#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o8j h ARG 924 N 7.18 0.38 -1.30 0.00 3.08 -1.89 -1.21 114.38 120.62 2o8j h ARG 924 Ca -0.42 -0.22 -0.04 0.00 0.07 0.00 0.00 59.98 59.37 2o8j h ARG 924 Cb 1.14 0.02 -0.24 0.00 0.08 0.00 0.00 29.97 30.97 2o8j h ARG 924 CO 0.48 0.80 -0.41 0.34 -1.07 0.00 0.00 179.97 180.11 2o8j s ASP 925 N -6.89 -0.80 0.52 7.04 2.15 -1.26 -3.13 116.67 114.31 2o8j s ASP 925 Ca -0.06 0.20 0.34 0.00 0.43 0.00 0.00 52.55 53.46 2o8j s ASP 925 Cb 0.12 1.70 1.63 0.00 -0.30 0.00 0.00 42.92 46.07 2o8j s ASP 925 CO 0.81 -0.31 2.03 -0.37 -0.17 0.00 0.00 175.17 177.16 2o8j h VAL 926 N 6.07 0.00 -0.01 1.11 -1.51 -1.13 -2.32 116.25 118.46 2o8j h VAL 926 Ca -0.10 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.12 2o8j h VAL 926 Cb 1.16 1.14 0.00 0.00 -2.13 0.00 0.00 31.29 31.46 2o8j h VAL 926 CO 0.22 0.00 -0.13 0.00 -1.23 0.00 0.00 177.57 176.43 2o8j n ALA 927 N -2.00 2.81 -4.00 5.19 0.00 -1.26 -4.85 120.51 116.40 2o8j n ALA 927 Ca -0.01 -0.30 -0.30 0.00 0.00 0.00 0.00 53.44 52.83 2o8j n ALA 927 Cb 0.19 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2o8j n ALA 927 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2o8j n ARG 928 N -0.82 -4.37 -0.98 0.00 1.74 -0.87 -1.74 116.66 109.62 2o8j n ARG 928 Ca 0.15 0.50 0.00 0.00 -0.77 0.00 0.00 57.85 57.72 2o8j n ARG 928 Cb 0.29 -5.18 0.00 0.00 -1.02 0.00 0.00 32.46 26.55 2o8j n ARG 928 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2o8j n GLY 929 N -1.64 0.56 0.22 -0.13 0.00 -1.26 -4.93 105.19 98.00 2o8j n GLY 929 Ca -0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.10 2o8j n GLY 929 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2o8j h TYR 930 N 0.00 0.00 -1.91 1.61 -1.99 -1.71 -3.46 116.97 109.51 2o8j h TYR 930 Ca 0.00 0.00 -0.44 0.00 2.00 0.00 0.00 58.73 60.29 2o8j h TYR 930 Cb 0.09 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.84 2o8j h TYR 930 CO 0.06 0.00 -0.28 -1.21 -0.00 0.00 0.00 178.16 176.73 2o8j s GLU 931 N -3.24 3.03 0.53 4.88 0.41 -1.26 -4.94 118.70 118.10 2o8j s GLU 931 Ca 0.07 -0.96 0.18 0.00 -0.41 0.00 0.00 54.97 53.84 2o8j s GLU 931 Cb 0.06 -2.76 1.32 0.00 -1.78 0.00 0.00 34.13 30.98 2o8j s GLU 931 CO 0.65 -0.08 2.16 -0.91 -0.49 0.00 0.00 175.26 176.59 2o8j h ASN 932 N 0.73 0.00 -4.46 -0.19 2.35 -1.89 -3.43 115.58 108.68 2o8j h ASN 932 Ca -0.45 0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 54.92 2o8j h ASN 932 Cb 1.26 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.42 2o8j h ASN 932 CO 0.52 0.01 -0.77 0.68 -1.65 0.00 0.00 177.43 176.22 2o8j s VAL 933 N -5.00 1.05 0.73 2.81 -7.23 -1.26 -5.08 120.40 106.41 2o8j s VAL 933 Ca -0.05 -1.35 -0.13 0.00 -1.81 0.00 0.00 61.98 58.64 2o8j s VAL 933 Cb 0.17 -1.09 0.04 0.00 0.56 0.00 0.00 36.38 36.05 2o8j s VAL 933 CO 0.66 -0.29 1.12 -2.16 -0.31 0.00 0.00 175.10 174.11 2o8j s PRO 934 N -1.91 2.40 -0.41 4.82 0.04 -1.26 -4.95 135.00 133.72 2o8j s PRO 934 Ca -0.01 1.37 0.02 0.00 0.04 0.00 0.00 61.00 62.41 2o8j s PRO 934 Cb -0.09 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.67 2o8j s PRO 934 CO 0.02 -1.56 0.19 0.42 0.04 0.00 0.00 177.00 176.11 2o8j s ILE 935 N -2.52 1.44 0.81 0.56 1.01 -1.26 -4.60 121.20 116.64 2o8j s ILE 935 Ca 0.66 -2.33 -0.12 0.00 0.00 0.00 0.00 60.65 58.86 2o8j s ILE 935 Cb -0.20 -2.03 0.08 0.00 0.01 0.00 0.00 42.46 40.32 2o8j s ILE 935 CO 0.48 -0.82 1.10 -2.16 0.00 0.00 0.00 174.94 173.55 2o8j s PRO 936 N 0.64 1.96 -0.04 2.79 0.04 -1.18 -0.61 135.00 138.59 2o8j s PRO 936 Ca 0.15 0.61 0.04 0.00 0.04 0.00 0.00 61.00 61.84 2o8j s PRO 936 Cb -0.23 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.41 2o8j s PRO 936 CO -0.06 -1.70 -0.16 0.00 0.04 0.00 0.00 177.00 175.12 2o8j s VAL 938 N 0.10 1.11 -0.22 0.00 -7.23 -0.58 -1.20 120.40 112.38 2o8j s VAL 938 Ca -0.05 -1.81 -0.05 0.00 -1.81 0.00 0.00 61.98 58.27 2o8j s VAL 938 Cb -0.12 -1.58 0.08 0.00 0.56 0.00 0.00 36.38 35.33 2o8j s VAL 938 CO 0.02 -0.60 0.11 0.21 -0.31 0.00 0.00 175.10 174.54 2o8j s ASN 939 N -2.71 2.80 -0.28 4.85 3.84 -1.26 -2.87 114.94 119.30 2o8j s ASN 939 Ca 0.10 -0.88 0.11 0.00 0.21 0.00 0.00 52.86 52.40 2o8j s ASN 939 Cb -0.01 -0.26 0.60 0.00 -0.55 0.00 0.00 41.25 41.02 2o8j s ASN 939 CO 0.01 -0.39 1.59 0.61 -2.79 0.00 0.00 177.10 176.13 2o8j n GLY 940 N 5.27 4.28 0.76 1.21 0.00 -1.26 -4.69 105.19 110.76 2o8j n GLY 940 Ca -0.06 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.86 2o8j n GLY 940 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2o8j n VAL 941 N -0.69 0.00 -2.84 1.61 0.31 -1.26 -5.12 118.33 110.34 2o8j n VAL 941 Ca 0.35 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.68 2o8j n VAL 941 Cb 1.16 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 2o8j n VAL 941 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2o8j n ASP 942 N -2.80 0.00 -1.38 4.52 5.68 -1.26 -5.07 116.55 116.24 2o8j n ASP 942 Ca 0.00 -0.32 0.09 0.00 -0.50 0.00 0.00 54.79 54.06 2o8j n ASP 942 Cb 0.46 0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.75 2o8j n ASP 942 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2o8j n GLY 943 N 0.00 2.30 3.66 6.12 0.00 -1.26 -4.93 105.19 111.08 2o8j n GLY 943 Ca 0.00 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 2o8j n GLY 943 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o8j s GLU 944 N -1.62 4.16 0.77 1.61 0.41 -1.26 -5.01 118.70 117.76 2o8j s GLU 944 Ca 0.45 2.39 -0.11 0.00 -0.41 0.00 0.00 54.97 57.29 2o8j s GLU 944 Cb 0.27 -4.07 0.05 0.00 -1.78 0.00 0.00 34.13 28.60 2o8j s GLU 944 CO 0.24 -0.90 1.08 -1.25 -0.49 0.00 0.00 175.26 173.94 2o8j s PRO 945 N 4.25 2.32 -0.04 0.39 0.04 -1.26 -4.90 135.00 135.79 2o8j s PRO 945 Ca 0.81 0.97 -0.40 0.00 0.04 0.00 0.00 61.00 62.41 2o8j s PRO 945 Cb -0.38 -1.92 -0.19 0.00 0.04 0.00 0.00 34.50 32.05 2o8j s PRO 945 CO 0.35 -1.54 1.18 0.00 0.04 0.00 0.00 177.00 177.03 2o8j n PRO 947 N 1.99 2.74 0.00 0.00 -0.04 -1.26 -4.91 135.00 133.52 2o8j n PRO 947 Ca 0.21 0.97 0.00 0.00 -0.04 0.00 0.00 63.50 64.64 2o8j n PRO 947 Cb 0.08 -2.76 0.00 0.00 -0.04 0.00 0.00 33.50 30.79 2o8j n PRO 947 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2o8j n GLU 948 N 1.87 0.36 -0.80 0.54 1.02 -1.26 -4.86 120.64 117.52 2o8j n GLU 948 Ca 0.07 -0.52 -0.13 0.00 -0.02 0.00 0.00 57.16 56.57 2o8j n GLU 948 Cb 0.37 -0.61 0.03 0.00 -0.02 0.00 0.00 31.44 31.21 2o8j n GLU 948 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2o8j n ASP 949 N -0.07 6.19 -3.88 1.62 2.03 -1.26 -4.81 116.55 116.37 2o8j n ASP 949 Ca 0.00 -2.92 -0.08 0.00 0.52 0.00 0.00 54.79 52.32 2o8j n ASP 949 Cb 0.36 -1.07 -0.03 0.00 -0.72 0.00 0.00 41.12 39.67 2o8j n ASP 949 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 2o8j s TYR 950 N -1.41 -0.09 -0.26 -0.67 -0.85 -1.26 -4.86 117.35 107.96 2o8j s TYR 950 Ca 0.24 -0.35 -0.05 0.00 -0.52 0.00 0.00 57.07 56.39 2o8j s TYR 950 Cb 0.19 0.60 -0.00 0.00 0.38 0.00 0.00 41.96 43.13 2o8j s TYR 950 CO -0.00 -1.18 0.02 0.21 -1.52 0.00 0.00 175.55 173.08 2o8j s LYS 951 N -3.94 3.27 -0.05 -3.49 2.47 0.58 -5.01 119.74 113.58 2o8j s LYS 951 Ca 0.13 -0.72 -0.30 0.00 -1.56 0.00 0.00 55.97 53.52 2o8j s LYS 951 Cb -0.05 -3.21 -0.05 0.00 -1.46 0.00 0.00 37.83 33.07 2o8j s LYS 951 CO 0.07 -0.31 1.42 -0.47 0.16 0.00 0.00 175.35 176.22 2o8j s TYR 952 N 1.50 2.68 -0.01 4.03 5.04 -1.26 -1.73 117.35 127.60 2o8j s TYR 952 Ca 0.04 0.74 0.05 0.00 -2.44 0.00 0.00 57.07 55.46 2o8j s TYR 952 Cb -0.16 -3.68 -0.01 0.00 0.35 0.00 0.00 41.96 38.46 2o8j s TYR 952 CO 0.00 -2.56 -0.15 0.96 -1.34 0.00 0.00 175.55 172.46 2o8j s ILE 953 N 2.97 1.21 -0.61 3.14 -4.36 -0.33 -4.89 121.20 118.32 2o8j s ILE 953 Ca 0.64 -0.70 0.24 0.00 -0.26 0.00 0.00 60.65 60.57 2o8j s ILE 953 Cb -0.30 -1.02 0.09 0.00 1.25 0.00 0.00 42.46 42.49 2o8j s ILE 953 CO 0.25 0.31 1.38 0.77 0.24 0.00 0.00 174.94 177.88 2o8j h SER 954 N 5.66 0.00 -4.77 4.36 4.64 -1.92 -3.26 113.55 118.27 2o8j h SER 954 Ca -0.36 -0.15 -0.23 0.00 -0.47 0.00 0.00 61.79 60.58 2o8j h SER 954 Cb 1.16 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.03 2o8j h SER 954 CO 0.48 0.08 -0.72 -1.61 -0.87 0.00 0.00 176.83 174.19 2o8j s GLU 955 N -3.18 0.42 0.39 4.77 2.02 -1.26 -4.98 118.70 116.88 2o8j s GLU 955 Ca 0.06 -0.65 -0.25 0.00 0.02 0.00 0.00 54.97 54.15 2o8j s GLU 955 Cb 0.12 -0.13 -0.12 0.00 0.10 0.00 0.00 34.13 34.11 2o8j s GLU 955 CO 0.71 0.01 1.01 0.09 0.02 0.00 0.00 175.26 177.10 2o8j n ASN 956 N 1.65 1.28 -4.63 -0.19 3.02 -1.26 -4.76 115.26 110.37 2o8j n ASN 956 Ca -0.22 1.07 -0.29 0.00 -0.03 0.00 0.00 54.58 55.11 2o8j n ASN 956 Cb 0.55 -1.34 -0.10 0.00 -0.61 0.00 0.00 39.78 38.29 2o8j n ASN 956 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2o8j s GLU 958 N -3.79 1.03 0.00 0.00 2.02 -1.26 -1.28 118.70 115.42 