#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fnu n GLN 902 N 0.00 0.15 -1.31 3.69 0.00 -1.26 -4.65 117.38 114.00 1fnu n GLN 902 Ca 0.00 0.07 -0.39 0.00 0.00 0.00 0.00 57.00 56.68 1fnu n GLN 902 Cb 0.00 -1.34 0.02 0.00 0.00 0.00 0.00 30.24 28.93 1fnu n GLN 902 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1fnu n ASP 903 N 1.58 -2.85 -4.77 2.61 9.92 -1.26 -5.00 116.55 116.78 1fnu n ASP 903 Ca 0.07 0.67 -0.35 0.00 -0.53 0.00 0.00 54.79 54.65 1fnu n ASP 903 Cb 0.49 -0.96 0.02 0.00 -0.64 0.00 0.00 41.12 40.03 1fnu n ASP 903 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1fnu s PRO 904 N -1.40 3.19 0.22 -0.24 0.04 -1.26 -5.04 135.00 130.50 1fnu s PRO 904 Ca 0.60 1.65 -0.03 0.00 0.04 0.00 0.00 61.00 63.26 1fnu s PRO 904 Cb -0.47 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.04 1fnu s PRO 904 CO 0.63 -0.99 0.43 0.16 0.04 0.00 0.00 177.00 177.27 1fnu s ASP 905 N -1.81 6.42 0.00 6.66 1.47 -1.26 -4.98 116.67 123.17 1fnu s ASP 905 Ca 0.73 0.52 0.00 0.00 1.18 0.00 0.00 52.55 54.98 1fnu s ASP 905 Cb -0.25 -2.06 0.00 0.00 -0.34 0.00 0.00 42.92 40.27 1fnu s ASP 905 CO 0.30 -0.07 0.52 -2.65 0.68 0.00 0.00 175.17 173.95 1fnu n PRO 906 N -0.61 0.00 0.13 2.11 -0.02 -1.26 -0.58 135.00 134.77 1fnu n PRO 906 Ca -0.03 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1fnu n PRO 906 Cb 0.53 -0.95 0.00 0.00 -0.02 0.00 0.00 33.50 33.06 1fnu n PRO 906 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1fnu n SER 907 N -1.31 0.00 -0.11 2.55 3.41 -1.26 -1.30 113.62 115.60 1fnu n SER 907 Ca 0.00 0.20 0.14 0.00 -0.26 0.00 0.00 58.87 58.95 1fnu n SER 907 Cb 0.00 0.00 0.59 0.00 -0.26 0.00 0.00 64.21 64.54 1fnu n SER 907 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fnu n GLN 908 N -1.41 0.62 -3.54 4.33 6.02 0.25 -4.85 117.38 118.80 1fnu n GLN 908 Ca 0.00 -0.22 -0.37 0.00 -0.01 0.00 0.00 57.00 56.40 1fnu n GLN 908 Cb 0.56 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 30.26 1fnu n GLN 908 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1fnu s LEU 909 N -2.53 4.31 0.16 1.08 1.43 -0.42 -4.96 118.68 117.75 1fnu s LEU 909 Ca 0.27 0.63 -0.31 0.00 -1.03 0.00 0.00 54.13 53.69 1fnu s LEU 909 Cb 0.20 -2.42 -0.10 0.00 0.03 0.00 0.00 46.19 43.90 1fnu s LEU 909 CO 0.49 0.17 1.54 -1.00 0.23 0.00 0.00 176.35 177.78 1fnu s HIS 910 N -0.02 3.09 -0.46 0.29 3.76 -1.26 -4.96 115.29 115.73 1fnu s HIS 910 Ca 0.19 0.69 -0.25 0.00 -0.15 0.00 0.00 55.06 55.54 1fnu s HIS 910 Cb -0.14 -3.88 0.03 0.00 1.11 0.00 0.00 32.58 29.69 1fnu s HIS 910 CO 0.07 -3.23 0.91 1.03 -0.85 0.00 0.00 174.74 172.66 1fnu s ARG 911 N 1.08 3.51 0.51 1.40 0.52 -1.26 -4.57 118.95 120.13 1fnu s ARG 911 Ca 0.69 0.11 0.33 0.00 -0.52 0.00 0.00 55.73 56.34 1fnu s ARG 911 Cb -0.43 -3.93 1.45 0.00 0.52 0.00 0.00 34.95 32.57 1fnu s ARG 911 CO 0.31 -1.22 1.78 0.66 0.02 0.00 0.00 175.30 176.86 1fnu h SER 912 N 9.07 0.11 0.61 0.23 4.64 -0.45 0.36 113.55 128.12 1fnu h SER 912 Ca -0.24 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1fnu h SER 912 Cb 1.08 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1fnu h SER 912 CO 1.02 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 175.45 1fnu n SER 913 N -4.30 0.00 0.02 4.97 3.41 -1.26 -2.45 113.62 114.01 1fnu n SER 913 Ca 0.27 0.22 0.11 0.00 -0.26 0.00 0.00 58.87 59.21 1fnu n SER 913 Cb 1.21 -0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 64.75 1fnu n SER 913 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1fnu n LEU 914 N -1.39 0.60 -4.72 1.04 4.77 0.12 -4.94 117.00 112.47 1fnu n LEU 914 Ca 0.08 -0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1fnu n LEU 914 Cb 0.23 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1fnu n LEU 914 CO 0.19 0.07 1.23 -0.69 -1.33 0.00 0.00 177.39 176.86 1fnu s VAL 915 N -3.20 2.67 -0.03 4.08 1.01 -1.03 -4.62 120.40 119.28 1fnu s VAL 915 Ca 0.03 0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.46 1fnu s VAL 915 Cb 0.15 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1fnu s VAL 915 CO 0.82 0.03 0.10 -1.59 0.00 0.00 0.00 175.10 174.46 1fnu s LYS 916 N 1.21 3.16 -1.34 2.72 0.00 0.15 -4.38 119.74 121.25 1fnu s LYS 916 Ca 0.70 -0.41 -0.07 0.00 0.00 0.00 0.00 55.97 56.19 1fnu s LYS 916 Cb -0.43 -2.93 0.02 0.00 0.00 0.00 0.00 37.83 34.49 1fnu s LYS 916 CO 0.31 0.67 1.09 0.09 0.00 0.00 0.00 175.35 177.51 1fnu n ASN 917 N 1.32 -4.87 0.34 0.03 3.02 -1.26 -4.75 115.26 109.10 1fnu n ASN 917 Ca -0.14 -0.61 0.23 0.00 -0.03 0.00 0.00 54.58 54.03 1fnu n ASN 917 Cb 0.53 -4.85 1.21 0.00 -0.61 0.00 0.00 39.78 36.06 1fnu n ASN 917 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1fnu h LEU 918 N -2.40 0.00 -1.98 3.41 5.85 -1.86 -2.24 115.31 116.10 1fnu h LEU 918 Ca -0.58 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 1fnu h LEU 918 Cb 1.36 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.39 1fnu h LEU 918 CO 0.56 0.00 -0.05 0.06 -0.34 0.00 0.00 178.44 178.67 1fnu h GLN 919 N 0.00 0.00 0.00 1.25 -0.00 -1.77 -0.79 115.11 113.80 1fnu h GLN 919 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1fnu h GLN 919 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1fnu h GLN 919 CO 0.00 0.05 0.00 -0.91 -0.00 0.00 0.00 178.83 177.97 1fnu h ASN 920 N 0.00 0.00 0.16 0.06 2.35 -1.76 0.10 115.58 116.49 1fnu h ASN 920 Ca -0.00 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.54 1fnu h ASN 920 Cb 0.09 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.49 1fnu h ASN 920 CO 0.01 0.00 -0.92 0.40 -1.65 0.00 0.00 177.43 175.26 1fnu h ILE 921 N 0.00 1.47 -0.09 2.81 1.08 -1.34 -3.32 117.51 118.12 1fnu h ILE 921 Ca 0.00 -2.56 0.04 0.00 -0.39 0.00 0.00 64.86 61.95 1fnu h ILE 921 Cb 0.28 3.17 -0.05 0.00 -3.07 0.00 0.00 36.82 37.15 1fnu h ILE 921 CO 0.00 0.73 -0.25 0.22 -0.69 0.00 0.00 178.15 178.16 1fnu h TYR 922 N -0.30 -0.66 -0.76 1.37 3.20 -1.15 -2.19 116.97 116.49 1fnu h TYR 922 Ca -0.16 0.03 0.22 0.00 3.14 0.00 0.00 58.73 61.95 1fnu h TYR 922 Cb 1.72 0.31 -0.03 0.00 1.54 0.00 0.00 36.73 40.26 1fnu h TYR 922 CO 0.19 -0.33 0.54 0.74 -1.64 0.00 0.00 178.16 177.66 1fnu h PHE 923 N -0.33 0.04 -0.19 -3.82 0.04 -0.99 0.14 116.94 111.84 1fnu h PHE 923 Ca 0.09 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.76 1fnu h PHE 923 Cb 0.46 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.60 1fnu h PHE 923 CO -0.33 0.01 -0.29 -0.07 -0.60 0.00 0.00 178.31 177.04 1fnu h LEU 924 N 0.03 0.58 0.00 1.54 3.38 -1.49 -3.02 115.31 116.32 1fnu h LEU 924 Ca 0.36 -0.52 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 1fnu h LEU 924 Cb 1.41 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1fnu h LEU 924 CO -0.02 0.99 -0.89 1.88 0.09 0.00 0.00 178.44 180.49 1fnu h TYR 925 N 0.18 0.00 0.00 1.13 0.05 -1.14 -3.33 116.97 113.86 1fnu h TYR 925 Ca 0.02 0.00 -0.22 0.00 0.05 0.00 0.00 58.73 58.57 1fnu h TYR 925 Cb 0.87 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.57 1fnu h TYR 925 CO 0.09 0.31 -1.13 1.49 -1.05 0.00 0.00 178.16 177.87 1fnu h GLU 926 N 0.00 0.00 -7.63 4.88 4.57 -0.88 -3.36 114.58 112.16 1fnu h GLU 926 Ca -0.06 0.00 -0.45 0.00 -1.18 0.00 0.00 59.36 57.67 1fnu h GLU 926 Cb 1.28 0.00 0.15 0.00 -0.16 0.00 0.00 28.75 30.02 1fnu h GLU 926 CO 0.03 0.87 0.33 0.20 -1.18 0.00 0.00 179.01 179.26 1fnu s GLY 927 N -4.78 1.79 0.49 1.92 0.00 -1.14 -5.04 107.32 100.56 1fnu s GLY 927 Ca -0.00 -1.47 -0.21 0.00 0.00 0.00 0.00 44.72 43.04 1fnu s GLY 927 CO 0.82 -0.72 1.07 0.99 0.00 0.00 0.00 173.10 175.26 1fnu s ASP 928 N -4.90 6.21 0.74 1.64 1.01 -1.26 -4.99 116.67 115.12 1fnu s ASP 928 Ca 0.73 2.03 -0.04 0.00 0.71 0.00 0.00 52.55 55.99 1fnu s ASP 928 Cb -0.03 -2.57 0.12 0.00 1.01 0.00 0.00 