#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ppq n ALA 958 N 0.00 4.66 -3.30 4.31 0.00 -1.26 -5.02 120.51 119.90 1ppq n ALA 958 Ca 0.00 -3.83 -0.17 0.00 0.00 0.00 0.00 53.44 49.44 1ppq n ALA 958 Cb 0.00 -0.51 -0.15 0.00 0.00 0.00 0.00 19.45 18.79 1ppq n ALA 958 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ppq s GLU 959 N -3.56 0.45 -0.06 0.00 2.12 -1.26 -5.14 118.70 111.26 1ppq s GLU 959 Ca 0.46 -0.07 -0.03 0.00 0.36 0.00 0.00 54.97 55.69 1ppq s GLU 959 Cb 0.40 -0.51 0.04 0.00 0.26 0.00 0.00 34.13 34.32 1ppq s GLU 959 CO -0.05 -0.02 0.10 0.00 -0.54 0.00 0.00 175.26 174.74 1ppq s ALA 960 N 0.51 0.09 -0.66 6.30 0.00 -1.26 -4.95 121.76 121.79 1ppq s ALA 960 Ca -0.06 0.32 -0.06 0.00 0.00 0.00 0.00 51.96 52.16 1ppq s ALA 960 Cb -0.09 -0.70 0.01 0.00 0.00 0.00 0.00 23.12 22.34 1ppq s ALA 960 CO -0.01 -0.53 0.66 1.17 0.00 0.00 0.00 175.76 177.06 1ppq n LYS 961 N 5.31 -1.64 -3.17 0.00 3.00 -1.26 -5.03 118.16 115.36 1ppq n LYS 961 Ca -0.04 1.53 0.03 0.00 -0.00 0.00 0.00 58.31 59.83 1ppq n LYS 961 Cb 0.50 -4.97 -0.02 0.00 0.00 0.00 0.00 35.03 30.54 1ppq n LYS 961 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1ppq s SER 962 N -2.81 -1.24 0.46 3.14 0.01 -1.26 -4.55 113.70 107.45 1ppq s SER 962 Ca 0.08 0.70 -0.16 0.00 1.31 0.00 0.00 55.95 57.88 1ppq s SER 962 Cb -0.02 2.03 -0.09 0.00 0.21 0.00 0.00 66.02 68.16 1ppq s SER 962 CO 0.79 -0.27 0.92 0.00 0.41 0.00 0.00 173.24 175.08 1ppq n LYS 964 N -1.19 0.39 -0.03 0.00 4.81 -1.26 -4.88 118.16 116.01 1ppq n LYS 964 Ca 0.06 -1.53 -0.07 0.00 -0.87 0.00 0.00 58.31 55.90 1ppq n LYS 964 Cb 0.54 -0.86 -0.02 0.00 0.02 0.00 0.00 35.03 34.70 1ppq n LYS 964 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1ppq n THR 965 N 2.66 0.96 -1.64 3.15 -1.04 -1.26 -4.98 114.28 112.12 1ppq n THR 965 Ca 0.14 0.09 -0.41 0.00 -2.04 0.00 0.00 64.05 61.83 1ppq n THR 965 Cb 0.60 -1.76 -0.03 0.00 -1.82 0.00 0.00 70.33 67.33 1ppq n THR 965 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1ppq s PRO 966 N -2.26 2.84 -0.94 -2.82 0.04 -1.26 -4.87 135.00 125.73 1ppq s PRO 966 Ca -0.12 1.76 -0.05 0.00 0.04 0.00 0.00 61.00 62.63 1ppq s PRO 966 Cb 0.03 -4.42 0.08 0.00 0.04 0.00 0.00 34.50 30.23 1ppq s PRO 966 CO 0.17 -2.43 2.60 -0.35 0.04 0.00 0.00 177.00 177.02 1ppq n PRO 967 N 8.82 3.62 -2.77 0.56 -0.04 -1.26 -4.81 135.00 139.12 1ppq n PRO 967 Ca 0.31 -2.91 -0.02 0.00 -0.04 0.00 0.00 63.50 60.84 1ppq n PRO 967 Cb 0.48 -2.42 -0.02 0.00 -0.04 0.00 0.00 33.50 31.50 1ppq n PRO 967 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ppq n ASP 968 N 1.45 -4.92 -4.53 3.54 2.03 -1.26 -4.86 116.55 108.00 1ppq n ASP 968 Ca 0.57 1.23 -0.42 0.00 0.52 0.00 0.00 54.79 56.70 1ppq n ASP 968 Cb 0.39 -4.46 0.01 0.00 -0.72 0.00 0.00 41.12 36.34 1ppq n ASP 968 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1ppq n PRO 969 N 1.36 0.94 -1.69 -0.67 -0.02 -1.26 -4.84 135.00 128.82 1ppq n PRO 969 Ca -0.16 0.34 -0.44 0.00 -2.02 0.00 0.00 63.50 61.21 1ppq n PRO 969 Cb 0.31 -1.76 -0.04 0.00 -0.02 0.00 0.00 33.50 31.99 1ppq n PRO 969 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1ppq n VAL 970 N -0.64 0.08 -3.12 -1.45 3.14 -1.26 -3.29 118.33 111.79 1ppq n VAL 970 Ca 0.11 -0.01 -0.18 0.00 -2.96 0.00 0.00 64.34 61.29 1ppq n VAL 970 Cb 0.39 -1.78 0.02 0.00 -1.06 0.00 0.00 33.84 31.40 1ppq n VAL 970 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1ppq n ASN 971 N 4.09 -7.03 0.00 6.55 3.02 -1.26 -4.80 115.26 115.83 1ppq n ASN 971 Ca 0.17 0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.92 1ppq n ASN 971 Cb 0.32 -4.03 0.00 0.00 -0.61 0.00 0.00 39.78 35.46 1ppq n ASN 971 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ppq n GLY 972 N -0.43 0.93 3.56 7.41 0.00 -1.21 -1.04 105.19 114.40 1ppq n GLY 972 Ca 0.03 -1.84 -0.14 0.00 0.00 0.00 0.00 46.02 44.06 1ppq n GLY 972 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1ppq s MET 973 N -2.00 0.82 0.06 1.61 0.23 -1.26 -4.48 119.30 114.28 1ppq s MET 973 Ca 0.00 0.28 -0.08 0.00 -1.03 0.00 0.00 55.69 54.87 1ppq s MET 973 Cb 0.00 0.39 -0.05 0.00 -1.53 0.00 0.00 34.83 33.64 1ppq s MET 973 CO 0.00 -0.24 0.34 0.54 -2.03 0.00 0.00 175.02 173.63 1ppq s VAL 974 N -0.97 5.19 -0.16 5.16 0.11 -1.26 -3.69 120.40 124.78 1ppq s VAL 974 Ca -0.06 0.26 0.01 0.00 -2.93 0.00 0.00 61.98 59.26 1ppq s VAL 974 Cb -0.01 -3.61 0.01 0.00 -1.53 0.00 0.00 36.38 31.24 1ppq s VAL 974 CO 0.05 0.28 -0.17 -1.00 -3.33 0.00 0.00 175.10 170.93 1ppq s HIS 975 N -1.40 2.77 0.06 1.54 3.76 -0.94 -5.04 115.29 116.05 1ppq s HIS 975 Ca 0.32 -1.29 -0.19 0.00 -0.15 0.00 0.00 55.06 53.75 1ppq s HIS 975 Cb -0.13 -1.90 -0.07 0.00 1.11 0.00 0.00 32.58 31.59 1ppq s HIS 975 CO 0.18 -0.62 0.55 0.54 -0.85 0.00 0.00 174.74 174.55 1ppq s VAL 976 N 1.02 4.78 0.00 -0.90 0.11 -1.26 -2.49 120.40 121.66 1ppq s VAL 976 Ca -0.02 1.17 0.00 0.00 -2.93 0.00 0.00 61.98 60.21 1ppq s VAL 976 