 0.01 -0.62 -1.23 0.00 0.00 174.94 171.62 1fq8 s ASP 215 N 3.77 4.80 0.01 3.58 -1.08 -1.18 -4.77 116.67 121.81 1fq8 s ASP 215 Ca 0.29 -1.60 0.27 0.00 -0.52 0.00 0.00 52.55 50.98 1fq8 s ASP 215 Cb -0.12 -1.67 1.13 0.00 -1.46 0.00 0.00 42.92 40.80 1fq8 s ASP 215 CO 0.10 -0.31 1.86 0.35 0.52 0.00 0.00 175.17 177.69 1fq8 n THR 216 N 4.49 0.18 0.79 1.71 -2.24 -1.26 -3.57 114.28 114.37 1fq8 n THR 216 Ca -0.08 0.02 0.11 0.00 -2.27 0.00 0.00 64.05 61.83 1fq8 n THR 216 Cb 0.42 -0.58 0.29 0.00 -2.10 0.00 0.00 70.33 68.36 1fq8 n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fq8 n GLY 217 N 1.27 0.97 3.54 3.38 0.00 -1.26 -4.75 105.19 108.34 1fq8 n GLY 217 Ca 0.06 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 1fq8 n GLY 217 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fq8 s THR 218 N -1.65 3.96 0.06 2.61 2.01 -1.23 -5.03 115.64 116.38 1fq8 s THR 218 Ca 0.35 -0.34 -0.19 0.00 0.31 0.00 0.00 61.69 61.82 1fq8 s THR 218 Cb 0.20 -2.71 -0.11 0.00 0.01 0.00 0.00 72.50 69.88 1fq8 s THR 218 CO 0.28 0.52 1.41 0.28 -0.69 0.00 0.00 174.62 176.42 1fq8 h SER 219 N 6.32 0.47 -1.15 3.53 0.02 -1.89 -0.99 113.55 119.86 1fq8 h SER 219 Ca -0.36 -0.43 0.00 0.00 -0.84 0.00 0.00 61.79 60.16 1fq8 h SER 219 Cb 1.19 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1fq8 h SER 219 CO 0.61 0.80 0.00 0.18 -1.14 0.00 0.00 176.83 177.28 1fq8 n LEU 220 N -4.52 0.00 -4.10 5.07 4.77 -1.26 -3.05 117.00 113.91 1fq8 n LEU 220 Ca -0.05 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.63 1fq8 n LEU 220 Cb 0.35 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.27 1fq8 n LEU 220 CO 0.40 0.00 -0.51 -0.63 -1.33 0.00 0.00 177.39 175.31 1fq8 s ILE 221 N 2.18 1.75 -0.12 -0.08 1.01 -0.59 -1.10 121.20 124.25 1fq8 s ILE 221 Ca 0.00 -0.78 -0.04 0.00 0.00 0.00 0.00 60.65 59.83 1fq8 s ILE 221 Cb 0.00 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 1fq8 s ILE 221 CO 0.00 0.49 0.03 0.42 0.00 0.00 0.00 174.94 175.88 1fq8 s THR 222 N 1.00 4.50 0.25 2.92 -4.23 0.25 -1.05 115.64 119.28 1fq8 s THR 222 Ca -0.05 -0.16 0.08 0.00 -1.18 0.00 0.00 61.69 60.38 1fq8 s THR 222 Cb -0.15 -2.95 -0.05 0.00 1.34 0.00 0.00 72.50 70.69 1fq8 s THR 222 CO -0.03 0.55 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.73 1fq8 s LEU 223 N -0.40 2.53 0.38 4.79 1.43 -0.09 -1.23 118.68 126.09 1fq8 s LEU 223 Ca 0.08 -1.10 -0.24 0.00 -1.03 0.00 0.00 54.13 51.84 1fq8 s LEU 223 Cb -0.12 -0.70 -0.13 0.00 0.03 0.00 0.00 46.19 45.27 1fq8 s LEU 223 CO 0.02 -0.23 0.74 -2.65 0.23 0.00 0.00 176.35 174.46 1fq8 n PRO 224 N -0.50 0.84 -0.11 1.29 -0.02 -1.25 -1.15 135.00 134.09 1fq8 n PRO 224 Ca -0.06 0.30 0.08 0.00 -2.02 0.00 0.00 63.50 61.79 1fq8 n PRO 224 Cb 0.62 -1.65 0.42 0.00 -0.02 0.00 0.00 33.50 32.86 1fq8 n PRO 224 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1fq8 h SER 225 N 1.20 0.53 0.52 2.55 4.64 -1.91 -2.78 113.55 118.30 1fq8 h SER 225 Ca -0.40 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.76 1fq8 h SER 225 Cb 1.38 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 1fq8 h SER 225 CO 0.55 0.34 -0.70 1.23 -0.87 0.00 0.00 176.83 177.38 1fq8 h GLY 226 N 0.60 0.17 1.86 -0.77 0.00 -1.97 -2.56 103.07 100.41 1fq8 h GLY 226 Ca 0.27 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.28 1fq8 h GLY 226 CO -0.08 0.22 -0.31 1.41 0.00 0.00 0.00 176.54 177.78 1fq8 h LEU 227 N 0.11 0.16 0.11 3.11 3.38 -1.84 -2.93 115.31 117.40 1fq8 h LEU 227 Ca -0.02 -0.05 -0.27 0.00 0.09 0.00 0.00 57.88 57.63 1fq8 h LEU 227 Cb 1.24 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 1fq8 h LEU 227 CO 0.10 0.47 -1.22 0.00 0.09 0.00 0.00 178.44 177.89 1fq8 h ALA 228 N 1.54 0.14 -0.39 1.53 0.00 -1.40 -2.83 119.26 117.86 1fq8 h ALA 228 Ca 0.02 -0.90 -0.07 0.00 0.00 0.00 0.00 