42.92 41.44 1fnu s ASP 928 CO 0.51 -0.87 1.02 -2.16 0.21 0.00 0.00 175.17 173.88 1fnu s PRO 929 N -3.13 1.71 -0.26 8.23 0.04 -1.26 -4.84 135.00 135.49 1fnu s PRO 929 Ca 0.67 -0.80 -0.12 0.00 0.04 0.00 0.00 61.00 60.79 1fnu s PRO 929 Cb -0.20 -2.24 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 1fnu s PRO 929 CO 0.24 -1.48 0.25 0.08 0.04 0.00 0.00 177.00 176.13 1fnu s VAL 930 N -3.23 5.28 -0.03 -0.36 1.01 0.68 -4.93 120.40 118.81 1fnu s VAL 930 Ca 0.65 0.34 -0.01 0.00 0.00 0.00 0.00 61.98 62.96 1fnu s VAL 930 Cb -0.07 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.76 1fnu s VAL 930 CO 0.45 0.25 0.05 0.42 0.00 0.00 0.00 175.10 176.27 1fnu s THR 931 N 1.61 -0.07 0.01 3.92 -4.23 -1.26 -0.96 115.64 114.66 1fnu s THR 931 Ca 0.11 0.25 -0.02 0.00 -1.18 0.00 0.00 61.69 60.84 1fnu s THR 931 Cb -0.15 -0.11 -0.01 0.00 1.34 0.00 0.00 72.50 73.57 1fnu s THR 931 CO 0.09 0.10 0.03 -1.00 -0.54 0.00 0.00 174.62 173.30 1fnu s HIS 932 N 1.27 0.13 -0.04 3.99 3.76 -0.79 -4.99 115.29 118.61 1fnu s HIS 932 Ca -0.07 -0.27 0.04 0.00 -0.15 0.00 0.00 55.06 54.61 1fnu s HIS 932 Cb -0.13 -0.10 -0.00 0.00 1.11 0.00 0.00 32.58 33.46 1fnu s HIS 932 CO -0.03 -0.17 -0.17 -1.21 -0.85 0.00 0.00 174.74 172.30 1fnu s GLU 933 N -1.08 1.77 -1.01 1.40 0.41 -1.26 -0.58 118.70 118.35 1fnu s GLU 933 Ca -0.12 -0.60 -0.06 0.00 -0.41 0.00 0.00 54.97 53.78 1fnu s GLU 933 Cb -0.07 -1.54 0.01 0.00 -1.78 0.00 0.00 34.13 30.75 1fnu s GLU 933 CO -0.00 0.24 0.88 -1.71 -0.49 0.00 0.00 175.26 174.17 1fnu n ASN 934 N 3.16 -4.83 -4.73 -0.19 4.05 -0.57 -4.98 115.26 107.16 1fnu n ASN 934 Ca -0.18 -0.42 -0.22 0.00 0.45 0.00 0.00 54.58 54.21 1fnu n ASN 934 Cb 0.53 -3.94 -0.06 0.00 1.23 0.00 0.00 39.78 37.54 1fnu n ASN 934 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1fnu s VAL 935 N -3.25 3.82 -0.00 3.44 -7.23 -0.30 -4.74 120.40 112.14 1fnu s VAL 935 Ca 0.38 -1.66 0.01 0.00 -1.81 0.00 0.00 61.98 58.89 1fnu s VAL 935 Cb -0.17 -3.10 -0.00 0.00 0.56 0.00 0.00 36.38 33.67 1fnu s VAL 935 CO 0.55 -0.34 -0.02 -0.75 -0.31 0.00 0.00 175.10 174.23 1fnu s LYS 936 N -3.77 0.21 0.66 4.82 2.20 -1.26 0.13 119.74 122.72 1fnu s LYS 936 Ca 0.33 -0.08 -0.17 0.00 -0.36 0.00 0.00 55.97 55.69 1fnu s LYS 936 Cb -0.07 -0.21 -0.00 0.00 -1.51 0.00 0.00 37.83 36.04 1fnu s LYS 936 CO 0.22 0.04 1.25 -1.54 -0.36 0.00 0.00 175.35 174.97 1fnu s SER 937 N 0.00 4.59 0.00 1.43 1.04 -1.25 -4.72 113.70 114.79 1fnu s SER 937 Ca 0.00 2.51 0.00 0.00 0.48 0.00 0.00 55.95 58.94 1fnu s SER 937 Cb -0.02 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1fnu s SER 937 CO -0.00 -2.01 0.05 1.33 0.98 0.00 0.00 173.24 173.59 1fnu n VAL 938 N -2.07 0.00 -3.88 5.02 0.24 -0.21 -4.92 118.33 112.51 1fnu n VAL 938 Ca 0.15 -0.46 -0.00 0.00 -2.04 0.00 0.00 64.34 61.98 1fnu n VAL 938 Cb 0.49 1.01 0.01 0.00 -1.47 0.00 0.00 33.84 33.88 1fnu n VAL 938 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1fnu n ASP 939 N -0.82 -1.19 -3.55 -1.34 2.03 -1.19 -5.02 116.55 105.47 1fnu n ASP 939 Ca 0.00 -1.49 -0.12 0.00 0.52 0.00 0.00 54.79 53.71 1fnu n ASP 939 Cb 0.00 1.90 -0.04 0.00 -0.72 0.00 0.00 41.12 42.26 1fnu n ASP 939 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fnu s GLN 940 N -2.03 1.14 -0.13 -0.67 -2.07 -1.26 -0.32 119.66 114.32 1fnu s GLN 940 Ca 0.21 -0.55 -0.15 0.00 -1.82 0.00 0.00 55.36 53.05 1fnu s GLN 940 Cb -0.02 0.51 -0.05 0.00 -1.09 0.00 0.00 33.01 32.37 1fnu s GLN 940 CO 0.02 -0.46 -0.29 -0.11 -1.32 0.00 0.00 175.29 173.13 1fnu n LEU 941 N -0.18 1.79 -5.01 2.60 7.94 -1.26 -4.93 117.00 117.95 1fnu n LEU 941 Ca -0.17 0.30 -0.19 0.00 -1.11 0.00 0.00 56.01 54.84 1fnu n LEU 941 Cb 0.64 -0.67 0.03 0.00 0.53 0.00 0.00 43.42 43.95 1fnu n LEU 941 CO 0.16 -0.34 0.26 -0.76 -1.11 0.00 0.00 177.39 175.59 1fnu s LEU 942 N -7.74 3.43 0.00 -1.96 1.43 -1.26 -4.99 118.68 107.59 1fnu s LEU 942 Ca -0.24 -0.44 0.19 0.00 -1.03 0.00 0.00 54.13 52.62 1fnu s LEU 942 Cb 0.03 -2.43 0.84 0.00 0.03 0.00 0.00 46.19 44.67 1fnu s LEU 942 CO 0.35 -1.02 1.62 -1.20 0.23 0.00 0.00 176.35 176.33 1fnu n SER 943 N -2.08 0.00 -1.00 2.29 7.64 -1.26 -3.26 113.62 115.94 1fnu n SER 943 Ca 0.10 0.44 0.08 0.00 1.01 0.00 0.00 58.87 60.50 1fnu n SER 943 Cb 0.60 -0.47 0.24 0.00 -1.01 0.00 0.00 64.21 63.57 1fnu n SER 943 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fnu n HIS 944 N -1.47 0.87 -4.59 1.43 1.44 -1.26 -4.05 115.22 107.58 1fnu n HIS 944 Ca 0.05 -0.61 -0.27 0.00 -2.01 0.00 0.00 57.72 54.88 1fnu n HIS 944 Cb 0.22 -0.14 -0.09 0.00 0.12 0.00 0.00 29.99 30.10 1fnu n HIS 944 CO 0.00 0.00 0.00 0.16 -2.81 0.00 0.00 176.34 173.69 1fnu s ASP 945 N -1.18 3.29 -0.05 4.39 1.47 -1.20 -0.64 116.67 122.75 1fnu s ASP 945 Ca 0.37 -1.53 -0.07 0.00 1.18 0.00 0.00 52.55 52.50 1fnu s ASP 945 Cb 0.23 0.16 0.01 0.00 -0.34 0.00 0.00 42.92 42.99 1fnu s ASP 945 CO 0.18 -0.72 0.17 -0.76 0.68 0.00 0.00 175.17 174.72 1fnu s LEU 946 N -3.67 1.39 -0.10 2.11 1.43 -0.20 -4.61 118.68 115.03 1fnu s LEU 946 Ca 0.24 0.19 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 1fnu s LEU 946 Cb 0.05 0.63 -0.02 0.00 0.03 0.00 0.00 46.19 46.89 1fnu s LEU 946 CO 0.12 -0.15 -0.14 -0.63 0.23 0.00 0.00 176.35 175.78 1fnu s ILE 947 N -0.34 2.99 -0.06 -0.59 1.01 0.57 -1.52 121.20 123.26 1fnu s ILE 947 Ca -0.04 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 59.93 1fnu s ILE 947 Cb -0.03 -2.21 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 1fnu s ILE 947 CO 0.01 0.55 -0.17 -0.31 0.00 0.00 0.00 174.94 175.02 1fnu s TYR 948 N -0.07 2.64 -1.20 3.97 1.51 -0.04 -1.04 117.35 123.11 1fnu s TYR 948 Ca -0.03 -0.36 -0.11 0.00 -1.01 0.00 0.00 57.07 55.56 1fnu s TYR 948 Cb -0.14 -1.65 0.20 0.00 -0.11 0.00 0.00 41.96 40.27 1fnu s TYR 948 CO 0.04 0.03 1.47 -1.71 -1.11 0.00 0.00 175.55 174.28 1fnu n ASN 949 N 2.62 5.34 -4.28 2.29 5.15 -1.26 -1.70 115.26 123.43 1fnu n ASN 949 Ca -0.17 -3.05 -0.17 0.00 -0.60 0.00 0.00 54.58 50.59 1fnu n ASN 949 Cb 0.52 -1.50 -0.10 0.00 -0.53 0.00 0.00 39.78 38.17 1fnu n ASN 949 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1fnu s VAL 950 N 0.49 1.43 0.04 3.44 -7.23 -1.25 -5.02 120.40 112.30 1fnu s VAL 950 Ca 0.39 -1.97 0.05 0.00 -1.81 0.00 0.00 61.98 58.64 1fnu s VAL 950 Cb -0.01 -1.79 -0.02 0.00 0.56 0.00 0.00 36.38 35.12 1fnu s VAL 950 CO -0.00 -0.56 -0.14 -0.44 -0.31 0.00 0.00 175.10 173.65 1fnu s SER 951 N -2.92 1.63 0.10 4.85 0.01 -1.26 -2.48 113.70 113.63 1fnu s SER 951 Ca 0.15 -0.47 -0.01 0.00 1.31 0.00 0.00 55.95 56.94 1fnu s SER 951 Cb -0.02 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.12 1fnu s SER 951 CO 0.04 0.02 0.15 0.61 0.41 0.00 0.00 173.24 174.46 1fnu n GLY 952 N 1.85 2.73 3.68 3.44 0.00 -0.46 -4.99 105.19 111.43 1fnu n GLY 952 Ca -0.18 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 1fnu n GLY 952 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1fnu s PRO 953 N -2.21 4.28 0.00 1.61 0.02 -1.26 -2.45 135.00 134.99 1fnu s PRO 953 Ca 0.08 1.89 0.00 0.00 0.02 0.00 0.00 61.00 62.99 1fnu s PRO 953 Cb -0.00 -3.62 0.00 0.00 0.02 0.00 0.00 34.50 30.89 1fnu s PRO 953 CO 0.06 -0.59 0.00 0.09 -0.33 0.00 0.00 177.00 176.23 1fnu n ASN 954 N 5.61 -1.21 -3.45 2.53 3.02 -1.26 -5.05 115.26 115.45 1fnu n ASN 954 Ca 0.13 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.55 1fnu n ASN 954 Cb 0.44 -0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.38 1fnu n ASN 954 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1fnu s TYR 955 N -2.51 -0.55 0.00 3.10 -0.85 -1.03 -4.59 117.35 110.93 1fnu s TYR 955 Ca 0.00 0.50 0.00 0.00 -0.52 0.00 0.00 57.07 57.05 1fnu s TYR 955 Cb 0.00 0.52 0.00 0.00 0.38 0.00 0.00 41.96 42.86 1fnu s TYR 955 CO 