2o8j s GLU 958 Ca 0.23 -0.65 0.01 0.00 0.02 0.00 0.00 54.97 54.58 2o8j s GLU 958 Cb 0.06 -1.03 0.00 0.00 0.10 0.00 0.00 34.13 33.27 2o8j s GLU 958 CO 0.12 0.27 0.35 -2.37 0.02 0.00 0.00 175.26 173.64 2o8j n THR 959 N 2.26 0.00 -3.76 3.63 5.66 -1.26 -5.00 114.28 115.81 2o8j n THR 959 Ca -0.16 -0.49 -0.10 0.00 -3.05 0.00 0.00 64.05 60.25 2o8j n THR 959 Cb 0.55 1.01 -0.05 0.00 -1.55 0.00 0.00 70.33 70.29 2o8j n THR 959 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2o8j s SER 960 N -0.43 -0.13 0.19 1.09 1.04 -1.26 -5.14 113.70 109.06 2o8j s SER 960 Ca 0.01 -0.52 -0.32 0.00 0.48 0.00 0.00 55.95 55.60 2o8j s SER 960 Cb 0.01 0.47 -0.12 0.00 0.10 0.00 0.00 66.02 66.47 2o8j s SER 960 CO 0.02 -0.89 1.73 0.41 0.98 0.00 0.00 173.24 175.49 2o8j n THR 961 N -0.22 0.06 -0.02 2.02 -1.04 -1.26 -4.94 114.28 108.88 2o8j n THR 961 Ca -0.13 -0.01 0.03 0.00 -2.04 0.00 0.00 64.05 61.90 2o8j n THR 961 Cb 0.63 -1.95 -0.14 0.00 -1.82 0.00 0.00 70.33 67.04 2o8j n THR 961 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 2o8j n MET 962 N 4.20 0.66 -3.84 -2.82 2.81 -1.26 -5.03 117.12 111.83 2o8j n MET 962 Ca 0.17 -0.06 -0.26 0.00 -1.81 0.00 0.00 57.70 55.74 2o8j n MET 962 Cb 0.34 -1.58 0.02 0.00 -0.71 0.00 0.00 33.22 31.29 2o8j n MET 962 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2o8j n ASN 963 N -2.53 -2.20 -4.77 7.83 3.02 -1.26 -4.94 115.26 110.41 2o8j n ASN 963 Ca -0.14 -0.85 -0.41 0.00 -0.03 0.00 0.00 54.58 53.15 2o8j n ASN 963 Cb 0.79 -3.75 -0.02 0.00 -0.61 0.00 0.00 39.78 36.19 2o8j n ASN 963 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2o8j s ILE 964 N -3.60 2.71 -0.46 2.41 1.01 -1.26 -4.93 121.20 117.09 2o8j s ILE 964 Ca 0.24 0.71 -0.29 0.00 0.00 0.00 0.00 60.65 61.31 2o8j s ILE 964 Cb -0.12 -3.45 0.02 0.00 0.01 0.00 0.00 42.46 38.92 2o8j s ILE 964 CO 0.84 0.17 1.26 -0.62 0.00 0.00 0.00 174.94 176.59 2o8j s ASP 965 N -0.43 6.49 0.00 3.58 2.15 -1.26 -4.85 116.67 122.35 2o8j s ASP 965 Ca 0.50 0.59 0.13 0.00 0.43 0.00 0.00 52.55 54.19 2o8j s ASP 965 Cb -0.40 -2.55 0.31 0.00 -0.30 0.00 0.00 42.92 39.98 2o8j s ASP 965 CO 0.52 -1.36 1.22 0.54 -0.17 0.00 0.00 175.17 175.93 2o8j n ARG 966 N 8.00 2.35 -1.61 4.34 1.74 -1.26 -4.49 116.66 125.73 2o8j n ARG 966 Ca 0.14 -1.96 -0.46 0.00 -0.77 0.00 0.00 57.85 54.80 2o8j n ARG 966 Cb 0.49 -1.31 -0.04 0.00 -1.02 0.00 0.00 32.46 30.57 2o8j n ARG 966 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2o8j n ASN 967 N 0.76 3.29 0.26 0.55 2.85 -1.26 -4.85 115.26 116.87 2o8j n ASN 967 Ca 0.13 0.60 0.12 0.00 -0.11 0.00 0.00 54.58 55.32 2o8j n ASN 967 Cb 0.44 -1.44 0.78 0.00 1.24 0.00 0.00 39.78 40.79 2o8j n ASN 967 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 2o8j h ILE 968 N 6.35 0.73 0.00 -1.44 2.10 -1.95 -1.10 117.51 122.20 2o8j h ILE 968 Ca -0.43 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.51 2o8j h ILE 968 Cb 1.26 0.97 0.00 0.00 -1.09 0.00 0.00 36.82 37.97 2o8j h ILE 968 CO 0.96 0.00 0.00 0.71 -1.08 0.00 0.00 178.15 178.74 2o8j h THR 969 N 0.00 0.00 -0.04 2.19 1.35 -2.02 -2.69 112.91 111.69 2o8j h THR 969 Ca 0.02 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2o8j h THR 969 Cb 0.09 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 2o8j h THR 969 CO -0.00 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 176.68 2o8j n HIS 970 N -2.42 0.05 -2.73 4.73 8.25 -0.42 -4.83 115.22 117.86 2o8j n HIS 970 Ca 0.04 -0.02 -0.43 0.00 -0.26 0.00 0.00 57.72 57.05 2o8j n HIS 970 Cb 0.39 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.47 2o8j n HIS 970 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2o8j s LEU 971 N -1.86 4.09 0.33 2.41 1.02 -1.02 -4.88 118.68 118.78 2o8j s LEU 971 Ca 0.38 1.28 -0.28 0.00 0.02 0.00 0.00 54.13 55.53 2o8j s LEU 971 Cb 0.20 -3.44 -0.09 0.00 0.02 0.00 0.00 46.19 42.87 2o8j s LEU 971 CO 0.31 -0.63 1.14 -1.10 0.02 0.00 0.00 176.35 176.10 2o8j s GLN 972 N 3.10 4.41 0.13 1.70 -0.21 -1.26 -5.02 119.66 122.51 2o8j s GLN 972 Ca 0.41 1.85 -0.20 0.00 0.02 0.00 0.00 55.36 57.44 2o8j s GLN 972 Cb -0.15 -2.98 0.05 0.00 1.00 0.00 0.00 33.01 30.93 2o8j s GLN 972 CO 0.06 -0.01 0.50 -3.38 -2.12 0.00 0.00 175.29 170.34 2o8j s HIS 973 N -1.27 -0.38 0.46 0.91 -3.43 -1.26 -4.93 115.29 105.40 2o8j s HIS 973 Ca 0.49 0.16 0.04 0.00 -0.80 0.00 0.00 55.06 54.96 2o8j s HIS 973 Cb -0.32 0.39 0.01 0.00 -1.43 0.00 0.00 32.58 31.24 2o8j s HIS 973 CO 0.41 -0.75 0.65 0.00 -2.00 0.00 0.00 174.74 173.05 2o8j n THR 975 N -2.04 1.92 -1.68 0.00 -2.24 -1.26 -2.53 114.28 106.45 2o8j n THR 975 Ca 0.06 -2.25 -0.45 0.00 -2.27 0.00 0.00 64.05 59.13 2o8j n THR 975 Cb 0.59 -0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 68.54 2o8j n THR 975 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2o8j n VAL 977 N 3.77 0.57 -2.44 0.00 0.24 -1.26 -3.43 118.33 115.77 2o8j n VAL 977 Ca 0.17 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.69 2o8j n VAL 977 Cb 0.30 0.91 0.00 0.00 -1.47 0.00 0.00 33.84 33.58 2o8j n VAL 977 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2o8j n ASP 978 N 1.38 0.98 -1.47 -1.34 5.75 -1.26 -5.05 116.55 115.54 2o8j n ASP 978 Ca 0.18 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.99 2o8j n ASP 978 Cb 0.57 0.00 0.25 0.00 -1.03 0.00 0.00 41.12 40.92 2o8j n ASP 978 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 2o8j n ASP 979 N 0.00 4.09 -1.48 -1.12 5.75 -1.26 -4.66 116.55 117.87 2o8j n ASP 979 Ca 0.00 -2.67 -0.17 0.00 -0.01 0.00 0.00 54.79 51.94 2o8j n ASP 979 Cb 0.00 -0.64 -0.05 0.00 -1.03 0.00 0.00 41.12 39.40 2o8j n ASP 979 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2o8j n SER 981 N -0.85 3.16 -4.95 0.00 3.41 -1.26 -4.73 113.62 108.40 2o8j n SER 981 Ca -0.18 -1.96 -0.24 0.00 -0.26 0.00 0.00 58.87 56.23 2o8j n SER 981 Cb 0.58 -0.32 -0.02 0.00 -0.26 0.00 0.00 64.21 64.19 2o8j n SER 981 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2o8j s SER 982 N -1.25 6.34 0.00 4.04 1.04 -1.26 -5.02 113.70 117.59 2o8j s SER 982 Ca 0.39 0.23 0.19 0.00 0.48 0.00 0.00 55.95 57.24 2o8j s SER 982 Cb 0.21 -1.93 0.85 0.00 0.10 0.00 0.00 66.02 65.25 2o8j s SER 982 CO 0.29 -0.07 1.60 -1.54 0.98 0.00 0.00 173.24 174.50 2o8j n SER 983 N -1.08 0.00 -0.12 7.02 3.41 -1.26 -2.67 113.62 118.92 2o8j n SER 983 Ca -0.07 0.35 0.14 0.00 -0.26 0.00 0.00 58.87 59.02 2o8j n SER 983 Cb 0.55 -0.43 0.52 0.00 -0.26 0.00 0.00 64.21 64.59 2o8j n SER 983 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2o8j n ASN 984 N -1.43 0.54 -4.63 4.04 5.03 -1.26 -4.82 115.26 112.73 2o8j n ASN 984 Ca 0.06 -0.50 -0.44 0.00 0.87 0.00 0.00 54.58 54.57 2o8j n ASN 984 Cb 0.20 -0.03 -0.04 0.00 -1.02 0.00 0.00 39.78 38.89 2o8j n ASN 984 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2o8j h LEU 986 N 11.78 0.88 -0.35 0.00 6.46 -1.89 -1.46 115.31 130.73 2o8j h LEU 986 Ca -0.46 0.01 -0.06 0.00 -0.12 0.00 0.00 57.88 57.25 2o8j h LEU 986 Cb 1.25 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.99 2o8j h LEU 986 CO 0.95 0.56 -0.01 0.00 -0.62 0.00 0.00 178.44 179.32 2o8j h GLY 988 N 0.44 1.45 1.51 0.00 0.00 -1.70 -2.39 103.07 102.38 2o8j h GLY 988 Ca 0.10 -0.43 -0.14 0.00 0.00 0.00 0.00 47.33 46.86 2o8j h GLY 988 CO 0.02 0.26 -0.45 1.46 0.00 0.00 0.00 176.54 177.83 2o8j h GLN 989 N 1.04 0.53 -0.04 4.80 4.20 -0.41 -1.65 115.11 123.57 2o8j h GLN 989 Ca 0.43 -0.29 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 2o8j h GLN 989 Cb 0.30 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 2o8j h GLN 989 CO -0.19 0.88 -0.06 -0.07 -0.67 0.00 0.00 178.83 178.72 2o8j h LEU 990 N 0.43 0.06 -1.37 1.46 3.38 -0.60 -1.07 115.31 117.60 2o8j h LEU 990 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2o8j h LEU 990 Cb 0.96 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2o8j h LEU 990 CO 0.08 0.13 0.00 -1.20 0.09 0.00 0.00 178.44 177.55 2o8j n SER 991 N -4.43 1.99 0.00 -0.43 7.64 -0.88 -4.82 113.62 112.70 2o8j n SER 991 Ca -0.02 -2.05 0.00 0.00 1.01 0.00 0.00 58.87 57.81 2o8j n SER 991 Cb 0.16 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 2o8j n SER 991 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2o8j n ILE 992 N 0.49 0.00 -4.17 0.44 5.41 -0.41 -4.72 119.36 116.40 2o8j n ILE 992 Ca 0.12 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.75 2o8j n ILE 992 Cb 0.33 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 39.17 2o8j n ILE 992 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2o8j s ARG 993 N 0.00 1.26 0.04 0.38 1.70 -0.68 -4.43 118.95 117.23 2o8j s ARG 993 Ca 0.00 -1.59 -0.31 0.00 -0.47 0.00 0.00 55.73 53.37 2o8j s ARG 993 Cb 0.00 0.30 -0.06 0.00 -0.57 0.00 0.00 34.95 34.62 2o8j s ARG 993 CO 0.00 -0.43 1.25 0.00 -1.08 0.00 0.00 175.30 175.04 2o8j n TRP 995 N 4.32 0.07 -3.46 0.00 7.02 -1.26 -4.90 