54.91 53.95 1fq8 h ALA 228 Cb 0.63 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1fq8 h ALA 228 CO 0.05 1.02 -0.07 0.93 0.00 0.00 0.00 179.25 181.18 1fq8 h GLU 229 N 0.06 0.65 0.48 0.00 5.08 -1.45 -2.11 114.58 117.30 1fq8 h GLU 229 Ca -0.12 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.03 1fq8 h GLU 229 Cb 1.94 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.13 1fq8 h GLU 229 CO 0.19 0.72 -0.23 1.98 -1.00 0.00 0.00 179.01 180.67 1fq8 h MET 230 N 0.61 -0.62 -0.72 2.33 4.05 -1.56 -0.09 114.93 118.92 1fq8 h MET 230 Ca 0.11 0.04 0.12 0.00 -0.28 0.00 0.00 59.70 59.70 1fq8 h MET 230 Cb 0.49 0.14 -0.08 0.00 -0.80 0.00 0.00 31.60 31.34 1fq8 h MET 230 CO 0.03 -0.41 0.31 0.82 0.23 0.00 0.00 176.91 177.88 1fq8 h ILE 231 N -0.73 0.73 -0.18 1.77 5.03 -1.54 0.81 117.51 123.39 1fq8 h ILE 231 Ca -0.07 -0.17 -0.10 0.00 -0.12 0.00 0.00 64.86 64.40 1fq8 h ILE 231 Cb 0.49 0.20 -0.01 0.00 -3.03 0.00 0.00 36.82 34.47 1fq8 h ILE 231 CO 0.11 0.09 -0.34 0.78 -0.68 0.00 0.00 178.15 178.11 1fq8 h ASN 232 N 0.49 0.39 -0.18 1.72 -0.26 -1.41 0.11 115.58 116.44 1fq8 h ASN 232 Ca 0.38 -0.15 -0.03 0.00 -0.56 0.00 0.00 56.30 55.94 1fq8 h ASN 232 Cb 0.52 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.66 1fq8 h ASN 232 CO -0.35 0.71 -0.02 0.00 -1.06 0.00 0.00 177.43 176.71 1fq8 h ALA 233 N 1.32 0.24 -0.09 -0.83 0.00 0.39 -0.45 119.26 119.83 1fq8 h ALA 233 Ca 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1fq8 h ALA 233 Cb 0.75 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1fq8 h ALA 233 CO 0.06 -0.02 -0.05 0.93 0.00 0.00 0.00 179.25 180.16 1fq8 h GLU 234 N 0.05 0.12 -0.45 0.00 5.08 -0.53 -2.73 114.58 116.13 1fq8 h GLU 234 Ca 0.05 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1fq8 h GLU 234 Cb 0.43 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1fq8 h GLU 234 CO 0.01 0.19 0.00 0.44 -1.00 0.00 0.00 179.01 178.65 1fq8 n ILE 235 N -4.40 0.59 -0.49 3.13 -5.35 0.35 -4.91 119.36 108.28 1fq8 n ILE 235 Ca -0.02 -0.74 0.00 0.00 -0.27 0.00 0.00 62.75 61.72 1fq8 n ILE 235 Cb 0.18 0.74 0.00 0.00 -1.74 0.00 0.00 39.64 38.82 1fq8 n ILE 235 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1fq8 n GLY 236 N 1.48 0.85 3.70 3.28 0.00 -1.02 -4.97 105.19 108.51 1fq8 n GLY 236 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1fq8 n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fq8 s ALA 237 N -3.03 3.47 -0.00 4.61 0.00 -0.21 -4.71 121.76 121.89 1fq8 s ALA 237 Ca 0.00 0.76 0.01 0.00 0.00 0.00 0.00 51.96 52.73 1fq8 s ALA 237 Cb 0.00 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1fq8 s ALA 237 CO 0.00 -0.67 0.00 0.15 0.00 0.00 0.00 175.76 175.24 1fq8 s LYS 238 N 1.82 2.79 -1.11 0.00 3.01 0.23 -4.51 119.74 121.97 1fq8 s LYS 238 Ca 0.58 -0.61 -0.23 0.00 -1.01 0.00 0.00 55.97 54.71 1fq8 s LYS 238 Cb -0.28 -2.67 -0.05 0.00 -1.01 0.00 0.00 37.83 33.82 1fq8 s LYS 238 CO 0.25 0.63 1.88 0.21 0.51 0.00 0.00 175.35 178.83 1fq8 s LYS 239 N -1.54 2.77 0.18 1.68 2.20 -1.26 -0.96 119.74 122.80 1fq8 s LYS 239 Ca 0.19 -1.02 -0.03 0.00 -0.36 0.00 0.00 55.97 54.76 1fq8 s LYS 239 Cb -0.11 -5.24 0.04 0.00 -1.51 0.00 0.00 37.83 31.01 1fq8 s LYS 239 CO 0.10 -3.48 0.18 0.41 -0.36 0.00 0.00 175.35 172.20 1fq8 n GLY 240 N 6.13 -1.99 0.00 5.54 0.00 -1.05 -4.69 105.19 109.13 1fq8 n GLY 240 Ca 0.43 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1fq8 n GLY 240 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1fq8 n TRP 241 N -2.64 0.00 -3.13 1.61 4.27 -1.26 -2.85 117.44 113.44 1fq8 n TRP 241 Ca 0.02 0.00 -0.21 0.00 -3.89 0.00 0.00 57.50 53.42 1fq8 n TRP 241 Cb 0.09 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 29.99 1fq8 n TRP 241 CO 0.00 0.00 0.00 2.41 -2.29 0.00 0.00 177.69 177.81 1fq8 n THR 242 N 0.00 -0.62 -0.90 -1.67 -1.04 -1.26 -4.95 114.28 103.84 1fq8 n THR 242 Ca 0.00 -3.49 -0.05 0.00 -2.04 0.00 0.00 64.05 58.47 1fq8 n THR 242 Cb 0.00 -1.31 -0.02 0.00 -1.82 0.00 0.00 70.33 67.18 1fq8 n THR 242 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1fq8 n GLY 243 N 1.60 0.48 3.60 3.41 0.00 -1.13 -4.92 105.19 108.23 1fq8 n GLY 243 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1fq8 n GLY 243 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fq8 s GLN 244 N -1.94 2.45 -0.27 1.61 2.00 -1.26 -5.01 119.66 117.24 1fq8 s GLN 244 Ca 0.00 -0.81 -0.21 0.00 -2.00 0.00 0.00 55.36 52.34 1fq8 s GLN 244 Cb 0.00 -2.46 -0.01 0.00 0.80 0.00 0.00 33.01 31.34 1fq8 s GLN 244 CO 0.00 0.57 0.66 0.71 -0.50 0.00 0.00 175.29 176.73 1fq8 s TYR 245 N -1.08 3.26 0.26 1.67 1.51 -1.26 -2.54 117.35 119.17 1fq8 s TYR 245 Ca 0.19 0.78 0.09 0.00 -1.01 0.00 0.00 57.07 57.12 1fq8 s TYR 245 Cb -0.11 -2.92 -0.04 0.00 -0.11 0.00 0.00 41.96 38.78 1fq8 s TYR 245 CO 0.10 -0.39 0.02 0.95 -1.11 0.00 0.00 175.55 175.13 1fq8 s THR 246 N 2.59 3.59 0.05 -0.71 -4.23 -0.14 -0.57 115.64 116.23 1fq8 s THR 246 Ca 0.27 -1.81 -0.01 0.00 -1.18 0.00 0.00 61.69 58.96 1fq8 s THR 246 Cb -0.15 -2.91 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 1fq8 s THR 246 CO 0.09 -0.35 -0.02 -1.48 -0.54 0.00 0.00 174.62 172.33 1fq8 s LEU 247 N -3.63 2.39 -0.14 4.79 2.34 -0.70 -0.60 118.68 123.13 1fq8 s LEU 247 Ca 0.31 -0.92 -0.29 0.00 0.06 0.00 0.00 54.13 53.29 1fq8 s LEU 247 Cb -0.07 0.24 -0.03 0.00 -0.56 0.00 0.00 46.19 45.78 1fq8 s LEU 247 CO 0.20 -0.57 1.44 -0.62 -1.06 0.00 0.00 176.35 175.74 1fq8 s ASP 248 N -2.74 6.76 0.21 1.48 2.15 -1.26 -3.86 116.67 119.41 1fq8 s ASP 248 Ca 0.04 1.83 0.10 0.00 0.43 0.00 0.00 52.55 54.96 1fq8 s ASP 248 Cb 0.06 -2.54 0.57 0.00 -0.30 0.00 0.00 42.92 40.71 1fq8 s ASP 248 CO -0.09 -0.90 1.23 0.00 -0.17 0.00 0.00 175.17 175.24 1fq8 n ASN 250 N -1.86 0.82 0.11 0.00 5.03 -1.26 -3.82 115.26 114.28 1fq8 n ASN 250 Ca -0.01 -0.67 0.12 0.00 0.87 0.00 0.00 54.58 54.89 1fq8 n ASN 250 Cb 0.19 0.14 0.27 0.00 -1.02 0.00 0.00 39.78 39.35 1fq8 n ASN 250 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1fq8 h THR 251 N 0.82 0.00 -0.29 3.41 1.35 -1.77 -3.35 112.91 113.08 1fq8 h THR 251 Ca 0.00 -0.60 0.08 0.00 -0.55 0.00 0.00 66.41 65.34 1fq8 h THR 251 Cb 0.49 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.33 1fq8 h THR 251 CO 0.00 0.00 0.29 0.03 -0.25 0.00 0.00 175.52 175.59 1fq8 h ARG 252 N 0.00 0.00 0.00 4.72 3.08 -1.74 -0.37 114.38 120.06 1fq8 h ARG 252 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1fq8 h ARG 252 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1fq8 h ARG 252 CO 0.00 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 178.65 1fq8 n ASP 253 N -3.88 0.62 -0.66 7.04 8.00 -1.26 -3.00 116.55 123.42 1fq8 n ASP 253 Ca 0.04 0.56 0.06 0.00 0.71 0.00 0.00 54.79 56.16 1fq8 n ASP 253 Cb 0.44 -0.73 0.16 0.00 -0.02 0.00 0.00 41.12 40.97 1fq8 n ASP 253 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1fq8 n ASN 254 N -2.09 2.93 -4.94 -2.24 5.03 -0.20 -5.02 115.26 108.73 1fq8 n ASN 254 Ca 0.06 -1.98 -0.24 0.00 0.87 0.00 0.00 54.58 53.28 1fq8 n ASN 254 Cb 0.40 -0.23 -0.01 0.00 -1.02 0.00 0.00 39.78 38.92 1fq8 n ASN 254 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1fq8 s LEU 255 N -1.00 4.00 0.55 3.41 1.43 -0.88 -5.10 118.68 121.11 1fq8 s LEU 255 Ca 0.24 0.48 0.04 0.00 -1.03 0.00 0.00 54.13 53.86 1fq8 s LEU 255 Cb 0.12 -3.34 0.05 0.00 0.03 0.00 0.00 46.19 43.05 1fq8 s LEU 255 CO 0.16 -0.30 0.77 -2.16 0.23 0.00 0.00 176.35 175.05 1fq8 s PRO 256 N -4.27 2.42 0.22 1.29 0.04 -1.26 -4.81 135.00 128.63 1fq8 s PRO 256 Ca 0.40 -1.09 -0.30 0.00 0.04 0.00 0.00 61.00 60.05 1fq8 s PRO 256 Cb -0.10 -2.55 -0.09 0.00 0.04 0.00 