0.00 -0.76 0.58 -0.40 -1.52 0.00 0.00 175.55 173.45 1fnu n ASP 956 N -0.06 0.00 -3.72 -0.18 5.68 -0.41 -1.36 116.55 116.51 1fnu n ASP 956 Ca -0.17 -1.20 -0.12 0.00 -0.50 0.00 0.00 54.79 52.80 1fnu n ASP 956 Cb 0.63 -0.04 -0.13 0.00 -1.14 0.00 0.00 41.12 40.44 1fnu n ASP 956 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1fnu s LYS 957 N 0.00 0.24 -0.10 0.11 -0.14 -1.03 -3.93 119.74 114.89 1fnu s LYS 957 Ca 0.00 0.60 0.02 0.00 -1.36 0.00 0.00 55.97 55.23 1fnu s LYS 957 Cb 0.00 -0.09 0.02 0.00 -1.68 0.00 0.00 37.83 36.07 1fnu s LYS 957 CO 0.00 -0.17 -0.14 -1.17 -0.76 0.00 0.00 175.35 173.11 1fnu s LEU 958 N 1.37 1.66 -0.11 3.17 2.96 -0.69 -2.09 118.68 124.97 1fnu s LEU 958 Ca -0.09 -0.40 -0.01 0.00 -0.22 0.00 0.00 54.13 53.41 1fnu s LEU 958 Cb -0.10 -1.03 -0.03 0.00 0.50 0.00 0.00 46.19 45.53 1fnu s LEU 958 CO -0.10 0.01 -0.05 -0.75 -1.32 0.00 0.00 176.35 174.14 1fnu s LYS 959 N 1.01 3.19 -0.08 1.98 2.20 -0.58 -0.86 119.74 126.60 1fnu s LYS 959 Ca -0.07 -0.53 0.04 0.00 -0.36 0.00 0.00 55.97 55.06 1fnu s LYS 959 Cb -0.15 -2.75 0.00 0.00 -1.51 0.00 0.00 37.83 33.42 1fnu s LYS 959 CO -0.01 0.48 -0.20 -0.08 -0.36 0.00 0.00 175.35 175.17 1fnu s THR 960 N -0.29 1.75 -0.33 3.43 -1.32 -0.57 -0.79 115.64 117.52 1fnu s THR 960 Ca 0.05 -0.86 -0.13 0.00 -1.21 0.00 0.00 61.69 59.54 1fnu s THR 960 Cb -0.13 -1.52 -0.02 0.00 -1.51 0.00 0.00 72.50 69.32 1fnu s THR 960 CO 0.02 0.49 0.25 -1.61 -2.21 0.00 0.00 174.62 171.56 1fnu s GLU 961 N 0.27 3.57 0.00 7.08 2.02 -0.85 -1.03 118.70 129.76 1fnu s GLU 961 Ca -0.13 -0.57 0.00 0.00 0.02 0.00 0.00 54.97 54.29 1fnu s GLU 961 Cb -0.16 -3.78 0.00 0.00 0.10 0.00 0.00 34.13 30.29 1fnu s GLU 961 CO 0.06 -0.41 0.00 1.28 0.02 0.00 0.00 175.26 176.21 1fnu n LEU 962 N 5.13 0.00 -0.00 1.80 4.77 0.19 -1.54 117.00 127.34 1fnu n LEU 962 Ca -0.12 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.79 1fnu n LEU 962 Cb 0.50 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.70 1fnu n LEU 962 CO 0.36 -0.22 0.60 0.50 -1.33 0.00 0.00 177.39 177.31 1fnu h LYS 963 N 0.00 0.55 0.00 3.23 3.64 -1.74 -3.46 116.57 118.78 1fnu h LYS 963 Ca 0.00 -0.27 0.14 0.00 -1.27 0.00 0.00 60.65 59.24 1fnu h LYS 963 Cb 0.00 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.80 1fnu h LYS 963 CO 0.00 0.85 0.37 0.27 -2.27 0.00 0.00 179.45 178.68 1fnu n ASN 964 N -4.03 -0.59 -0.00 4.20 0.23 -1.26 -5.01 115.26 108.79 1fnu n ASN 964 Ca -0.02 -1.18 0.00 0.00 -0.53 0.00 0.00 54.58 52.86 1fnu n ASN 964 Cb 0.51 0.93 0.31 0.00 -2.08 0.00 0.00 39.78 39.45 1fnu n ASN 964 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1fnu h GLN 965 N 0.00 0.53 -0.44 -3.83 3.07 -1.88 -2.49 115.11 110.06 1fnu h GLN 965 Ca -0.10 -0.10 -0.09 0.00 0.09 0.00 0.00 58.65 58.45 1fnu h GLN 965 Cb 0.53 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 27.99 1fnu h GLN 965 CO 0.14 0.53 -0.08 0.93 0.09 0.00 0.00 178.83 180.44 1fnu h GLU 966 N 0.51 0.83 -0.32 0.06 3.07 -1.96 0.22 114.58 116.98 1fnu h GLU 966 Ca 0.11 -0.31 -0.07 0.00 -0.50 0.00 0.00 59.36 58.59 1fnu h GLU 966 Cb 0.29 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 1fnu h GLU 966 CO 0.01 0.93 -0.08 1.98 -1.40 0.00 0.00 179.01 180.45 1fnu h MET 967 N 0.67 0.62 -0.37 2.33 4.05 -1.93 -2.53 114.93 117.77 1fnu h MET 967 Ca 0.12 -0.24 0.00 0.00 -0.28 0.00 0.00 59.70 59.30 1fnu h MET 967 Cb 0.61 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.36 1fnu h MET 967 CO 0.04 0.80 0.23 0.00 0.23 0.00 0.00 176.91 178.21 1fnu h ALA 968 N 0.80 0.47 0.00 0.39 0.00 -1.21 -0.96 119.26 118.76 1fnu h ALA 968 Ca 0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1fnu h ALA 968 Cb 0.57 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1fnu h ALA 968 CO 0.03 -0.05 -0.09 1.79 0.00 0.00 0.00 179.25 180.93 1fnu h THR 969 N 0.49 0.52 0.74 0.00 1.35 -0.58 -0.62 112.91 114.80 1fnu h THR 969 Ca 0.13 -0.41 -0.04 0.00 -0.55 0.00 0.00 66.41 65.55 1fnu h THR 969 Cb -0.02 1.27 0.01 0.00 -1.73 0.00 0.00 68.15 67.67 1fnu h THR 969 CO -0.03 0.09 -0.37 0.25 -0.25 0.00 0.00 175.52 175.21 1fnu h LEU 970 N 0.00 -0.87 -1.02 3.87 6.46 -0.73 -3.25 115.31 119.76 1fnu h LEU 970 Ca -0.00 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 1fnu h LEU 970 Cb 0.26 0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 1fnu h LEU 970 CO 0.01 -0.61 0.00 -0.26 -0.62 0.00 0.00 178.44 176.96 1fnu h PHE 971 N -1.01 0.00 -0.91 1.25 0.04 -1.16 -3.38 116.94 111.77 1fnu h PHE 971 Ca -0.10 0.00 0.24 0.00 2.80 0.00 0.00 57.97 60.90 1fnu h PHE 971 Cb 0.78 0.00 -0.16 0.00 2.20 0.00 0.00 35.95 38.76 1fnu h PHE 971 CO 0.05 0.00 0.03 -0.22 -0.60 0.00 0.00 178.31 177.56 1fnu h LYS 972 N 0.00 0.05 -0.44 1.51 3.64 -1.15 -0.09 116.57 120.10 1fnu h LYS 972 Ca 0.00 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1fnu h LYS 972 Cb 0.65 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.40 1fnu h LYS 972 CO 0.00 0.04 0.06 -0.25 -2.27 0.00 0.00 179.45 177.03 1fnu n ASP 973 N -5.43 4.03 -4.55 4.20 8.00 -1.26 -3.84 116.55 117.71 1fnu n ASP 973 Ca 0.20 -3.21 -0.34 0.00 0.71 0.00 0.00 54.79 52.15 1fnu n ASP 973 Cb 0.66 -0.63 -0.11 0.00 -0.02 0.00 0.00 41.12 41.01 1fnu n ASP 973 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1fnu s LYS 974 N -2.95 3.38 0.10 -1.24 1.02 -0.05 -5.04 119.74 114.95 1fnu s LYS 974 Ca 0.47 -0.50 -0.31 0.00 0.02 0.00 0.00 55.97 55.65 1fnu s LYS 974 Cb 0.39 -2.84 -0.08 0.00 -0.52 0.00 0.00 37.83 34.78 1fnu s LYS 974 CO 0.09 0.41 1.46 -0.80 -0.92 0.00 0.00 175.35 175.59 1fnu s ASN 975 N -0.09 6.76 0.33 2.83 0.01 -1.26 -4.45 114.94 119.08 1fnu s ASN 975 Ca 0.02 2.36 0.04 0.00 -0.71 0.00 0.00 52.86 54.57 1fnu s ASN 975 Cb -0.13 -2.58 -0.03 0.00 0.41 0.00 0.00 41.25 38.92 1fnu s ASN 975 CO 0.02 -0.72 0.16 0.68 -1.51 0.00 0.00 177.10 175.73 1fnu s VAL 976 N 1.54 0.40 0.13 1.60 -7.23 0.35 -2.52 120.40 114.67 1fnu s VAL 976 Ca 0.67 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.92 1fnu s VAL 976 Cb -0.37 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.04 1fnu s VAL 976 CO 0.30 0.00 -0.11 -1.81 -0.31 0.00 0.00 175.10 173.17 1fnu s ASP 977 N -3.44 4.29 0.02 4.85 1.01 0.17 -1.15 116.67 122.42 1fnu s ASP 977 Ca 0.33 -0.48 0.03 0.00 0.71 0.00 0.00 52.55 53.15 1fnu s ASP 977 Cb 0.04 -0.76 -0.01 0.00 1.01 0.00 0.00 42.92 43.19 1fnu s ASP 977 CO 0.18 0.15 -0.09 -0.63 0.21 0.00 0.00 175.17 174.98 1fnu s ILE 978 N -1.39 0.72 -0.28 0.77 1.01 0.25 -1.91 121.20 120.37 1fnu s ILE 978 Ca 0.22 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 60.18 1fnu s ILE 978 Cb -0.10 -0.67 0.15 0.00 0.01 0.00 0.00 42.46 41.85 1fnu s ILE 978 CO 0.14 -0.01 0.37 -0.47 0.00 0.00 0.00 174.94 174.97 1fnu s TYR 979 N -0.66 -0.82 0.12 3.97 6.14 -0.85 -1.89 117.35 123.36 1fnu s TYR 979 Ca -0.01 0.25 0.01 0.00 0.64 0.00 0.00 57.07 57.97 1fnu s TYR 979 Cb -0.06 -0.22 -0.04 0.00 0.42 0.00 0.00 41.96 42.05 1fnu s TYR 979 CO 0.00 -0.93 -0.04 0.20 0.64 0.00 0.00 175.55 175.43 1fnu s GLY 980 N 2.49 0.88 -0.50 8.97 0.00 -0.13 -4.38 107.32 114.64 1fnu s GLY 980 Ca 0.10 -1.41 -0.17 0.00 0.00 0.00 0.00 44.72 43.23 1fnu s GLY 980 CO -0.29 -1.46 0.53 0.14 0.00 0.00 0.00 173.10 172.02 1fnu s VAL 981 N -3.67 5.04 0.51 1.40 1.01 -1.26 -0.23 120.40 123.20 1fnu s VAL 981 Ca 0.15 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 1fnu s VAL 981 Cb 0.06 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 1fnu s VAL 981 CO -0.02 -0.74 0.85 -1.83 0.00 0.00 0.00 175.10 173.36 1fnu s GLU 982 N 2.18 3.58 0.09 2.72 1.03 -1.26 -4.67 118.70 122.37 1fnu s GLU 982 Ca 0.10 0.37 -0.01 0.00 0.03 0.00 0.00 54.97 55.46 1fnu s GLU 982 Cb -0.22 -2.30 -0.04 0.00 -0.80 0.00 0.00 34.13 30.77 1fnu