117.44 119.23 2o8j n TRP 995 Ca 0.10 -0.03 -0.37 0.00 -1.02 0.00 0.00 57.50 56.18 2o8j n TRP 995 Cb 0.45 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.28 2o8j n TRP 995 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 2o8j s TYR 996 N -1.93 3.51 0.41 -5.99 2.02 -1.26 -0.67 117.35 113.44 2o8j s TYR 996 Ca 0.32 0.73 -0.07 0.00 -0.37 0.00 0.00 57.07 57.69 2o8j s TYR 996 Cb 0.20 -2.40 0.10 0.00 -0.40 0.00 0.00 41.96 39.46 2o8j s TYR 996 CO 0.31 0.26 0.48 -0.40 -1.57 0.00 0.00 175.55 174.63 2o8j n ASP 997 N 3.42 -0.48 0.05 2.29 5.68 0.62 -4.88 116.55 123.25 2o8j n ASP 997 Ca -0.11 -1.03 0.08 0.00 -0.50 0.00 0.00 54.79 53.23 2o8j n ASP 997 Cb 0.52 -0.39 0.34 0.00 -1.14 0.00 0.00 41.12 40.45 2o8j n ASP 997 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2o8j n LYS 998 N -2.34 0.07 -0.17 0.11 2.85 -1.26 -2.07 118.16 115.35 2o8j n LYS 998 Ca 0.06 0.37 0.07 0.00 -1.05 0.00 0.00 58.31 57.76 2o8j n LYS 998 Cb 0.23 -1.65 0.16 0.00 -0.65 0.00 0.00 35.03 33.11 2o8j n LYS 998 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2o8j n ASP 999 N -1.78 2.90 0.00 -5.58 8.00 -1.26 -4.98 116.55 113.85 2o8j n ASP 999 Ca 0.02 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.61 2o8j n ASP 999 Cb 0.15 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 2o8j n ASP 999 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2o8j n GLY 1000N 0.71 0.67 3.90 0.44 0.00 -0.88 -5.05 105.19 104.98 2o8j n GLY 1000Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 2o8j n GLY 1000CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o8j s ARG 1001N -0.23 3.49 0.43 1.61 0.52 -1.26 -4.58 118.95 118.93 2o8j s ARG 1001Ca 0.00 -0.24 -0.26 0.00 -0.52 0.00 0.00 55.73 54.72 2o8j s ARG 1001Cb 0.00 -3.08 -0.09 0.00 0.52 0.00 0.00 34.95 32.30 2o8j s ARG 1001CO 0.00 0.65 1.42 1.28 0.02 0.00 0.00 175.30 178.67 2o8j n LEU 1002N 0.93 4.87 -4.77 2.53 4.77 -0.03 -0.28 117.00 125.02 2o8j n LEU 1002Ca -0.10 1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 56.66 2o8j n LEU 1002Cb 0.53 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 2o8j n LEU 1002CO 0.44 -0.18 0.81 -0.76 -1.33 0.00 0.00 177.39 176.36 2o8j s LEU 1003N -2.38 3.82 0.36 2.23 1.43 0.15 -4.63 118.68 119.66 2o8j s LEU 1003Ca 0.60 2.26 0.13 0.00 -1.03 0.00 0.00 54.13 56.09 2o8j s LEU 1003Cb -0.46 -4.48 0.96 0.00 0.03 0.00 0.00 46.19 42.24 2o8j s LEU 1003CO 0.59 -1.19 1.79 1.56 0.23 0.00 0.00 176.35 179.32 2o8j h GLN 1004N 1.41 0.52 0.00 1.70 4.20 -1.92 -0.15 115.11 120.86 2o8j h GLN 1004Ca -0.50 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.18 2o8j h GLN 1004Cb 1.26 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.93 2o8j h GLN 1004CO 0.58 0.34 0.00 0.39 -0.67 0.00 0.00 178.83 179.47 2o8j n GLU 1005N -4.67 0.16 -1.62 1.46 4.71 -1.26 -4.87 120.64 114.55 2o8j n GLU 1005Ca 0.24 0.43 -0.49 0.00 -0.01 0.00 0.00 57.16 57.32 2o8j n GLU 1005Cb 0.73 -1.82 -0.05 0.00 -1.01 0.00 0.00 31.44 29.29 2o8j n GLU 1005CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2o8j n PHE 1006N -2.11 1.75 -2.00 -0.32 7.35 -0.07 -4.81 117.46 117.24 2o8j n PHE 1006Ca 0.02 0.52 -0.25 0.00 -0.76 0.00 0.00 57.45 56.98 2o8j n PHE 1006Cb 0.19 -2.39 -0.05 0.00 0.35 0.00 0.00 39.48 37.57 2o8j n PHE 1006CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 2o8j s ASN 1007N 0.53 5.01 0.00 -2.13 3.84 -1.26 -4.77 114.94 116.16 2o8j s ASN 1007Ca 0.80 -0.68 0.28 0.00 0.21 0.00 0.00 52.86 53.47 2o8j s ASN 1007Cb -0.84 -2.56 1.61 0.00 -0.55 0.00 0.00 41.25 38.90 2o8j s ASN 1007CO 0.45 -2.88 2.04 2.29 -2.79 0.00 0.00 177.10 176.21 2o8j n LYS 1008N 8.81 1.06 -0.08 0.43 -0.00 -1.26 -1.85 118.16 125.27 2o8j n LYS 1008Ca 0.41 -0.09 -0.11 0.00 -0.00 0.00 0.00 58.31 58.52 2o8j n LYS 1008Cb 0.47 -1.44 -0.07 0.00 -0.00 0.00 0.00 35.03 33.99 2o8j n LYS 1008CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2o8j n ILE 1009N -0.83 0.89 -3.69 0.58 5.41 -1.26 -4.77 119.36 115.68 2o8j n ILE 1009Ca 0.21 -0.33 -0.28 0.00 1.00 0.00 0.00 62.75 63.35 2o8j n ILE 1009Cb 0.12 -1.12 -0.11 0.00 -0.71 0.00 0.00 39.64 37.82 2o8j n ILE 1009CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2o8j n GLU 1010N -3.03 1.33 -1.75 0.38 2.13 -1.23 -5.13 120.64 113.34 2o8j n GLU 1010Ca -0.28 -4.05 -0.39 0.00 0.66 0.00 0.00 57.16 53.10 2o8j n GLU 1010Cb 0.79 -2.06 0.04 0.00 0.27 0.00 0.00 31.44 30.47 2o8j n GLU 1010CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 2o8j n PRO 1011N 2.15 1.80 -1.79 5.31 -0.02 -0.77 -4.79 135.00 136.90 2o8j n PRO 1011Ca 0.24 0.66 -0.31 0.00 -2.02 0.00 0.00 63.50 62.07 2o8j n PRO 1011Cb 0.40 -2.60 0.04 0.00 -0.02 0.00 0.00 33.50 31.32 2o8j n PRO 1011CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2o8j s PRO 1012N -2.84 3.02 0.24 0.52 0.04 -1.26 -4.96 135.00 129.77 2o8j s PRO 1012Ca 0.70 0.66 -0.30 0.00 0.04 0.00 0.00 61.00 62.10 2o8j s PRO 1012Cb -0.42 -2.02 -0.11 0.00 0.04 0.00 0.00 34.50 31.99 2o8j s PRO 1012CO 0.50 -0.96 1.53 -0.51 0.04 0.00 0.00 177.00 177.60 2o8j s LEU 1013N -5.38 4.37 -0.22 -3.56 1.43 -1.26 -4.61 118.68 109.45 2o8j s LEU 1013Ca 0.57 2.75 -0.09 0.00 -1.03 0.00 0.00 54.13 56.34 2o8j s LEU 1013Cb -0.12 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.44 2o8j s LEU 1013CO 0.53 -0.81 0.11 -0.63 0.23 0.00 0.00 176.35 175.78 2o8j s ILE 1014N 0.29 4.97 -0.41 -0.59 1.01 -0.29 -4.48 121.20 121.70 2o8j s ILE 1014Ca 0.64 0.04 -0.06 0.00 0.00 0.00 0.00 60.65 61.26 2o8j s ILE 1014Cb -0.44 -3.29 0.09 0.00 0.01 0.00 0.00 42.46 38.83 2o8j s ILE 1014CO 0.42 0.39 0.22 -0.36 0.00 0.00 0.00 174.94 175.61 2o8j s PHE 1015N 0.86 3.43 0.71 3.97 0.08 -1.26 -0.37 117.98 125.40 2o8j s PHE 1015Ca 0.05 -1.93 -0.11 0.00 0.12 0.00 0.00 56.93 55.06 2o8j s PHE 1015Cb -0.13 -3.04 0.02 0.00 -0.57 0.00 0.00 43.02 39.29 2o8j s PHE 1015CO 0.03 -0.91 1.09 -1.21 -0.10 0.00 0.00 175.22 174.12 2o8j s GLU 1016N 1.30 2.79 0.85 0.44 2.02 0.10 -4.49 118.70 121.70 2o8j s GLU 1016Ca 0.04 0.52 -0.11 0.00 0.02 0.00 0.00 54.97 55.45 2o8j s GLU 1016Cb -0.23 -2.01 0.10 0.00 0.10 0.00 0.00 34.13 32.09 2o8j s GLU 1016CO -0.01 -1.10 1.10 0.00 0.02 0.00 0.00 175.26 175.27 2o8j n ASN 1018N -3.82 -0.84 0.14 0.00 0.23 -1.26 -4.84 115.26 104.87 2o8j n ASN 1018Ca 0.09 -2.38 0.12 0.00 -0.53 0.00 0.00 54.58 51.88 2o8j n ASN 1018Cb 0.53 1.62 0.51 0.00 -2.08 0.00 0.00 39.78 40.37 2o8j n ASN 1018CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2o8j n GLN 1019N -0.42 0.20 0.10 -3.83 0.00 -1.26 -2.12 117.38 110.05 2o8j n GLN 1019Ca 0.02 0.45 0.10 0.00 0.00 0.00 0.00 57.00 57.57 2o8j n GLN 1019Cb 0.41 -1.90 -0.00 0.00 0.00 0.00 0.00 30.24 28.75 2o8j n GLN 1019CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2o8j h ALA 1020N 2.23 0.56 -3.00 2.61 0.00 -1.94 -3.47 119.26 116.24 2o8j h ALA 1020Ca 0.00 -0.13 -0.55 0.00 0.00 0.00 0.00 54.91 54.23 2o8j h ALA 1020Cb 0.33 0.04 0.14 0.00 0.00 0.00 0.00 17.79 18.30 2o8j h ALA 1020CO 0.00 0.15 0.51 0.00 0.00 0.00 0.00 179.25 179.91 2o8j h SER 1022N 0.76 0.00 -4.10 0.00 4.64 -1.74 -3.47 113.55 109.63 2o8j h SER 1022Ca -0.51 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.36 2o8j h SER 1022Cb 1.32 0.00 0.14 0.00 -0.31 0.00 0.00 62.40 63.55 2o8j h SER 1022CO 0.54 0.00 0.27 0.00 -0.87 0.00 0.00 176.83 176.78 2o8j s TRP 1024N -3.24 3.51 0.66 0.00 0.52 -1.26 -4.96 118.94 114.18 2o8j s TRP 1024Ca 0.65 1.18 0.36 0.00 0.02 0.00 0.00 56.10 58.32 2o8j s TRP 1024Cb -0.14 -2.58 1.99 0.00 -1.15 0.00 0.00 33.47 31.58 2o8j s TRP 1024CO 0.54 -0.34 2.13 -0.09 0.02 0.00 0.00 176.95 179.21 2o8j h ARG 1025N 0.65 0.00 -0.51 4.98 9.65 -1.97 -2.02 114.38 125.17 2o8j h ARG 1025Ca -0.46 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.38 2o8j h ARG 1025Cb 1.19 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.75 2o8j h ARG 1025CO 0.62 0.00 0.04 0.27 2.80 0.00 0.00 179.97 183.71 2o8j n ASN 1026N -3.01 5.02 -3.89 -3.80 6.94 -1.26 -4.96 115.26 110.30 2o8j n ASN 1026Ca -0.02 -3.03 -0.30 0.00 -0.02 0.00 0.00 54.58 51.21 2o8j n ASN 1026Cb 0.24 -0.66 0.26 0.00 -2.36 0.00 0.00 39.78 37.27 2o8j n ASN 1026CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2o8j n LYS 1028N -5.13 0.91 -2.06 0.00 4.76 -0.72 -3.99 118.16 111.93 2o8j n LYS 1028Ca 0.10 -0.38 -0.33 0.00 -2.87 0.00 0.00 58.31 54.83 2o8j n LYS 1028Cb 0.58 -1.49 0.03 0.00 -1.84 0.00 0.00 35.03 32.31 2o8j n LYS 1028CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2o8j n ASN 1029N -0.72 6.26 -2.01 4.39 5.15 -1.26 -4.66 115.26 122.41 2o8j n ASN 1029Ca 0.16 -3.78 0.00 0.00 -0.60 0.00 0.00 54.58 50.36 2o8j n ASN 1029Cb 0.29 -0.76 0.03 0.00 -0.53 0.00 0.00 39.78 38.81 2o8j n ASN 1029CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2o8j n ARG 1030N -0.59 0.73 0.20 1.20 1.74 -1.26 -0.85 116.66 117.84 2o8j n ARG 1030Ca 