0.00 34.50 31.80 1fq8 s PRO 256 CO 0.36 -0.76 1.33 -0.51 0.04 0.00 0.00 177.00 177.46 1fq8 s ASP 257 N -4.50 6.84 0.02 6.66 1.11 -1.26 -4.45 116.67 121.09 1fq8 s ASP 257 Ca 0.59 2.48 -0.17 0.00 0.18 0.00 0.00 52.55 55.63 1fq8 s ASP 257 Cb -0.09 -2.62 -0.06 0.00 1.07 0.00 0.00 42.92 41.23 1fq8 s ASP 257 CO 0.38 -0.56 0.49 -0.22 1.18 0.00 0.00 175.17 176.45 1fq8 s LEU 258 N -0.36 4.48 -0.23 1.23 2.96 0.11 -4.45 118.68 122.42 1fq8 s LEU 258 Ca 0.56 1.08 0.01 0.00 -0.22 0.00 0.00 54.13 55.56 1fq8 s LEU 258 Cb -0.38 -2.74 0.04 0.00 0.50 0.00 0.00 46.19 43.61 1fq8 s LEU 258 CO 0.41 0.26 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.95 1fq8 s ILE 259 N -0.87 2.37 0.14 6.68 1.01 -0.53 -1.53 121.20 128.46 1fq8 s ILE 259 Ca 0.26 -1.22 0.00 0.00 0.00 0.00 0.00 60.65 59.69 1fq8 s ILE 259 Cb -0.18 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1fq8 s ILE 259 CO 0.16 0.22 0.31 -0.36 0.00 0.00 0.00 174.94 175.27 1fq8 s PHE 260 N 1.23 3.49 -0.16 3.97 0.40 0.12 -2.16 117.98 124.87 1fq8 s PHE 260 Ca -0.02 0.27 -0.00 0.00 -0.60 0.00 0.00 56.93 56.58 1fq8 s PHE 260 Cb -0.17 -1.78 0.04 0.00 0.51 0.00 0.00 43.02 41.62 1fq8 s PHE 260 CO -0.07 0.48 -0.06 1.21 0.70 0.00 0.00 175.22 177.48 1fq8 s ASN 261 N -2.96 2.80 -0.23 1.36 3.04 -0.00 -1.10 114.94 117.85 1fq8 s ASN 261 Ca 0.37 -0.64 -0.04 0.00 0.04 0.00 0.00 52.86 52.58 1fq8 s ASN 261 Cb -0.12 -0.92 -0.00 0.00 -1.54 0.00 0.00 41.25 38.67 1fq8 s ASN 261 CO 0.28 -0.18 -0.03 -0.36 -3.04 0.00 0.00 177.10 173.77 1fq8 s PHE 262 N 1.63 2.99 -1.60 0.43 0.08 -0.36 -1.38 117.98 119.77 1fq8 s PHE 262 Ca 0.01 -1.02 0.00 0.00 0.12 0.00 0.00 56.93 56.04 1fq8 s PHE 262 Cb -0.15 -2.11 0.00 0.00 -0.57 0.00 0.00 43.02 40.19 1fq8 s PHE 262 CO -0.08 -0.58 0.00 -1.71 -0.10 0.00 0.00 175.22 172.76 1fq8 n ASN 263 N 4.79 -4.03 0.00 1.36 5.15 0.13 -1.52 115.26 121.13 1fq8 n ASN 263 Ca -0.18 0.36 0.00 0.00 -0.60 0.00 0.00 54.58 54.17 1fq8 n ASN 263 Cb 0.50 -3.68 0.00 0.00 -0.53 0.00 0.00 39.78 36.07 1fq8 n ASN 263 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1fq8 n GLY 264 N -0.31 0.47 3.57 8.20 0.00 -1.26 -5.08 105.19 110.77 1fq8 n GLY 264 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 1fq8 n GLY 264 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fq8 s TYR 265 N -2.00 2.71 -0.14 1.61 1.51 -0.58 -5.10 117.35 115.36 1fq8 s TYR 265 Ca 0.00 -0.17 -0.06 0.00 -1.01 0.00 0.00 57.07 55.82 1fq8 s TYR 265 Cb 0.00 -1.40 -0.04 0.00 -0.11 0.00 0.00 41.96 40.41 1fq8 s TYR 265 CO 0.00 0.44 0.09 -0.80 -1.11 0.00 0.00 175.55 174.17 1fq8 s ASN 266 N -2.33 5.96 -0.15 2.29 0.01 -1.26 -1.22 114.94 118.24 1fq8 s ASN 266 Ca 0.22 0.28 0.00 0.00 -0.71 0.00 0.00 52.86 52.65 1fq8 s ASN 266 Cb -0.11 -1.93 0.03 0.00 0.41 0.00 0.00 41.25 39.66 1fq8 s ASN 266 CO 0.14 0.32 -0.10 -0.36 -1.51 0.00 0.00 177.10 175.59 1fq8 s PHE 267 N -0.50 1.91 -0.13 2.20 0.08 -0.26 -4.99 117.98 116.30 1fq8 s PHE 267 Ca 0.11 -1.12 -0.05 0.00 0.12 0.00 0.00 56.93 55.98 1fq8 s PHE 267 Cb -0.12 -1.44 -0.04 0.00 -0.57 0.00 0.00 43.02 40.86 1fq8 s PHE 267 CO 0.02 -0.63 0.07 0.99 -0.10 0.00 0.00 175.22 175.57 1fq8 s THR 268 N 1.57 4.86 -0.02 0.64 2.01 -1.26 0.15 115.64 123.59 1fq8 s THR 268 Ca 0.03 -0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.03 1fq8 s THR 268 Cb -0.14 -3.12 -0.00 0.00 0.01 0.00 0.00 72.50 69.25 1fq8 s THR 268 CO -0.09 0.56 -0.11 0.27 -0.69 0.00 0.00 174.62 174.56 1fq8 s ILE 269 N -0.51 0.93 0.92 1.82 -4.36 -0.58 -4.98 121.20 114.44 1fq8 s ILE 269 Ca 0.10 -0.48 -0.14 0.00 -0.26 0.00 0.00 60.65 59.88 1fq8 s ILE 269 Cb -0.12 -0.79 0.15 0.00 1.25 0.00 0.00 42.46 42.95 1fq8 s ILE 269 CO 0.02 0.27 1.18 -0.83 0.24 0.00 0.00 174.94 175.82 1fq8 s GLY 270 N -0.10 1.62 0.00 6.27 0.00 -1.26 0.10 107.32 113.94 1fq8 