#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 -3.14 -2.58 4.31 0.00 -1.26 -4.89 120.51 112.94 1ppq n ALA 958 Ca 0.00 0.64 -0.43 0.00 0.00 0.00 0.00 53.44 53.65 1ppq n ALA 958 Cb 0.00 -1.85 -0.03 0.00 0.00 0.00 0.00 19.45 17.57 1ppq n ALA 958 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ppq s GLU 959 N -1.90 3.66 -0.06 0.00 8.01 -1.26 -4.92 118.70 122.22 1ppq s GLU 959 Ca 0.10 0.39 -0.02 0.00 0.01 0.00 0.00 54.97 55.44 1ppq s GLU 959 Cb -0.02 -3.89 -0.01 0.00 -4.31 0.00 0.00 34.13 25.90 1ppq s GLU 959 CO 0.71 -1.22 -0.04 0.00 0.01 0.00 0.00 175.26 174.72 1ppq h ALA 960 N 9.00 0.00 -3.77 5.21 0.00 -1.98 -3.43 119.26 124.28 1ppq h ALA 960 Ca -0.23 -0.18 -0.34 0.00 0.00 0.00 0.00 54.91 54.16 1ppq h ALA 960 Cb 1.07 0.12 -0.27 0.00 0.00 0.00 0.00 17.79 18.72 1ppq h ALA 960 CO 1.05 0.12 -0.76 0.21 0.00 0.00 0.00 179.25 179.87 1ppq s LYS 961 N -1.45 0.56 0.00 0.00 2.20 -1.26 -4.21 119.74 115.58 1ppq s LYS 961 Ca -0.04 -0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.19 1ppq s LYS 961 Cb 0.00 -0.51 0.00 0.00 -1.51 0.00 0.00 37.83 35.82 1ppq s LYS 961 CO 0.05 0.13 0.00 -1.13 -0.36 0.00 0.00 175.35 174.04 1ppq n SER 962 N 2.53 0.00 -4.73 1.43 3.41 -1.26 -5.02 113.62 109.99 1ppq n SER 962 Ca -0.15 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.08 1ppq n SER 962 Cb 0.57 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.46 1ppq n SER 962 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ppq n LYS 964 N 3.61 0.73 0.04 0.00 3.00 -1.26 -4.71 118.16 119.57 1ppq n LYS 964 Ca -0.07 -1.92 0.00 0.00 -0.00 0.00 0.00 58.31 56.32 1ppq n LYS 964 Cb 0.52 -1.45 0.00 0.00 0.00 0.00 0.00 35.03 34.09 1ppq n LYS 964 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1ppq n THR 965 N 1.85 0.75 -1.48 3.15 -1.04 -1.26 -5.03 114.28 111.22 1ppq n THR 965 Ca 0.12 0.25 -0.46 0.00 -2.04 0.00 0.00 64.05 61.91 1ppq n THR 965 Cb 0.61 -1.45 -0.07 0.00 -1.82 0.00 0.00 70.33 67.60 1ppq n THR 965 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1ppq n PRO 966 N -3.32 1.01 -0.06 -2.82 -0.02 -1.26 -4.95 135.00 123.57 1ppq n PRO 966 Ca 0.00 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1ppq n PRO 966 Cb 0.15 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.04 1ppq n PRO 966 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1ppq n PRO 967 N 8.43 1.16 -2.58 0.52 -0.04 -1.26 -5.01 135.00 136.23 1ppq n PRO 967 Ca 0.43 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.46 1ppq n PRO 967 Cb 0.28 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.72 1ppq n PRO 967 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1ppq s ASP 968 N -1.00 6.76 0.63 3.54 -4.77 -1.26 -4.50 116.67 116.06 1ppq s ASP 968 Ca 0.00 0.87 -0.17 0.00 -3.30 0.00 0.00 52.55 49.95 1ppq s ASP 968 Cb 0.00 -2.54 -0.02 0.00 -1.09 0.00 