Cb -0.15 -3.88 0.00 0.00 -1.53 0.00 0.00 36.38 30.83 1ppq s VAL 976 CO -0.05 0.55 0.84 -0.38 -3.33 0.00 0.00 175.10 172.74 1ppq n ILE 977 N 1.78 0.00 0.00 7.04 2.08 -1.26 -4.85 119.36 124.15 1ppq n ILE 977 Ca -0.11 1.34 0.00 0.00 0.56 0.00 0.00 62.75 64.55 1ppq n ILE 977 Cb 0.51 -2.28 0.00 0.00 -0.75 0.00 0.00 39.64 37.11 1ppq n ILE 977 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1ppq n THR 978 N -1.63 0.00 -4.28 1.39 -1.04 -1.26 -5.14 114.28 102.32 1ppq n THR 978 Ca 0.00 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.83 1ppq n THR 978 Cb 0.00 -0.05 -0.09 0.00 -1.82 0.00 0.00 70.33 68.37 1ppq n THR 978 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1ppq s ASP 979 N -3.13 1.32 -0.57 8.00 1.01 -1.26 -5.10 116.67 116.93 1ppq s ASP 979 Ca 0.00 -1.64 0.07 0.00 0.71 0.00 0.00 52.55 51.68 1ppq s ASP 979 Cb 0.00 0.49 0.26 0.00 1.01 0.00 0.00 42.92 44.69 1ppq s ASP 979 CO 0.00 -0.98 0.73 -0.38 0.21 0.00 0.00 175.17 174.74 1ppq n ILE 980 N -0.54 1.72 -4.51 0.77 5.41 -1.26 -4.89 119.36 116.05 1ppq n ILE 980 Ca 0.05 -4.99 -0.24 0.00 1.00 0.00 0.00 62.75 58.57 1ppq n ILE 980 Cb 0.64 -1.91 -0.06 0.00 -0.71 0.00 0.00 39.64 37.60 1ppq n ILE 980 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ppq n GLN 981 N 0.80 0.83 -1.75 0.38 6.02 -1.26 -3.64 117.38 118.75 1ppq n GLN 981 Ca 0.28 -2.91 -0.41 0.00 -0.01 0.00 0.00 57.00 53.95 1ppq n GLN 981 Cb 0.44 1.17 0.00 0.00 1.02 0.00 0.00 30.24 32.87 1ppq n GLN 981 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 1ppq n VAL 982 N -0.89 2.12 0.00 5.09 3.14 -1.26 -2.11 118.33 124.42 1ppq n VAL 982 Ca -0.11 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.77 1ppq n VAL 982 Cb 0.51 -1.85 0.00 0.00 -1.06 0.00 0.00 33.84 31.44 1ppq n VAL 982 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ppq n GLY 983 N 0.55 2.84 3.79 7.55 0.00 -1.26 -5.03 105.19 113.63 1ppq n GLY 983 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1ppq n GLY 983 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ppq s SER 984 N -1.45 5.95 -0.37 1.61 0.01 -0.90 -4.94 113.70 113.62 1ppq s SER 984 Ca 0.00 1.96 0.01 0.00 1.31 0.00 0.00 55.95 59.23 1ppq s SER 984 Cb 0.00 -2.56 0.14 0.00 0.21 0.00 0.00 66.02 63.82 1ppq s SER 984 CO 0.00 -1.05 0.23 -0.60 0.41 0.00 0.00 173.24 172.23 1ppq s ARG 985 N -3.54 0.68 0.89 12.44 3.52 -1.26 -3.09 118.95 128.58 1ppq s ARG 985 Ca 0.68 -1.49 -0.13 0.00 -0.13 0.00 0.00 55.73 54.65 1ppq