0.49 -2.26 -0.14 0.00 -0.77 0.00 0.00 57.85 55.17 2o8j n ARG 1030Cb 0.52 -0.41 -0.08 0.00 -1.02 0.00 0.00 32.46 31.47 2o8j n ARG 1030CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2o8j h VAL 1031N 5.90 0.60 -0.54 1.55 2.07 -1.89 -2.96 116.25 120.97 2o8j h VAL 1031Ca -0.28 -0.46 -0.12 0.00 0.82 0.00 0.00 66.70 66.67 2o8j h VAL 1031Cb 1.55 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 2o8j h VAL 1031CO 0.04 0.08 -0.12 0.58 0.02 0.00 0.00 177.57 178.17 2o8j h VAL 1032N -0.78 1.27 0.00 2.57 2.07 -1.93 -2.54 116.25 116.91 2o8j h VAL 1032Ca -0.05 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.19 2o8j h VAL 1032Cb 0.52 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2o8j h VAL 1032CO 0.08 0.45 0.00 0.06 0.02 0.00 0.00 177.57 178.19 2o8j h GLN 1033N 0.92 0.00 -0.00 1.57 3.07 -1.96 -1.96 115.11 116.74 2o8j h GLN 1033Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.88 2o8j h GLN 1033Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.25 2o8j h GLN 1033CO 0.05 0.00 -0.22 0.43 0.09 0.00 0.00 178.83 179.18 2o8j n SER 1034N -2.78 0.62 0.00 0.06 7.64 -0.96 -5.03 113.62 113.16 2o8j n SER 1034Ca 0.00 -0.53 0.00 0.00 1.01 0.00 0.00 58.87 59.35 2o8j n SER 1034Cb 0.21 0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 2o8j n SER 1034CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2o8j n GLY 1035N 1.36 -1.78 3.72 0.23 0.00 -0.74 -4.90 105.19 103.07 2o8j n GLY 1035Ca 0.11 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 2o8j n GLY 1035CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2o8j s ILE 1036N 0.00 4.18 0.00 -0.61 1.01 -1.26 -4.92 121.20 119.60 2o8j s ILE 1036Ca 0.00 1.67 0.00 0.00 0.00 0.00 0.00 60.65 62.32 2o8j s ILE 1036Cb 0.00 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.40 2o8j s ILE 1036CO 0.00 0.19 0.00 0.29 0.00 0.00 0.00 174.94 175.42 2o8j n LYS 1037N 3.35 1.27 -2.57 2.79 4.76 -1.26 -4.32 118.16 122.18 2o8j n LYS 1037Ca 0.06 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.19 2o8j n LYS 1037Cb 0.47 -0.99 -0.02 0.00 -1.84 0.00 0.00 35.03 32.66 2o8j n LYS 1037CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2o8j s VAL 1038N -1.95 4.72 -0.28 -0.18 -7.23 -1.26 -5.00 120.40 109.22 2o8j s VAL 1038Ca 0.00 0.78 -0.23 0.00 -1.81 0.00 0.00 61.98 60.71 2o8j s VAL 1038Cb 0.00 -3.76 -0.00 0.00 0.56 0.00 0.00 36.38 33.17 2o8j s VAL 1038CO 0.00 -0.69 0.78 -0.13 -0.31 0.00 0.00 175.10 174.75 2o8j s ARG 1039N -4.19 4.04 0.30 4.82 0.52 -1.26 -4.97 118.95 118.21 2o8j s ARG 1039Ca 0.53 0.68 0.10 0.00 -0.52 0.00 0.00 55.73 56.52 2o8j s ARG 1039Cb -0.10 -3.70 -0.05 0.00 0.52 0.00 0.00 34.95 31.62 2o8j s ARG 1039CO 0.36 -0.60 -0.05 -0.51 0.02 0.00 0.00 175.30 174.52 2o8j s LEU 1040N 2.87 2.96 -0.08 2.53 1.43 -1.26 -1.03 118.68 126.10 2o8j s LEU 1040Ca 0.32 -0.88 -0.05 0.00 -1.03 0.00 0.00 54.13 52.50 2o8j s LEU 1040Cb -0.15 -1.42 0.04 0.00 0.03 0.00 0.00 46.19 44.69 2o8j s LEU 1040CO 0.11 -0.09 0.19 -1.58 0.23 0.00 0.00 176.35 175.21 2o8j s GLN 1041N -3.65 0.17 -0.09 1.70 0.74 -0.43 -4.04 119.66 114.05 2o8j s GLN 1041Ca 0.32 0.39 -0.27 0.00 0.05 0.00 0.00 55.36 55.86 2o8j s GLN 1041Cb -0.04 -0.08 -0.02 0.00 1.10 0.00 0.00 33.01 33.97 2o8j s GLN 1041CO 0.18 -0.12 0.86 -1.17 -0.55 0.00 0.00 175.29 174.49 2o8j s LEU 1042N 0.89 4.28 0.07 3.68 2.96 0.15 -1.58 118.68 129.13 2o8j s LEU 1042Ca -0.07 1.36 -0.06 0.00 -0.22 0.00 0.00 54.13 55.14 2o8j s LEU 1042Cb -0.08 -3.33 -0.02 0.00 0.50 0.00 0.00 46.19 43.27 2o8j s LEU 1042CO -0.05 -0.29 0.10 -0.72 -1.32 0.00 0.00 176.35 174.07 2o8j s TYR 1043N 1.46 0.30 -0.28 5.38 -0.85 -0.29 -1.53 117.35 121.55 2o8j s TYR 1043Ca 0.43 -0.78 -0.23 0.00 -0.52 0.00 0.00 57.07 55.97 2o8j s TYR 1043Cb -0.18 -0.19 -0.00 0.00 0.38 0.00 0.00 41.96 41.96 2o8j s TYR 1043CO 0.19 -0.48 0.77 0.50 -1.52 0.00 0.00 175.55 175.01 2o8j s ARG 1044N -3.89 4.06 0.77 -3.49 6.06 -1.14 -0.37 118.95 120.95 2o8j s ARG 1044Ca 0.06 0.69 -0.12 0.00 -2.50 0.00 0.00 55.73 53.86 2o8j s ARG 1044Cb 0.06 -3.69 0.05 0.00 0.06 0.00 0.00 34.95 31.44 2o8j s ARG 1044CO -0.11 -0.58 1.14 0.95 -2.50 0.00 0.00 175.30 174.20 2o8j s THR 1045N 2.83 2.73 0.13 4.11 -4.23 0.40 -4.73 115.64 116.88 2o8j s THR 1045Ca 0.32 0.24 -0.11 0.00 -1.18 0.00 0.00 61.69 60.96 2o8j s THR 1045Cb -0.15 -3.21 -0.10 0.00 1.34 0.00 0.00 72.50 70.38 2o8j s THR 1045CO 0.10 -0.31 1.39 0.00 -0.54 0.00 0.00 174.62 175.27 2o8j h ALA 1046N -0.90 0.46 0.00 3.99 0.00 -1.97 -3.40 119.26 117.43 2o8j h ALA 1046Ca -0.46 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 53.92 2o8j h ALA 1046Cb 1.29 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2o8j h ALA 1046CO 0.64 0.68 0.00 1.63 0.00 0.00 0.00 179.25 182.21 2o8j n LYS 1047N -3.98 -0.17 -0.02 0.00 5.02 -1.26 -4.85 118.16 112.89 2o8j n LYS 1047Ca -0.05 -0.18 0.01 0.00 -2.02 0.00 0.00 58.31 56.07 2o8j n LYS 1047Cb 0.65 -0.66 0.01 0.00 -0.02 0.00 0.00 35.03 35.01 2o8j n LYS 1047CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2o8j n MET 1048N -0.03 2.13 0.00 1.97 2.81 -1.26 -4.96 117.12 117.78 2o8j n MET 1048Ca 0.00 -1.37 0.00 0.00 -1.81 0.00 0.00 57.70 54.52 2o8j n MET 1048Cb 0.14 -0.92 0.00 0.00 -0.71 0.00 0.00 33.22 31.73 2o8j n MET 1048CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2o8j n GLY 1049N -0.46 0.37 3.82 3.03 0.00 -1.26 -4.80 105.19 105.88 2o8j n GLY 1049Ca 0.01 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.71 2o8j n GLY 1049CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2o8j s TRP 1050N 0.00 3.39 0.27 1.61 0.52 -1.26 -0.45 118.94 123.02 2o8j s TRP 1050Ca 0.00 1.60 -0.00 0.00 0.02 0.00 0.00 56.10 57.72 2o8j s TRP 1050Cb 0.00 -2.83 -0.02 0.00 -1.15 0.00 0.00 33.47 29.47 2o8j s TRP 1050CO 0.00 -0.03 0.28 0.20 0.02 0.00 0.00 176.95 177.43 2o8j s GLY 1051N -2.08 1.61 -0.07 0.98 0.00 0.50 -4.77 107.32 103.49 2o8j s GLY 1051Ca 0.59 -1.68 0.05 0.00 0.00 0.00 0.00 44.72 43.68 2o8j s GLY 1051CO 0.15 -1.25 -0.23 0.14 0.00 0.00 0.00 173.10 171.92 2o8j s VAL 1052N -3.71 1.92 0.14 1.40 1.01 -1.24 -1.13 120.40 118.78 2o8j s VAL 1052Ca 0.36 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.41 2o8j s VAL 1052Cb 0.03 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2o8j s VAL 1052CO 0.18 0.53 -0.09 0.00 0.00 0.00 0.00 175.10 175.72 2o8j s ARG 1053N 0.13 1.04 0.16 2.72 1.70 -0.61 -0.20 118.95 123.88 2o8j s ARG 1053Ca -0.11 -1.44 -0.29 0.00 -0.47 0.00 0.00 55.73 53.42 2o8j s ARG 1053Cb -0.15 -0.55 -0.07 0.00 -0.57 0.00 0.00 34.95 33.60 2o8j s ARG 1053CO 0.06 0.05 0.90 0.00 -1.08 0.00 0.00 175.30 175.23 2o8j s ALA 1054N -3.38 3.33 -1.92 7.88 0.00 -0.73 -1.32 121.76 125.61 2o8j s ALA 1054Ca 0.17 0.52 0.22 0.00 0.00 0.00 0.00 51.96 52.87 2o8j s ALA 1054Cb 0.03 -3.17 0.63 0.00 0.00 0.00 0.00 23.12 20.62 2o8j s ALA 1054CO 0.00 0.13 1.53 1.28 0.00 0.00 0.00 175.76 178.69 2o8j n LEU 1055N 2.10 3.92 -3.80 0.00 4.77 -0.20 0.67 117.00 124.46 2o8j n LEU 1055Ca -0.01 -2.00 -0.10 0.00 -0.03 0.00 0.00 56.01 53.88 2o8j n LEU 1055Cb 0.48 -0.48 -0.05 0.00 -2.33 0.00 0.00 43.42 41.05 2o8j n LEU 1055CO 0.49 0.98 0.19 0.00 -1.33 0.00 0.00 177.39 177.72 2o8j s GLN 1056N -1.00 1.31 0.29 3.23 -2.07 -1.26 -4.83 119.66 115.33 2o8j s GLN 1056Ca 0.48 -0.96 -0.29 0.00 -1.82 0.00 0.00 55.36 52.77 2o8j s GLN 1056Cb 0.25 0.48 -0.10 0.00 -1.09 0.00 0.00 33.01 32.55 2o8j s GLN 1056CO 0.33 -0.54 1.22 0.99 -1.32 0.00 0.00 175.29 175.97 2o8j s THR 1057N -3.90 3.11 -0.21 3.63 2.01 -1.26 -3.40 115.64 115.62 2o8j s THR 1057Ca 0.11 1.09 -0.01 0.00 0.31 0.00 0.00 61.69 63.19 2o8j s THR 1057Cb 0.00 -3.70 0.06 0.00 0.01 0.00 0.00 72.50 68.88 2o8j s THR 1057CO -0.02 0.25 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.52 2o8j s ILE 1058N -0.99 0.99 0.70 1.82 1.01 0.01 -4.95 121.20 119.78 2o8j s ILE 1058Ca 0.48 -0.84 -0.16 0.00 0.00 0.00 0.00 60.65 60.12 2o8j s ILE 1058Cb -0.36 -1.37 0.02 0.00 0.01 0.00 0.00 42.46 40.76 2o8j s ILE 1058CO 0.46 -0.14 1.25 -2.84 0.00 0.00 0.00 174.94 173.67 2o8j s PRO 1059N 1.65 2.29 0.26 2.79 0.02 -1.26 -0.27 135.00 140.47 2o8j s PRO 1059Ca -0.03 1.92 -0.29 0.00 0.02 0.00 0.00 61.00 62.63 2o8j s PRO 1059Cb -0.18 -1.83 -0.15 0.00 0.02 0.00 0.00 34.50 32.36 2o8j s PRO 1059CO -0.07 -1.76 0.92 0.94 -0.33 0.00 0.00 177.00 176.70 2o8j n GLN 1060N -2.36 1.05 -0.71 5.54 7.27 -1.24 -2.98 117.38 123.95 2o8j n GLN 1060Ca 0.15 0.37 0.00 0.00 0.07 0.00 0.00 57.00 57.59 2o8j n GLN 1060Cb 0.49 -1.68 0.00 0.00 2.41 0.00 0.00 30.24 31.47 2o8j n GLN 1060CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2o8j n GLY 1061N 1.45 0.82 3.73 1.69 0.00 -0.45 -4.73 105.19 107.70 2o8j n GLY 1061Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2o8j n GLY 1061CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2o8j s THR 1062N -3.19 4.38 