s GLU 982 CO 0.09 -0.28 -0.00 1.52 -1.33 0.00 0.00 175.26 175.25 1fnu s TYR 983 N -2.82 0.71 -0.04 4.83 1.13 0.56 -4.93 117.35 116.80 1fnu s TYR 983 Ca 0.50 -1.11 -0.00 0.00 -1.41 0.00 0.00 57.07 55.04 1fnu s TYR 983 Cb -0.10 -0.45 -0.02 0.00 -1.10 0.00 0.00 41.96 40.28 1fnu s TYR 983 CO 0.46 -0.40 -0.04 0.66 -2.51 0.00 0.00 175.55 173.72 1fnu n TYR 984 N 0.01 0.00 -2.08 -3.49 4.01 -1.26 -0.83 117.16 113.51 1fnu n TYR 984 Ca -0.10 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.21 1fnu n TYR 984 Cb 0.62 -0.14 -0.03 0.00 -0.31 0.00 0.00 39.34 39.48 1fnu n TYR 984 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1fnu s HIS 985 N -2.07 2.02 0.00 -0.72 2.46 -1.26 -1.88 115.29 113.83 1fnu s HIS 985 Ca -0.05 0.54 0.00 0.00 0.47 0.00 0.00 55.06 56.02 1fnu s HIS 985 Cb 0.01 -4.03 0.00 0.00 -0.13 0.00 0.00 32.58 28.44 1fnu s HIS 985 CO 0.08 -3.00 0.00 1.28 -2.47 0.00 0.00 174.74 170.64 1fnu n LEU 986 N 8.85 0.00 -4.69 8.88 4.77 -1.26 -4.64 117.00 128.92 1fnu n LEU 986 Ca 0.20 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.75 1fnu n LEU 986 Cb 0.45 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 1fnu n LEU 986 CO 0.66 0.00 0.81 0.00 -1.33 0.00 0.00 177.39 177.53 1fnu s TYR 988 N 2.02 2.06 0.00 0.00 1.51 -1.26 -5.00 117.35 116.68 1fnu s TYR 988 Ca 0.49 -1.19 0.00 0.00 -1.01 0.00 0.00 57.07 55.37 1fnu s TYR 988 Cb -0.19 -1.52 0.00 0.00 -0.11 0.00 0.00 41.96 40.13 1fnu s TYR 988 CO 0.19 -0.65 0.00 -0.11 -1.11 0.00 0.00 175.55 173.86 1fnu n LEU 989 N 4.79 0.19 -3.64 -1.29 0.00 -1.26 -5.02 117.00 110.77 1fnu n LEU 989 Ca -0.16 0.00 -0.08 0.00 0.00 0.00 0.00 56.01 55.78 1fnu n LEU 989 Cb 0.49 0.00 -0.07 0.00 0.00 0.00 0.00 43.42 43.84 1fnu n LEU 989 CO 0.20 0.03 0.77 0.00 0.00 0.00 0.00 177.39 178.39 1fnu h GLU 991 N 4.35 0.00 -0.29 0.00 4.11 -2.03 -2.48 114.58 118.24 1fnu h GLU 991 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 1fnu h GLU 991 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1fnu h GLU 991 CO 0.13 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.30 1fnu n ASN 992 N -3.38 2.74 -4.60 3.06 3.02 -1.26 -4.96 115.26 109.89 1fnu n ASN 992 Ca 0.04 -1.91 -0.39 0.00 -0.03 0.00 0.00 54.58 52.28 1fnu n ASN 992 Cb 0.55 -0.19 -0.09 0.00 -0.61 0.00 0.00 39.78 39.44 1fnu n ASN 992 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fnu s ALA 993 N -0.98 3.56 -1.93 5.41 0.00 -0.94 -4.94 121.76 121.94 1fnu s ALA 993 Ca 0.21 -0.87 0.22 0.00 0.00 0.00 0.00 51.96 51.53 1fnu s ALA 993 Cb 0.11 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 1fnu s ALA 993 CO 0.15 -0.69 1.07 0.39 0.00 0.00 0.00 175.76 176.68 1fnu n GLU 994 N 5.32 1.10 -3.27 0.00 1.02 -1.26 -4.56 120.64 118.99 1fnu n GLU 994 Ca -0.09 -0.90 -0.25 0.00 -0.02 0.00 0.00 57.16 55.90 1fnu n GLU 994 Cb 0.51 -1.48 -0.07 0.00 -0.02 0.00 0.00 31.44 30.37 1fnu n GLU 994 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1fnu n ARG 995 N -0.17 1.24 -4.18 3.49 1.74 -1.26 -5.09 116.66 112.43 1fnu n ARG 995 Ca 0.09 -3.66 -0.22 0.00 -0.77 0.00 0.00 57.85 53.28 1fnu n ARG 995 Cb 0.45 -1.54 -0.06 0.00 -1.02 0.00 0.00 32.46 30.29 1fnu n ARG 995 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1fnu s SER 996 N -1.53 5.04 0.07 0.55 1.04 -1.26 -1.29 113.70 116.32 1fnu s SER 996 Ca 0.36 -0.46 0.03 0.00 0.48 0.00 0.00 55.95 56.36 1fnu s SER 996 Cb 0.16 -1.10 -0.03 0.00 0.10 0.00 0.00 66.02 65.15 1fnu s SER 996 CO -0.08 -0.05 -0.10 0.00 0.98 0.00 0.00 173.24 173.99 1fnu s ALA 997 N -2.24 0.86 0.03 5.32 0.00 -0.89 -4.80 121.76 120.05 1fnu s ALA 997 Ca 0.33 -0.96 0.05 0.00 0.00 0.00 0.00 51.96 51.37 1fnu s ALA 997 Cb -0.07 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1fnu s ALA 997 CO 0.23 -0.00 -0.13 0.00 0.00 0.00 0.00 175.76 175.85 1fnu s ILE 999 N -0.81 0.00 -0.03 0.00 -4.36 0.03 -0.32 121.20 115.71 1fnu s ILE 999 Ca 0.01 -1.85 0.06 0.00 -0.26 0.00 0.00 60.65 58.62 1fnu s ILE 999 Cb -0.08 -2.44 -0.01 0.00 1.25 0.00 0.00 42.46 41.18 1fnu s ILE 999 CO 0.01 0.00 -0.21 -0.31 0.24 0.00 0.00 174.94 174.67 1fnu s TYR 1000N -4.01 2.00 0.00 1.37 2.02 -1.26 -2.00 117.35 115.48 1fnu s TYR 1000Ca 0.35 -0.47 0.00 0.00 -0.37 0.00 0.00 57.07 56.58 1fnu s TYR 1000Cb 0.05 -1.31 0.00 0.00 -0.40 0.00 0.00 41.96 40.30 1fnu s TYR 1000CO 0.13 -0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.42 1fnu n GLY 1001N 2.75 2.01 2.42 0.71 0.00 -0.59 -4.43 105.19 108.05 1fnu n GLY 1001Ca -0.16 -0.53 -0.17 0.00 0.00 0.00 0.00 46.02 45.15 1fnu n GLY 1001CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fnu n GLY 1002N 0.00 0.79 3.44 -0.02 0.00 -1.26 -4.80 105.19 103.33 1fnu n GLY 1002Ca 0.00 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1fnu n GLY 1002CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fnu s VAL 1003N -2.73 3.49 0.02 1.61 1.01 -1.26 -2.00 120.40 120.54 1fnu s VAL 1003Ca 0.00 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 1fnu s VAL 1003Cb 0.00 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 1fnu s VAL 1003CO 0.00 0.51 0.07 0.42 0.00 0.00 0.00 175.10 176.09 1fnu s THR 1004N 0.37 0.11 0.30 3.92 -4.23 -0.80 -4.96 115.64 110.35 1fnu s THR 1004Ca -0.07 -0.92 -0.30 0.00 -1.18 0.00 0.00 61.69 59.23 1fnu s THR 1004Cb -0.15 -0.55 -0.11 0.00 1.34 0.00 0.00 72.50 73.03 1fnu s THR 1004CO 0.04 -0.50 1.57 0.20 -0.54 0.00 0.00 174.62 175.39 1fnu s ASN 1005N -1.67 6.38 -0.13 3.99 0.01 -1.26 0.46 114.94 122.72 1fnu s ASN 1005Ca -0.12 2.95 -0.20 0.00 -0.71 0.00 0.00 52.86 54.78 1fnu s ASN 1005Cb -0.06 -2.64 -0.25 0.00 0.41 0.00 0.00 41.25 38.71 1fnu s ASN 1005CO -0.01 -0.90 0.54 -0.74 -1.51 0.00 0.00 177.10 174.48 1fnu h HIS 1006N 4.58 0.25 -1.42 2.20 -0.00 -1.75 -3.41 115.15 115.60 1fnu h HIS 1006Ca -0.48 -0.18 -0.62 0.00 -0.00 0.00 0.00 60.37 59.09 1fnu h HIS 1006Cb 1.22 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 28.61 1fnu h HIS 1006CO 0.58 1.40 1.48 -0.85 -0.00 0.00 0.00 177.93 180.54 1fnu n GLU 1007N -4.21 1.36 0.00 5.26 0.00 -1.26 -1.55 120.64 120.24 1fnu n GLU 1007Ca -0.23 0.34 0.00 0.00 0.00 0.00 0.00 57.16 57.28 1fnu n GLU 1007Cb 0.75 -2.80 0.00 0.00 0.00 0.00 0.00 31.44 29.40 1fnu n GLU 1007CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1fnu n GLY 1008N 6.23 3.26 0.00 -1.84 0.00 -1.26 -4.92 105.19 106.66 1fnu n GLY 1008Ca 0.38 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.47 1fnu n GLY 1008CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1fnu n ASN 1009N 0.02 0.00 -4.73 1.61 5.15 -0.60 -4.86 115.26 111.86 1fnu n ASN 1009Ca 0.00 0.47 -0.41 0.00 -0.60 0.00 0.00 54.58 54.04 1fnu n ASN 1009Cb 0.00 -0.49 -0.03 0.00 -0.53 0.00 0.00 39.78 38.73 1fnu n ASN 1009CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 1fnu s HIS 1010N -2.97 3.52 -0.27 1.20 2.46 -1.26 -0.99 115.29 116.98 1fnu s HIS 1010Ca 0.08 1.47 -0.09 0.00 0.47 0.00 0.00 55.06 57.00 1fnu s HIS 1010Cb 0.11 -3.33 -0.03 0.00 -0.13 0.00 0.00 32.58 29.20 1fnu s HIS 1010CO 0.29 -0.88 0.12 -0.51 -2.47 0.00 0.00 174.74 171.29 1fnu s LEU 1011N 0.34 3.75 0.15 8.88 1.43 0.44 -4.86 118.68 128.81 1fnu s LEU 1011Ca 0.54 -0.28 -0.18 0.00 -1.03 0.00 0.00 54.13 53.18 1fnu s LEU 1011Cb -0.29 -1.98 0.05 0.00 0.03 0.00 0.00 46.19 44.00 1fnu s LEU 1011CO 0.32 -0.09 1.68 -0.33 0.23 0.00 0.00 176.35 178.17 1fnu h GLU 1012N 8.30 0.01 -5.40 1.70 4.39 -1.97 -3.36 114.58 118.25 1fnu h GLU 1012Ca -0.36 -0.00 -0.63 0.00 0.34 0.00 0.00 59.36 58.71 1fnu h GLU 1012Cb 1.17 -0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 29.67 1fnu h GLU 1012CO 0.58 0.01 -0.56 0.42 -1.16 0.00 0.00 179.01 178.30 1fnu s ILE 1013N -6.21 4.83 0.10 3.13 1.09 -1.26 -5.07 121.20 117.82 1fnu s ILE 1013Ca -0.14 -0.02 -0.30 0.00 -1.10 0.00 0.00 60.65 59.09 1fnu s ILE 1013Cb 0.13 -3.16 -0.06 0.00 -1.06 0.00 0.00 42.46 38.31 1fnu s ILE 1013CO 0.70 0.49 1.19 -2.84 -0.10 0.00 0.00 174.94 174.39 1fnu s PRO 1014N 0.08 4.46 0.04 2.79 0.02 -1.26 -4.99 135.00 136.14 1fnu s PRO 1014Ca 0.06 1.80 -0.30 0.00 0.02 0.00 0.00 61.00 62.57 1fnu s PRO 1014Cb -0.12 -3.31 -0.04 0.00 0.02 0.00 0.00 34.50 31.04 1fnu s PRO 1014CO 0.01 -0.19 1.06 0.21 -0.33 0.00 0.00 177.00 177.76 1fnu s LYS 1015N 0.61 4.53 -0.01 5.54 2.47 -0.56 -4.86 119.74 127.46 1fnu s LYS 1015Ca 0.57 1.56 -0.09 0.00 -1.56 0.00 0.00 55.97 56.45 1fnu s LYS 1015Cb -0.30 -3.40 -0.05 0.00 -1.46 0.00 0.00 37.83 32.62 1fnu s LYS 1015CO 0.31 -0.09 0.29 0.15 0.16 0.00 0.00 175.35 176.18 1fnu s LYS 1016N 0.84 3.66 -0.07 4.03 1.02 -1.26 -1.89 119.74 126.07 1fnu s LYS 1016Ca 0.54 0.07 0.04 0.00 0.02 0.00 0.00 55.97 56.63 1fnu s LYS 1016Cb -0.25 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 1fnu s LYS 1016CO 0.29 0.68 -0.18 0.42 -0.92 0.00 0.00 175.35 175.64 1fnu s ILE 1017N -1.19 1.58 0.14 2.17 1.01 0.19 -4.94 121.20 120.15 1fnu s ILE 1017Ca 0.24 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 59.84 1fnu s ILE 1017Cb -0.14 -1.38 -0.07 0.00 0.01 0.00 0.00 42.46 40.88 1fnu s ILE 1017CO 0.13 0.45 1.22 -0.69 0.00 0.00 0.00 174.94 176.05 1fnu s VAL 1018N 0.37 3.69 -0.37 2.92 1.01 -1.26 -1.12 120.40 125.64 1fnu s VAL 1018Ca -0.13 1.33 0.01 0.00 0.00 0.00 0.00 61.98 63.18 1fnu s VAL 1018Cb -0.16 -3.85 0.10 0.00 0.00 0.00 0.00 36.38 32.47 1fnu s VAL 1018CO 0.05 0.17 0.11 -0.69 0.00 0.00 0.00 175.10 174.74 1fnu s VAL 1019N 0.41 2.76 -0.04 2.92 1.01 -0.05 -4.08 120.40 123.32 1fnu s VAL 1019Ca 0.56 -2.15 -0.30 0.00 0.00 0.00 0.00 61.98 60.08 1fnu s VAL 1019Cb -0.32 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1fnu s VAL 1019CO 0.34 -0.60 1.18 -0.54 0.00 0.00 0.00 175.10 175.47 1fnu s LYS 1020N 1.03 4.37 -0.20 2.72 1.02 -0.40 -2.87 119.74 125.41 1fnu s LYS 1020Ca 0.08 1.66 0.01 0.00 0.02 0.00 0.00 55.97 57.75 1fnu s LYS 1020Cb -0.21 -3.53 0.04 0.00 -0.52 0.00 0.00 37.83 33.62 1fnu s LYS 1020CO -0.06 -0.40 -0.13 0.08 -0.92 0.00 0.00 175.35 173.93 1fnu s VAL 1021N 2.00 1.78 0.04 3.17 1.01 -0.70 -1.13 120.40 126.57 1fnu s VAL 1021Ca 0.56 -1.04 0.04 0.00 0.00 0.00 0.00 61.98 61.54 1fnu s VAL 1021Cb -0.25 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 1fnu s VAL 1021CO 0.23 0.24 -0.04 -0.44 0.00 0.00 0.00 175.10 175.09 1fnu s SER 1022N 1.35 4.81 -0.06 3.32 0.01 0.65 -2.37 113.70 121.40 1fnu s SER 1022Ca -0.00 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.09 1fnu s SER 1022Cb -0.16 -1.13 0.02 0.00 0.21 0.00 0.00 66.02 64.97 1fnu s SER 1022CO -0.09 0.23 -0.04 -0.63 0.41 0.00 0.00 173.24 173.13 1fnu s ILE 1023N -1.14 0.58 -1.52 1.44 1.01 -0.14 -0.83 121.20 120.60 1fnu s ILE 1023Ca 0.21 -0.08 -0.09 0.00 0.00 0.00 0.00 60.65 60.69 1fnu s ILE 1023Cb -0.11 -0.64 0.07 0.00 0.01 0.00 0.00 42.46 41.78 1fnu s ILE 1023CO 0.12 0.26 0.67 0.47 0.00 0.00 0.00 174.94 176.47 1fnu n ASP 1024N 4.53 -2.23 0.00 3.58 8.00 0.26 -1.53 116.55 129.17 1fnu n ASP 1024Ca -0.17 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.38 1fnu n ASP 1024Cb 0.50 -3.20 0.00 0.00 -0.02 0.00 0.00 41.12 38.40 1fnu n ASP 1024CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fnu n GLY 1025N -1.70 0.81 3.34 0.44 0.00 -1.26 -5.02 105.19 101.80 1fnu n GLY 1025Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 1fnu n GLY 1025CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1fnu s ILE 1026N -3.40 2.11 -0.03 -0.61 -0.00 -0.58 -5.08 121.20 113.60 1fnu s ILE 1026Ca 0.00 -1.46 -0.30 0.00 -0.00 0.00 0.00 60.65 58.89 1fnu s ILE 1026Cb 0.00 -1.82 -0.04 0.00 -0.00 0.00 0.00 42.46 40.60 1fnu s ILE 1026CO 0.00 0.28 1.26 -1.58 -0.00 0.00 0.00 174.94 174.90 1fnu s GLN 1027N -1.43 4.33 -0.02 0.37 -0.44 -1.26 -0.97 119.66 120.25 1fnu s GLN 1027Ca 0.12 1.76 0.18 0.00 -2.50 0.00 0.00 55.36 54.92 1fnu s GLN 1027Cb -0.10 -3.55 -0.24 0.00 -1.64 0.00 0.00 33.01 27.48 1fnu s GLN 1027CO 0.03 -0.48 0.51 0.43 0.50 0.00 0.00 175.29 176.29 1fnu n SER 1028N 5.19 0.89 0.00 6.67 7.64 -1.00 -4.93 113.62 128.08 1fnu n SER 1028Ca 0.11 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.67 1fnu n SER 1028Cb 0.45 1.52 0.00 0.00 -1.01 0.00 0.00 64.21 65.17 1fnu n SER 1028CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fnu n LEU 1029N -1.86 0.00 -4.11 -3.43 -0.00 -1.19 -5.08 117.00 101.33 1fnu n LEU 1029Ca -0.01 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.89 1fnu n LEU 1029Cb 0.39 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.74 1fnu n LEU 1029CO 0.37 0.00 -0.03 -0.44 -0.00 0.00 0.00 177.39 177.29 1fnu s SER 1030N -0.94 0.18 0.09 1.45 0.01 -1.26 -1.73 113.70 111.50 1fnu s SER 1030Ca 0.00 -1.22 -0.21 0.00 1.31 0.00 0.00 55.95 55.83 1fnu s SER 1030Cb 0.00 0.50 0.05 0.00 0.21 0.00 0.00 66.02 66.78 1fnu s SER 1030CO 0.00 -1.02 0.50 0.72 0.41 0.00 0.00 173.24 173.86 1fnu s PHE 1031N -3.97 -0.38 0.33 2.43 -0.71 -1.14 -4.97 117.98 109.57 1fnu s PHE 1031Ca 0.31 0.28 -0.01 0.00 -1.04 0.00 0.00 56.93 56.47 1fnu s PHE 1031Cb 0.03 0.36 -0.04 0.00 -1.21 0.00 0.00 43.02 42.16 1fnu s PHE 1031CO 0.12 -0.70 0.56 -0.51 -1.34 0.00 0.00 175.22 173.35 1fnu s ASP 1032N -2.35 6.34 0.12 1.98 1.11 -1.26 -0.87 116.67 121.74 1fnu s ASP 1032Ca -0.02 0.55 0.02 0.00 0.18 0.00 0.00 52.55 53.28 1fnu s ASP 1032Cb -0.00 -2.08 -0.04 0.00 1.07 0.00 0.00 42.92 41.87 1fnu s ASP 1032CO -0.07 -0.27 -0.04 0.27 1.18 0.00 0.00 175.17 176.24 1fnu s ILE 1033N -2.25 0.67 0.11 0.77 -4.36 -0.28 -4.93 121.20 110.92 1fnu s ILE 1033Ca 0.41 -1.95 0.06 0.00 -0.26 0.00 0.00 60.65 58.92 1fnu s ILE 1033Cb -0.10 -1.81 -0.04 0.00 1.25 0.00 0.00 42.46 41.77 1fnu s ILE 1033CO 0.35 -0.76 -0.15 -1.61 0.24 0.00 0.00 174.94 173.01 1fnu s GLU 1034N -3.86 0.98 0.05 0.37 2.02 -1.26 0.55 118.70 117.54 1fnu s GLU 1034Ca 0.15 -1.16 -0.12 0.00 0.02 0.00 0.00 54.97 53.87 1fnu s GLU 1034Cb 0.06 -0.92 0.01 0.00 0.10 0.00 0.00 34.13 33.38 1fnu s GLU 1034CO -0.02 0.19 0.25 -0.08 0.02 0.00 0.00 175.26 175.61 1fnu s THR 1035N -1.83 0.10 -1.54 3.63 -1.32 -0.79 -5.00 115.64 108.89 1fnu s THR 1035Ca 0.06 -0.80 0.16 0.00 -1.21 0.00 0.00 61.69 59.89 1fnu s THR 1035Cb -0.07 -0.95 0.38 0.00 -1.51 0.00 0.00 72.50 70.35 1fnu s THR 1035CO 0.03 -0.44 1.30 0.59 -2.21 0.00 0.00 174.62 173.88 1fnu n ASN 1036N 0.57 3.15 -4.53 8.08 3.02 -1.26 -1.49 115.26 122.80 1fnu n ASN 1036Ca -0.18 -1.93 -0.33 0.00 -0.03 0.00 0.00 54.58 52.11 1fnu n ASN 1036Cb 0.59 -0.27 -0.12 0.00 -0.61 0.00 0.00 39.78 39.38 1fnu n ASN 1036CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1fnu s LYS 1037N -1.09 2.60 0.02 3.52 1.02 -1.26 -0.42 119.74 124.13 1fnu s LYS 1037Ca 0.31 -0.64 -0.21 0.00 0.02 0.00 0.00 55.97 55.45 1fnu s LYS 1037Cb 0.17 -2.47 -0.17 0.00 -0.52 0.00 0.00 37.83 34.84 1fnu s LYS 1037CO 0.23 0.64 1.28 0.87 -0.92 0.00 0.00 175.35 177.44 1fnu h LYS 1038N 5.22 0.32 -4.67 1.68 1.57 -1.40 -3.39 116.57 115.90 1fnu h LYS 1038Ca -0.48 -0.20 -0.69 0.00 -1.87 0.00 0.00 60.65 57.42 1fnu h LYS 1038Cb 1.16 0.02 -0.32 0.00 0.08 0.00 0.00 32.23 33.17 1fnu h LYS 1038CO 0.51 0.78 -0.63 -1.64 -0.57 0.00 0.00 179.45 177.90 1fnu s MET 1039N -4.04 2.38 0.12 3.15 -1.94 -1.26 -1.47 119.30 116.24 1fnu s MET 1039Ca -0.14 -1.38 0.04 0.00 -1.71 0.00 0.00 55.69 52.50 1fnu s MET 1039Cb 0.04 -3.37 -0.04 0.00 2.01 0.00 0.00 34.83 33.48 1fnu s MET 1039CO 0.75 -0.75 0.10 0.14 -0.01 0.00 0.00 175.02 175.25 1fnu s VAL 1040N 1.27 4.46 0.43 -6.03 -7.23 -1.04 -4.83 120.40 107.43 1fnu s VAL 1040Ca -0.01 -0.95 -0.22 0.00 -1.81 0.00 0.00 61.98 58.99 1fnu s VAL 1040Cb -0.20 -3.21 -0.09 0.00 0.56 0.00 0.00 36.38 33.43 1fnu s VAL 1040CO -0.01 0.01 1.01 0.42 -0.31 0.00 0.00 175.10 176.22 1fnu s THR 1041N -1.57 3.94 0.47 5.32 -4.23 -1.26 0.29 115.64 118.61 1fnu s THR 1041Ca 0.30 1.32 0.21 0.00 -1.18 0.00 0.00 61.69 62.34 1fnu s THR 1041Cb -0.11 -3.60 0.25 0.00 1.34 0.00 0.00 72.50 70.38 1fnu s THR 1041CO 0.22 -0.15 2.08 0.00 -0.54 0.00 0.00 174.62 176.23 1fnu h ALA 1042N 2.06 1.60 0.22 3.99 0.00 0.43 -2.98 119.26 124.58 1fnu h ALA 1042Ca -0.49 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 1fnu h ALA 1042Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1fnu h ALA 1042CO 0.61 0.14 -0.11 0.37 0.00 0.00 0.00 179.25 180.26 1fnu h GLN 1043N 0.00 -0.29 -0.75 0.00 4.15 -1.92 -0.53 115.11 115.78 1fnu h GLN 1043Ca -0.00 0.02 0.14 0.00 0.77 0.00 0.00 58.65 59.58 1fnu h GLN 1043Cb 0.23 0.07 -0.10 0.00 0.21 0.00 0.00 27.48 27.89 1fnu h GLN 1043CO 0.01 -0.17 0.29 1.49 -1.93 0.00 0.00 178.83 178.53 1fnu h GLU 1044N -0.33 0.42 -0.02 1.69 4.81 -1.74 -1.88 114.58 117.52 1fnu h GLU 1044Ca -0.03 -0.03 -0.17 0.00 -0.13 0.00 0.00 59.36 59.00 1fnu h GLU 1044Cb 0.25 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1fnu h GLU 1044CO 0.05 0.28 -0.76 -0.07 -0.73 0.00 0.00 179.01 177.78 1fnu h LEU 1045N 0.43 0.24 -1.00 1.64 3.38 -1.55 -2.87 115.31 115.59 1fnu h LEU 1045Ca 0.41 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 58.13 1fnu h LEU 1045Cb 0.62 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1fnu h LEU 1045CO -0.41 0.91 -0.08 -0.78 0.09 0.00 0.00 178.44 178.17 1fnu h ASP 1046N 0.13 0.61 0.35 -0.43 3.58 -0.44 -2.66 116.42 117.56 1fnu h ASP 1046Ca -0.03 -0.16 -0.02 0.00 0.42 0.00 0.00 57.03 57.25 1fnu h ASP 1046Cb 1.34 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.23 1fnu h ASP 1046CO 0.12 0.73 -0.17 0.22 -2.88 0.00 0.00 179.24 177.26 1fnu h TYR 1047N 0.58 -0.44 -0.64 0.28 3.20 -1.37 -0.02 116.97 118.56 1fnu h TYR 1047Ca 0.11 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.10 1fnu h TYR 1047Cb 0.49 0.15 -0.10 0.00 1.54 0.00 0.00 36.73 38.81 1fnu h TYR 1047CO 0.02 -0.11 0.11 0.87 -1.64 0.00 0.00 178.16 177.40 1fnu h LYS 1048N -0.80 0.22 0.41 1.82 1.57 -1.52 0.28 116.57 118.56 1fnu h LYS 1048Ca -0.05 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1fnu h LYS 1048Cb 0.52 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1fnu h LYS 1048CO 0.08 0.14 -0.32 0.28 -0.57 0.00 0.00 179.45 179.06 1fnu h VAL 1049N 0.23 0.34 -0.50 0.50 2.07 -1.37 -2.15 116.25 115.37 1fnu h VAL 1049Ca 0.34 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.83 1fnu h VAL 1049Cb 0.55 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1fnu h VAL 1049CO -0.46 0.00 0.15 0.03 0.02 0.00 0.00 177.57 177.31 1fnu h ARG 1050N -0.73 0.73 -0.10 1.57 3.08 -0.20 -1.29 114.38 117.44 1fnu h ARG 1050Ca -0.04 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.89 1fnu h ARG 1050Cb 0.63 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1fnu h ARG 1050CO -0.00 0.64 0.05 -0.22 -1.07 0.00 0.00 179.97 179.36 1fnu h LYS 1051N 0.72 0.10 -0.52 0.04 1.63 -0.36 0.27 116.57 118.46 1fnu h LYS 1051Ca 0.17 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.94 1fnu h LYS 1051Cb 0.21 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.80 1fnu h LYS 1051CO -0.01 0.07 0.26 -0.92 -3.45 0.00 0.00 179.45 175.39 1fnu h TYR 1052N 0.10 0.74 0.00 1.91 3.20 -1.21 -1.99 116.97 119.71 1fnu h TYR 1052Ca 0.04 -0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.77 1fnu h TYR 1052Cb 0.00 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 1fnu h TYR 1052CO -0.09 0.57 -0.49 1.79 -1.64 0.00 0.00 178.16 178.30 1fnu h THR 1053N 0.69 1.31 0.11 1.81 1.35 -1.03 0.13 112.91 117.29 1fnu h THR 1053Ca 0.18 -1.70 -0.01 0.00 -0.55 0.00 0.00 66.41 64.33 1fnu h THR 1053Cb 0.10 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1fnu h THR 1053CO -0.02 0.48 -0.05 0.40 -0.25 0.00 0.00 175.52 176.07 1fnu h ILE 1054N 0.00 1.09 0.00 6.82 2.04 -0.17 -1.41 117.51 125.89 1fnu h ILE 1054Ca -0.00 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1fnu h ILE 1054Cb 0.89 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 1fnu h ILE 1054CO 0.06 0.21 0.00 0.47 0.00 0.00 0.00 178.15 178.90 1fnu n ASP 1055N -4.96 0.71 -0.02 1.72 8.00 -0.77 -2.13 116.55 119.10 1fnu n ASP 1055Ca -0.09 0.59 0.04 0.00 0.71 0.00 0.00 54.79 56.04 1fnu n ASP 1055Cb 0.24 -0.77 -0.10 0.00 -0.02 0.00 0.00 41.12 40.47 1fnu n ASP 1055CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1fnu n ASN 1056N -2.19 1.91 -0.79 -2.24 3.02 0.45 -4.72 115.26 110.69 1fnu n ASN 1056Ca 0.05 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.61 1fnu n ASN 1056Cb 0.38 1.43 0.00 0.00 -0.61 0.00 0.00 39.78 40.99 1fnu n ASN 1056CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1fnu n LYS 1057N -2.08 0.00 -3.93 3.52 0.00 -0.66 -5.03 118.16 109.98 1fnu n LYS 1057Ca -0.07 -1.17 -0.25 0.00 0.00 0.00 0.00 58.31 56.82 1fnu n LYS 1057Cb 0.48 -0.27 -0.02 0.00 0.00 0.00 0.00 35.03 35.22 1fnu n LYS 1057CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1fnu n GLN 1058N 0.13 -3.37 -0.28 1.64 3.00 -0.90 -4.89 117.38 112.72 1fnu n GLN 1058Ca 0.00 0.42 0.08 0.00 -0.01 0.00 0.00 57.00 57.49 1fnu n GLN 1058Cb 0.80 -4.56 0.31 0.00 0.00 0.00 0.00 30.24 26.79 1fnu n GLN 1058CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 1fnu h LEU 1059N -1.84 0.77 -8.05 1.08 5.85 -1.41 -3.40 115.31 108.32 1fnu h LEU 1059Ca -0.63 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 57.96 1fnu h LEU 1059Cb 1.37 -0.14 -0.19 0.00 0.37 0.00 0.00 40.66 42.08 1fnu h LEU 1059CO 0.61 0.45 -0.68 -0.31 -0.34 0.00 0.00 178.44 178.18 1fnu s TYR 1060N -5.79 0.33 0.23 1.25 2.02 -1.26 -4.68 117.35 109.45 1fnu s TYR 1060Ca -0.11 -0.68 0.00 0.00 -0.37 0.00 0.00 57.07 55.92 1fnu s TYR 1060Cb 0.21 -0.24 -0.04 0.00 -0.40 0.00 0.00 41.96 41.49 1fnu s TYR 1060CO 0.79 -0.26 0.18 0.95 -1.57 0.00 0.00 175.55 175.64 1fnu s THR 1061N -2.25 0.00 -1.25 -0.71 -4.23 -1.26 -4.89 115.64 101.05 1fnu s THR 1061Ca -0.09 -1.97 -0.19 0.00 -1.18 0.00 0.00 61.69 58.27 1fnu s THR 1061Cb -0.04 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.31 1fnu s THR 1061CO -0.04 0.00 1.89 -3.20 -0.54 0.00 0.00 174.62 172.73 1fnu n ASN 1062N -0.54 4.07 0.00 3.99 2.85 -1.26 -4.43 115.26 119.94 1fnu n ASN 1062Ca 0.03 -2.83 0.00 0.00 -0.11 0.00 0.00 54.58 51.67 1fnu n ASN 1062Cb 0.65 -1.67 0.00 0.00 1.24 0.00 0.00 39.78 40.00 1fnu n ASN 1062CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1fnu n GLY 1063N 5.18 0.22 3.70 8.20 0.00 -1.26 -4.96 105.19 116.27 1fnu n GLY 1063Ca 0.49 -1.26 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 1fnu n GLY 1063CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1fnu n PRO 1064N 0.00 0.87 -4.02 1.61 -0.02 -1.26 -4.28 135.00 127.89 1fnu n PRO 1064Ca 0.00 0.36 -0.21 0.00 -2.02 0.00 0.00 63.50 61.62 1fnu n PRO 1064Cb 0.00 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.01 1fnu n PRO 1064CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1fnu s SER 1065N -1.51 5.84 0.03 2.55 0.15 -1.26 -4.26 113.70 115.24 1fnu s SER 1065Ca 0.80 -0.13 -0.13 0.00 0.70 0.00 0.00 55.95 57.18 1fnu s SER 1065Cb -0.37 -1.56 -0.34 0.00 -1.71 0.00 0.00 66.02 62.04 1fnu s SER 1065CO 0.44 -0.08 1.00 0.50 1.20 0.00 0.00 173.24 176.30 1fnu h LYS 1066N 1.33 0.48 -6.48 5.44 3.64 -1.83 -3.47 116.57 115.68 1fnu h LYS 1066Ca -0.50 -0.82 -0.53 0.00 -1.27 0.00 0.00 60.65 57.53 1fnu h LYS 1066Cb 1.24 0.30 -0.03 0.00 -0.41 0.00 0.00 32.23 33.33 1fnu h LYS 1066CO 0.60 1.39 0.06 0.71 -2.27 0.00 0.00 179.45 179.94 1fnu s TYR 1067N -2.61 3.66 -0.09 1.91 2.02 -1.26 -3.96 117.35 117.02 