#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ow6 s SER 910 N 0.00 6.52 0.70 9.51 0.01 -1.26 -5.10 113.70 124.08 1ow6 s SER 910 Ca 0.00 0.88 -0.02 0.00 1.31 0.00 0.00 55.95 58.12 1ow6 s SER 910 Cb 0.00 -2.21 0.10 0.00 0.21 0.00 0.00 66.02 64.12 1ow6 s SER 910 CO 0.00 -0.21 0.98 -2.16 0.41 0.00 0.00 173.24 172.25 1ow6 s PRO 911 N -3.41 1.85 0.33 12.44 0.04 -1.26 -5.01 135.00 139.98 1ow6 s PRO 911 Ca 0.47 -0.86 -0.26 0.00 0.04 0.00 0.00 61.00 60.38 1ow6 s PRO 911 Cb -0.11 -2.30 -0.13 0.00 0.04 0.00 0.00 34.50 32.00 1ow6 s PRO 911 CO 0.28 -1.34 0.86 -2.30 0.04 0.00 0.00 177.00 174.54 1ow6 n PRO 912 N -2.82 1.04 -1.61 0.56 -0.02 -1.26 -4.82 135.00 126.07 1ow6 n PRO 912 Ca 0.12 0.37 -0.59 0.00 -2.02 0.00 0.00 63.50 61.39 1ow6 n PRO 912 Cb 0.60 -1.72 -0.08 0.00 -0.02 0.00 0.00 33.50 32.29 1ow6 n PRO 912 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ow6 n PRO 913 N 0.62 0.53 -1.65 0.52 -0.02 -1.26 -4.75 135.00 128.98 1ow6 n PRO 913 Ca 0.11 0.19 -0.43 0.00 -2.02 0.00 0.00 63.50 61.35 1ow6 n PRO 913 Cb 0.34 -1.76 -0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1ow6 n PRO 913 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1ow6 n THR 914 N 2.86 2.16 1.02 3.45 5.66 -1.26 -4.88 114.28 123.29 1ow6 n THR 914 Ca 0.23 -0.50 0.13 0.00 -3.05 0.00 0.00 64.05 60.86 1ow6 n THR 914 Cb 0.09 -1.34 0.51 0.00 -1.55 0.00 0.00 70.33 68.04 1ow6 n THR 914 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ow6 n ALA 915 N 0.06 2.72 0.88 1.79 0.00 -1.26 -3.75 120.51 120.95 1ow6 n ALA 915 Ca 0.07 -0.18 0.01 0.00 0.00 0.00 0.00 53.44 53.34 1ow6 n ALA 915 Cb 0.36 -1.36 0.08 0.00 0.00 0.00 0.00 19.45 18.53 1ow6 n ALA 915 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ow6 n ASN 916 N -1.48 0.00 -3.92 0.00 3.02 -1.26 -4.62 115.26 107.00 1ow6 n ASN 916 Ca 0.07 -0.80 -0.26 0.00 -0.03 0.00 0.00 54.58 53.56 1ow6 n ASN 916 Cb 0.34 0.00 -0.17 0.00 -0.61 0.00 0.00 39.78 39.34 1ow6 n ASN 916 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ow6 s LEU 917 N -1.19 1.24 -0.05 3.41 1.43 -1.25 -5.10 118.68 117.17 1ow6 s LEU 917 Ca 0.04 -0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 52.56 1ow6 s LEU 917 Cb 0.02 -0.80 -0.04 0.00 0.03 0.00 0.00 46.19 45.39 1ow6 s LEU 917 CO 0.03 -0.09 1.40 -0.62 0.23 0.00 0.00 176.35 177.30 1ow6 s ASP 918 N 1.51 6.86 -0.04 2.29 -1.08 -1.26 -4.90 116.67 120.05 1ow6 s ASP 918 Ca 0.01 2.02 0.12 0.00 -0.52 0.00 0.00 52.55 54.17 1ow6 s ASP 918 Cb -0.13 -2.55 0.40 0.00 -1.46 0.00 0.00 42.92 39.18 1ow6 s ASP 918 CO -0.06 -0.75 1.29 0.54 0.52 0.00 0.00 175.17 176.71 1ow6 n ARG 919 N 5.93 2.34 -0.33 4.34 5.12 -1.26 -4.53 116.66 128.27 1ow6 n ARG 919 Ca 0.14 -1.61 -0.04 0.00 -1.93 0.00 0.00 57.85 54.41 1ow6 n ARG 919 Cb 0.44 -1.50 0.09 0.00 -1.16 0.00 0.00 32.46 30.33 1ow6 n ARG 919 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 1ow6 h SER 920 N 2.44 1.13 -0.50 0.55 0.02 -2.06 -3.14 113.55 112.00 1ow6 h SER 920 Ca 0.00 -0.10 -0.36 0.00 -0.84 0.00 0.00 61.79 60.48 1ow6 h SER 920 Cb 0.79 -0.29 -0.30 0.00 0.14 0.00 0.00 62.40 62.74 1ow6 h SER 920 CO 0.08 0.91 -0.75 0.59 -1.14 0.00 0.00 176.83 176.52 1ow6 n ASN 921 N -4.33 3.69 -4.36 3.07 3.02 -1.26 -4.97 115.26 110.12 1ow6 n ASN 921 Ca 0.10 -3.64 -0.46 0.00 -0.03 0.00 0.00 54.58 50.55 1ow6 n ASN 921 Cb 0.10 -0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 38.84 1ow6 n ASN 921 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ow6 s ASP 922 N -3.47 6.58 0.54 6.41 -1.08 -1.19 -4.89 116.67 119.58 1ow6 s ASP 922 Ca 0.45 -2.25 0.32 0.00 -0.52 0.00 0.00 52.55 50.55 1ow6 s ASP 922 Cb 0.39 -2.27 1.41 0.00 -1.46 0.00 0.00 42.92 41.00 1ow6 s ASP 922 CO -0.00 -0.80 2.01 0.11 0.52 0.00 0.00 175.17 177.01 1ow6 h LYS 923 N 8.35 0.00 -0.15 4.34 1.79 -1.93 -2.12 116.57 126.85 1ow6 h LYS 923 Ca 0.01 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 1ow6 h LYS 923 Cb 1.05 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1ow6 h LYS 923 CO 0.92 0.05 -0.04 0.28 -1.08 0.00 0.00 179.45 179.58 1ow6 h VAL 924 N 0.00 1.29 -0.32 0.50 2.07 -1.92 0.62 116.25 118.49 1ow6 h VAL 924 Ca -0.00 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 1ow6 h VAL 924 Cb 0.48 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1ow6 h VAL 924 CO 0.01 0.29 0.14 0.22 0.02 0.00 0.00 177.57 178.24 1ow6 h TYR 925 N -0.02 0.47 -0.93 1.57 5.03 -1.89 0.37 116.97 121.57 1ow6 h TYR 925 Ca 0.04 -0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.33 1ow6 h TYR 925 Cb 0.46 -0.14 -0.05 0.00 1.55 0.00 0.00 36.73 38.55 1ow6 h TYR 925 CO 0.05 0.43 0.61 1.49 -1.32 0.00 0.00 178.16 179.43 1ow6 h GLU 926 N 0.37 1.21 -0.17 1.82 4.81 -1.36 0.22 114.58 121.47 1ow6 h GLU 926 Ca 0.11 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.12 1ow6 h GLU 926 Cb 0.15 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.26 1ow6 h GLU 926 CO -0.01 0.80 -0.46 -0.91 -0.73 0.00 0.00 179.01 177.69 1ow6 h ASN 927 N 1.25 0.71 -0.35 1.04 2.35 -0.26 0.60 115.58 