s ARG 985 Cb -0.18 -1.44 0.13 0.00 -1.56 0.00 0.00 34.95 31.90 1ppq s ARG 985 CO 0.28 -1.22 1.18 0.96 -0.81 0.00 0.00 175.30 175.68 1ppq s ILE 986 N 0.87 1.98 -0.01 4.11 -4.36 -1.26 -4.75 121.20 117.79 1ppq s ILE 986 Ca 0.20 0.00 0.03 0.00 -0.26 0.00 0.00 60.65 60.62 1ppq s ILE 986 Cb -0.20 -2.88 -0.01 0.00 1.25 0.00 0.00 42.46 40.62 1ppq s ILE 986 CO -0.01 0.00 -0.10 0.42 0.24 0.00 0.00 174.94 175.49 1ppq s THR 987 N -3.48 0.78 -0.05 8.37 -4.23 -1.04 -3.66 115.64 112.33 1ppq s THR 987 Ca 0.65 -0.44 -0.03 0.00 -1.18 0.00 0.00 61.69 60.68 1ppq s THR 987 Cb -0.12 -0.66 -0.04 0.00 1.34 0.00 0.00 72.50 73.03 1ppq s THR 987 CO 0.52 0.21 0.12 -0.31 -0.54 0.00 0.00 174.62 174.62 1ppq s TYR 988 N -0.26 3.45 -0.00 3.99 1.51 -1.26 -2.20 117.35 122.58 1ppq s TYR 988 Ca 0.04 0.35 0.00 0.00 -1.01 0.00 0.00 57.07 56.45 1ppq s TYR 988 Cb -0.04 -1.84 -0.00 0.00 -0.11 0.00 0.00 41.96 39.97 1ppq s TYR 988 CO -0.00 0.63 -0.00 0.43 -1.11 0.00 0.00 175.55 175.50 1ppq n SER 989 N 1.47 4.24 -1.32 2.29 7.64 -1.24 -4.82 113.62 121.88 1ppq n SER 989 Ca -0.15 -0.00 0.16 0.00 1.01 0.00 0.00 58.87 59.89 1ppq n SER 989 Cb 0.53 0.15 -0.08 0.00 -1.01 0.00 0.00 64.21 63.80 1ppq n SER 989 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ppq n THR 991 N -4.15 3.09 -1.70 0.00 5.66 -0.21 -4.66 114.28 112.32 1ppq n THR 991 Ca -0.07 -0.50 -0.43 0.00 -3.05 0.00 0.00 64.05 60.00 1ppq n THR 991 Cb 0.62 -1.62 -0.01 0.00 -1.55 0.00 0.00 70.33 67.77 1ppq n THR 991 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1ppq n THR 992 N -0.59 1.49 -0.52 1.09 5.66 -1.26 -2.27 114.28 117.87 1ppq n THR 992 Ca 0.08 -0.37 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 1ppq n THR 992 Cb 0.42 -1.61 0.00 0.00 -1.55 0.00 0.00 70.33 67.59 1ppq n THR 992 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ppq n GLY 993 N 1.44 0.70 2.74 1.09 0.00 -1.26 -5.05 105.19 104.84 1ppq n GLY 993 Ca 0.07 -0.30 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 1ppq n GLY 993 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ppq s HIS 994 N -2.00 0.54 -0.36 1.61 4.02 -0.96 -2.17 115.29 115.97 1ppq s HIS 994 Ca 0.00 -0.14 -0.17 0.00 1.02 0.00 0.00 55.06 55.77 1ppq s HIS 994 Cb 0.00 -0.74 -0.00 0.00 -1.02 0.00 0.00 32.58 30.81 1ppq s HIS 994 CO 0.00 -0.33 0.48 0.50 1.02 0.00 0.00 174.74 176.41 1ppq s ARG 995 N 2.02 3.53 0.76 1.40 3.52 0.05 -4.72 118.95 125.50 1ppq s ARG 995 Ca 0.04 -0.30 -0.15 0.00 -0.13 