0.16 2.61 2.01 -1.16 -0.85 115.64 119.60 2o8j s THR 1062Ca 0.00 1.92 -0.31 0.00 0.31 0.00 0.00 61.69 63.61 2o8j s THR 1062Cb 0.00 -4.22 -0.09 0.00 0.01 0.00 0.00 72.50 68.20 2o8j s THR 1062CO 0.00 0.26 1.41 0.12 -0.69 0.00 0.00 174.62 175.72 2o8j s PHE 1063N 0.21 3.19 -0.08 4.92 5.36 -1.26 -0.89 117.98 129.42 2o8j s PHE 1063Ca 0.49 0.97 -0.10 0.00 -0.96 0.00 0.00 56.93 57.33 2o8j s PHE 1063Cb -0.25 -3.72 -0.03 0.00 -0.34 0.00 0.00 43.02 38.68 2o8j s PHE 1063CO 0.31 -2.48 -0.19 -0.89 -1.46 0.00 0.00 175.22 170.50 2o8j n ILE 1064N 3.45 1.04 -3.64 3.12 2.08 0.59 -4.69 119.36 121.31 2o8j n ILE 1064Ca 0.10 0.25 -0.05 0.00 0.56 0.00 0.00 62.75 63.61 2o8j n ILE 1064Cb 0.41 -1.95 -0.02 0.00 -0.75 0.00 0.00 39.64 37.34 2o8j n ILE 1064CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2o8j s GLU 1066N -3.13 3.59 -0.50 0.00 2.12 -1.26 -0.88 118.70 118.63 2o8j s GLU 1066Ca 0.09 -0.11 -0.28 0.00 0.36 0.00 0.00 54.97 55.04 2o8j s GLU 1066Cb -0.01 -2.99 0.03 0.00 0.26 0.00 0.00 34.13 31.42 2o8j s GLU 1066CO -0.03 0.57 1.09 -0.47 -0.54 0.00 0.00 175.26 175.89 2o8j s TYR 1067N -1.46 2.78 -0.01 5.30 5.04 0.14 -4.50 117.35 124.64 2o8j s TYR 1067Ca 0.34 0.53 0.07 0.00 -2.44 0.00 0.00 57.07 55.56 2o8j s TYR 1067Cb -0.13 -4.34 -0.02 0.00 0.35 0.00 0.00 41.96 37.81 2o8j s TYR 1067CO 0.21 -1.32 -0.22 0.08 -1.34 0.00 0.00 175.55 172.96 2o8j s VAL 1068N 4.40 2.45 0.00 3.14 1.01 -1.26 -4.44 120.40 125.70 2o8j s VAL 1068Ca 0.43 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2o8j s VAL 1068Cb -0.08 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.38 2o8j s VAL 1068CO 0.28 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.52 2o8j n GLY 1069N 2.22 1.09 3.64 4.51 0.00 -1.26 -2.90 105.19 112.49 2o8j n GLY 1069Ca -0.16 -0.40 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 2o8j n GLY 1069CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o8j s GLU 1070N 1.62 4.11 -0.08 1.61 2.12 -0.18 -1.73 118.70 126.17 2o8j s GLU 1070Ca 0.00 0.19 -0.30 0.00 0.36 0.00 0.00 54.97 55.22 2o8j s GLU 1070Cb 0.00 -3.59 -0.03 0.00 0.26 0.00 0.00 34.13 30.77 2o8j s GLU 1070CO 0.00 -0.17 1.18 -0.51 -0.54 0.00 0.00 175.26 175.22 2o8j s LEU 1071N 1.72 4.26 0.07 2.70 1.43 -0.40 -0.55 118.68 127.90 2o8j s LEU 1071Ca 0.19 1.75 0.01 0.00 -1.03 0.00 0.00 54.13 55.05 2o8j s LEU 1071Cb -0.15 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 2o8j s LEU 1071CO 0.09 -0.59 -0.05 0.27 0.23 0.00 0.00 176.35 176.29 2o8j s ILE 1072N 2.38 0.47 0.66 -0.59 -4.36 -0.39 -4.54 121.20 114.83 2o8j s ILE 1072Ca 0.54 -1.70 -0.14 0.00 -0.26 0.00 0.00 60.65 59.10 2o8j s ILE 1072Cb -0.23 -1.37 -0.00 0.00 1.25 0.00 0.00 42.46 42.11 2o8j s ILE 1072CO 0.20 -0.82 1.08 -0.94 0.24 0.00 0.00 174.94 174.70 2o8j s SER 1073N -2.68 5.34 0.29 4.36 1.04 -1.26 -0.54 113.70 120.25 2o8j s SER 1073Ca 0.05 1.82 0.03 0.00 0.48 0.00 0.00 55.95 58.34 2o8j s SER 1073Cb 0.03 -2.53 0.69 0.00 0.10 0.00 0.00 66.02 64.31 2o8j s SER 1073CO -0.06 -1.47 1.73 -2.24 0.98 0.00 0.00 173.24 172.18 2o8j h ASP 1074N -0.14 0.48 -0.68 7.02 2.03 -1.59 -1.24 116.42 122.31 2o8j h ASP 1074Ca -0.46 0.13 -0.03 0.00 -0.73 0.00 0.00 57.03 55.94 2o8j h ASP 1074Cb 1.23 0.06 -0.03 0.00 -0.83 0.00 0.00 39.33 39.76 2o8j h ASP 1074CO 0.55 0.11 0.30 0.00 -1.03 0.00 0.00 179.24 179.17 2o8j h ALA 1075N 1.66 0.88 -0.80 4.15 0.00 -1.92 -2.44 119.26 120.78 2o8j h ALA 1075Ca 0.54 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 2o8j h ALA 1075Cb 0.94 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2o8j h ALA 1075CO -0.45 0.47 0.36 1.49 0.00 0.00 0.00 179.25 181.12 2o8j h GLU 1076N 0.95 1.17 -0.74 0.00 4.57 -1.77 -2.49 114.58 116.26 2o8j h GLU 1076Ca 0.23 -0.19 0.07 0.00 -1.18 0.00 0.00 59.36 58.29 2o8j h GLU 1076Cb 0.17 -0.20 -0.05 0.00 -0.16 0.00 0.00 28.75 28.51 2o8j h GLU 1076CO -0.02 0.92 0.49 0.00 -1.18 0.00 0.00 179.01 179.21 2o8j h ALA 1077N 1.19 1.70 -0.32 2.92 0.00 -0.95 -2.06 119.26 121.74 2o8j h ALA 1077Ca 0.27 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2o8j h ALA 1077Cb 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2o8j h ALA 1077CO -0.03 0.17 0.15 -0.44 0.00 0.00 0.00 179.25 179.10 2o8j h ASP 1078N 0.76 0.43 0.70 0.00 5.19 -1.02 -3.20 116.42 119.29 2o8j h ASP 1078Ca 0.32 -0.14 -0.02 0.00 -0.62 0.00 0.00 57.03 56.57 2o8j h ASP 1078Cb 0.29 -0.11 -0.00 0.00 0.18 0.00 0.00 39.33 39.68 2o8j h ASP 1078CO -0.11 0.45 -0.11 -0.37 -3.12 0.00 0.00 179.24 175.98 2o8j h VAL 1079N 0.38 0.35 -3.61 -1.35 -1.51 -1.00 -3.44 116.25 106.06 2o8j h VAL 1079Ca 0.11 -0.67 -0.51 0.00 -1.23 0.00 0.00 66.70 64.40 2o8j h VAL 1079Cb 0.14 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 30.79 2o8j h VAL 1079CO -0.01 0.11 0.39 -0.13 -1.23 0.00 0.00 177.57 176.70 2o8j s ARG 1080N -3.86 4.70 0.10 5.19 0.52 -1.00 -4.96 118.95 119.64 2o8j s ARG 1080Ca -0.01 1.55 -0.18 0.00 -0.52 0.00 0.00 55.73 56.57 2o8j s ARG 1080Cb 0.11 -3.32 -0.06 0.00 0.52 0.00 0.00 34.95 32.20 2o8j s ARG 1080CO 0.57 0.24 1.58 0.93 0.02 0.00 0.00 175.30 178.65 2o8j h GLU 1081N 5.08 0.49 -5.17 3.54 5.08 -1.89 -3.42 114.58 118.30 2o8j h GLU 1081Ca -0.44 -0.13 -0.62 0.00 -1.00 0.00 0.00 59.36 57.17 2o8j h GLU 1081Cb 1.21 -0.06 -0.14 0.00 0.50 0.00 0.00 28.75 30.26 2o8j h GLU 1081CO 0.71 0.58 -0.27 0.34 -1.00 0.00 0.00 179.01 179.37 2o8j s ASP 1082N -5.89 6.25 -0.08 1.42 3.68 -1.26 -4.93 116.67 115.86 2o8j s ASP 1082Ca -0.13 0.29 0.12 0.00 2.13 0.00 0.00 52.55 54.96 2o8j s ASP 1082Cb 0.08 -2.20 0.34 0.00 -1.45 0.00 0.00 42.92 39.69 2o8j s ASP 1082CO 0.75 -0.15 1.26 -0.90 0.13 0.00 0.00 175.17 176.26 2o8j n ASP 1083N 5.15 3.05 0.09 -0.34 5.68 -1.26 -4.72 116.55 124.19 2o8j n ASP 1083Ca -0.09 -2.52 0.12 0.00 -0.50 0.00 0.00 54.79 51.80 2o8j n ASP 1083Cb 0.51 -0.34 0.45 0.00 -1.14 0.00 0.00 41.12 40.61 2o8j n ASP 1083CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2o8j n SER 1084N -0.28 0.53 -1.09 -1.12 7.64 -1.26 -3.46 113.62 114.57 2o8j n SER 1084Ca 0.14 0.59 0.04 0.00 1.01 0.00 0.00 58.87 60.65 2o8j n SER 1084Cb 0.60 -0.72 0.12 0.00 -1.01 0.00 0.00 64.21 63.20 2o8j n SER 1084CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2o8j n TYR 1085N -2.04 0.18 -3.82 1.43 4.01 -1.26 -5.06 117.16 110.60 2o8j n TYR 1085Ca 0.04 -1.17 -0.35 0.00 -0.16 0.00 0.00 57.90 56.25 2o8j n TYR 1085Cb 0.30 -0.22 -0.08 0.00 -0.31 0.00 0.00 39.34 39.03 2o8j n TYR 1085CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2o8j s LEU 1086N -2.03 4.17 -0.21 7.72 1.43 -1.23 -0.32 118.68 128.21 2o8j s LEU 1086Ca 0.37 0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.74 2o8j s LEU 1086Cb 0.38 -2.06 0.04 0.00 0.03 0.00 0.00 46.19 44.58 2o8j s LEU 1086CO -0.10 0.24 -0.16 0.12 0.23 0.00 0.00 176.35 176.67 2o8j s PHE 1087N 0.01 2.94 0.03 0.29 5.36 0.48 -4.98 117.98 122.10 2o8j s PHE 1087Ca 0.09 -1.89 -0.30 0.00 -0.96 0.00 0.00 56.93 53.86 2o8j s PHE 1087Cb -0.11 -1.91 -0.06 0.00 -0.34 0.00 0.00 43.02 40.60 2o8j s PHE 1087CO -0.00 -0.83 1.43 -0.51 -1.46 0.00 0.00 175.22 173.85 2o8j s ASP 1088N 1.23 6.82 -1.13 6.13 1.01 -1.26 -0.36 116.67 129.10 2o8j s ASP 1088Ca -0.00 2.20 -0.18 0.00 0.71 0.00 0.00 52.55 55.27 2o8j s ASP 1088Cb -0.16 -2.57 0.11 0.00 1.01 0.00 0.00 42.92 41.31 2o8j s ASP 1088CO -0.10 -0.73 1.46 -0.76 0.21 0.00 0.00 175.17 175.25 2o8j s LEU 1089N 2.19 4.35 -0.11 1.23 1.43 -0.54 -4.89 118.68 122.33 2o8j s LEU 1089Ca 0.65 -2.28 -0.03 0.00 -1.03 0.00 0.00 54.13 51.44 2o8j s LEU 1089Cb -0.33 -2.49 -0.12 0.00 0.03 0.00 0.00 46.19 43.27 2o8j s LEU 1089CO 0.28 -1.11 2.06 0.47 0.23 0.00 0.00 176.35 178.28 2o8j n ASP 1090N 7.37 2.88 -4.65 2.29 9.92 -1.26 -4.42 116.55 128.68 2o8j n ASP 1090Ca 0.37 -2.03 -0.64 0.00 -0.53 0.00 0.00 54.79 51.96 2o8j n ASP 1090Cb 0.47 -0.76 -0.09 0.00 -0.64 0.00 0.00 41.12 40.10 2o8j n ASP 1090CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2o8j n ASN 1091N 2.96 0.81 0.17 -2.24 5.03 -1.26 -4.85 115.26 115.88 2o8j n ASN 1091Ca 0.24 1.17 0.05 0.00 0.87 0.00 0.00 54.58 56.91 2o8j n ASN 1091Cb 0.42 -0.92 0.23 0.00 -1.02 0.00 0.00 39.78 38.49 2o8j n ASN 1091CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 2o8j h LYS 1092N 4.33 0.00 -4.57 3.52 1.57 -1.97 -3.47 116.57 115.98 2o8j h LYS 1092Ca -0.47 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 57.97 2o8j h LYS 1092Cb 1.39 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.58 2o8j h LYS 1092CO 0.85 0.41 -0.43 0.16 -0.57 0.00 0.00 179.45 179.87 2o8j s ASP 1093N -6.41 1.01 0.44 0.86 -4.77 -1.26 -5.13 116.67 101.40 2o8j s ASP 1093Ca 0.02 -1.55 0.00 0.00 -3.30 0.00 0.00 52.55 47.71 2o8j s ASP 1093Cb 0.09 0.54 0.00 0.00 -1.09 0.00 0.00 42.92 42.46 2o8j s ASP 1093CO 0.70 -1.07 0.00 0.61 0.70 0.00 0.00 175.17 176.12 2o8j n GLY 1094N -0.51 -1.31 3.74 2.12 