s GLY 270 Ca 0.01 -0.73 0.30 0.00 0.00 0.00 0.00 44.72 44.31 1fq8 s GLY 270 CO 0.00 -0.11 2.05 -1.55 0.00 0.00 0.00 173.10 173.49 1fq8 n PRO 271 N -3.75 0.49 0.00 2.90 -0.04 -1.26 -1.40 135.00 131.94 1fq8 n PRO 271 Ca 0.09 0.01 0.13 0.00 -0.04 0.00 0.00 63.50 63.69 1fq8 n PRO 271 Cb 0.60 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.95 1fq8 n PRO 271 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1fq8 n TYR 272 N -1.25 0.02 -0.05 0.54 4.01 -1.26 -2.60 117.16 116.56 1fq8 n TYR 272 Ca 0.15 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.86 1fq8 n TYR 272 Cb 0.22 -0.36 -0.01 0.00 -0.31 0.00 0.00 39.34 38.88 1fq8 n TYR 272 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1fq8 n ASP 273 N -1.52 1.29 0.00 7.72 8.00 -0.99 -4.39 116.55 126.67 1fq8 n ASP 273 Ca 0.06 0.48 0.04 0.00 0.71 0.00 0.00 54.79 56.08 1fq8 n ASP 273 Cb 0.34 -0.75 0.25 0.00 -0.02 0.00 0.00 41.12 40.94 1fq8 n ASP 273 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fq8 n TYR 274 N -3.92 0.00 -4.43 1.24 0.18 -0.49 -4.75 117.16 104.99 1fq8 n TYR 274 Ca -0.06 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.51 1fq8 n TYR 274 Cb 0.21 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.07 1fq8 n TYR 274 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1fq8 s THR 275 N -2.00 1.80 -0.01 -3.48 -4.23 -1.07 -0.32 115.64 106.33 1fq8 s THR 275 Ca 0.13 -2.18 0.01 0.00 -1.18 0.00 0.00 61.69 58.47 1fq8 s THR 275 Cb 0.06 -2.37 0.01 0.00 1.34 0.00 0.00 72.50 71.54 1fq8 s THR 275 CO 0.10 -0.36 -0.02 -0.22 -0.54 0.00 0.00 174.62 173.58 1fq8 s LEU 276 N -3.44 1.77 -0.38 4.79 2.96 0.11 -4.83 118.68 119.67 1fq8 s LEU 276 Ca 0.28 -0.04 -0.20 0.00 -0.22 0.00 0.00 54.13 53.95 1fq8 s LEU 276 Cb 0.02 -0.15 0.01 0.00 0.50 0.00 0.00 46.19 46.56 1fq8 s LEU 276 CO 0.12 -0.00 0.62 -0.70 -1.32 0.00 0.00 176.35 175.06 1fq8 s GLU 277 N 0.23 3.55 -0.47 1.98 2.12 -1.26 0.80 118.70 125.65 1fq8 s GLU 277 Ca -0.02 -0.10 0.04 0.00 0.36 0.00 0.00 54.97 55.25 1fq8 s GLU 277 Cb -0.04 -3.85 0.13 0.00 0.26 0.00 0.00 34.13 30.62 1fq8 s GLU 277 CO -0.01 -0.81 0.22 0.08 -0.54 0.00 0.00 175.26 174.21 1fq8 s VAL 278 N 2.71 2.30 -0.99 3.70 1.01 -0.25 -4.85 120.40 124.03 1fq8 s VAL 278 Ca 0.23 -3.00 -0.05 0.00 0.00 0.00 0.00 61.98 59.16 1fq8 s VAL 278 Cb -0.14 -2.62 -0.05 0.00 0.00 0.00 0.00 36.38 33.56 1fq8 s VAL 278 CO 0.16 -0.78 0.86 -1.20 0.00 0.00 0.00 175.10 174.14 1fq8 n SER 279 N 3.40 -5.62 0.00 3.32 7.64 -1.26 -3.28 113.62 117.82 1fq8 n SER 279 Ca 0.05 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.29 1fq8 n SER 279 Cb 0.34 -4.83 0.00 0.00 -1.01 0.00 0.00 64.21 58.71 1fq8 n SER 279 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fq8 n GLY 280 N -1.23 2.98 3.31 0.23 0.00 -1.26 -5.01 105.19 104.22 1fq8 n GLY 280 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1fq8 n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fq8 s SER 281 N -3.68 3.01 0.05 1.61 1.04 -1.21 -4.96 113.70 109.57 1fq8 s SER 281 Ca 0.00 -0.51 -0.16 0.00 0.48 0.00 0.00 55.95 55.76 1fq8 s SER 281 Cb 0.00 -0.31 -0.06 0.00 0.10 0.00 0.00 66.02 65.75 1fq8 s SER 281 CO 0.00 0.28 0.48 0.00 0.98 0.00 0.00 173.24 174.98 1fq8 s ILE 283 N -1.17 1.61 0.39 0.00 -4.36 0.24 -1.72 121.20 116.18 1fq8 s ILE 283 Ca 0.28 -1.70 -0.25 0.00 -0.26 0.00 0.00 60.65 58.72 1fq8 s ILE 283 Cb -0.17 -1.61 -0.09 0.00 1.25 0.00 0.00 42.46 41.84 1fq8 s ILE 283 CO 0.16 -0.26 1.06 -0.55 0.24 0.00 0.00 174.94 175.60 1fq8 s SER 284 N -2.31 6.80 0.00 4.36 0.15 0.27 0.10 113.70 123.06 1fq8 s SER 284 Ca 0.10 2.08 0.28 0.00 0.70 0.00 0.00 55.95 59.10 1fq8 s SER 284 Cb -0.07 -2.59 1.00 0.00 -1.71 0.00 0.00 66.02 62.65 1fq8 s SER 284 CO 0.05 -0.47 1.72 0.00 1.20 0.00 0.00 173.24 175.74 1fq8 n ALA 285 N 0.08 2.57 -2.52 5.45 0.00 0.56 -4.77 120.51 121.88 1fq8 n ALA 285 Ca 0.04 -0.46 -0.42 0.00 0.00 0.00 0.00 53.44 52.60 1fq8 n ALA 285 Cb 0.49 -1.15 -0.08 0.00 0.00 0.00 0.00 19.45 18.71 1fq8 n ALA 285 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1fq8 s ILE 286 N -1.99 4.98 -0.07 0.00 -1.09 -1.26 -1.54 121.20 120.23 1fq8 s ILE 286 Ca 0.37 0.03 0.01 0.00 -2.23 0.00 0.00 60.65 58.83 1fq8 s ILE 286 Cb 0.21 -4.07 -0.03 0.00 -1.58 0.00 0.00 42.46 36.99 1fq8 s ILE 286 CO 0.33 -0.41 -0.08 -0.89 -1.23 0.00 0.00 174.94 172.66 1fq8 s THR 287 N 2.44 3.64 -0.06 2.92 2.01 -0.21 -4.91 115.64 121.46 1fq8 s THR 287 Ca 0.18 -0.50 -0.11 0.00 0.31 0.00 0.00 61.69 61.57 1fq8 s THR 287 Cb -0.16 -2.48 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 1fq8 s THR 287 CO 0.15 0.59 0.27 -2.16 -0.69 0.00 0.00 174.62 172.79 1fq8 s PRO 288 N -0.76 3.68 -0.22 4.92 0.04 -1.26 -0.91 135.00 140.49 1fq8 s PRO 288 Ca 0.12 0.14 -0.08 0.00 0.04 0.00 0.00 61.00 61.21 1fq8 s PRO 288 Cb -0.11 -3.21 0.10 0.00 0.04 0.00 0.00 34.50 31.32 1fq8 s PRO 288 CO 0.01 0.73 0.49 1.41 0.04 0.00 0.00 177.00 179.68 1fq8 s MET 289 N -1.03 0.41 -0.22 4.56 1.75 -0.30 -4.89 119.30 119.57 1fq8 s MET 289 Ca 0.19 1.12 -0.07 0.00 -1.25 0.00 0.00 55.69 55.68 1fq8 s MET 289 Cb -0.14 0.42 -0.03 0.00 2.84 0.00 0.00 34.83 37.91 1fq8 s MET 289 CO 0.09 -0.22 0.06 -0.51 -0.65 0.00 0.00 175.02 173.78 1fq8 s ASP 290 N 2.51 5.21 -0.16 1.11 1.01 -1.26 -3.91 116.67 121.17 1fq8 s ASP 290 Ca -0.04 -0.13 -0.12 0.00 0.71 0.00 0.00 52.55 52.97 1fq8 s ASP 290 Cb -0.11 -1.92 -0.05 0.00 1.01 0.00 0.00 42.92 41.85 1fq8 s ASP 290 CO -0.15 0.04 0.24 -0.36 0.21 0.00 0.00 175.17 175.16 1fq8 s PHE 291 N 1.18 3.47 0.77 4.23 0.08 -1.26 -5.04 117.98 121.41 1fq8 s PHE 291 Ca 0.04 0.54 -0.14 0.00 0.12 0.00 0.00 56.93 57.49 1fq8 s PHE 291 Cb -0.14 -2.26 0.06 0.00 -0.57 0.00 0.00 43.02 40.10 1fq8 s PHE 291 CO 0.03 0.31 1.20 -1.25 -0.10 0.00 0.00 175.22 175.41 1fq8 s PRO 292 N 0.26 1.91 0.71 0.24 0.04 -1.26 -2.97 135.00 133.93 1fq8 s PRO 292 Ca 0.14 1.74 -0.12 0.00 0.04 0.00 0.00 61.00 62.80 1fq8 s PRO 292 Cb -0.13 -1.81 0.02 0.00 0.04 0.00 0.00 34.50 32.63 1fq8 s PRO 292 CO 0.03 -2.01 1.08 -2.00 0.04 0.00 0.00 177.00 174.14 1fq8 s GLU 293 N -4.05 2.67 0.00 4.56 2.56 -1.26 -0.92 118.70 122.26 1fq8 s GLU 293 Ca 0.73 1.15 0.18 0.00 0.00 0.00 0.00 54.97 57.03 1fq8 s GLU 293 Cb -0.28 -1.95 0.79 0.00 2.00 0.00 0.00 34.13 34.68 1fq8 s GLU 293 CO 0.48 -1.32 1.57 -0.35 -0.56 0.00 0.00 175.26 175.08 1fq8 n PRO 294 N -3.05 0.03 0.00 4.30 -0.04 -1.26 -4.83 135.00 130.16 1fq8 n PRO 294 Ca 0.09 0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 1fq8 n PRO 294 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1fq8 n PRO 294 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1fq8 n VAL 295 N -1.47 0.00 -0.43 0.52 0.31 -0.69 -4.79 118.33 111.78 1fq8 n VAL 295 Ca 0.05 1.00 -0.29 0.00 -0.01 0.00 0.00 64.34 65.09 1fq8 n VAL 295 Cb 0.20 -1.90 0.26 0.00 -0.91 0.00 0.00 33.84 31.49 1fq8 n VAL 295 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fq8 n GLY 296 N 0.27 -2.60 3.67 2.92 0.00 -0.09 -4.47 105.19 104.88 1fq8 n GLY 296 Ca 0.00 -1.28 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1fq8 n GLY 296 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fq8 s PRO 297 N -4.41 4.26 -0.01 1.61 0.04 -1.26 -4.49 135.00 130.73 1fq8 s PRO 297 Ca 0.67 1.86 0.01 0.00 0.04 0.00 0.00 61.00 63.58 1fq8 s PRO 297 Cb -0.21 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1fq8 s PRO 297 CO 0.63 -0.65 -0.04 -1.17 0.04 0.00 0.00 177.00 175.82 1fq8 s LEU 298 N 3.03 1.79 0.32 -3.56 2.96 -1.26 -1.99 118.68 119.97 1fq8 s LEU 298 Ca 0.61 -0.