0.00 0.00 55.73 55.20 1ppq s ARG 995 Cb -0.13 -3.83 0.03 0.00 -1.56 0.00 0.00 34.95 29.46 1ppq s ARG 995 CO -0.05 -0.66 1.03 1.47 -0.81 0.00 0.00 175.30 176.27 1ppq n LEU 996 N 5.68 3.68 -3.76 -0.88 -0.00 -1.26 -0.66 117.00 119.80 1ppq n LEU 996 Ca -0.06 0.62 -0.30 0.00 -0.00 0.00 0.00 56.01 56.28 1ppq n LEU 996 Cb 0.49 -1.44 -0.13 0.00 -0.00 0.00 0.00 43.42 42.34 1ppq n LEU 996 CO 0.45 -1.98 -0.24 -0.63 -0.00 0.00 0.00 177.39 174.98 1ppq s ILE 997 N -1.95 1.60 0.00 1.47 -1.09 -1.14 -4.76 121.20 115.33 1ppq s ILE 997 Ca 0.73 -2.64 0.00 0.00 -2.23 0.00 0.00 60.65 56.51 1ppq s ILE 997 Cb -0.32 -2.12 0.00 0.00 -1.58 0.00 0.00 42.46 38.44 1ppq s ILE 997 CO 0.51 -0.87 0.00 0.61 -1.23 0.00 0.00 174.94 173.97 1ppq n GLY 998 N 3.53 4.17 0.00 6.18 0.00 -1.26 -4.47 105.19 113.34 1ppq n GLY 998 Ca 0.07 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1ppq n GLY 998 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ppq n HIS 999 N 0.00 0.00 -3.74 1.61 8.25 -1.26 -4.71 115.22 115.37 1ppq n HIS 999 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.20 1ppq n HIS 999 Cb 0.00 -0.11 0.02 0.00 1.12 0.00 0.00 29.99 31.03 1ppq n HIS 999 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1ppq n SER 1000N -0.83 -2.92 -0.94 0.41 3.41 -1.26 -4.64 113.62 106.84 1ppq n SER 1000Ca 0.00 -0.95 0.09 0.00 -0.26 0.00 0.00 58.87 57.76 1ppq n SER 1000Cb 0.00 -3.57 -0.05 0.00 -0.26 0.00 0.00 64.21 60.33 1ppq n SER 1000CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1ppq n SER 1001N -2.89 -5.11 -3.05 4.04 2.88 -1.26 -5.04 113.62 103.19 1ppq n SER 1001Ca -0.21 0.99 -0.17 0.00 -1.33 0.00 0.00 58.87 58.15 1ppq n SER 1001Cb 0.64 -3.16 -0.06 0.00 -0.75 0.00 0.00 64.21 60.88 1ppq n SER 1001CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ppq n ALA 1002N -3.29 0.42 -3.69 -1.46 0.00 -1.24 -4.83 120.51 106.40 1ppq n ALA 1002Ca -0.05 -1.76 -0.19 0.00 0.00 0.00 0.00 53.44 51.44 1ppq n ALA 1002Cb 0.42 1.42 -0.18 0.00 0.00 0.00 0.00 19.45 21.12 1ppq n ALA 1002CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ppq s GLU 1003N -3.14 -0.06 -0.52 0.00 2.12 -1.26 -4.24 118.70 111.60 1ppq s GLU 1003Ca 0.35 0.33 -0.26 0.00 0.36 0.00 0.00 54.97 55.75 1ppq s GLU 1003Cb 0.01 -0.45 -0.08 0.00 0.26 0.00 0.00 34.13 33.87 1ppq s GLU 1003CO 0.25 -0.29 2.41 0.00 -0.54 0.00 0.00 175.26 177.08 1ppq s ILE 1005N 12.45 1.83 0.23 0.00 -4.36 -0.57 -4.00 121.20 126.79 1ppq s ILE 1005Ca 0.97 -0.91 -0.22 0.00 -0.26 0.00 0.00 60.65 60.22 1ppq s ILE 1005Cb -0.17 -1.57 -0.09 0.00 1.25 0.00 0.00 42.46 41.89 1ppq s ILE 1005CO 0.24 0.51 0.79 -0.76 0.24 0.00 0.00 174.94 175.96 1ppq s LEU 1006N 0.15 4.40 0.00 0.37 1.02 -1.26 -1.08 118.68 122.28 1ppq s LEU 1006Ca -0.10 1.56 0.08 0.00 0.02 0.00 0.00 54.13 55.69 1ppq s LEU 1006Cb -0.15 -3.62 0.13 0.00 0.02 0.00 0.00 46.19 42.57 1ppq s LEU 1006CO 0.05 0.05 1.05 -1.54 0.02 0.00 0.00 176.35 175.98 1ppq n SER 1007N 0.88 0.30 0.00 2.29 3.41 -1.24 -4.93 113.62 114.33 1ppq n SER 1007Ca -0.02 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.60 1ppq n SER 1007Cb 0.50 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1ppq n SER 1007CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ppq n GLY 1008N 0.15 -0.53 0.28 5.00 0.00 -1.26 -4.91 105.19 103.92 1ppq n GLY 1008Ca 0.02 0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1ppq n GLY 1008CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ppq n ASN 1009N 0.00 1.21 -3.86 1.61 5.15 -1.26 -4.88 115.26 113.23 1ppq n ASN 1009Ca 0.00 -0.99 -0.12 0.00 -0.60 0.00 0.00 54.58 52.87 1ppq n ASN 1009Cb 0.00 0.23 -0.13 0.00 -0.53 0.00 0.00 39.78 39.35 1ppq n ASN 1009CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1ppq s THR 1010N -2.52 0.02 -0.05 -0.44 2.01 -1.26 -5.05 115.64 108.34 1ppq s THR 1010Ca 0.22 -0.15 -0.22 0.00 0.31 0.00 0.00 61.69 61.85 1ppq s THR 1010Cb 0.19 -0.15 -0.04 0.00 0.01 0.00 0.00 72.50 72.50 1ppq s THR 1010CO 0.54 -0.08 0.64 0.00 -0.69 0.00 0.00 174.62 175.03 1ppq s ALA 1011N -0.23 3.40 0.22 7.40 0.00 -1.26 -3.59 121.76 127.69 1ppq s ALA 1011Ca -0.03 0.07 0.09 0.00 0.00 0.00 0.00 51.96 52.09 1ppq s ALA 1011Cb -0.02 -2.85 -0.05 0.00 0.00 0.00 0.00 23.12 20.20 1ppq s ALA 1011CO 0.00 -0.01 -0.17 -1.01 0.00 0.00 0.00 175.76 174.58 1ppq s HIS 1012N 0.47 1.89 0.36 0.00 3.76 -0.24 -4.16 115.29 117.37 1ppq s HIS 1012Ca 0.34 -0.49 -0.08 0.00 -0.15 0.00 0.00 55.06 54.68 1ppq s HIS 1012Cb -0.18 -0.87 -0.06 0.00 1.11 0.00 0.00 32.58 32.59 1ppq s HIS 1012CO 0.17 0.46 0.68 -1.58 -0.85 0.00 0.00 174.74 173.62 1ppq s TRP 1013N -2.72 3.48 -0.07 1.40 0.52 -1.26 -1.51 118.94 118.78 1ppq s TRP 1013Ca 0.24 0.86 -0.00 0.00 0.02 0.00 0.00 56.10 57.22 1ppq s TRP 1013Cb -0.03 -2.29 0.06 0.00 -1.15 0.00 0.00 33.47 30.06 1ppq s TRP 1013CO 0.09 0.00 1.77 0.43 0.02 0.00 0.00 176.95 179.27 1ppq n SER 1014N -1.20 4.97 -3.78 2.95 7.64 -1.21 -4.75 113.62 118.23 1ppq