0.00 -1.26 -4.82 105.19 103.15 2o8j n GLY 1094Ca 0.04 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 2o8j n GLY 1094CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o8j s GLU 1095N 0.00 4.20 -0.24 1.61 2.02 -1.26 -5.00 118.70 120.02 2o8j s GLU 1095Ca 0.00 2.43 -0.07 0.00 0.02 0.00 0.00 54.97 57.35 2o8j s GLU 1095Cb 0.00 -3.09 -0.03 0.00 0.10 0.00 0.00 34.13 31.11 2o8j s GLU 1095CO 0.00 -0.57 0.07 0.08 0.02 0.00 0.00 175.26 174.86 2o8j s VAL 1096N 0.43 4.38 0.34 2.63 1.01 -1.26 -4.83 120.40 123.10 2o8j s VAL 1096Ca 0.65 -0.15 0.09 0.00 0.00 0.00 0.00 61.98 62.57 2o8j s VAL 1096Cb -0.45 -3.04 -0.06 0.00 0.00 0.00 0.00 36.38 32.83 2o8j s VAL 1096CO 0.40 0.35 -0.02 -0.31 0.00 0.00 0.00 175.10 175.52 2o8j s TYR 1097N 1.46 2.51 0.09 5.22 2.02 -1.26 -1.52 117.35 125.86 2o8j s TYR 1097Ca 0.06 -0.44 0.01 0.00 -0.37 0.00 0.00 57.07 56.33 2o8j s TYR 1097Cb -0.15 -1.44 -0.04 0.00 -0.40 0.00 0.00 41.96 39.93 2o8j s TYR 1097CO 0.04 0.52 -0.06 0.00 -1.57 0.00 0.00 175.55 174.47 2o8j s ILE 1099N -3.58 4.09 -0.34 0.00 1.01 0.51 -1.27 121.20 121.62 2o8j s ILE 1099Ca 0.10 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 60.02 2o8j s ILE 1099Cb 0.05 -3.09 -0.01 0.00 0.01 0.00 0.00 42.46 39.42 2o8j s ILE 1099CO -0.05 0.10 0.23 -0.62 0.00 0.00 0.00 174.94 174.60 2o8j s ASP 1100N 1.53 5.99 -0.03 3.58 2.15 0.28 -0.39 116.67 129.79 2o8j s ASP 1100Ca 0.03 -0.47 0.16 0.00 0.43 0.00 0.00 52.55 52.71 2o8j s ASP 1100Cb -0.17 -2.12 0.52 0.00 -0.30 0.00 0.00 42.92 40.85 2o8j s ASP 1100CO 0.03 -0.24 1.42 0.00 -0.17 0.00 0.00 175.17 176.21 2o8j n ALA 1101N 5.09 2.57 0.04 3.66 0.00 0.56 -1.01 120.51 131.43 2o8j n ALA 1101Ca -0.13 -1.06 -0.13 0.00 0.00 0.00 0.00 53.44 52.13 2o8j n ALA 1101Cb 0.49 -0.97 -0.08 0.00 0.00 0.00 0.00 19.45 18.89 2o8j n ALA 1101CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2o8j h ARG 1102N 3.27 -0.05 0.06 0.00 9.65 -1.93 -3.36 114.38 122.01 2o8j h ARG 1102Ca 0.00 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.51 2o8j h ARG 1102Cb 0.88 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.43 2o8j h ARG 1102CO 0.05 0.10 -2.19 0.66 2.80 0.00 0.00 179.97 181.39 2o8j n TYR 1103N -5.05 0.65 -4.31 2.20 4.01 -1.26 -4.68 117.16 108.72 2o8j n TYR 1103Ca -0.08 0.15 -0.22 0.00 -0.16 0.00 0.00 57.90 57.59 2o8j n TYR 1103Cb 0.11 -1.09 -0.16 0.00 -0.31 0.00 0.00 39.34 37.88 2o8j n TYR 1103CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2o8j s TYR 1104N -2.54 1.07 0.04 -0.72 2.02 -1.26 -0.31 117.35 115.66 2o8j s TYR 1104Ca -0.25 -0.37 -0.28 0.00 -0.37 0.00 0.00 57.07 55.80 2o8j s TYR 1104Cb 0.08 -0.86 0.10 0.00 -0.40 0.00 0.00 41.96 40.87 2o8j s TYR 1104CO 0.71 -0.25 1.15 0.20 -1.57 0.00 0.00 175.55 175.79 2o8j s GLY 1105N 0.88 -0.34 0.00 0.71 0.00 -0.70 -3.47 107.32 104.40 2o8j s GLY 1105Ca -0.11 0.51 0.00 0.00 0.00 0.00 0.00 44.72 45.12 2o8j s GLY 1105CO 0.01 0.10 0.00 1.16 0.00 0.00 0.00 173.10 174.37 2o8j n ASN 1106N -0.46 1.02 0.11 1.64 6.94 -1.14 -1.19 115.26 122.17 2o8j n ASN 1106Ca -0.07 -0.51 0.18 0.00 -0.02 0.00 0.00 54.58 54.16 2o8j n ASN 1106Cb 0.62 0.00 0.75 0.00 -2.36 0.00 0.00 39.78 38.78 2o8j n ASN 1106CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 2o8j h ILE 1107N 0.26 0.59 0.00 1.53 6.09 -1.89 -2.31 117.51 121.78 2o8j h ILE 1107Ca 0.00 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2o8j h ILE 1107Cb 0.00 0.77 -0.00 0.00 0.47 0.00 0.00 36.82 38.06 2o8j h ILE 1107CO 0.00 0.00 -0.02 0.28 -3.07 0.00 0.00 178.15 175.34 2o8j h SER 1108N 0.00 0.00 0.45 2.19 0.02 -1.92 -2.18 113.55 112.11 2o8j h SER 1108Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2o8j h SER 1108Cb 0.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2o8j h SER 1108CO -0.00 0.02 0.00 0.08 -1.14 0.00 0.00 176.83 175.79 2o8j h ARG 1109N 0.00 0.00 -0.12 3.45 0.11 -1.73 -2.36 114.38 113.74 2o8j h ARG 1109Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2o8j h ARG 1109Cb 0.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.13 2o8j h ARG 1109CO 0.00 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.26 2o8j n PHE 1110N -2.49 0.13 -2.69 4.08 3.72 -0.82 -4.93 117.46 114.46 2o8j n PHE 1110Ca 0.00 -0.06 -0.43 0.00 -0.05 0.00 0.00 57.45 56.91 2o8j n PHE 1110Cb 0.16 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.68 2o8j n PHE 1110CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2o8j s ILE 1111N -1.87 4.74 0.71 4.37 1.01 -0.89 -3.71 121.20 125.55 2o8j s ILE 1111Ca 0.33 2.02 -0.11 0.00 0.00 0.00 0.00 60.65 62.88 2o8j s ILE 1111Cb 0.21 -4.30 0.01 0.00 0.01 0.00 0.00 42.46 38.39 2o8j s ILE 1111CO 0.31 -0.08 1.08 0.20 0.00 0.00 0.00 174.94 176.45 2o8j s ASN 1112N 1.15 5.39 0.11 3.58 0.02 -1.26 -4.88 114.94 119.05 2o8j s ASN 1112Ca 0.46 1.27 -0.30 0.00 -1.02 0.00 0.00 52.86 53.27 2o8j s ASN 1112Cb -0.17 -2.11 -0.06 0.00 0.02 0.00 0.00 41.25 38.93 2o8j s ASN 1112CO 0.12 -1.39 1.10 -2.28 0.02 0.00 0.00 177.10 174.67 2o8j s HIS 1113N -3.25 3.58 -0.05 2.20 5.65 -1.26 -2.92 115.29 119.23 2o8j s HIS 1113Ca 0.58 1.54 0.05 0.00 0.25 0.00 0.00 55.06 57.48 2o8j s HIS 1113Cb -0.12 -3.27 -0.01 0.00 -1.18 0.00 0.00 32.58 28.00 2o8j s HIS 1113CO 0.53 -0.64 -0.21 -0.51 -0.65 0.00 0.00 174.74 173.26 2o8j s LEU 1114N 0.31 1.98 0.40 8.88 1.43 -0.88 -4.74 118.68 126.05 2o8j s LEU 1114Ca 0.52 -0.42 0.22 0.00 -1.03 0.00 0.00 54.13 53.41 2o8j s LEU 1114Cb -0.28 -1.15 0.62 0.00 0.03 0.00 0.00 46.19 45.41 2o8j s LEU 1114CO 0.32 0.19 1.69 0.00 0.23 0.00 0.00 176.35 178.78 2o8j n ASP 1116N -3.30 4.22 -4.77 0.00 2.03 -1.26 -4.93 116.55 108.53 2o8j n ASP 1116Ca 0.01 -3.25 -0.33 0.00 0.52 0.00 0.00 54.79 51.74 2o8j n ASP 1116Cb 0.53 -0.95 0.04 0.00 -0.72 0.00 0.00 41.12 40.01 2o8j n ASP 1116CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2o8j s PRO 1117N -1.82 2.89 0.00 -0.67 0.04 -1.21 -4.99 135.00 129.24 2o8j s PRO 1117Ca 0.30 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.72 2o8j s PRO 1117Cb -0.00 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2o8j s PRO 1117CO -0.08 -1.18 0.70 0.27 0.04 0.00 0.00 177.00 176.75 2o8j n ASN 1118N -2.32 1.37 -4.12 6.66 0.23 -0.64 -4.91 115.26 111.53 2o8j n ASN 1118Ca 0.10 -1.43 -0.13 0.00 -0.53 0.00 0.00 54.58 52.59 2o8j n ASN 1118Cb 0.52 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.11 2o8j n ASN 1118CO 0.00 0.00 0.00 0.27 -0.93 0.00 0.00 177.26 176.60 2o8j s ILE 1119N -0.43 0.71 0.03 1.53 -4.36 -1.07 -0.63 121.20 116.99 2o8j s ILE 1119Ca 0.00 -1.45 0.05 0.00 -0.26 0.00 0.00 60.65 58.99 2o8j s ILE 1119Cb 0.00 -1.10 -0.02 0.00 1.25 0.00 0.00 42.46 42.60 2o8j s ILE 1119CO 0.00 -0.54 -0.13 0.27 0.24 0.00 0.00 174.94 174.78 2o8j s ILE 1120N -2.20 1.06 0.15 8.37 -4.36 0.02 -4.43 121.20 119.81 2o8j s ILE 1120Ca -0.00 -0.90 -0.26 0.00 -0.26 0.00 0.00 60.65 59.23 2o8j s ILE 1120Cb -0.04 -0.95 -0.08 0.00 1.25 0.00 0.00 42.46 42.64 2o8j s ILE 1120CO -0.01 0.05 0.80 -2.16 0.24 0.00 0.00 174.94 173.86 2o8j s PRO 1121N -0.96 4.59 -0.05 0.37 0.04 -1.26 -1.65 135.00 136.08 2o8j s PRO 1121Ca 0.02 1.19 0.02 0.00 0.04 0.00 0.00 61.00 62.27 2o8j s PRO 1121Cb -0.07 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 31.19 2o8j s PRO 1121CO 0.01 0.50 -0.09 0.08 0.04 0.00 0.00 177.00 177.54 2o8j s VAL 1122N -0.90 0.85 0.02 -0.36 1.01 0.94 -4.88 120.40 117.08 2o8j s VAL 1122Ca 0.37 -0.34 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 2o8j s VAL 1122Cb -0.23 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 2o8j s VAL 1122CO 0.26 0.28 1.07 -0.13 0.00 0.00 0.00 175.10 176.58 2o8j s ARG 1123N 0.56 4.50 0.01 2.72 0.52 -1.26 -0.51 118.95 125.49 2o8j s ARG 1123Ca -0.10 1.55 0.01 0.00 -0.52 0.00 0.00 55.73 56.68 2o8j s ARG 1123Cb -0.13 -3.42 -0.01 0.00 0.52 0.00 0.00 34.95 31.91 2o8j s ARG 1123CO 0.02 -0.15 -0.05 0.08 0.02 0.00 0.00 175.30 175.22 2o8j s VAL 1124N 1.09 0.37 -0.07 3.52 1.01 0.03 -1.14 120.40 125.22 2o8j s VAL 1124Ca 0.54 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.18 2o8j s VAL 1124Cb -0.24 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.77 2o8j s VAL 1124CO 0.28 -0.01 -0.17 -0.36 0.00 0.00 0.00 175.10 174.83 2o8j s PHE 1125N -0.39 2.65 0.00 5.22 0.08 0.50 -1.29 117.98 124.74 2o8j s PHE 1125Ca -0.01 -0.42 0.00 0.00 0.12 0.00 0.00 56.93 56.62 2o8j s PHE 1125Cb -0.04 -1.67 0.00 0.00 -0.57 0.00 0.00 43.02 40.75 2o8j s PHE 1125CO -0.00 -0.01 0.00 -1.33 -0.10 0.00 0.00 175.22 173.78 2o8j n MET 1126N 2.76 0.00 0.06 0.44 2.81 -1.26 -0.72 117.12 121.21 2o8j n MET 1126Ca -0.17 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 55.85 2o8j n MET 1126Cb 0.52 0.00 0.42 0.00 -0.71 0.00 0.00 33.22 33.45 2o8j n MET 1126CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2o8j n LEU 1127N -0.04 0.54 -4.12 4.03 4.77 -1.26 -4.63 117.00 116.30 2o8j n LEU 1127Ca 0.00 0.46 -0.10 0.00 -0.03 0.00 0.00 56.01 56.34 2o8j n LEU 1127Cb 0.00 -0.35 -0.09 0.00 -2.33 0.00 0.00 43.42 40.65 2o8j n LEU 1127CO 0.00 -0.09 -0.21 -1.38 -1.33 0.00 0.00 177.39 174.38 2o8j s HIS 1128N -3.07 0.82 -0.15 -1.77 -3.43 -1.26 -4.92 115.29 101.51 2o8j s HIS 1128Ca 0.11 -1.16 0.19 0.00 -0.80 0.00 0.00 55.06 53.40 2o8j s HIS 1128Cb 0.15 -0.39 0.45 0.00 -1.43 0.00 0.00 32.58 31.35 2o8j s HIS 1128CO 0.60 -0.60 1.17 1.04 -2.00 0.00 0.00 174.74 174.96 2o8j n GLN 1129N -0.16 1.28 -2.16 -0.38 6.02 -1.26 -4.80 117.38 115.91 2o8j n GLN 1129Ca -0.04 -2.96 -0.42 0.00 -0.01 0.00 0.00 57.00 53.57 2o8j n GLN 1129Cb 0.64 -1.08 -0.03 0.00 1.02 0.00 0.00 30.24 30.80 2o8j n GLN 1129CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2o8j s ASP 1130N -2.92 6.02 0.53 1.08 -1.08 -1.26 -4.90 116.67 114.14 2o8j s ASP 1130Ca 0.36 0.95 0.35 0.00 -0.52 0.00 0.00 52.55 53.70 2o8j s ASP 1130Cb 0.37 -2.53 1.69 0.00 -1.46 0.00 0.00 42.92 40.99 2o8j s ASP 1130CO -0.09 -1.67 2.06 -0.07 0.52 0.00 0.00 175.17 175.92 2o8j h LEU 1131N 13.34 0.00 -1.81 -1.34 3.38 -1.98 -0.39 115.31 126.51 2o8j h LEU 1131Ca -0.30 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 2o8j h LEU 1131Cb 1.