120.91 1ow6 h ASN 927 Ca 0.35 -0.58 -0.02 0.00 -0.55 0.00 0.00 56.30 55.50 1ow6 h ASN 927 Cb -0.12 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.03 1ow6 h ASN 927 CO -0.08 1.16 0.14 0.58 -1.65 0.00 0.00 177.43 177.58 1ow6 h VAL 928 N 0.29 1.19 -0.90 2.81 2.07 -0.13 -0.24 116.25 121.34 1ow6 h VAL 928 Ca -0.01 -0.57 0.10 0.00 0.82 0.00 0.00 66.70 67.04 1ow6 h VAL 928 Cb 1.08 0.91 -0.08 0.00 -1.52 0.00 0.00 31.29 31.68 1ow6 h VAL 928 CO 0.10 0.20 0.54 0.74 0.02 0.00 0.00 177.57 179.17 1ow6 h THR 929 N 0.42 0.92 -0.60 2.57 2.02 -0.82 -1.16 112.91 116.26 1ow6 h THR 929 Ca 0.12 -0.30 -0.08 0.00 0.77 0.00 0.00 66.41 66.91 1ow6 h THR 929 Cb 0.18 -0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 1ow6 h THR 929 CO -0.01 0.16 0.05 1.23 0.37 0.00 0.00 175.52 177.32 1ow6 h GLY 930 N 0.88 1.08 0.70 2.16 0.00 0.55 -1.35 103.07 107.10 1ow6 h GLY 930 Ca 0.43 -0.74 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 1ow6 h GLY 930 CO -0.25 0.68 -0.13 -2.00 0.00 0.00 0.00 176.54 174.84 1ow6 h LEU 931 N 0.93 0.31 -0.35 3.11 5.85 -0.78 0.53 115.31 124.92 1ow6 h LEU 931 Ca 0.18 -0.49 0.04 0.00 0.84 0.00 0.00 57.88 58.44 1ow6 h LEU 931 Cb 0.47 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 1ow6 h LEU 931 CO 0.02 0.74 0.13 0.58 -0.34 0.00 0.00 178.44 179.57 1ow6 h VAL 932 N -0.11 0.91 -0.32 1.05 2.07 -1.11 -2.37 116.25 116.37 1ow6 h VAL 932 Ca 0.02 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.51 1ow6 h VAL 932 Cb 0.66 0.60 -0.07 0.00 -1.52 0.00 0.00 31.29 30.96 1ow6 h VAL 932 CO 0.03 0.05 -0.15 0.50 0.02 0.00 0.00 177.57 178.02 1ow6 h LYS 933 N 0.28 -0.10 -0.19 1.57 3.64 -1.05 -1.17 116.57 119.56 1ow6 h LYS 933 Ca 0.16 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1ow6 h LYS 933 Cb 0.12 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1ow6 h LYS 933 CO -0.15 -0.06 0.00 0.00 -2.27 0.00 0.00 179.45 176.97 1ow6 h ALA 934 N 1.15 1.67 0.05 5.00 0.00 -0.60 -0.53 119.26 126.00 1ow6 h ALA 934 Ca 0.17 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ow6 h ALA 934 Cb 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ow6 h ALA 934 CO -0.39 0.25 -0.02 0.28 0.00 0.00 0.00 179.25 179.37 1ow6 h VAL 935 N 0.26 1.21 -0.79 0.00 2.07 -1.05 -2.95 116.25 115.00 1ow6 h VAL 935 Ca 0.06 -0.87 0.10 0.00 0.82 0.00 0.00 66.70 66.81 1ow6 h VAL 935 Cb 0.18 1.78 -0.07 0.00 -1.52 0.00 0.00 31.29 31.65 1ow6 h VAL 935 CO 0.00 0.22 0.43 0.40 0.02 0.00 0.00 177.57 178.64 1ow6 h ILE 936 N -0.45 0.87 -0.67 4.57 2.04 -0.30 0.45 117.51 124.03 1ow6 h ILE 936 Ca -0.01 -0.24 0.14 0.00 1.00 0.00 0.00 64.86 65.75 1ow6 h ILE 936 Cb 0.41 0.10 -0.11 0.00 -0.74 0.00 0.00 36.82 36.48 1ow6 h ILE 936 CO 0.01 0.13 0.10 -0.08 0.00 0.00 0.00 178.15 178.31 1ow6 h GLU 937 N 0.71 0.20 0.20 2.37 4.57 -1.10 -0.80 114.58 120.73 1ow6 h GLU 937 Ca 0.39 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.54 1ow6 h GLU 937 Cb 0.39 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1ow6 h GLU 937 CO -0.26 0.13 -0.10 1.98 -1.18 0.00 0.00 179.01 179.58 1ow6 h MET 938 N 0.20 -0.27 -0.96 1.92 4.05 -0.43 -1.90 114.93 117.55 1ow6 h MET 938 Ca 0.37 0.02 0.26 0.00 -0.28 0.00 0.00 59.70 60.07 1ow6 h MET 938 Cb 0.61 0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.42 1ow6 h MET 938 CO -0.51 0.09 0.67 0.66 0.23 0.00 0.00 176.91 178.05 1ow6 h SER 939 N -0.68 0.12 0.00 1.39 4.64 0.05 -2.24 113.55 116.82 1ow6 h SER 939 Ca -0.03 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1ow6 h SER 939 Cb 0.48 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1ow6 h SER 939 CO 0.05 0.04 -1.26 -0.24 -0.87 0.00 0.00 176.83 174.54 1ow6 n SER 940 N -4.33 0.74 0.00 4.97 2.88 -0.33 -4.77 113.62 112.77 1ow6 n SER 940 Ca 0.20 -0.64 0.00 0.00 -1.33 0.00 0.00 58.87 57.10 1ow6 n SER 940 Cb 0.95 1.31 0.00 0.00 -0.75 0.00 0.00 64.21 65.73 1ow6 n SER 940 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1ow6 n LYS 941 N -1.71 0.00 0.00 -1.46 0.00 -0.72 -4.86 118.16 109.41 1ow6 n LYS 941 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.32 1ow6 n LYS 941 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.41 1ow6 n LYS 941 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 1ow6 n ILE 942 N 0.00 0.00 0.00 3.15 3.06 -0.91 -4.30 119.36 120.36 1ow6 n ILE 942 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1ow6 n ILE 942 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1ow6 n ILE 942 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1ow6 n GLN 943 N 0.00 0.00 0.00 9.51 1.13 -1.26 -1.06 117.38 125.70 1ow6 n GLN 943 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1ow6 n GLN 943 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 1ow6 n GLN 943 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 1ow6 n PRO 944 N -0.47 0.00 -1.07 -1.09 -0.02 -1.26 -4.91 135.00 126.18 1ow6 n PRO 944 Ca 0.00 0.72 -0.35 0.00 -2.02 0.00 0.00 63.50 61.85 1ow6 n PRO 944 Cb 0.00 -1.21 -0.01 0.00 -0.02 0.00 0.00 33.50 32.26 1ow6 n PRO 944 