n SER 1014Ca 0.01 -2.46 -0.17 0.00 1.01 0.00 0.00 58.87 57.26 1ppq n SER 1014Cb 0.54 -0.97 -0.16 0.00 -1.01 0.00 0.00 64.21 62.61 1ppq n SER 1014CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ppq s THR 1015N -0.49 0.06 1.06 0.44 -4.23 -1.26 -4.83 115.64 106.39 1ppq s THR 1015Ca 0.07 0.17 -0.12 0.00 -1.18 0.00 0.00 61.69 60.63 1ppq s THR 1015Cb 0.06 -0.19 0.23 0.00 1.34 0.00 0.00 72.50 73.93 1ppq s THR 1015CO 0.00 0.13 1.07 -1.59 -0.54 0.00 0.00 174.62 173.69 1ppq s LYS 1016N 1.17 -0.12 0.09 3.99 0.00 -1.26 -4.87 119.74 118.74 1ppq s LYS 1016Ca -0.08 1.09 -0.32 0.00 0.00 0.00 0.00 55.97 56.66 1ppq s LYS 1016Cb -0.13 -1.63 -0.18 0.00 0.00 0.00 0.00 37.83 35.90 1ppq s LYS 1016CO -0.02 -3.26 0.76 -2.30 0.00 0.00 0.00 175.35 170.52 1ppq n PRO 1017N -4.62 0.00 -1.77 1.78 -0.02 -1.26 -4.74 135.00 124.37 1ppq n PRO 1017Ca 0.06 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.14 1ppq n PRO 1017Cb 0.53 -1.19 0.01 0.00 -0.02 0.00 0.00 33.50 32.84 1ppq n PRO 1017CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ppq n PRO 1018N 1.19 2.37 -4.21 0.52 -0.02 -1.26 -4.92 135.00 128.66 1ppq n PRO 1018Ca 0.18 0.84 -0.12 0.00 -2.02 0.00 0.00 63.50 62.38 1ppq n PRO 1018Cb 0.16 -2.65 -0.10 0.00 -0.02 0.00 0.00 33.50 30.89 1ppq n PRO 1018CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ppq s ILE 1019N -1.17 0.59 -0.10 4.25 1.01 -1.26 -4.87 121.20 119.65 1ppq s ILE 1019Ca 0.59 -1.96 -0.06 0.00 0.00 0.00 0.00 60.65 59.22 1ppq s ILE 1019Cb -0.45 -2.03 0.04 0.00 0.01 0.00 0.00 42.46 40.03 1ppq s ILE 1019CO 0.59 -0.55 0.24 0.00 0.00 0.00 0.00 174.94 175.22 1ppq s GLN 1021N 0.86 3.35 0.16 0.00 0.74 0.17 -4.89 119.66 120.04 1ppq s GLN 1021Ca -0.06 -0.65 -0.31 0.00 0.05 0.00 0.00 55.36 54.38 1ppq s GLN 1021Cb -0.07 -2.90 -0.11 0.00 1.10 0.00 0.00 33.01 31.02 1ppq s GLN 1021CO -0.05 -0.12 1.77 0.50 -0.55 0.00 0.00 175.29 176.83 1ppq s ARG 1022N 1.26 4.14 -0.39 1.67 3.52 -1.26 -0.77 118.95 127.10 1ppq s ARG 1022Ca 0.03 2.59 -0.23 0.00 -0.13 0.00 0.00 55.73 57.99 1ppq s ARG 1022Cb -0.14 -3.36 0.01 0.00 -1.56 0.00 0.00 34.95 29.90 1ppq s ARG 1022CO -0.03 -0.79 0.76 0.42 -0.81 0.00 0.00 175.30 174.85 1ppq s ILE 1023N 2.02 4.72 -2.00 4.11 1.01 -0.92 -4.91 121.20 125.23 1ppq s ILE 1023Ca 0.78 0.67 0.14 0.00 0.00 0.00 0.00 60.65 62.25 1ppq s ILE 1023Cb -0.47 -4.23 0.41 0.00 0.01 0.00 0.00 42.46 38.17 1ppq s ILE 1023CO 0.34 -0.52 1.28 -0.81 0.00 0.00 0.00 174.94 175.22