0.00 42.92 39.27 1ppq s ASP 968 CO 0.00 -1.07 1.14 -2.16 0.70 0.00 0.00 175.17 173.79 1ppq s PRO 969 N 4.07 2.89 0.19 2.11 0.04 -1.26 -4.95 135.00 138.09 1ppq s PRO 969 Ca 0.49 1.57 -0.32 0.00 0.04 0.00 0.00 61.00 62.78 1ppq s PRO 969 Cb -0.11 -1.95 -0.11 0.00 0.04 0.00 0.00 34.50 32.37 1ppq s PRO 969 CO 0.23 -1.21 1.69 0.54 0.04 0.00 0.00 177.00 178.28 1ppq s VAL 970 N -2.02 2.23 -0.93 -0.36 0.11 -1.26 -3.13 120.40 115.04 1ppq s VAL 970 Ca 0.71 0.14 -0.09 0.00 -2.93 0.00 0.00 61.98 59.81 1ppq s VAL 970 Cb -0.24 -3.09 0.00 0.00 -1.53 0.00 0.00 36.38 31.52 1ppq s VAL 970 CO 0.37 0.01 0.67 0.59 -3.33 0.00 0.00 175.10 173.41 1ppq n ASN 971 N 4.11 -5.42 0.00 3.54 4.13 -1.26 -4.66 115.26 115.71 1ppq n ASN 971 Ca 0.15 -0.86 0.00 0.00 1.68 0.00 0.00 54.58 55.56 1ppq n ASN 971 Cb 0.36 -2.72 0.00 0.00 -1.54 0.00 0.00 39.78 35.88 1ppq n ASN 971 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ppq n GLY 972 N -1.74 -0.55 3.38 7.41 0.00 -1.18 -0.42 105.19 112.09 1ppq n GLY 972 Ca -0.18 -1.07 -0.14 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.77 0.60 0.21 1.61 0.23 -0.89 -4.44 119.30 114.85 1ppq s MET 973 Ca 0.00 0.60 -0.26 0.00 -1.03 0.00 0.00 55.69 55.00 1ppq s MET 973 Cb 0.00 0.29 -0.08 0.00 -1.53 0.00 0.00 34.83 33.51 1ppq s MET 973 CO 0.00 -0.09 0.83 0.54 -2.03 0.00 0.00 175.02 174.27 1ppq s VAL 974 N 0.08 4.29 -0.33 5.16 0.11 -1.26 -3.40 120.40 125.05 1ppq s VAL 974 Ca -0.01 1.78 0.01 0.00 -2.93 0.00 0.00 61.98 60.83 1ppq s VAL 974 Cb -0.03 -4.15 0.09 0.00 -1.53 0.00 0.00 36.38 30.75 1ppq s VAL 974 CO 0.01 0.45 0.04 -1.00 -3.33 0.00 0.00 175.10 171.27 1ppq s HIS 975 N -1.24 3.54 -0.46 1.54 3.76 -0.45 -4.99 115.29 117.00 1ppq s HIS 975 Ca 0.39 -2.55 -0.28 0.00 -0.15 0.00 0.00 55.06 52.47 1ppq s HIS 975 Cb -0.23 -2.64 0.03 0.00 1.11 0.00 0.00 32.58 30.85 1ppq s HIS 975 CO 0.27 -0.92 1.09 0.54 -0.85 0.00 0.00 174.74 174.88 1ppq s VAL 976 N 1.05 4.29 0.27 -0.90 0.11 -1.26 -1.97 120.40 121.99 1ppq s VAL 976 Ca 0.03 1.20 -0.04 0.00 -2.93 0.00 0.00 61.98 60.25 1ppq s VAL 976 Cb -0.20 -4.55 0.26 0.00 -1.53 0.00 0.00 36.38 30.36 1ppq s VAL 976 CO -0.05 -0.91 1.93 0.40 -3.33 0.00 0.00 175.10 173.13 1ppq h ILE 977 N 6.14 1.20 0.00 7.04 2.04 -1.91 -3.43 117.51 128.59 1ppq h ILE 977 Ca -0.23 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1ppq h ILE 977 Cb 1.06 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1ppq h ILE 977 CO 1.10 0.23 0.00 0.41 0.00 0.00 0.00 178.15 179.88 1ppq n THR 978 N -4.42 0.00 -3.45 -0.27 -1.04 -1.26 -5.15 114.28 98.69 1ppq n THR 978 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1ppq n THR 978 Cb 0.06 -0.07 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 1ppq n THR 978 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1ppq n ASP 979 N -2.51 0.00 -2.02 8.00 8.00 -1.26 -5.09 116.55 121.68 1ppq n ASP 979 Ca 0.00 -0.76 -0.00 0.00 0.71 0.00 0.00 54.79 54.73 1ppq n ASP 979 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.13 1ppq n ASP 979 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1ppq n ILE 980 N 0.00 0.38 -2.72 0.53 -5.35 -1.26 -4.75 119.36 106.19 1ppq n ILE 980 Ca 0.00 -1.39 -0.18 0.00 -0.27 0.00 0.00 62.75 60.91 1ppq n ILE 980 Cb 0.00 1.00 0.09 0.00 -1.74 0.00 0.00 39.64 38.98 1ppq n ILE 980 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ppq n GLN 981 N -0.29 0.23 -1.79 6.28 10.64 -1.26 -3.79 117.38 127.40 1ppq n GLN 981 Ca -0.04 -2.43 -0.41 0.00 -1.83 0.00 0.00 57.00 52.28 1ppq n GLN 981 Cb 0.91 -0.44 -0.01 0.00 -0.86 0.00 0.00 30.24 29.84 1ppq n GLN 981 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1ppq s VAL 982 N -2.40 2.05 0.00 -0.39 1.01 -1.26 -1.65 120.40 117.75 1ppq s VAL 982 Ca 0.55 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.57 1ppq s VAL 982 Cb -0.04 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1ppq s VAL 982 CO 0.36 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.08 1ppq n GLY 983 N 1.30 2.69 3.87 4.51 0.00 -1.25 -5.01 105.19 111.31 1ppq n GLY 983 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.84 6.64 -0.04 1.61 0.01 -0.66 -4.97 113.70 113.45 1ppq s SER 984 Ca 0.00 0.95 0.03 0.00 1.31 0.00 0.00 55.95 58.24 1ppq s SER 984 Cb 0.00 -2.24 0.01 0.00 0.21 0.00 0.00 66.02 64.00 1ppq s SER 984 CO 0.00 -0.09 -0.11 -0.60 0.41 0.00 0.00 173.24 172.85 1ppq s ARG 985 N -2.84 1.34 0.42 12.44 3.52 -1.26 -3.45 118.95 129.13 1ppq s ARG 985 Ca 0.48 -0.37 0.06 0.00 -0.13 0.00 0.00 55.73 55.77 1ppq s ARG 985 Cb -0.11 -1.18 0.06 0.00 -1.56 0.00 0.00 34.95 32.16 1ppq s ARG 985 CO 0.21 0.08 0.48 0.44 -0.81 0.00 0.00 175.30 175.69 1ppq n ILE 986 N 3.54 0.00 -3.96 4.11 -5.35 -1.22 -4.62 119.36 111.86 1ppq n ILE 986 Ca -0.21 -1.52 -0.14 0.00 -0.27 0.00 0.00 62.75 60.61 1ppq n ILE 986 Cb 0.53 -0.43 -0.15 0.00 -1.74 0.00 0.00 39.64 37.85 1ppq n ILE 986 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1ppq s THR 987 N -1.83 0.16 0.08 7.28 -4.23 -0.83 -3.60 115.64 112.67 1ppq s THR 987 Ca 0.36 -0.04 0.02 0.00 -1.18 0.00 0.00 61.69 60.85 1ppq s THR 987 Cb -0.03 -0.16 -0.04 0.00 1.34 0.00 0.00 72.50 73.61 1ppq s THR 987 CO 0.23 0.07 0.12 -0.31 -0.54 0.00 0.00 174.62 174.19 1ppq s TYR 988 N 0.20 3.28 -0.21 3.99 2.02 -1.18 -1.34 117.35 124.10 1ppq s TYR 988 Ca -0.02 0.12 -0.17 0.00 -0.37 0.00 0.00 57.07 56.63 1ppq s TYR 988 Cb -0.04 -1.65 0.06 0.00 -0.40 0.00 0.00 41.96 39.93 1ppq s TYR 988 CO -0.01 0.54 0.54 -1.12 -1.57 0.00 0.00 175.55 173.94 1ppq s SER 989 N -2.51 -0.61 1.12 2.29 0.01 -1.22 -4.88 113.70 107.90 1ppq s SER 989 Ca 0.31 1.12 -0.15 0.00 1.31 0.00 0.00 55.95 58.54 1ppq s SER 989 Cb -0.12 1.10 0.22 0.00 0.21 0.00 