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ow6 n ALA 945 N -1.94 -2.60 -1.90 3.55 0.00 -0.22 -5.05 120.51 112.35 1ow6 n ALA 945 Ca 0.00 0.19 -0.10 0.00 0.00 0.00 0.00 53.44 53.53 1ow6 n ALA 945 Cb 0.00 -1.22 0.07 0.00 0.00 0.00 0.00 19.45 18.31 1ow6 n ALA 945 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ow6 n PRO 946 N 0.97 -0.17 0.00 0.00 -0.04 -1.26 -4.85 135.00 129.65 1ow6 n PRO 946 Ca 0.11 -1.08 0.00 0.00 -0.04 0.00 0.00 63.50 62.49 1ow6 n PRO 946 Cb 0.27 -0.47 0.00 0.00 -0.04 0.00 0.00 33.50 33.27 1ow6 n PRO 946 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1ow6 n PRO 947 N -2.07 0.00 0.09 0.54 -0.02 -1.26 -1.84 135.00 130.44 1ow6 n PRO 947 Ca 0.08 0.43 0.13 0.00 -2.02 0.00 0.00 63.50 62.11 1ow6 n PRO 947 Cb 0.27 -1.55 0.46 0.00 -0.02 0.00 0.00 33.50 32.65 1ow6 n PRO 947 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ow6 n GLU 948 N -1.43 0.19 0.00 -0.52 1.02 -1.26 -3.97 120.64 114.67 1ow6 n GLU 948 Ca 0.00 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1ow6 n GLU 948 Cb 0.05 -1.75 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 1ow6 n GLU 948 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ow6 n GLU 949 N -2.08 3.14 -0.12 3.49 1.02 -0.77 -4.79 120.64 120.54 1ow6 n GLU 949 Ca 0.05 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.94 1ow6 n GLU 949 Cb 0.35 -0.32 -0.11 0.00 -0.02 0.00 0.00 31.44 31.35 1ow6 n GLU 949 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1ow6 n TYR 950 N -0.48 0.30 -0.42 -0.32 0.18 -1.08 -3.81 117.16 111.53 1ow6 n TYR 950 Ca 0.00 0.11 0.36 0.00 1.88 0.00 0.00 57.90 60.25 1ow6 n TYR 950 Cb 0.00 -1.03 0.63 0.00 -0.38 0.00 0.00 39.34 38.56 1ow6 n TYR 950 CO 0.00 0.00 0.00 0.28 -2.08 0.00 0.00 176.86 175.06 1ow6 h VAL 951 N -0.69 0.07 0.00 -3.48 2.07 -1.84 0.32 116.25 112.70 1ow6 h VAL 951 Ca -0.59 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.91 1ow6 h VAL 951 Cb 1.66 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1ow6 h VAL 951 CO -0.27 0.01 -0.00 -0.65 0.02 0.00 0.00 177.57 176.68 1ow6 h PRO 952 N 0.06 -0.01 -0.05 1.57 0.11 -1.87 -2.60 132.00 129.22 1ow6 h PRO 952 Ca 0.84 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.97 1ow6 h PRO 952 Cb 2.52 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 33.63 1ow6 h PRO 952 CO -0.53 0.87 0.89 1.98 -0.21 0.00 0.00 178.00 181.01 1ow6 h MET 953 N -0.95 0.00 0.00 1.05 4.05 -0.59 0.21 114.93 118.70 1ow6 h MET 953 Ca -0.00 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.39 1ow6 h MET 953 Cb 0.88 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.68 1ow6 h MET 953 CO 0.00 0.00 -0.62 0.28 0.23 0.00 0.00 176.91 176.80 1ow6 n VAL 954 N -2.61 1.43 0.25 -5.77 0.31 0.18 -3.75 118.33 108.38 1ow6 n VAL 954 Ca 0.01 0.19 0.10 0.00 -0.01 0.00 0.00 64.34 64.62 1ow6 n VAL 954 Cb 0.92 -2.36 0.39 0.00 -0.91 0.00 0.00 33.84 31.88 1ow6 n VAL 954 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1ow6 h LYS 955 N -1.00 0.00 0.13 5.55 1.63 -0.26 -0.66 116.57 121.95 1ow6 h LYS 955 Ca -0.04 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 1ow6 h LYS 955 Cb 0.62 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.25 1ow6 h LYS 955 CO -0.02 0.00 -0.06 0.93 -3.45 0.00 0.00 179.45 176.85 1ow6 h GLU 956 N 0.00 -0.16 -1.73 1.90 5.08 -1.22 -1.78 114.58 116.67 1ow6 h GLU 956 Ca 0.07 0.01 0.51 0.00 -1.00 0.00 0.00 59.36 58.95 1ow6 h GLU 956 Cb 1.58 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.79 1ow6 h GLU 956 CO -0.00 -0.11 1.24 0.28 -1.00 0.00 0.00 179.01 179.42 1ow6 h VAL 957 N -0.65 0.12 -0.15 3.13 2.07 -1.40 0.15 116.25 119.51 1ow6 h VAL 957 Ca -0.02 -0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.30 1ow6 h VAL 957 Cb 0.13 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1ow6 h VAL 957 CO 0.03 0.00 -0.67 1.23 0.02 0.00 0.00 177.57 178.18 1ow6 h GLY 958 N 0.01 0.80 1.07 2.17 0.00 -1.11 -2.26 103.07 103.75 1ow6 h GLY 958 Ca 0.84 -1.10 -0.13 0.00 0.00 0.00 0.00 47.33 46.94 1ow6 h GLY 958 CO -0.04 0.98 -0.22 1.41 0.00 0.00 0.00 176.54 178.67 1ow6 h LEU 959 N 0.42 0.95 -1.82 3.11 3.38 0.13 -2.10 115.31 119.38 1ow6 h LEU 959 Ca -0.04 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1ow6 h LEU 959 Cb 1.31 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 1ow6 h LEU 959 CO 0.14 1.15 -0.04 0.00 0.09 0.00 0.00 178.44 179.78 1ow6 h ALA 960 N 0.83 1.04 0.05 1.53 0.00 -1.09 -2.10 119.26 119.52 1ow6 h ALA 960 Ca 0.10 -0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.69 1ow6 h ALA 960 Cb 0.80 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1ow6 h ALA 960 CO 0.07 0.05 -1.49 1.25 0.00 0.00 0.00 179.25 179.13 1ow6 h LEU 961 N 0.00 0.15 -0.30 0.00 5.85 -1.28 -3.11 115.31 116.63 1ow6 h LEU 961 Ca -0.00 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.50 1ow6 h LEU 961 Cb 0.40 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1ow6 h LEU 961 CO 0.00 1.20 0.19 -0.09 -0.34 0.00 0.00 178.44 179.40 1ow6 h ARG 962 N 0.03 