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 2o8j h LEU 1131CO 1.08 0.00 -0.00 0.03 0.09 0.00 0.00 178.44 179.64 2o8j h ARG 1132N 0.00 0.00 -2.18 1.13 3.08 -1.90 -3.37 114.38 111.14 2o8j h ARG 1132Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 2o8j h ARG 1132Cb 0.25 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 29.89 2o8j h ARG 1132CO 0.00 0.00 -0.83 1.19 -1.07 0.00 0.00 179.97 179.27 2o8j n PHE 1133N -3.09 2.68 -1.94 3.04 3.72 -0.16 -4.54 117.46 117.17 2o8j n PHE 1133Ca -0.00 -3.94 -0.34 0.00 -0.05 0.00 0.00 57.45 53.12 2o8j n PHE 1133Cb 0.25 -0.47 0.03 0.00 -0.94 0.00 0.00 39.48 38.36 2o8j n PHE 1133CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2o8j s PRO 1134N -3.00 2.98 0.02 -1.08 0.04 -1.26 -4.89 135.00 127.80 2o8j s PRO 1134Ca 0.45 1.51 -0.01 0.00 0.04 0.00 0.00 61.00 63.00 2o8j s PRO 1134Cb 0.29 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.83 2o8j s PRO 1134CO -0.11 -1.13 0.13 1.03 0.04 0.00 0.00 177.00 176.96 2o8j s ARG 1135N -3.75 3.21 -0.31 4.56 0.52 -0.41 -4.88 118.95 117.89 2o8j s ARG 1135Ca 0.70 -0.46 -0.10 0.00 -0.52 0.00 0.00 55.73 55.35 2o8j s ARG 1135Cb -0.23 -2.94 -0.02 0.00 0.52 0.00 0.00 34.95 32.29 2o8j s ARG 1135CO 0.36 0.64 0.17 0.42 0.02 0.00 0.00 175.30 176.91 2o8j s ILE 1136N -1.31 4.81 -0.15 1.52 -1.09 -1.26 -0.79 121.20 122.92 2o8j s ILE 1136Ca 0.27 -0.29 -0.02 0.00 -2.23 0.00 0.00 60.65 58.37 2o8j s ILE 1136Cb -0.12 -3.42 -0.02 0.00 -1.58 0.00 0.00 42.46 37.31 2o8j s ILE 1136CO 0.19 0.09 -0.08 0.00 -1.23 0.00 0.00 174.94 173.90 2o8j s ALA 1137N 1.65 2.80 -0.17 9.38 0.00 0.34 -0.68 121.76 135.08 2o8j s ALA 1137Ca 0.05 -0.89 -0.15 0.00 0.00 0.00 0.00 51.96 50.97 2o8j s ALA 1137Cb -0.17 -1.41 -0.04 0.00 0.00 0.00 0.00 23.12 21.50 2o8j s ALA 1137CO 0.07 0.16 0.36 -0.06 0.00 0.00 0.00 175.76 176.30 2o8j s PHE 1138N 0.48 3.43 0.08 0.00 0.08 -0.06 -0.04 117.98 121.95 2o8j s PHE 1138Ca -0.06 0.64 0.10 0.00 0.12 0.00 0.00 56.93 57.73 2o8j s PHE 1138Cb -0.15 -2.45 -0.03 0.00 -0.57 0.00 0.00 43.02 39.82 2o8j s PHE 1138CO 0.04 0.12 -0.26 -0.06 -0.10 0.00 0.00 175.22 174.96 2o8j s PHE 1139N 0.84 2.22 0.33 0.36 0.08 -0.66 -0.30 117.98 120.85 2o8j s PHE 1139Ca 0.19 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.55 2o8j s PHE 1139Cb -0.14 -1.27 -0.11 0.00 -0.57 0.00 0.00 43.02 40.92 2o8j s PHE 1139CO 0.07 0.21 1.56 -1.54 -0.10 0.00 0.00 175.22 175.41 2o8j s SER 1140N -1.58 6.34 0.00 1.36 1.04 -0.07 -0.80 113.70 120.00 2o8j s SER 1140Ca 0.12 3.01 0.23 0.00 0.48 0.00 0.00 55.95 59.79 2o8j s SER 1140Cb -0.10 -2.65 0.16 0.00 0.10 0.00 0.00 66.02 63.53 2o8j s SER 1140CO 0.04 -0.91 1.19 -1.54 0.98 0.00 0.00 173.24 172.99 2o8j n SER 1141N 1.43 1.68 -3.79 7.02 3.41 0.20 -1.34 113.62 122.23 2o8j n SER 1141Ca 0.05 -1.30 -0.05 0.00 -0.26 0.00 0.00 58.87 57.31 2o8j n SER 1141Cb 0.38 0.44 -0.02 0.00 -0.26 0.00 0.00 64.21 64.76 2o8j n SER 1141CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2o8j s ARG 1142N -2.54 1.52 0.24 4.33 1.70 -1.26 -4.86 118.95 118.08 2o8j s ARG 1142Ca 0.19 -0.85 -0.31 0.00 -0.47 0.00 0.00 55.73 54.29 2o8j s ARG 1142Cb 0.18 0.52 -0.12 0.00 -0.57 0.00 0.00 34.95 34.96 2o8j s ARG 1142CO 0.59 -0.70 1.68 -0.51 -1.08 0.00 0.00 175.30 175.28 2o8j s ASP 1143N -2.94 6.37 -0.09 -2.89 1.01 -1.26 -3.70 116.67 113.17 2o8j s ASP 1143Ca 0.12 2.90 0.03 0.00 0.71 0.00 0.00 52.55 56.30 2o8j s ASP 1143Cb -0.04 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.27 2o8j s ASP 1143CO 0.05 -0.96 -0.18 -0.63 0.21 0.00 0.00 175.17 173.67 2o8j s ILE 1144N 0.78 2.69 0.37 0.77 1.01 0.63 -4.90 121.20 122.55 2o8j s ILE 1144Ca 0.71 -0.82 -0.11 0.00 0.00 0.00 0.00 60.65 60.43 2o8j s ILE 1144Cb -0.49 -2.07 -0.07 0.00 0.01 0.00 0.00 42.46 39.84 2o8j s ILE 1144CO 0.37 0.55 0.74 -0.60 0.00 0.00 0.00 174.94 176.00 2o8j s ARG 1145N 0.02 3.83 0.24 2.79 6.06 -1.26 -0.81 118.95 129.81 2o8j s ARG 1145Ca -0.06 0.48 -0.31 0.00 -2.50 0.00 0.00 55.73 53.34 2o8j s ARG 1145Cb -0.15 -2.43 -0.14 0.00 0.06 0.00 0.00 34.95 32.29 2o8j s ARG 1145CO 0.05 0.05 1.21 -2.37 -2.50 0.00 0.00 175.30 171.73 2o8j n THR 1146N -0.98 1.32 -0.46 4.11 5.66 -1.22 -1.87 114.28 120.85 2o8j n THR 1146Ca 0.02 -0.33 0.00 0.00 -3.05 0.00 0.00 64.05 60.69 2o8j n THR 1146Cb 0.54 -1.15 0.00 0.00 -1.55 0.00 0.00 70.33 68.17 2o8j n THR 1146CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2o8j n GLY 1147N 1.72 1.84 3.74 1.09 0.00 0.21 -4.95 105.19 108.85 2o8j n GLY 1147Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2o8j n GLY 1147CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o8j s GLU 1148N -0.09 4.66 0.11 1.61 2.12 -0.78 -4.73 118.70 121.60 2o8j s GLU 1148Ca 0.00 1.64 -0.30 0.00 0.36 0.00 0.00 54.97 56.67 2o8j s GLU 1148Cb 0.00 -3.29 -0.07 0.00 0.26 0.00 0.00 34.13 31.04 2o8j s GLU 1148CO 0.00 0.18 1.21 -2.00 -0.54 0.00 0.00 175.26 174.11 2o8j s GLU 1149N -0.52 4.45 0.34 4.30 2.12 -1.26 -1.78 118.70 126.35 2o8j s GLU 1149Ca 0.47 1.82 -0.26 0.00 0.36 0.00 0.00 54.97 57.37 2o8j s GLU 1149Cb -0.28 -3.30 -0.10 0.00 0.26 0.00 0.00 34.13 30.71 2o8j s GLU 1149CO 0.34 -0.20 0.96 -0.51 -0.54 0.00 0.00 175.26 175.31 2o8j s LEU 1150N 0.59 4.29 -0.13 2.70 1.43 0.72 -4.89 118.68 123.39 2o8j s LEU 1150Ca 0.57 1.86 -0.30 0.00 -1.03 0.00 0.00 54.13 55.23 2o8j s LEU 1150Cb -0.31 -4.07 0.11 0.00 0.03 0.00 0.00 46.19 41.95 2o8j s LEU 1150CO 0.32 -0.14 0.91 -0.83 0.23 0.00 0.00 176.35 176.84 2o8j s GLY 1151N -1.63 -0.35 0.35 -3.19 0.00 -1.26 -4.08 107.32 97.15 2o8j s GLY 1151Ca 0.52 1.85 0.07 0.00 0.00 0.00 0.00 44.72 47.16 2o8j s GLY 1151CO 0.24 1.02 -0.03 -0.11 0.00 0.00 0.00 173.10 174.22 2o8j s PHE 1152N -1.11 2.27 -0.53 1.90 -0.12 -1.15 -1.63 117.98 117.62 2o8j s PHE 1152Ca -0.04 -0.67 -0.27 0.00 -0.05 0.00 0.00 56.93 55.89 2o8j s PHE 1152Cb -0.00 -1.43 0.03 0.00 -0.63 0.00 0.00 43.02 40.98 2o8j s PHE 1152CO 0.04 0.38 1.10 0.34 -0.05 0.00 0.00 175.22 177.03 2o8j s ASP 1153N -3.58 6.49 0.58 1.98 2.15 -1.26 -2.08 116.67 120.95 2o8j s ASP 1153Ca 0.33 0.15 0.34 0.00 0.43 0.00 0.00 52.55 53.79 2o8j s ASP 1153Cb 0.06 -2.52 1.79 0.00 -0.30 0.00 0.00 42.92 41.96 2o8j s ASP 1153CO 0.16 -1.31 2.18 1.88 -0.17 0.00 0.00 175.17 177.91 2o8j h TYR 1154N 9.35 0.00 0.00 -5.34 -1.99 -1.93 -3.49 116.97 113.57 2o8j h TYR 1154Ca -0.24 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.49 2o8j h TYR 1154Cb 1.06 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.79 2o8j h TYR 1154CO 0.98 0.05 0.00 0.41 -0.00 0.00 0.00 178.16 179.59 2o8j n GLY 1155N -0.83 0.20 0.31 3.88 0.00 -1.26 -4.54 105.19 102.96 2o8j n GLY 1155Ca -0.02 -1.73 0.07 0.00 0.00 0.00 0.00 46.02 44.34 2o8j n GLY 1155CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2o8j h ASP 1156N 0.00 0.57 -0.37 1.61 5.19 -1.99 -2.85 116.42 118.57 2o8j h ASP 1156Ca 0.00 0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.45 2o8j h ASP 1156Cb 0.00 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.48 2o8j h ASP 1156CO 0.00 0.25 0.10 0.03 -3.12 0.00 0.00 179.24 176.50 2o8j h ARG 1157N 0.66 0.66 -0.24 3.56 -0.00 -2.00 0.18 114.38 117.21 2o8j h ARG 1157Ca 0.46 -0.12 -0.01 0.00 -0.50 0.00 0.00 59.98 59.81 2o8j h ARG 1157Cb 0.62 -0.11 -0.01 0.00 0.00 0.00 0.00 29.97 30.47 2o8j h ARG 1157CO -0.35 0.61 0.11 0.35 0.00 0.00 0.00 179.97 180.70 2o8j h PHE 1158N 0.64 0.35 0.00 3.04 3.57 -1.74 -3.19 116.94 119.62 2o8j h PHE 1158Ca 0.15 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 2o8j h PHE 1158Cb 0.25 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 2o8j h PHE 1158CO 0.01 0.35 -0.16 -1.49 -2.23 0.00 0.00 178.31 174.79 2o8j h TRP 1159N 0.25 0.00 0.00 0.41 4.06 -1.37 -1.17 115.95 118.13 2o8j h TRP 1159Ca 0.08 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.94 2o8j h TRP 1159Cb 0.13 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.28 2o8j h TRP 1159CO -0.02 0.16 -0.44 -0.44 -3.56 0.00 0.00 178.44 174.14 2o8j h ASP 1160N 0.00 0.00 0.25 -3.49 3.32 -1.01 -2.54 116.42 112.95 2o8j h ASP 1160Ca -0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 2o8j h ASP 1160Cb 0.95 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.47 2o8j h ASP 1160CO 0.02 0.44 -1.90 -0.38 -1.72 0.00 0.00 179.24 175.70 2o8j n ILE 1161N -3.77 1.72 0.03 0.35 2.08 -1.05 -4.54 119.36 114.17 2o8j n ILE 1161Ca -0.01 -0.71 -0.02 0.00 0.56 0.00 0.00 62.75 62.58 2o8j n ILE 1161Cb 0.50 -1.48 -0.09 0.00 -0.75 0.00 0.00 39.64 37.83 2o8j n ILE 1161CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2o8j h LYS 1162N 0.05 0.00 -0.07 0.38 1.79 -1.28 -3.39 116.57 114.05 2o8j h LYS 1162Ca -0.38 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.11 2o8j h LYS 1162Cb 2.