0.00 66.02 67.43 1ppq s SER 989 CO 0.24 -0.20 0.96 0.00 0.41 0.00 0.00 173.24 174.65 1ppq n THR 991 N -4.04 0.50 0.00 0.00 5.66 0.44 -4.21 114.28 112.64 1ppq n THR 991 Ca 0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.13 1ppq n THR 991 Cb 0.47 -0.73 0.00 0.00 -1.55 0.00 0.00 70.33 68.52 1ppq n THR 991 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1ppq n THR 992 N -1.84 0.00 0.00 1.09 -1.04 -1.26 -4.96 114.28 106.27 1ppq n THR 992 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 1ppq n THR 992 Cb 0.32 -0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.68 1ppq n THR 992 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ppq n GLY 993 N 1.89 0.31 3.66 3.41 0.00 -1.26 -5.15 105.19 108.05 1ppq n GLY 993 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.31 1.91 0.26 1.61 3.76 -1.26 -4.93 115.29 116.33 1ppq s HIS 994 Ca 0.00 1.44 -0.30 0.00 -0.15 0.00 0.00 55.06 56.05 1ppq s HIS 994 Cb 0.00 -3.19 -0.11 0.00 1.11 0.00 0.00 32.58 30.39 1ppq s HIS 994 CO 0.00 -2.80 1.56 0.50 -0.85 0.00 0.00 174.74 173.15 1ppq s ARG 995 N -4.73 4.17 -0.31 1.40 3.52 -1.26 -4.72 118.95 117.02 1ppq s ARG 995 Ca 0.65 2.48 -0.23 0.00 -0.13 0.00 0.00 55.73 58.50 1ppq s ARG 995 Cb -0.21 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 30.11 1ppq s ARG 995 CO 0.59 -0.58 0.78 -1.17 -0.81 0.00 0.00 175.30 174.11 1ppq s LEU 996 N -0.16 4.09 -1.34 -0.88 1.98 -1.26 -1.42 118.68 119.70 1ppq s LEU 996 Ca 0.64 0.65 -0.17 0.00 -2.89 0.00 0.00 54.13 52.36 1ppq s LEU 996 Cb -0.46 -3.06 0.05 0.00 0.66 0.00 0.00 46.19 43.38 1ppq s LEU 996 CO 0.43 -0.61 1.91 -0.38 -1.89 0.00 0.00 176.35 175.82 1ppq n ILE 997 N 5.53 3.69 0.00 6.68 2.08 -0.88 -4.57 119.36 131.90 1ppq n ILE 997 Ca 0.03 -3.65 0.00 0.00 0.56 0.00 0.00 62.75 59.70 1ppq n ILE 997 Cb 0.48 -2.43 0.00 0.00 -0.75 0.00 0.00 39.64 36.94 1ppq n ILE 997 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1ppq n GLY 998 N 4.97 -0.12 3.12 7.39 0.00 -1.26 -4.24 105.19 115.05 1ppq n GLY 998 Ca 0.50 -0.06 -0.12 0.00 0.00 0.00 0.00 46.02 46.34 1ppq n GLY 998 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ppq s HIS 999 N 0.00 -0.42 -0.09 1.61 2.46 -1.26 -5.03 115.29 112.55 1ppq s HIS 999 Ca 0.00 0.95 0.01 0.00 0.47 0.00 0.00 55.06 56.49 1ppq s HIS 999 Cb 0.00 0.11 0.13 0.00 -0.13 0.00 0.00 32.58 32.69 1ppq s HIS 999 CO 0.00 -0.27 1.21 0.43 -2.47 0.00 0.00 174.74 173.64 1ppq n SER 1000N 4.30 3.25 -3.56 9.88 7.64 -1.26 -4.67 113.62 129.20 1ppq n SER 1000Ca -0.24 -2.33 -0.01 0.00 1.01 0.00 0.00 58.87 57.29 1ppq n SER 1000Cb 0.53 -0.59 -0.05 0.00 -1.01 0.00 0.00 64.21 63.09 1ppq n SER 1000CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ppq s SER 1001N 0.57 -0.68 0.25 6.43 1.04 -1.26 -3.10 113.70 116.95 1ppq s SER 1001Ca 0.11 1.00 0.09 0.00 0.48 0.00 0.00 55.95 57.64 