1fnu s TYR 1067Ca -0.09 1.32 -0.09 0.00 -0.37 0.00 0.00 57.07 57.84 1fnu s TYR 1067Cb 0.05 -2.56 -0.28 0.00 -0.40 0.00 0.00 41.96 38.77 1fnu s TYR 1067CO 0.93 0.39 0.50 1.49 -1.57 0.00 0.00 175.55 177.28 1fnu h GLU 1068N 3.58 0.32 -4.97 -0.62 4.57 -0.54 -3.42 114.58 113.50 1fnu h GLU 1068Ca -0.48 -0.55 -0.37 0.00 -1.18 0.00 0.00 59.36 56.78 1fnu h GLU 1068Cb 1.20 0.20 -0.14 0.00 -0.16 0.00 0.00 28.75 29.85 1fnu h GLU 1068CO 0.65 1.26 -0.63 0.95 -1.18 0.00 0.00 179.01 180.07 1fnu s THR 1069N -2.56 0.77 0.00 0.32 -4.23 -1.24 0.25 115.64 108.94 1fnu s THR 1069Ca -0.20 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.31 1fnu s THR 1069Cb 0.06 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.35 1fnu s THR 1069CO 0.80 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 175.38 1fnu n GLY 1070N -0.47 1.16 3.37 3.99 0.00 -1.25 -2.67 105.19 109.32 1fnu n GLY 1070Ca -0.02 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 1fnu n GLY 1070CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fnu s TYR 1071N -1.66 -0.38 -0.04 1.61 1.13 -0.96 0.31 117.35 117.36 1fnu s TYR 1071Ca 0.00 0.17 0.07 0.00 -1.41 0.00 0.00 57.07 55.90 1fnu s TYR 1071Cb 0.00 0.40 -0.01 0.00 -1.10 0.00 0.00 41.96 41.24 1fnu s TYR 1071CO 0.00 -0.75 -0.24 -1.50 -2.51 0.00 0.00 175.55 170.55 1fnu s ILE 1072N -3.55 1.93 -0.12 -3.49 2.07 -0.85 -2.06 121.20 115.14 1fnu s ILE 1072Ca 0.01 -1.02 0.01 0.00 -1.41 0.00 0.00 60.65 58.24 1fnu s ILE 1072Cb 0.00 -1.62 -0.01 0.00 0.13 0.00 0.00 42.46 40.96 1fnu s ILE 1072CO -0.11 0.54 -0.16 -0.75 -1.91 0.00 0.00 174.94 172.55 1fnu s LYS 1073N -0.31 3.27 -0.30 3.50 2.20 0.46 -2.20 119.74 126.36 1fnu s LYS 1073Ca 0.02 -0.75 -0.08 0.00 -0.36 0.00 0.00 55.97 54.80 1fnu s LYS 1073Cb -0.12 -2.54 -0.00 0.00 -1.51 0.00 0.00 37.83 33.67 1fnu s LYS 1073CO 0.02 0.19 0.12 -0.06 -0.36 0.00 0.00 175.35 175.25 1fnu s PHE 1074N 0.39 3.16 -0.71 4.03 0.08 -0.16 -1.45 117.98 123.32 1fnu s PHE 1074Ca -0.13 -0.70 -0.08 0.00 0.12 0.00 0.00 56.93 56.14 1fnu s PHE 1074Cb -0.16 -2.31 0.18 0.00 -0.57 0.00 0.00 43.02 40.16 1fnu s PHE 1074CO 0.06 -0.49 0.58 0.42 -0.10 0.00 0.00 175.22 175.69 1fnu s ILE 1075N 1.57 4.59 1.03 0.64 1.01 -0.75 -1.13 121.20 128.16 1fnu s ILE 1075Ca 0.04 -2.68 -0.12 0.00 0.00 0.00 0.00 60.65 57.89 1fnu s ILE 1075Cb -0.17 -3.91 0.21 0.00 0.01 0.00 0.00 42.46 38.60 1fnu s ILE 1075CO 0.05 -0.94 1.07 -2.84 0.00 0.00 0.00 174.94 172.28 1fnu s PRO 1076N 0.12 0.14 -0.07 2.79 0.02 -1.26 -2.22 135.00 134.52 1fnu s PRO 1076Ca 0.17 0.79 -0.27 0.00 0.02 0.00 0.00 61.00 61.71 1fnu s PRO 1076Cb -0.16 -1.68 -0.23 0.00 0.02 0.00 0.00 34.50 32.45 1fnu s PRO 1076CO -0.06 -3.00 1.06 -0.22 -0.33 0.00 0.00 177.00 174.46 1fnu h LYS 1077N -2.10 0.03 0.00 5.54 3.64 -1.90 -3.42 116.57 118.36 1fnu h LYS 1077Ca -0.55 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.81 1fnu h LYS 1077Cb 1.32 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1fnu h LYS 1077CO 0.53 0.73 0.00 0.27 -2.27 0.00 0.00 179.45 178.70 1fnu n ASN 1078N -4.72 0.00 -0.00 4.20 0.23 -1.26 -5.03 115.26 108.68 1fnu n ASN 1078Ca -0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.96 1fnu n ASN 1078Cb 0.36 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.06 1fnu n ASN 1078CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 1fnu n LYS 1079N 0.00 3.34 -1.64 -3.83 4.81 -1.26 -4.97 118.16 114.61 1fnu n LYS 1079Ca 0.00 0.00 -0.61 0.00 -0.87 0.00 0.00 58.31 56.83 1fnu n LYS 1079Cb 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 34.97 1fnu n LYS 1079CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1fnu n GLU 1080N 0.00 0.30 -0.75 1.64 2.13 -1.26 -4.14 120.64 118.56 1fnu n GLU 1080Ca 0.00 0.11 -0.30 0.00 0.66 0.00 0.00 57.16 57.63 1fnu n GLU 1080Cb 0.00 -1.65 0.25 0.00 0.27 0.00 0.00 31.44 30.31 1fnu n GLU 1080CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1fnu s SER 1081N 1.73 0.35 -0.08 4.31 1.04 -1.26 -4.66 113.70 115.12 1fnu s SER 1081Ca 0.97 0.90 -0.30 0.00 0.48 0.00 0.00 55.95 58.00 1fnu s SER 1081Cb -1.29 -1.32 0.10 0.00 0.10 0.00 0.00 66.02 63.60 1fnu s SER 1081CO 0.67 -4.50 0.86 0.72 0.98 0.00 0.00 173.24 171.96 1fnu s PHE 1082N -2.65 -0.46 0.26 5.02 -0.12 -0.29 -3.54 117.98 116.20 1fnu s PHE 1082Ca 0.69 0.70 0.05 0.00 -0.05 0.00 0.00 56.93 58.32 1fnu s PHE 1082Cb -0.14 0.46 -0.06 0.00 -0.63 0.00 0.00 43.02 42.65 1fnu s PHE 1082CO 0.58 -0.48 -0.01 1.67 -0.05 0.00 0.00 175.22 176.93 1fnu s TRP 1083N -1.59 1.75 -0.03 3.49 1.48 -1.26 -0.99 118.94 121.78 1fnu s TRP 1083Ca -0.03 -0.85 0.04 0.00 -1.06 0.00 0.00 56.10 54.19 1fnu s TRP 1083Cb -0.00 -1.03 -0.00 0.00 -1.16 0.00 0.00 33.47 31.28 1fnu s TRP 1083CO 0.02 0.08 -0.14 -0.06 -4.06 0.00 0.00 176.95 172.79 1fnu s PHE 1084N -3.26 1.37 0.13 1.66 0.08 -0.93 -4.99 117.98 112.03 1fnu s PHE 1084Ca 0.30 -0.37 -0.26 0.00 0.12 0.00 0.00 56.93 56.72 1fnu s PHE 1084Cb 0.05 -0.94 -0.07 0.00 -0.57 0.00 0.00 43.02 41.50 1fnu s PHE 1084CO 0.11 -0.13 0.81 0.34 -0.10 0.00 0.00 175.22 176.25 1fnu s ASP 1085N 0.08 7.38 0.38 1.36 -1.08 -1.26 -2.00 116.67 121.52 1fnu s ASP 1085Ca -0.03 1.64 0.26 0.00 -0.52 0.00 0.00 52.55 53.90 1fnu s ASP 1085Cb -0.10 -2.51 0.71 0.00 -1.46 0.00 0.00 42.92 39.56 1fnu s ASP 1085CO 0.01 0.11 1.73 -0.26 0.52 0.00 0.00 175.17 177.28 1fnu h PHE 1086N 4.87 0.00 -3.53 -5.34 0.04 -0.51 -3.45 116.94 109.02 1fnu h PHE 1086Ca -0.45 0.00 -0.66 0.00 2.80 0.00 0.00 57.97 59.65 1fnu h PHE 1086Cb 1.21 0.00 -0.17 0.00 2.20 0.00 0.00 35.95 39.19 1fnu h PHE 1086CO 0.64 0.00 -0.77 -0.06 -0.60 0.00 0.00 178.31 177.52 1fnu s PHE 1087N -3.27 2.62 0.25 -0.55 0.08 -1.26 -5.01 117.98 110.84 1fnu s PHE 1087Ca 0.07 -0.22 0.01 0.00 0.12 0.00 0.00 56.93 56.91 1fnu s PHE 1087Cb 0.08 -1.36 0.05 0.00 -0.57 0.00 0.00 43.02 41.22 1fnu s PHE 1087CO 0.60 0.43 0.35 -0.35 -0.10 0.00 0.00 175.22 176.15 1fnu n PRO 1088N 0.61 0.53 -1.50 0.24 -0.04 -1.26 -4.71 135.00 128.87 1fnu n PRO 1088Ca -0.14 -1.08 -0.31 0.00 -0.04 0.00 0.00 63.50 61.93 1fnu n PRO 1088Cb 0.53 -0.19 0.06 0.00 -0.04 0.00 0.00 33.50 33.86 1fnu n PRO 1088CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1fnu s GLU 1089N -3.25 2.72 0.15 0.54 2.02 -1.26 -4.78 118.70 114.84 1fnu s GLU 1089Ca 0.24 1.06 -0.32 0.00 0.02 0.00 0.00 54.97 55.98 1fnu s GLU 1089Cb -0.02 -1.96 -0.08 0.00 0.10 0.00 0.00 34.13 32.18 1fnu s GLU 1089CO 0.16 -1.27 1.54 -1.35 0.02 0.00 0.00 175.26 174.36 1fnu h PRO 1090N -0.76 -0.17 -4.80 0.39 0.11 -1.94 -3.30 132.00 121.54 1fnu h PRO 1090Ca -0.44 0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.00 1fnu h PRO 1090Cb 1.22 0.04 -0.26 0.00 0.11 0.00 0.00 31.00 32.10 1fnu h PRO 1090CO 0.55 -0.11 -0.62 -1.21 -0.21 0.00 0.00 178.00 176.40 1fnu s GLU 1091N -5.57 3.06 0.30 1.05 2.02 -1.26 -0.67 118.70 117.62 1fnu s GLU 1091Ca -0.13 -0.88 0.03 0.00 0.02 0.00 0.00 54.97 54.01 1fnu s GLU 1091Cb 0.10 -3.37 -0.03 0.00 0.10 0.00 0.00 34.13 30.93 1fnu s GLU 1091CO 0.62 -0.46 0.28 -0.59 0.02 0.00 0.00 175.26 175.14 1fnu s PHE 1092N 1.49 1.43 0.11 1.61 -0.71 -1.24 -5.09 117.98 115.58 1fnu s PHE 1092Ca 0.02 -1.49 0.06 0.00 -1.04 0.00 0.00 56.93 54.49 1fnu s PHE 1092Cb -0.17 -0.53 -0.04 0.00 -1.21 0.00 0.00 43.02 41.07 1fnu s PHE 1092CO 0.02 -0.87 -0.16 0.95 -1.34 0.00 0.00 175.22 173.83 1fnu s THR 1093N -3.58 1.40 0.26 -4.49 -4.23 -1.26 -5.04 115.64 98.71 1fnu s THR 1093Ca 0.38 -1.59 -0.03 0.00 -1.18 0.00 0.00 61.69 59.26 1fnu s THR 1093Cb 0.03 -1.45 0.27 0.00 1.34 0.00 0.00 72.50 72.69 1fnu s THR 1093CO 0.22 -0.29 1.89 1.56 -0.54 0.00 0.00 174.62 177.46 1fnu h GLN 1094N 3.80 1.18 -0.35 3.99 4.20 -1.92 -0.36 115.11 125.66 1fnu h GLN 1094Ca -0.42 