0.37 0.12 1.25 2.43 -0.75 -1.27 114.38 116.56 1ow6 h ARG 962 Ca -0.21 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 58.96 1ow6 h ARG 962 Cb 1.95 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 31.38 1ow6 h ARG 962 CO 0.12 0.25 -0.33 1.15 -1.51 0.00 0.00 179.97 179.65 1ow6 h THR 963 N 0.38 0.30 -0.90 0.20 2.02 -1.53 -0.82 112.91 112.57 1ow6 h THR 963 Ca 0.11 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.36 1ow6 h THR 963 Cb -0.03 0.30 -0.06 0.00 -1.74 0.00 0.00 68.15 66.62 1ow6 h THR 963 CO -0.04 0.00 0.56 0.25 0.37 0.00 0.00 175.52 176.67 1ow6 h LEU 964 N -0.56 0.88 -0.70 2.58 5.85 -1.45 -0.13 115.31 121.79 1ow6 h LEU 964 Ca 0.03 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 1ow6 h LEU 964 Cb 0.59 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 1ow6 h LEU 964 CO -0.19 0.56 -0.16 -0.07 -0.34 0.00 0.00 178.44 178.23 1ow6 h LEU 965 N 1.01 0.84 -0.65 2.25 3.38 -0.78 -1.02 115.31 120.34 1ow6 h LEU 965 Ca 0.39 -0.28 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 1ow6 h LEU 965 Cb 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1ow6 h LEU 965 CO -0.18 1.00 -0.36 0.00 0.09 0.00 0.00 178.44 178.99 1ow6 h ALA 966 N 1.07 0.83 -0.30 1.53 0.00 -0.29 -0.87 119.26 121.23 1ow6 h ALA 966 Ca 0.11 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1ow6 h ALA 966 Cb 0.68 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1ow6 h ALA 966 CO 0.05 0.64 -0.15 1.15 0.00 0.00 0.00 179.25 180.94 1ow6 h THR 967 N 0.55 1.24 -0.11 0.00 2.02 -0.80 -1.53 112.91 114.28 1ow6 h THR 967 Ca 0.05 -1.09 -0.16 0.00 0.77 0.00 0.00 66.41 65.98 1ow6 h THR 967 Cb 0.87 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 1ow6 h THR 967 CO 0.08 0.36 -0.61 0.58 0.37 0.00 0.00 175.52 176.29 1ow6 h VAL 968 N 0.48 1.36 -0.56 3.16 2.07 -1.03 -1.35 116.25 120.38 1ow6 h VAL 968 Ca 0.08 -1.94 -0.07 0.00 0.82 0.00 0.00 66.70 65.59 1ow6 h VAL 968 Cb 0.54 1.94 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 1ow6 h VAL 968 CO 0.03 0.59 0.05 0.44 0.02 0.00 0.00 177.57 178.70 1ow6 h ASP 969 N 0.29 0.89 1.10 0.57 3.32 -0.81 -1.59 116.42 120.18 1ow6 h ASP 969 Ca -0.01 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 1ow6 h ASP 969 Cb 1.14 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.45 1ow6 h ASP 969 CO 0.10 0.92 -0.07 -0.33 -1.72 0.00 0.00 179.24 178.14 1ow6 h GLU 970 N 0.87 0.00 0.00 3.56 5.08 -0.91 -3.30 114.58 119.88 1ow6 h GLU 970 Ca 0.17 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.33 1ow6 h GLU 970 Cb 0.44 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1ow6 h GLU 970 CO 0.02 0.07 -1.42 1.15 -1.00 0.00 0.00 179.01 177.83 1ow6 h THR 971 N 0.00 0.65 -0.37 1.13 2.02 -0.31 -3.40 112.91 112.62 1ow6 h THR 971 Ca -0.00 -2.24 0.00 0.00 0.77 0.00 0.00 66.41 64.94 1ow6 h THR 971 Cb 0.64 2.18 -0.02 0.00 -1.74 0.00 0.00 68.15 69.21 1ow6 h THR 971 CO 0.01 0.37 0.24 0.40 0.37 0.00 0.00 175.52 176.91 1ow6 h ILE 972 N 0.00 1.10 -1.19 3.11 2.04 -1.46 -2.79 117.51 118.31 1ow6 h ILE 972 Ca -0.18 -0.20 0.34 0.00 1.00 0.00 0.00 64.86 65.82 1ow6 h ILE 972 Cb 1.69 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 38.28 1ow6 h ILE 972 CO 0.06 0.10 0.83 -0.65 0.00 0.00 0.00 178.15 178.49 1ow6 h PRO 973 N 0.50 0.09 -0.20 2.37 0.11 -1.77 -1.35 132.00 131.75 1ow6 h PRO 973 Ca 0.14 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.09 1ow6 h PRO 973 Cb -0.04 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.05 1ow6 h PRO 973 CO -0.03 0.06 -0.46 1.25 -0.21 0.00 0.00 178.00 178.62 1ow6 h LEU 974 N 0.10 0.75-10.45 2.35 5.85 -1.78 -3.47 115.31 108.65 1ow6 h LEU 974 Ca 0.60 -0.56 -0.49 0.00 0.84 0.00 0.00 57.88 58.27 1ow6 h LEU 974 Cb 2.17 -0.22 0.09 0.00 0.37 0.00 0.00 40.66 43.06 1ow6 h LEU 974 CO -0.10 1.17 0.40 -0.76 -0.34 0.00 0.00 178.44 178.81 1ow6 s LEU 975 N -8.73 2.85 0.65 2.25 1.43 -0.51 -4.96 118.68 111.66 1ow6 s LEU 975 Ca -0.12 1.20 -0.17 0.00 -1.03 0.00 0.00 54.13 54.01 1ow6 s LEU 975 Cb 0.08 -3.96 -0.08 0.00 0.03 0.00 0.00 46.19 42.26 1ow6 s LEU 975 CO 0.84 -1.47 0.38 -2.65 0.23 0.00 0.00 176.35 173.68 1ow6 n PRO 976 N -3.10 0.32 -0.25 1.29 -0.02 -1.26 -4.89 135.00 127.10 1ow6 n PRO 976 Ca 0.07 0.14 -0.07 0.00 -2.02 0.00 0.00 63.50 61.61 1ow6 n PRO 976 Cb 0.57 -1.64 0.04 0.00 -0.02 0.00 0.00 33.50 32.45 1ow6 n PRO 976 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ow6 h ALA 977 N -0.14 0.92 -0.40 3.55 0.00 -1.94 -3.15 119.26 118.12 1ow6 h ALA 977 Ca -0.45 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.18 1ow6 h ALA 977 Cb 1.38 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1ow6 h ALA 977 CO 0.43 0.65 0.10 0.66 0.00 0.00 0.00 179.25 181.09 1ow6 h SER 978 N 1.06 0.53 -0.00 0.00 4.64 -2.02 -2.84 113.55 114.92 1ow6 h SER 978 Ca 0.22 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1ow6 h SER 978 Cb 0.38 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1ow6 h SER 978 CO 0.00 0.53 0.00 0.35 -0.87 0.00 0.00 176.83 176.84 1ow6 n THR 