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.47 1fq8 s LEU 298 Cb -0.28 -0.25 -0.03 0.00 0.50 0.00 0.00 46.19 46.14 1fq8 s LEU 298 CO 0.22 0.02 0.50 0.00 -1.32 0.00 0.00 176.35 175.77 1fq8 s ALA 299 N 0.19 3.82 -0.28 5.97 0.00 0.20 -4.31 121.76 127.36 1fq8 s ALA 299 Ca -0.02 -1.07 -0.00 0.00 0.00 0.00 0.00 51.96 50.87 1fq8 s ALA 299 Cb -0.05 -1.96 0.08 0.00 0.00 0.00 0.00 23.12 21.19 1fq8 s ALA 299 CO -0.00 0.02 0.05 0.42 0.00 0.00 0.00 175.76 176.25 1fq8 s ILE 300 N -2.22 1.13 -0.79 0.00 1.01 -0.37 -0.68 121.20 119.28 1fq8 s ILE 300 Ca 0.39 -1.32 -0.18 0.00 0.00 0.00 0.00 60.65 59.54 1fq8 s ILE 300 Cb -0.09 -1.71 0.13 0.00 0.01 0.00 0.00 42.46 40.80 1fq8 s ILE 300 CO 0.34 -0.45 0.93 -0.69 0.00 0.00 0.00 174.94 175.07 1fq8 s VAL 301 N 1.52 4.86 0.00 2.92 1.01 -0.83 0.88 120.40 130.77 1fq8 s VAL 301 Ca 0.04 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.58 1fq8 s VAL 301 Cb -0.18 -4.64 0.00 0.00 0.00 0.00 0.00 36.38 31.56 1fq8 s VAL 301 CO -0.16 -1.32 0.00 0.61 0.00 0.00 0.00 175.10 174.23 1fq8 n GLY 302 N 5.14 1.04 0.46 4.51 0.00 -0.26 -3.07 105.19 113.01 1fq8 n GLY 302 Ca 0.10 -1.77 0.30 0.00 0.00 0.00 0.00 46.02 44.65 1fq8 n GLY 302 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1fq8 h ASP 303 N 0.00 0.27 -0.50 1.61 3.32 -1.18 -1.30 116.42 118.64 1fq8 h ASP 303 Ca 0.00 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 1fq8 h ASP 303 Cb 0.00 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1fq8 h ASP 303 CO 0.00 0.01 0.22 0.00 -1.72 0.00 0.00 179.24 177.74 1fq8 h ALA 304 N 1.54 0.65 0.17 3.45 0.00 -1.77 -1.63 119.26 121.66 1fq8 h ALA 304 Ca 0.64 -0.14 -0.28 0.00 0.00 0.00 0.00 54.91 55.13 1fq8 h ALA 304 Cb 2.00 -0.20 0.03 0.00 0.00 0.00 0.00 17.79 19.62 1fq8 h ALA 304 CO -0.23 0.24 -1.18 0.35 0.00 0.00 0.00 179.25 178.43 1fq8 h PHE 305 N 0.67 0.86 -0.02 0.00 3.04 -1.61 -3.37 116.94 116.51 1fq8 h PHE 305 Ca 0.17 -0.59 -0.01 0.00 3.98 0.00 0.00 57.97 61.52 1fq8 h PHE 305 Cb 0.17 -0.05 -0.00 0.00 2.56 0.00 0.00 35.95 38.63 1fq8 h PHE 305 CO 0.00 1.45 -0.02 -0.07 -2.02 0.00 0.00 178.31 177.65 1fq8 h LEU 306 N 0.03 0.02 -1.63 0.59 3.38 -1.19 -2.85 115.31 113.67 1fq8 h LEU 306 Ca -0.20 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1fq8 h LEU 306 Cb 1.90 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.64 1fq8 h LEU 306 CO 0.22 0.05 -0.11 0.03 0.09 0.00 0.00 178.44 178.72 1fq8 h ARG 307 N 0.03 0.00 -0.01 1.13 3.08 -1.45 -2.49 114.38 114.66 1fq8 h ARG 307 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1fq8 h ARG 307 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1fq8 h ARG 307 CO 0.00 0.11 -0.38 1.63 -1.07 0.00 0.00 179.97 180.26 1fq8 n LYS 308 N -3.35 0.88 -3.84 0.04 4.76 -1.08 -4.74 118.16 110.82 1fq8 n LYS 308 Ca -0.01 -0.61 -0.22 0.00 -2.87 0.00 0.00 58.31 54.60 1fq8 n LYS 308 Cb 0.30 -1.49 -0.17 0.00 -1.84 0.00 0.00 35.03 31.83 1fq8 n LYS 308 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1fq8 s TYR 309 N -2.55 0.63 0.02 2.13 2.02 -0.94 -1.82 117.35 116.84 1fq8 s TYR 309 Ca 0.21 -0.14 -0.30 0.00 -0.37 0.00 0.00 57.07 56.46 1fq8 s TYR 309 Cb 0.19 -0.73 -0.06 0.00 -0.40 0.00 0.00 41.96 40.96 1fq8 s TYR 309 CO 0.56 -0.28 1.37 -0.47 -1.57 0.00 0.00 175.55 175.16 1fq8 s TYR 310 N 1.72 2.98 -0.02 2.71 5.04 0.85 -4.69 117.35 125.95 1fq8 s TYR 310 Ca 0.01 0.90 0.05 0.00 -2.44 0.00 0.00 57.07 55.60 1fq8 s TYR 310 Cb -0.13 -3.63 -0.03 0.00 0.35 0.00 0.00 41.96 38.52 1fq8 s TYR 310 CO -0.04 -2.28 -0.18 -1.54 -1.34 0.00 0.00 175.55 170.18 1fq8 s SER 311 N 1.66 3.78 -0.17 4.32 1.04 -0.77 -2.20 113.70 121.36 1fq8 s SER 311 Ca 0.63 -0.31 -0.00 0.00 0.48 0.00 0.00 55.95 56.75 1fq8 s SER 311 Cb -0.32 -0.69 0.04 0.00 0.10 0.00 0.00 66.02 65.16 1fq8 s SER 311 CO 0.27 0.32 -0.07 -0.63 0.98 0.00 0.00 173.24 174.10 1fq8 s ILE 312 N -0.76 1.26 -0.35 -1.02 1.01 -0.99 