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.09 1fnu h GLN 1094Cb 1.19 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 1fnu h GLN 1094CO 0.46 0.78 -0.33 0.66 -0.67 0.00 0.00 178.83 179.72 1fnu h SER 1095N 1.21 0.81 -0.20 1.46 4.64 -1.96 -2.17 113.55 117.34 1fnu h SER 1095Ca 0.42 -0.34 -0.07 0.00 -0.47 0.00 0.00 61.79 61.34 1fnu h SER 1095Cb 0.11 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1fnu h SER 1095CO -0.16 1.07 -0.13 0.50 -0.87 0.00 0.00 176.83 177.24 1fnu h LYS 1096N 0.65 0.45 -1.00 4.77 3.64 -1.91 -3.27 116.57 119.89 1fnu h LYS 1096Ca 0.07 -0.21 0.10 0.00 -1.27 0.00 0.00 60.65 59.34 1fnu h LYS 1096Cb 0.87 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.61 1fnu h LYS 1096CO 0.08 0.76 0.64 -0.92 -2.27 0.00 0.00 179.45 177.73 1fnu h TYR 1097N 0.14 1.16 0.00 1.91 3.20 -1.02 -2.59 116.97 119.77 1fnu h TYR 1097Ca 0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1fnu h TYR 1097Cb 0.64 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.54 1fnu h TYR 1097CO 0.07 0.52 0.00 1.28 -1.64 0.00 0.00 178.16 178.39 1fnu n LEU 1098N -4.57 0.00 0.04 2.82 4.77 -0.82 -3.57 117.00 115.68 1fnu n LEU 1098Ca 0.18 0.21 0.03 0.00 -0.03 0.00 0.00 56.01 56.39 1fnu n LEU 1098Cb 0.29 -0.21 0.15 0.00 -2.33 0.00 0.00 43.42 41.32 1fnu n LEU 1098CO 0.29 -0.04 0.59 0.23 -1.33 0.00 0.00 177.39 177.13 1fnu n MET 1099N -1.21 0.04 0.26 3.23 2.81 -0.98 -0.57 117.12 120.69 1fnu n MET 1099Ca 0.13 0.51 0.18 0.00 -1.81 0.00 0.00 57.70 56.70 1fnu n MET 1099Cb 0.16 -1.66 0.86 0.00 -0.71 0.00 0.00 33.22 31.87 1fnu n MET 1099CO 0.00 0.00 0.00 -0.84 1.51 0.00 0.00 175.97 176.64 1fnu h ILE 1100N 0.00 0.00 -0.02 2.02 3.07 -1.80 -2.18 117.51 118.60 1fnu h ILE 1100Ca 0.00 -0.15 0.00 0.00 1.55 0.00 0.00 64.86 66.26 1fnu h ILE 1100Cb 0.09 1.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.64 1fnu h ILE 1100CO 0.00 0.00 -0.41 -1.22 -1.05 0.00 0.00 178.15 175.47 1fnu n TYR 1101N -2.79 0.00 0.26 0.16 4.01 0.26 -4.43 117.16 114.63 1fnu n TYR 1101Ca -0.01 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.81 1fnu n TYR 1101Cb 0.14 0.00 0.64 0.00 -0.31 0.00 0.00 39.34 39.81 1fnu n TYR 1101CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1fnu h LYS 1102N 2.65 0.00 0.00 -0.72 3.64 -1.54 -1.43 116.57 119.16 1fnu h LYS 1102Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1fnu h LYS 1102Cb 0.77 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1fnu h LYS 1102CO 0.00 0.01 0.00 -0.40 -2.27 0.00 0.00 179.45 176.79 1fnu n ASP 1103N -4.50 0.13 -2.23 4.20 5.75 -1.26 -2.79 116.55 115.85 1fnu n ASP 1103Ca -0.03 0.54 -0.17 0.00 -0.01 0.00 0.00 54.79 55.12 1fnu n ASP 1103Cb 0.10 -0.56 -0.02 0.00 -1.03 0.00 0.00 41.12 39.60 1fnu n ASP 1103CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1fnu n ASN 1104N -1.65 -4.89 -4.67 -1.12 5.15 -0.54 -4.72 115.26 102.82 1fnu n ASN 1104Ca 0.03 0.15 -0.47 0.00 -0.60 0.00 0.00 54.58 53.68 1fnu n ASN 1104Cb 0.16 -4.16 -0.05 0.00 -0.53 0.00 0.00 39.78 35.20 1fnu n ASN 1104CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1fnu n GLU 1105N -2.76 2.21 -4.97 1.20 4.07 -1.26 -4.87 120.64 114.26 1fnu n GLU 1105Ca -0.19 0.80 -0.32 0.00 -0.06 0.00 0.00 57.16 57.38 1fnu n GLU 1105Cb 0.63 -2.71 -0.14 0.00 -0.06 0.00 0.00 31.44 29.16 1fnu n GLU 1105CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 1fnu s THR 1106N 4.50 2.86 -0.05 6.31 2.01 -1.26 0.11 115.64 130.12 1fnu s THR 1106Ca 0.94 -0.80 -0.09 0.00 0.31 0.00 0.00 61.69 62.05 1fnu s THR 1106Cb -0.65 -2.10 0.02 0.00 0.01 0.00 0.00 72.50 69.78 1fnu s THR 1106CO 0.50 0.59 0.21 -1.48 -0.69 0.00 0.00 174.62 173.74 1fnu s LEU 1107N -0.68 1.23 -0.38 4.42 0.05 0.84 -4.90 118.68 119.27 1fnu s LEU 1107Ca 0.10 0.20 -0.39 0.00 0.05 0.00 0.00 54.13 54.10 1fnu s LEU 1107Cb -0.11 0.80 -0.14 0.00 -2.05 0.00 0.00 46.19 44.69 1fnu s LEU 1107CO 0.00 -0.21 2.08 -0.67 -0.55 0.00 0.00 176.35 176.99 1fnu n ASP 1108N 2.28 1.79 0.10 1.48 2.03 -1.26 -2.49 116.55 120.48 1fnu n ASP 1108Ca -0.17 0.63 0.12 0.00 0.52 0.00 0.00 54.79 55.90 1fnu n ASP 1108Cb 0.57 -1.13 0.45 0.00 -0.72 0.00 0.00 41.12 40.29 1fnu n ASP 1108CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1fnu n ASN 1109N 8.20 0.68 0.09 1.67 6.94 -0.54 -2.26 115.26 130.03 1fnu n ASN 1109Ca 0.42 0.60 -0.14 0.00 -0.02 0.00 0.00 54.58 55.44 1fnu n ASN 1109Cb 0.13 -0.77 -0.14 0.00 -2.36 0.00 0.00 39.78 36.65 1fnu n ASN 1109CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 1fnu h LYS 1110N 0.00 0.21 0.02 -3.83 1.63 -1.89 -3.39 116.57 109.32 1fnu h LYS 1110Ca 0.00 -0.36 -0.36 0.00 -0.85 0.00 0.00 60.65 59.08 1fnu h LYS 1110Cb 0.58 0.13 -0.06 0.00 -0.60 0.00 0.00 32.23 32.28 1fnu h LYS 1110CO 0.00 1.15 -2.21 0.25 -3.45 0.00 0.00 179.45 175.19 1fnu n THR 1111N -3.48 1.52 0.00 1.00 -2.24 -1.24 -5.03 114.28 104.82 1fnu n THR 1111Ca -0.08 -0.74 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 1fnu n THR 1111Cb 1.01 -1.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 1fnu n THR 1111CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1fnu n SER 1112N -3.05 -0.98 -3.57 3.42 7.64 -0.96 -4.41 113.62 111.71 1fnu n SER 1112Ca -0.33 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.41 1fnu n SER 1112Cb 1.08 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 64.22 1fnu n SER 1112CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1fnu s GLN 1113N -1.46 0.84 -0.11 1.43 0.74 -0.94 -4.87 119.66 115.28 1fnu s GLN 1113Ca 0.00 0.40 0.00 0.00 0.05 0.00 0.00 55.36 55.81 1fnu s GLN 1113Cb 0.00 0.40 0.02 0.00 1.10 0.00 0.00 33.01 34.53 1fnu s GLN 1113CO 0.00 -0.22 -0.09 0.42 -0.55 0.00 0.00 175.29 174.85 1fnu s ILE 1114N -0.73 1.11 -0.02 -2.34 1.01 -1.26 -1.81 121.20 117.16 1fnu s ILE 1114Ca -0.05 -0.36 0.07 0.00 0.00 0.00 0.00 60.65 60.31 1fnu s ILE 1114Cb -0.02 -1.09 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 1fnu s ILE 1114CO 0.04 0.38 -0.22 -1.61 0.00 0.00 0.00 174.94 173.53 1fnu s GLU 1115N 1.52 1.77 -0.02 2.79 2.02 -0.53 -1.28 118.70 124.98 1fnu s GLU 1115Ca 0.02 -0.79 0.06 0.00 0.02 0.00 0.00 54.97 54.28 1fnu s GLU 1115Cb -0.13 -1.72 -0.01 0.00 0.10 0.00 0.00 34.13 32.37 1fnu s GLU 1115CO -0.07 0.47 -0.19 0.08 0.02 0.00 0.00 175.26 175.57 1fnu s VAL 1116N -0.52 1.53 -0.06 2.63 1.01 -0.29 0.17 120.40 124.87 1fnu s VAL 1116Ca 0.08 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.25 1fnu s VAL 1116Cb -0.08 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 35.04 1fnu s VAL 1116CO -0.01 0.43 -0.05 -0.31 0.00 0.00 0.00 175.10 175.17 1fnu s TYR 1117N -0.36 0.95 0.12 5.22 2.02 -0.87 -0.25 117.35 124.17 1fnu s TYR 1117Ca 0.05 -0.33 0.04 0.00 -0.37 0.00 0.00 57.07 56.46 1fnu s TYR 1117Cb -0.08 -0.85 -0.04 0.00 -0.40 0.00 0.00 41.96 40.59 1fnu s TYR 1117CO -0.00 -0.29 -0.10 -0.51 -1.57 0.00 0.00 175.55 173.08 1fnu s LEU 1118N 1.24 2.46 0.06 -1.29 1.43 -0.01 -2.26 118.68 120.31 1fnu s LEU 1118Ca -0.05 -0.89 0.04 0.00 -1.03 0.00 0.00 54.13 52.19 1fnu s LEU 1118Cb -0.14 -0.34 -0.03 0.00 0.03 0.00 0.00 46.19 45.72 1fnu s LEU 1118CO -0.02 -0.28 -0.12 0.42 0.23 0.00 0.00 176.35 176.58 1fnu s THR 1119N -2.78 0.90 0.00 5.49 -4.23 -1.09 -0.57 115.64 113.36 1fnu s THR 1119Ca 0.10 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 1fnu s THR 1119Cb -0.01 -0.93 0.00 0.00 1.34 0.00 0.00 72.50 72.90 1fnu s THR 1119CO 0.00 -0.30 0.00 0.41 -0.54 0.00 0.00 174.62 174.19 1fnu n THR 1120N 1.29 0.00 0.00 3.99 -1.04 -1.26 0.10 114.28 117.36 1fnu n THR 1120Ca -0.21 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 1fnu n THR 1120Cb 0.55 -0.75 0.00 0.00 -1.82 0.00 0.00 70.33 68.30 1fnu n THR 1120CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60