979 N -4.33 0.00 0.34 2.95 -2.24 -1.19 -4.18 114.28 105.63 1ow6 n THR 979 Ca 0.02 -0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.95 1ow6 n THR 979 Cb 0.19 -0.45 0.55 0.00 -2.10 0.00 0.00 70.33 68.52 1ow6 n THR 979 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1ow6 h HIS 980 N 0.03 0.00 0.17 4.78 3.86 -1.61 -3.27 115.15 119.10 1ow6 h HIS 980 Ca 0.00 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 58.99 1ow6 h HIS 980 Cb 0.01 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.50 1ow6 h HIS 980 CO 0.00 0.00 -0.96 -0.09 0.86 0.00 0.00 177.93 177.74 1ow6 h ARG 981 N 0.00 0.36 -0.79 2.45 9.65 -1.83 -2.29 114.38 121.93 1ow6 h ARG 981 Ca 0.00 -0.61 0.04 0.00 -1.10 0.00 0.00 59.98 58.31 1ow6 h ARG 981 Cb 0.54 0.23 -0.05 0.00 -1.39 0.00 0.00 29.97 29.30 1ow6 h ARG 981 CO 0.00 1.29 0.52 1.49 2.80 0.00 0.00 179.97 186.07 1ow6 h GLU 982 N -0.25 0.92 -0.08 0.20 4.81 -1.85 0.40 114.58 118.72 1ow6 h GLU 982 Ca -0.17 -0.06 -0.20 0.00 -0.13 0.00 0.00 59.36 58.81 1ow6 h GLU 982 Cb 1.76 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.94 1ow6 h GLU 982 CO 0.18 0.61 -0.77 0.82 -0.73 0.00 0.00 179.01 179.12 1ow6 h ILE 983 N 0.95 1.36 -0.04 2.32 2.04 -1.62 0.01 117.51 122.53 1ow6 h ILE 983 Ca 0.32 -2.16 -0.22 0.00 1.00 0.00 0.00 64.86 63.81 1ow6 h ILE 983 Cb 0.09 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.31 1ow6 h ILE 983 CO -0.10 0.65 -0.87 -0.33 0.00 0.00 0.00 178.15 177.51 1ow6 h GLU 984 N 0.32 0.48 -0.12 2.37 5.08 -0.97 -1.72 114.58 120.01 1ow6 h GLU 984 Ca -0.04 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 57.84 1ow6 h GLU 984 Cb 1.37 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.73 1ow6 h GLU 984 CO 0.14 1.10 0.01 0.52 -1.00 0.00 0.00 179.01 179.78 1ow6 h MET 985 N 0.30 0.21 -0.27 2.33 2.86 -0.82 -1.69 114.93 117.84 1ow6 h MET 985 Ca -0.07 -0.06 0.08 0.00 -2.06 0.00 0.00 59.70 57.59 1ow6 h MET 985 Cb 1.49 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 33.12 1ow6 h MET 985 CO 0.16 0.44 0.21 0.00 1.06 0.00 0.00 176.91 178.78 1ow6 h ALA 986 N 0.76 2.17 -0.04 6.32 0.00 -0.94 -1.10 119.26 126.44 1ow6 h ALA 986 Ca 0.03 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.69 1ow6 h ALA 986 Cb 0.34 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1ow6 h ALA 986 CO 0.00 -0.35 -0.94 1.96 0.00 0.00 0.00 179.25 179.92 1ow6 h GLN 987 N 0.00 0.64 -0.65 0.00 4.20 -0.85 -3.21 115.11 115.24 1ow6 h GLN 987 Ca 0.13 -0.63 -0.09 0.00 0.06 0.00 0.00 58.65 58.12 1ow6 h GLN 987 Cb 0.55 0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 1ow6 h GLN 987 CO -0.00 1.24 0.06 -0.22 -0.67 0.00 0.00 178.83 179.24 1ow6 h LYS 988 N 0.38 1.10 -0.92 1.46 1.63 -0.33 -2.22 116.57 117.67 1ow6 h LYS 988 Ca -0.09 -0.32 0.14 0.00 -0.85 0.00 0.00 60.65 59.53 1ow6 h LYS 988 Cb 1.58 -0.12 -0.08 0.00 -0.60 0.00 0.00 32.23 33.02 1ow6 h LYS 988 CO 0.18 1.03 0.59 1.25 -3.45 0.00 0.00 179.45 179.05 1ow6 h LEU 989 N 1.01 0.72 -0.48 5.20 5.85 -1.33 -0.03 115.31 126.26 1ow6 h LEU 989 Ca 0.19 0.05 -0.15 0.00 0.84 0.00 0.00 57.88 58.81 1ow6 h LEU 989 Cb 0.50 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1ow6 h LEU 989 CO 0.02 0.36 -0.37 -0.07 -0.34 0.00 0.00 178.44 178.04 1ow6 h LEU 990 N 0.76 0.90 -0.62 2.25 3.38 -1.41 -2.10 115.31 118.46 1ow6 h LEU 990 Ca 0.47 -0.40 0.07 0.00 0.09 0.00 0.00 57.88 58.10 1ow6 h LEU 990 Cb 0.68 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 1ow6 h LEU 990 CO -0.23 1.17 0.32 0.78 0.09 0.00 0.00 178.44 180.57 1ow6 h ASN 991 N 0.70 0.44 0.20 -0.43 2.35 -0.69 -1.62 115.58 116.53 1ow6 h ASN 991 Ca 0.06 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.77 1ow6 h ASN 991 Cb 0.94 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.26 1ow6 h ASN 991 CO 0.09 0.28 -0.32 0.77 -1.65 0.00 0.00 177.43 176.60 1ow6 h SER 992 N 0.58 0.19 0.20 5.81 4.64 -1.35 -1.89 113.55 121.73 1ow6 h SER 992 Ca 0.29 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 61.46 1ow6 h SER 992 Cb 0.23 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1ow6 h SER 992 CO -0.21 0.50 -0.32 0.44 -0.87 0.00 0.00 176.83 176.38 1ow6 h ASP 993 N 0.17 0.19 0.65 4.97 3.32 -0.61 -1.45 116.42 123.66 1ow6 h ASP 993 Ca 0.02 -0.06 -0.18 0.00 0.02 0.00 0.00 57.03 56.83 1ow6 h ASP 993 Cb 0.65 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1ow6 h ASP 993 CO 0.05 0.51 -0.80 0.25 -1.72 0.00 0.00 179.24 177.52 1ow6 h LEU 994 N 0.17 0.14 -0.17 1.55 5.85 -1.06 -2.69 115.31 119.09 1ow6 h LEU 994 Ca 0.02 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.69 1ow6 h LEU 994 Cb 0.65 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.58 1ow6 h LEU 994 CO 0.05 0.88 -0.20 1.23 -0.34 0.00 0.00 178.44 180.06 1ow6 h GLY 995 N 2.03 -0.13 0.96 3.75 0.00 -0.50 -1.83 103.07 107.35 1ow6 h GLY 995 Ca -0.02 0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.55 1ow6 h GLY 995 CO 0.11 -0.18 -0.03 -2.09 0.00 0.00 0.00 176.54 174.35 1ow6 h GLU 996 N -0.23 -0.08 -0.42 4.80 4.81 -1.25 -1.26 114.58 120.95 1ow6 h GLU 996 Ca 0.11 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1ow6 h GLU 996 Cb 0.40 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1ow6 h GLU 996 CO -0.31 -0.01 0.26 1.25 -0.73 0.00 0.00 179.01 179.47 1ow6 h LEU 997 N -0.13 0.49 0.01 1.64 5.85 -1.28 -1.01 115.31 120.88 1ow6 h LEU 997 Ca -0.01 -0.02 -0.21 0.00 0.84 0.00 0.00 57.88 58.48 1ow6 h LEU 997 Cb 0.11 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1ow6 h LEU 997 CO 0.01 0.38 -1.01 0.40 -0.34 0.00 0.00 178.44 177.88 1ow6 h ILE 998 N 0.57 1.71 -0.24 4.05 2.04 -0.90 -2.30 117.51 122.45 1ow6 h ILE 998 Ca 0.15 -3.41 -0.02 0.00 1.00 0.00 0.00 64.86 62.58 1ow6 h ILE 998 Cb -0.03 2.