1.00 121.20 121.34 1fq8 s ILE 312 Ca 0.12 -0.69 -0.11 0.00 0.00 0.00 0.00 60.65 59.97 1fq8 s ILE 312 Cb -0.10 -1.38 0.01 0.00 0.01 0.00 0.00 42.46 41.00 1fq8 s ILE 312 CO 0.02 0.18 0.19 -0.31 0.00 0.00 0.00 174.94 175.02 1fq8 s TYR 313 N 1.57 3.22 -0.45 3.97 1.51 -1.05 -0.33 117.35 125.80 1fq8 s TYR 313 Ca 0.01 -0.73 -0.09 0.00 -1.01 0.00 0.00 57.07 55.24 1fq8 s TYR 313 Cb -0.15 -2.42 0.10 0.00 -0.11 0.00 0.00 41.96 39.38 1fq8 s TYR 313 CO -0.08 -0.55 0.31 0.34 -1.11 0.00 0.00 175.55 174.46 1fq8 s ASP 314 N 1.60 5.69 0.37 2.29 -1.08 -0.49 -1.96 116.67 123.08 1fq8 s ASP 314 Ca 0.04 -1.68 0.10 0.00 -0.52 0.00 0.00 52.55 50.48 1fq8 s ASP 314 Cb -0.18 -2.01 0.71 0.00 -1.46 0.00 0.00 42.92 39.98 1fq8 s ASP 314 CO 0.07 -0.62 1.85 -0.29 0.52 0.00 0.00 175.17 176.70 1fq8 h ILE 315 N 6.09 1.23 -0.08 4.11 2.10 -0.51 -0.13 117.51 130.32 1fq8 h ILE 315 Ca -0.22 -1.09 -0.09 0.00 1.08 0.00 0.00 64.86 64.54 1fq8 h ILE 315 Cb 1.08 1.48 -0.01 0.00 -1.09 0.00 0.00 36.82 38.28 1fq8 h ILE 315 CO 0.81 0.32 -0.35 1.23 -1.08 0.00 0.00 178.15 179.09 1fq8 h GLY 316 N 0.95 0.17 -0.00 8.18 0.00 -1.89 -3.21 103.07 107.26 1fq8 h GLY 316 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.21 1fq8 h GLY 316 CO 0.04 0.13 -0.69 0.70 0.00 0.00 0.00 176.54 176.72 1fq8 n ASN 317 N -4.09 0.69 -3.31 0.19 5.03 -1.10 -5.01 115.26 107.67 1fq8 n ASN 317 Ca -0.01 -0.85 -0.14 0.00 0.87 0.00 0.00 54.58 54.45 1fq8 n ASN 317 Cb 0.42 1.00 0.03 0.00 -1.02 0.00 0.00 39.78 40.21 1fq8 n ASN 317 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1fq8 n ASN 318 N -1.34 -6.68 -3.64 6.41 3.02 -0.09 -4.85 115.26 108.09 1fq8 n ASN 318 Ca 0.03 -0.56 -0.08 0.00 -0.03 0.00 0.00 54.58 53.94 1fq8 n ASN 318 Cb 0.23 -4.61 -0.07 0.00 -0.61 0.00 0.00 39.78 34.72 1fq8 n ASN 318 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fq8 s ALA 319 N -3.23 -2.01 -0.23 5.41 0.00 -1.05 -1.42 121.76 119.24 1fq8 s ALA 319 Ca 0.26 2.06 -0.12 0.00 0.00 0.00 0.00 51.96 54.16 1fq8 s ALA 319 Cb -0.05 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.55 1fq8 s ALA 319 CO 0.78 -0.30 0.21 0.08 0.00 0.00 0.00 175.76 176.53 1fq8 s VAL 320 N 0.73 5.33 0.05 0.00 1.01 -0.55 -1.39 120.40 125.58 1fq8 s VAL 320 Ca -0.02 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.29 1fq8 s VAL 320 Cb -0.05 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1fq8 s VAL 320 CO -0.09 0.34 0.06 -0.83 0.00 0.00 0.00 175.10 174.57 1fq8 s GLY 321 N 0.97 1.99 0.01 4.51 0.00 0.55 -0.06 107.32 115.28 1fq8 s GLY 321 Ca 0.10 -0.99 0.06 0.00 0.00 0.00 0.00 44.72 43.90 1fq8 s GLY 321 CO 0.05 -0.93 -0.18 1.08 0.00 0.00 0.00 173.10 173.12 1fq8 s LEU 322 N -2.13 2.08 -0.06 0.66 1.43 0.95 -2.35 118.68 119.26 1fq8 s LEU 322 Ca 0.26 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 52.86 1fq8 s LEU 322 Cb -0.12 -0.88 0.02 0.00 0.03 0.00 0.00 46.19 45.24 1fq8 s LEU 322 CO 0.18 0.18 0.30 0.00 0.23 0.00 0.00 176.35 177.24 1fq8 s ALA 323 N -0.56 -0.74 0.02 4.21 0.00 -0.94 -0.72 121.76 123.04 1fq8 s ALA 323 Ca 0.06 0.56 -0.34 0.00 0.00 0.00 0.00 51.96 52.24 1fq8 s ALA 323 Cb -0.07 -0.20 -0.13 0.00 0.00 0.00 0.00 23.12 22.71 1fq8 s ALA 323 CO 0.00 -0.20 1.73 1.63 0.00 0.00 0.00 175.76 178.92 1fq8 n LYS 324 N 2.07 2.14 -1.53 0.00 4.76 -1.24 -0.10 118.16 124.25 1fq8 n LYS 324 Ca -0.18 0.78 -0.29 0.00 -2.87 0.00 0.00 58.31 55.75 1fq8 n LYS 324 Cb 0.57 -2.58 0.14 0.00 -1.84 0.00 0.00 35.03 31.31 1fq8 n LYS 324 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1fq8 s ALA 325 N 2.59 1.75 -2.75 7.82 0.00 -0.76 -1.38 121.76 129.03 1fq8 s ALA 325 Ca 0.86 -0.54 0.26 0.00 0.00 0.00 0.00 51.96 52.55 1fq8 s ALA 325 Cb -0.70 -3.03 0.61 0.00 0.00 0.00 0.00 23.12 20.01 1fq8 s ALA 325 CO 0.46 -2.31 1.50 1.51 0.00 0.00 0.00 175.76 176.91