1ppq s SER 1001Cb 0.10 1.53 -0.04 0.00 0.10 0.00 0.00 66.02 67.71 1ppq s SER 1001CO 0.02 -0.15 -0.02 0.00 0.98 0.00 0.00 173.24 174.07 1ppq s ALA 1002N 1.96 3.13 -0.10 5.32 0.00 -1.24 -4.87 121.76 125.97 1ppq s ALA 1002Ca -0.07 -1.62 0.01 0.00 0.00 0.00 0.00 51.96 50.29 1ppq s ALA 1002Cb -0.06 -0.77 0.02 0.00 0.00 0.00 0.00 23.12 22.31 1ppq s ALA 1002CO -0.17 0.30 -0.13 -2.00 0.00 0.00 0.00 175.76 173.77 1ppq s GLU 1003N -3.52 1.93 -0.53 0.00 2.12 -1.26 -3.38 118.70 114.06 1ppq s GLU 1003Ca 0.30 -0.45 -0.27 0.00 0.36 0.00 0.00 54.97 54.92 1ppq s GLU 1003Cb -0.07 -1.71 -0.03 0.00 0.26 0.00 0.00 34.13 32.59 1ppq s GLU 1003CO 0.19 -0.10 1.94 0.00 -0.54 0.00 0.00 175.26 176.75 1ppq s ILE 1005N 9.10 2.16 -0.06 0.00 -4.36 -1.24 -3.81 121.20 122.99 1ppq s ILE 1005Ca 0.75 -1.96 0.04 0.00 -0.26 0.00 0.00 60.65 59.22 1ppq s ILE 1005Cb -0.16 -2.93 -0.00 0.00 1.25 0.00 0.00 42.46 40.62 1ppq s ILE 1005CO 0.24 -0.05 -0.19 -0.76 0.24 0.00 0.00 174.94 174.42 1ppq s LEU 1006N -3.74 1.94 0.00 0.37 1.43 -1.26 -2.67 118.68 114.75 1ppq s LEU 1006Ca 0.36 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1ppq s LEU 1006Cb 0.07 -1.11 0.00 0.00 0.03 0.00 0.00 46.19 45.18 1ppq s LEU 1006CO 0.19 0.16 0.00 -1.54 0.23 0.00 0.00 176.35 175.39 1ppq n SER 1007N 3.22 0.00 0.00 2.29 3.41 -1.26 -5.07 113.62 116.22 1ppq n SER 1007Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1ppq n SER 1007Cb 0.53 0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 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 -0.02 0.62 0.00 5.00 0.00 -1.26 -4.98 105.19 104.55 1ppq n GLY 1008Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1ppq n GLY 1008CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ppq n ASN 1009N 0.00 0.90 -3.81 1.61 3.02 -1.26 -4.93 115.26 110.80 1ppq n ASN 1009Ca 0.00 -0.87 -0.13 0.00 -0.03 0.00 0.00 54.58 53.55 1ppq n ASN 1009Cb 0.00 1.00 -0.13 0.00 -0.61 0.00 0.00 39.78 40.03 1ppq n ASN 1009CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1ppq s THR 1010N -3.03 -0.01 0.07 3.41 -1.32 -1.26 -5.13 115.64 108.37 1ppq s THR 1010Ca 0.07 0.05 -0.31 0.00 -1.21 0.00 0.00 61.69 60.30 1ppq s THR 1010Cb 0.16 -0.19 -0.08 0.00 -1.51 0.00 0.00 72.50 70.87 1ppq s THR 1010CO 0.86 0.02 1.64 0.00 -2.21 0.00 0.00 174.62 174.93 1ppq s ALA 1011N 0.38 3.68 0.03 11.08 0.00 -1.26 -4.67 121.76 131.00 1ppq s ALA 1011Ca -0.03 1.20 0.04 0.00 0.00 0.00 0.00 51.96 53.18 1ppq s ALA 1011Cb -0.04 -3.69 -0.02 0.00 0.00 0.00 0.00 23.12 19.37 1ppq s ALA 1011CO -0.02 -1.09 -0.11 -3.38 0.00 0.00 0.00 175.76 171.16 1ppq s HIS 1012N 2.60 1.01 0.45 0.00 -3.43 -1.09 -4.53 115.29 110.31 1ppq s HIS 1012Ca 0.74 -0.31 -0.24 0.00 -0.80 0.00 0.00 55.06 54.45 1ppq s HIS 1012Cb -0.40 -0.61 -0.07 0.00 -1.43 0.00 0.00 32.58 30.07 1ppq s HIS 1012CO 0.32 0.00 1.22 -1.58 -2.00 0.00 0.00 174.74 172.70 1ppq s TRP 1013N -0.73 2.81 -0.08 0.38 0.52 -1.26 -3.66 118.94 116.91 1ppq s TRP 1013Ca 0.00 1.49 0.01 0.00 0.02 0.00 0.00 56.10 57.62 1ppq s TRP 1013Cb -0.07 -3.49 0.11 0.00 -1.15 0.00 0.00 33.47 28.88 1ppq s TRP 1013CO 0.01 -1.78 1.24 -1.13 0.02 0.00 0.00 176.95 175.31 1ppq n SER 1014N -0.38 3.39 -3.85 2.95 3.41 -1.18 -4.74 113.62 113.22 1ppq n SER 1014Ca 0.07 -2.32 -0.20 0.00 -0.26 0.00 0.00 58.87 56.16 1ppq n SER 1014Cb 0.47 -0.61 -0.17 0.00 -0.26 0.00 0.00 64.21 63.64 1ppq n SER 1014CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ppq s THR 1015N -0.61 0.40 0.91 6.66 -4.23 -1.26 -4.88 115.64 112.63 1ppq s THR 1015Ca 0.10 -0.01 -0.10 0.00 -1.18 0.00 0.00 61.69 60.50 1ppq s THR 1015Cb 0.08 -0.47 0.14 0.00 1.34 0.00 0.00 72.50 73.59 1ppq s THR 1015CO 0.02 0.21 1.12 -1.59 -0.54 0.00 0.00 174.62 173.84 1ppq s LYS 1016N 1.17 1.10 -0.29 3.99 0.00 -1.26 -4.85 119.74 119.59 1ppq s LYS 1016Ca -0.07 1.36 -0.37 0.00 0.00 0.00 0.00 55.97 56.88 1ppq s LYS 1016Cb -0.14 -1.75 -0.13 0.00 0.00 0.00 0.00 37.83 35.81 1ppq s LYS 1016CO -0.01 -2.51 1.96 -0.35 0.00 0.00 0.00 175.35 174.44 1ppq n PRO 1017N -4.13 1.23 -1.98 1.78 -0.04 -1.26 -4.83 135.00 125.76 1ppq n PRO 1017Ca 0.10 0.41 -0.39 0.00 -0.04 0.00 0.00 63.50 63.58 1ppq n PRO 1017Cb 0.53 -2.30 0.01 0.00 -0.04 0.00 0.00 33.50 31.69 1ppq n PRO 1017CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1ppq s PRO 1018N 4.82 3.69 0.21 0.54 0.04 -1.26 -4.96 135.00 138.07 1ppq s PRO 1018Ca 1.03 2.15 0.04 0.00 0.04 0.00 0.00 61.00 64.26 1ppq s PRO 1018Cb -0.95 -2.56 -0.05 0.00 0.04 0.00 0.00 34.50 30.98 1ppq s PRO 1018CO 0.57 -0.72 -0.03 0.42 0.04 0.00 0.00 177.00 177.28 1ppq s ILE 1019N -1.31 1.05 -0.26 0.56 1.01 -1.26 -4.58 121.20 116.41 1ppq s ILE 1019Ca 0.62 -2.04 -0.01 0.00 0.00 0.00 0.00 60.65 59.23 1ppq s ILE 1019Cb -0.38 -2.20 0.04 0.00 0.01 0.00 0.00 42.46 39.93 1ppq s ILE 1019CO 0.47 -0.44 -0.07 0.00 0.00 0.00 0.00 174.94 174.90 1ppq n GLN 1021N 4.61 0.18 -2.00 0.00 7.27 -0.50 -4.91 117.38 122.03 1ppq n GLN 1021Ca -0.16 0.34 0.00 0.00 0.07 0.00 0.00 57.00 57.26 1ppq n GLN 1021Cb 0.45 -1.81 0.00 0.00 2.41 0.00 0.00 30.24 31.30 1ppq n GLN 1021CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1ppq n ARG 1022N -2.15 -4.37 -3.94 3.69 0.63 -1.26 -4.91 116.66 104.35 1ppq n ARG 1022Ca 0.03 3.23 -0.35 0.00 -0.92 0.00 0.00 57.85 59.85 1ppq n ARG 1022Cb 0.27 -3.81 -0.10 0.00 0.45 0.00 0.00 32.46 29.28 1ppq n ARG 1022CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1ppq s ILE 1023N -0.47 4.79 -2.00 5.15 1.01 -1.26 -4.90 121.20 123.52 1ppq s ILE 1023Ca 0.00 -0.03 0.15 0.00 0.00 0.00 0.00 60.65 60.77 1ppq s ILE 1023Cb 0.00 -3.18 0.43 0.00 0.01 0.00 0.00 42.46 39.72 1ppq s ILE 1023CO 0.00 0.43 1.31 -0.81 0.00 0.00 0.00 174.94 175.88