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1ow6 h ILE 998 CO -0.03 0.98 0.07 0.78 0.00 0.00 0.00 178.15 179.95 1ow6 h ASN 999 N 0.00 0.35 0.82 1.72 2.35 -0.19 0.03 115.58 120.66 1ow6 h ASN 999 Ca -0.02 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 1ow6 h ASN 999 Cb 1.78 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 40.06 1ow6 h ASN 999 CO 0.13 0.46 -0.05 0.11 -1.65 0.00 0.00 177.43 176.44 1ow6 h LYS 1000N 0.22 0.00 0.18 0.81 1.79 -1.15 -2.40 116.57 116.01 1ow6 h LYS 1000Ca 0.08 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 1ow6 h LYS 1000Cb 0.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 1ow6 h LYS 1000CO -0.00 0.05 -0.08 1.98 -1.08 0.00 0.00 179.45 180.31 1ow6 h MET 1001N 0.00 -0.23 0.00 3.15 4.05 -0.80 -2.43 114.93 118.67 1ow6 h MET 1001Ca -0.00 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.44 1ow6 h MET 1001Cb 0.47 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 1ow6 h MET 1001CO 0.01 -0.14 0.48 0.87 0.23 0.00 0.00 176.91 178.36 1ow6 h LYS 1002N -1.06 0.00 0.05 0.39 1.57 -0.86 0.15 116.57 116.81 1ow6 h LYS 1002Ca -0.02 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.41 1ow6 h LYS 1002Cb 0.19 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 1ow6 h LYS 1002CO 0.04 0.00 -1.98 1.28 -0.57 0.00 0.00 179.45 178.22 1ow6 n LEU 1003N -2.37 2.42 0.24 2.94 4.77 -0.92 -3.27 117.00 120.82 1ow6 n LEU 1003Ca -0.01 0.21 0.16 0.00 -0.03 0.00 0.00 56.01 56.35 1ow6 n LEU 1003Cb 0.50 -1.00 0.75 0.00 -2.33 0.00 0.00 43.42 41.35 1ow6 n LEU 1003CO 0.07 0.69 0.98 0.00 -1.33 0.00 0.00 177.39 177.80 1ow6 h ALA 1004N -0.23 1.00 0.11 -1.18 0.00 -0.24 -2.26 119.26 116.46 1ow6 h ALA 1004Ca -0.47 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.26 1ow6 h ALA 1004Cb 1.77 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.57 1ow6 h ALA 1004CO -0.09 0.00 -0.80 1.96 0.00 0.00 0.00 179.25 180.32 1ow6 h GLN 1005N 0.00 0.23 -0.38 0.00 4.20 -1.40 -3.19 115.11 114.58 1ow6 h GLN 1005Ca 0.00 -0.40 0.08 0.00 0.06 0.00 0.00 58.65 58.39 1ow6 h GLN 1005Cb 0.27 0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 1ow6 h GLN 1005CO 0.00 1.19 0.26 0.37 -0.67 0.00 0.00 178.83 179.98 1ow6 h GLN 1006N -0.48 0.16 -1.78 1.46 4.15 -1.47 -3.20 115.11 113.95 1ow6 h GLN 1006Ca -0.15 -0.01 -0.67 0.00 0.77 0.00 0.00 58.65 58.59 1ow6 h GLN 1006Cb 1.55 -0.04 -0.36 0.00 0.21 0.00 0.00 27.48 28.85 1ow6 h GLN 1006CO 0.10 0.11 0.03 0.66 -1.93 0.00 0.00 178.83 177.80 1ow6 n TYR 1007N -4.46 3.27 -2.79 3.99 4.02 -0.88 -5.05 117.16 115.26 1ow6 n TYR 1007Ca 0.05 -2.85 -0.36 0.00 -0.01 0.00 0.00 57.90 54.73 1ow6 n TYR 1007Cb 0.33 -0.57 -0.07 0.00 -0.02 0.00 0.00 39.34 39.01 1ow6 n TYR 1007CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1ow6 s VAL 1008N -5.25 4.24 -0.58 -0.72 1.01 -1.21 -3.14 120.40 114.76 1ow6 s VAL 1008Ca 0.49 1.74 -0.18 0.00 0.00 0.00 0.00 61.98 64.02 1ow6 s VAL 1008Cb 0.40 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.90 1ow6 s VAL 1008CO -0.27 0.03 0.64 0.23 0.00 0.00 0.00 175.10 175.73 1ow6 n MET 1009N 0.26 -1.86 -3.44 2.72 2.81 -1.26 -5.01 117.12 111.34 1ow6 n MET 1009Ca 0.03 1.46 -0.12 0.00 -1.81 0.00 0.00 57.70 57.26 1ow6 n MET 1009Cb 0.51 -3.60 -0.02 0.00 -0.71 0.00 0.00 33.22 29.40 1ow6 n MET 1009CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1ow6 s THR 1010N -2.35 0.00 0.41 2.03 2.01 -1.26 -5.01 115.64 111.48 1ow6 s THR 1010Ca 0.20 0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.28 1ow6 s THR 1010Cb -0.03 -1.00 0.26 0.00 0.01 0.00 0.00 72.50 71.74 1ow6 s THR 1010CO 0.84 0.00 2.06 0.77 -0.69 0.00 0.00 174.62 177.59 1ow6 h SER 1011N 2.06 0.44 1.46 3.53 4.64 -1.96 -3.22 113.55 120.51 1ow6 h SER 1011Ca -0.32 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 60.94 1ow6 h SER 1011Cb 1.29 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1ow6 h SER 1011CO 0.37 0.33 -0.20 -0.07 -0.87 0.00 0.00 176.83 176.39 1ow6 h LEU 1012N 0.52 0.00 -0.85 5.97 3.38 -1.95 -3.22 115.31 119.16 1ow6 h LEU 1012Ca 0.14 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1ow6 h LEU 1012Cb -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1ow6 h LEU 1012CO -0.03 0.20 -0.53 -0.61 0.09 0.00 0.00 178.44 177.57 1ow6 h GLN 1013N 0.00 0.00 0.00 1.13 4.15 -1.55 -1.29 