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.68 2o8j h LYS 1162CO 0.08 0.35 0.11 0.66 -1.08 0.00 0.00 179.45 179.57 2o8j h SER 1163N 0.00 0.00 0.57 0.86 4.64 -1.47 0.19 113.55 118.35 2o8j h SER 1163Ca -0.18 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.11 2o8j h SER 1163Cb 1.66 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.74 2o8j h SER 1163CO 0.05 0.00 -0.16 0.11 -0.87 0.00 0.00 176.83 175.97 2o8j h LYS 1164N 0.00 0.00 0.00 4.77 6.56 -1.86 -3.30 116.57 122.75 2o8j h LYS 1164Ca 0.03 0.00 -0.25 0.00 -1.06 0.00 0.00 60.65 59.37 2o8j h LYS 1164Cb 0.26 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 31.87 2o8j h LYS 1164CO -0.00 0.16 -1.94 0.66 -2.06 0.00 0.00 179.45 176.27 2o8j n TYR 1165N -3.52 0.00 -3.51 -1.35 4.01 0.58 -5.04 117.16 108.32 2o8j n TYR 1165Ca -0.01 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.57 2o8j n TYR 1165Cb 0.31 -0.65 -0.05 0.00 -0.31 0.00 0.00 39.34 38.63 2o8j n TYR 1165CO 0.00 0.00 0.00 -0.59 -0.46 0.00 0.00 176.86 175.81 2o8j s PHE 1166N -2.33 -0.60 0.43 -0.72 -0.12 -0.58 -5.17 117.98 108.89 2o8j s PHE 1166Ca -0.14 0.92 0.06 0.00 -0.05 0.00 0.00 56.93 57.72 2o8j s PHE 1166Cb 0.05 0.44 -0.05 0.00 -0.63 0.00 0.00 43.02 42.83 2o8j s PHE 1166CO 0.48 -0.62 0.12 0.95 -0.05 0.00 0.00 175.22 176.10 2o8j s THR 1167N -1.67 2.04 0.18 -4.49 -4.23 -1.26 -3.41 115.64 102.80 2o8j s THR 1167Ca -0.08 -1.81 -0.30 0.00 -1.18 0.00 0.00 61.69 58.32 2o8j s THR 1167Cb -0.00 -2.86 -0.09 0.00 1.34 0.00 0.00 72.50 70.89 2o8j s THR 1167CO 0.05 0.00 1.35 0.00 -0.54 0.00 0.00 174.62 175.47 2o8j n GLN 1169N 2.95 2.37 0.25 0.00 1.13 -1.26 -4.18 117.38 118.65 2o8j n GLN 1169Ca 0.08 -2.88 0.10 0.00 -1.94 0.00 0.00 57.00 52.36 2o8j n GLN 1169Cb 0.42 -1.78 0.68 0.00 0.11 0.00 0.00 30.24 29.67 2o8j n GLN 1169CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2o8j n GLY 1171N -0.91 0.66 3.78 0.00 0.00 -1.26 -5.00 105.19 102.46 2o8j n GLY 1171Ca -0.02 -0.62 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 2o8j n GLY 1171CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2o8j s SER 1172N -2.70 6.96 0.51 1.61 0.15 -1.26 -4.93 113.70 114.04 2o8j s SER 1172Ca 0.00 2.04 0.18 0.00 0.70 0.00 0.00 55.95 58.87 2o8j s SER 1172Cb 0.00 -2.59 1.27 0.00 -1.71 0.00 0.00 66.02 62.99 2o8j s SER 1172CO 0.00 -0.35 2.09 -0.08 1.20 0.00 0.00 173.24 176.10 2o8j h GLU 1173N 2.85 0.05 -0.58 5.44 4.57 -2.02 -1.95 114.58 122.93 2o8j h GLU 1173Ca -0.48 -0.00 -0.28 0.00 -1.18 0.00 0.00 59.36 57.42 2o8j h GLU 1173Cb 1.21 -0.01 -0.16 0.00 -0.16 0.00 0.00 28.75 29.62 2o8j h GLU 1173CO 0.64 0.03 0.19 0.36 -1.18 0.00 0.00 179.01 179.04 2o8j n LYS 1174N -4.49 2.21 -1.68 1.92 2.85 -1.26 -5.01 118.16 112.71 2o8j n LYS 1174Ca 0.02 -3.10 -0.45 0.00 -1.05 0.00 0.00 58.31 53.72 2o8j n LYS 1174Cb 0.26 -1.97 -0.04 0.00 -0.65 0.00 0.00 35.03 32.63 2o8j n LYS 1174CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2o8j n LYS 1176N 3.64 1.01 -0.13 0.00 5.02 -1.26 -4.60 118.16 121.84 2o8j n LYS 1176Ca 0.17 -1.31 0.02 0.00 -2.02 0.00 0.00 58.31 55.17 2o8j n LYS 1176Cb 0.30 -1.27 0.02 0.00 -0.02 0.00 0.00 35.03 34.07 2o8j n LYS 1176CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2o8j n HIS 1177N 0.74 0.00 -1.51 2.13 8.25 -1.26 -4.78 115.22 118.79 2o8j n HIS 1177Ca 0.08 -0.30 -0.30 0.00 -0.26 0.00 0.00 57.72 56.94 2o8j n HIS 1177Cb 0.35 -0.05 0.09 0.00 1.12 0.00 0.00 29.99 31.50 2o8j n HIS 1177CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2o8j s SER 1178N -0.99 4.54 0.24 0.41 1.04 -1.26 -0.92 113.70 116.75 2o8j s SER 1178Ca 0.06 1.40 -0.05 0.00 0.48 0.00 0.00 55.95 57.84 2o8j s SER 1178Cb 0.05 -2.15 0.42 0.00 0.10 0.00 0.00 66.02 64.44 2o8j s SER 1178CO 0.01 -1.95 1.73 0.00 0.98 0.00 0.00 173.24 174.00 2o8j h ALA 1179N -1.08 1.01 0.02 5.32 0.00 -1.91 -1.33 119.26 121.29 2o8j h ALA 1179Ca -0.47 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 2o8j h ALA 1179Cb 1.26 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2o8j h ALA 1179CO 0.58 -0.20 -0.01 1.49 0.00 0.00 0.00 179.25 181.11 2o8j h GLU 1180N 0.44 -0.02 -0.55 0.00 4.81 -1.95 -0.72 114.58 116.59 2o8j h GLU 1180Ca 0.39 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.69 2o8j h GLU 1180Cb 0.57 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.90 2o8j h GLU 1180CO -0.38 0.04 0.25 0.00 -0.73 0.00 0.00 179.01 178.18 2o8j h ALA 1181N 0.90 0.70 -0.37 2.92 0.00 -1.80 0.71 119.26 122.32 2o8j h ALA 1181Ca -0.00 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2o8j h ALA 1181Cb 0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2o8j h ALA 1181CO 0.00 -0.13 0.10 0.82 0.00 0.00 0.00 179.25 180.05 2o8j h ILE 1182N 0.47 1.22 -0.71 0.00 2.04 -1.11 -1.71 117.51 117.71 2o8j h ILE 1182Ca 0.25 -0.74 -0.07 0.00 1.00 0.00 0.00 64.86 65.31 2o8j h ILE 1182Cb 0.22 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 2o8j h ILE 1182CO -0.21 0.26 0.18 0.00 0.00 0.00 0.00 178.15 178.37 2o8j h ALA 1183N 0.94 0.97 -0.60 1.87 0.00 -0.84 -1.88 119.26 119.73 2o8j h ALA 1183Ca 0.12 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2o8j h ALA 1183Cb 0.29 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2o8j h ALA 1183CO -0.00 0.67 0.27 -0.07 0.00 0.00 0.00 179.25 180.11 2o8j h LEU 1184N 1.08 0.80 -0.36 0.00 4.07 -0.72 -1.77 115.31 118.40 2o8j h LEU 1184Ca 0.23 -0.15 -0.14 0.00 0.08 0.00 0.00 57.88 57.90 2o8j h LEU 1184Cb 0.36 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.89 2o8j h LEU 1184CO 0.00 0.72 -0.31 -0.08 -1.08 0.00 0.00 178.44 177.69 2o8j h GLU 1185N 0.82 0.85 -0.30 1.13 4.57 -1.16 0.57 114.58 121.06 2o8j h GLU 1185Ca 0.20 -0.43 0.03 0.00 -1.18 0.00 0.00 59.36 57.99 2o8j h GLU 1185Cb 0.15 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.72 2o8j h GLU 1185CO -0.02 1.07 0.09 0.37 -1.18 0.00 0.00 179.01 179.34 2o8j h GLN 1186N 0.64 0.21 -0.18 1.92 4.15 -1.33 -0.68 115.11 119.84 2o8j h GLN 1186Ca 0.06 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.48 2o8j h GLN 1186Cb 0.89 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.52 2o8j h GLN 1186CO 0.08 0.14 0.09 0.77 -1.93 0.00 0.00 178.83 177.98 2o8j h SER 1187N 0.22 0.13 -0.26 -0.69 0.02 -1.17 -1.81 113.55 110.00 2o8j h SER 1187Ca 0.13 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 2o8j h SER 1187Cb 0.11 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 62.59 2o8j h SER 1187CO -0.15 0.11 -0.07 -0.09 -1.14 0.00 0.00 176.83 175.49 2o8j h ARG 1188N 0.19 -0.00 -0.31 3.45 2.43 -0.64 -1.10 114.38 118.41 2o8j h ARG 1188Ca 0.07 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2o8j h ARG 1188Cb 0.02 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2o8j h ARG 1188CO -0.05 -0.00 0.01 -0.07 -1.51 0.00 0.00 179.97 178.35 2o8j h LEU 1189N -0.00 0.43 -0.31 3.80 3.38 -1.02 -2.31 115.31 119.26 2o8j h LEU 1189Ca 0.12 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2o8j h LEU 1189Cb 0.19 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2o8j h LEU 1189CO -0.27 0.49 0.07 0.00 0.09 0.00 0.00 178.44 178.81 2o8j h ALA 1190N 1.57 0.41 -0.58 1.53 0.00 -0.78 -3.22 119.26 118.19 2o8j h ALA 1190Ca 0.10 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2o8j h ALA 1190Cb 0.28 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2o8j h ALA 1190CO 0.01 0.09 0.14 -0.09 0.00 0.00 0.00 179.25 179.39 2o8j h ARG 1191N 0.34 0.90 -0.02 0.00 2.43 -0.78 -3.51 114.38 113.74 2o8j h ARG 1191Ca 0.10 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2o8j h ARG 1191Cb 0.31 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2o8j h ARG 1191CO 0.00 0.81 0.00 1.28 -1.51 0.00 0.00 179.97 180.55