115.11 117.56 1ow6 h GLN 1013Ca -0.00 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 1ow6 h GLN 1013Cb 0.99 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.68 1ow6 h GLN 1013CO 0.03 0.53 -0.05 0.37 -1.93 0.00 0.00 178.83 177.77 1ow6 h GLN 1014N 0.00 0.00 0.00 1.69 -0.00 -1.72 -2.73 115.11 112.35 1ow6 h GLN 1014Ca -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.58 1ow6 h GLN 1014Cb 1.00 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.47 1ow6 h GLN 1014CO 0.07 0.05 -0.34 1.49 0.00 0.00 0.00 178.83 180.10 1ow6 h GLU 1015N 0.00 0.00 0.00 1.69 4.57 -1.55 -3.07 114.58 116.22 1ow6 h GLU 1015Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1ow6 h GLU 1015Cb 0.69 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.28 1ow6 h GLU 1015CO 0.01 0.98 0.00 0.66 -1.18 0.00 0.00 179.01 179.48 1ow6 n TYR 1016N -4.56 0.54 0.10 0.92 4.01 -0.53 -2.15 117.16 115.47 1ow6 n TYR 1016Ca -0.16 0.25 -0.23 0.00 -0.16 0.00 0.00 57.90 57.61 1ow6 n TYR 1016Cb 0.53 -0.91 -0.15 0.00 -0.31 0.00 0.00 39.34 38.50 1ow6 n TYR 1016CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1ow6 h LYS 1017N 0.00 0.43 -0.41 -0.72 1.57 -1.50 -2.44 116.57 113.50 1ow6 h LYS 1017Ca 0.00 -0.74 0.07 0.00 -1.87 0.00 0.00 60.65 58.11 1ow6 h LYS 1017Cb 0.12 0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 1ow6 h LYS 1017CO 0.00 1.35 0.28 0.87 -0.57 0.00 0.00 179.45 181.38 1ow6 h LYS 1018N -0.04 0.27 0.00 3.15 1.57 -1.33 -1.84 116.57 118.35 1ow6 h LYS 1018Ca -0.24 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.45 1ow6 h LYS 1018Cb 1.98 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 34.22 1ow6 h LYS 1018CO 0.21 0.18 -0.36 1.96 -0.57 0.00 0.00 179.45 180.87 1ow6 h GLN 1019N 0.28 0.00 -0.05 3.15 4.20 -1.41 -2.09 115.11 119.19 1ow6 h GLN 1019Ca 0.18 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.87 1ow6 h GLN 1019Cb 0.37 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 1ow6 h GLN 1019CO -0.04 0.36 -0.07 0.52 -0.67 0.00 0.00 178.83 178.92 1ow6 h MET 1020N 0.00 0.14 0.00 1.46 2.86 -0.85 -2.46 114.93 116.09 1ow6 h MET 1020Ca -0.00 -0.08 -0.05 0.00 -2.06 0.00 0.00 59.70 57.50 1ow6 h MET 1020Cb 1.01 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 1ow6 h MET 1020CO 0.05 0.63 -0.23 -0.07 1.06 0.00 0.00 176.91 178.35 1ow6 h LEU 1021N -0.34 0.00 -0.37 1.22 3.38 -1.21 -1.78 115.31 116.21 1ow6 h LEU 1021Ca 0.01 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 1ow6 h LEU 1021Cb 0.62 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ow6 h LEU 1021CO 0.02 0.23 -0.63 0.74 0.09 0.00 0.00 178.44 178.89 1ow6 h THR 1022N 0.00 1.31 0.00 0.22 2.02 -1.32 -1.78 112.91 113.35 1ow6 h THR 1022Ca -0.00 -1.88 -0.10 0.00 0.77 0.00 0.00 66.41 65.20 1ow6 h THR 1022Cb 0.45 1.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 1ow6 h THR 1022CO 0.03 0.59 -0.49 0.00 0.37 0.00 0.00 175.52 176.02 1ow6 h ALA 1023N 0.81 0.98 0.09 6.16 0.00 -0.88 -2.73 119.26 123.69 1ow6 h ALA 1023Ca -0.01 -0.44 -0.29 0.00 0.00 0.00 0.00 54.91 54.17 1ow6 h ALA 1023Cb 1.21 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1ow6 h ALA 1023CO 0.12 0.61 -1.47 0.00 0.00 0.00 0.00 179.25 178.51 1ow6 h ALA 1024N 1.51 0.32 0.00 0.00 0.00 -1.35 -2.80 119.26 116.94 1ow6 h ALA 1024Ca -0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 54.91 53.76 1ow6 h ALA 1024Cb 1.00 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1ow6 h ALA 1024CO 0.06 1.19 -0.20 1.25 0.00 0.00 0.00 179.25 181.55 1ow6 h HIS 1025N 0.05 0.00 0.05 0.00 6.17 -1.25 -2.33 115.15 117.84 1ow6 h HIS 1025Ca -0.21 0.00 -0.25 0.00 0.71 0.00 0.00 60.37 60.62 1ow6 h HIS 1025Cb 1.98 0.00 -0.02 0.00 2.52 0.00 0.00 27.41 31.89 1ow6 h HIS 1025CO 0.05 0.20 -1.20 0.00 0.71 0.00 0.00 177.93 177.70 1ow6 h ALA 1026N 1.80 0.31 -0.10 5.26 0.00 -1.51 -1.99 119.26 123.02 1ow6 h ALA 1026Ca -0.00 -0.98 -0.01 0.00 0.00 0.00 0.00 54.91 53.92 1ow6 h ALA 1026Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ow6 h ALA 1026CO 0.03 1.19 0.04 1.25 0.00 0.00 0.00 179.25 181.76 1ow6 h LEU 1027N 0.03 0.12 0.08 0.00 5.85 -1.20 -1.35 115.31 118.85 1ow6 h LEU 1027Ca -0.10 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.49 1ow6 h LEU 1027Cb 1.88 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 42.89 1ow6 h LEU 1027CO 0.15 0.12 -0.55 0.00 -0.34 0.00 0.00 178.44 177.82 1ow6 h ALA 1028N 1.90 -0.03 -0.86 1.25 0.00 -1.20 -2.66 119.26 117.67 1ow6 h ALA 1028Ca 0.04 -0.66 0.14 0.00 0.00 0.00 0.00 54.91 54.43 1ow6 h ALA 1028Cb 0.04 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 1ow6 h ALA 1028CO -0.00 0.27 0.56 0.28 0.00 0.00 0.00 179.25 180.35 1ow6 h VAL 1029N -0.63 0.83 0.00 0.00 2.07 -1.26 -2.11 116.25 115.15 1ow6 h VAL 1029Ca -0.10 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 1ow6 h VAL 1029Cb 1.40 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1ow6 h VAL 1029CO 0.08 0.12 -0.12 0.44 0.02 0.00 0.00 177.57 178.10 1ow6 h ASP 1030N 0.63 0.00 0.36 0.57 3.32 -1.27 -2.31 116.42 117.73 1ow6 h ASP 1030Ca 0.43 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 57.20 1ow6 h ASP 1030Cb 0.73 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.30 1ow6 h ASP 1030CO -0.18 0.12 -1.21 0.00 -1.72 0.00 0.00 179.24 176.25 1ow6 h ALA 1031N 1.88 0.09 0.00 3.45 0.00 -1.02 -2.09 119.26 121.56 1ow6 h ALA 1031Ca -0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 54.91 54.05 1ow6 h ALA 1031Cb 1.01 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1ow6 h ALA 1031CO 0.02 0.81 -0.26 0.87 0.00 0.00 0.00 179.25 180.69 1ow6 h LYS 1032N 0.18 0.00 0.00 0.00 1.57 -1.33 -2.23 116.57 114.76 1ow6 h LYS 1032Ca -0.16 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.42 1ow6 h LYS 1032Cb 1.89 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 34.17 1ow6 h LYS 1032CO 0.22 0.26 -0.96 -0.91 -0.57 0.00 0.00 179.45 177.48 1ow6 h ASN 1033N 0.00 0.00 0.30 0.86 -0.26 -1.32 -2.44 115.58 112.72 1ow6 h ASN 1033Ca -0.00 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.72 1ow6 h ASN 1033Cb 0.53 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.80 1ow6 h ASN 1033CO 0.03 0.96 -0.15 0.25 -1.06 0.00 0.00 177.43 177.47 1ow6 h LEU 1034N 0.00 -0.35 -0.99 1.61 5.85 -1.01 -1.62 115.31 118.81 1ow6 h LEU 1034Ca -0.01 -0.05 0.24 0.00 0.84 0.00 0.00 57.88 58.90 1ow6 h LEU 1034Cb 1.73 0.09 -0.13 0.00 0.37 0.00 0.00 40.66 42.72 1ow6 h LEU 1034CO 0.13 -0.17 0.56 0.25 -0.34 0.00 0.00 178.44 178.87 1ow6 h LEU 1035N -0.50 0.62 -0.74 2.25 6.46 -1.45 -1.24 115.31 120.71 1ow6 h LEU 1035Ca -0.04 0.14 -0.11 0.00 -0.12 0.00 0.00 57.88 57.74 1ow6 h LEU 1035Cb 0.38 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.34 1ow6 h LEU 1035CO 0.07 0.08 -0.26 -0.78 -0.62 0.00 0.00 178.44 176.93 1ow6 h ASP 1036N 0.55 0.69 0.56 1.25 1.82 -0.86 -3.04 116.42 117.38 1ow6 h ASP 1036Ca 0.63 -0.25 -0.02 0.00 -0.39 0.00 0.00 57.03 57.00 1ow6 h ASP 1036Cb 1.21 -0.19 -0.00 0.00 0.68 0.00 0.00 39.33 41.03 1ow6 h ASP 1036CO -0.49 0.92 -0.32 0.58 -1.61 0.00 0.00 179.24 178.33 1ow6 h VAL 1037N 0.58 0.35 -0.81 2.25 2.07 -0.31 -1.98 116.25 118.40 1ow6 h VAL 1037Ca 0.08 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.77 1ow6 h VAL 1037Cb 0.75 0.35 -0.11 0.00 -1.52 0.00 0.00 31.29 30.76 1ow6 h VAL 1037CO 0.06 0.00 0.31 0.40 0.02 0.00 0.00 177.57 178.36 1ow6 h ILE 1038N -0.82 0.55 -0.25 4.57 2.04 -1.59 0.22 117.51 122.22 1ow6 h ILE 1038Ca -0.07 -0.13 -0.10 0.00 1.00 0.00 0.00 64.86 65.56 1ow6 h ILE 1038Cb 0.66 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1ow6 h ILE 1038CO 0.09 0.07 -0.23 0.44 0.00 0.00 0.00 178.15 178.52 1ow6 h ASP 1039N 0.39 0.63 -0.01 1.72 5.19 -1.46 -1.37 116.42 121.51 1ow6 h ASP 1039Ca 0.48 -0.47 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1ow6 h ASP 1039Cb 0.82 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 40.15 1ow6 h ASP 1039CO -0.48 0.96 0.01 1.56 -3.12 0.00 0.00 179.24 178.17 1ow6 h GLN 1040N 0.30 0.00 -0.01 3.56 4.20 -0.41 0.59 115.11 123.34 1ow6 h GLN 1040Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1ow6 h GLN 1040Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1ow6 h GLN 1040CO 0.06 0.00 -0.18 0.00 -0.67 0.00 0.00 178.83 178.04 1ow6 n ALA 1041N -2.21 2.92 -0.08 3.87 0.00 0.64 -2.22 120.51 123.42 1ow6 n ALA 1041Ca -0.03 -0.47 -0.09 0.00 0.00 0.00 0.00 53.44 52.85 1ow6 n ALA 1041Cb 0.09 -1.07 -0.11 0.00 0.00 0.00 0.00 19.45 18.36 1ow6 n ALA 1041CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ow6 n ARG 1042N -0.12 1.30 -0.10 0.00 1.74 0.19 -3.73 116.66 115.95 1ow6 n ARG 1042Ca 0.14 0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 57.15 1ow6 n ARG 1042Cb 0.39 -1.38 -0.02 0.00 -1.02 0.00 0.00 32.46 30.43 1ow6 n ARG 1042CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1ow6 h LEU 1043N 0.00 0.40 0.11 0.55 3.38 -1.07 -1.18 115.31 117.51 1ow6 h LEU 1043Ca -0.41 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.45 1ow6 h LEU 1043Cb 1.84 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 42.45 1ow6 h LEU 1043CO -0.00 0.43 -0.30 0.50 0.09 0.00 0.00 178.44 179.16 1ow6 h LYS 1044N 0.35 -0.49 -0.62 1.13 3.64 -1.64 -0.53 116.57 118.40 1ow6 h LYS 1044Ca 0.10 0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.70 1ow6 h LYS 1044Cb 0.14 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 1ow6 h LYS 1044CO -0.01 -0.33 0.56 1.98 -2.27 0.00 0.00 179.45 179.38 1ow6 h MET 1045N -0.51 0.00 0.00 1.90 4.05 -1.59 -2.43 114.93 116.35 1ow6 h MET 1045Ca 0.03 0.00 -0.15 0.00 -0.28 0.00 0.00 59.70 59.31 1ow6 h MET 1045Cb 0.54 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.32 1ow6 h MET 1045CO -0.18 0.00 -1.28 -0.07 0.23 0.00 0.00 176.91 175.61 1ow6 h LEU 1046N 0.00 0.00 -1.43 3.39 3.38 0.14 -3.51 115.31 117.28 1ow6 h LEU 1046Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1ow6 h LEU 1046Cb 1.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.17 1ow6 h LEU 1046CO -0.00 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.66