#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 -3.50 -3.85 0.62 0.00 -1.26 -4.69 120.51 107.82 1ppq n ALA 958 Ca 0.00 0.56 -0.32 0.00 0.00 0.00 0.00 53.44 53.68 1ppq n ALA 958 Cb 0.00 -1.29 -0.12 0.00 0.00 0.00 0.00 19.45 18.04 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 -2.75 2.31 0.20 0.00 0.41 -1.26 -4.75 118.70 112.87 1ppq s GLU 959 Ca 0.00 -2.75 -0.06 0.00 -0.41 0.00 0.00 54.97 51.75 1ppq s GLU 959 Cb 0.00 -3.50 0.02 0.00 -1.78 0.00 0.00 34.13 28.88 1ppq s GLU 959 CO 0.00 -1.16 0.38 0.00 -0.49 0.00 0.00 175.26 173.98 1ppq n ALA 960 N 2.99 -0.74 -1.17 5.21 0.00 -1.26 -5.04 120.51 120.50 1ppq n ALA 960 Ca 0.09 -0.72 0.05 0.00 0.00 0.00 0.00 53.44 52.86 1ppq n ALA 960 Cb 0.34 0.58 -0.03 0.00 0.00 0.00 0.00 19.45 20.34 1ppq n ALA 960 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ppq n LYS 961 N -0.29 -2.95 -4.24 0.00 4.81 -1.26 -4.08 118.16 110.15 1ppq n LYS 961 Ca -0.03 2.33 -0.34 0.00 -0.87 0.00 0.00 58.31 59.40 1ppq n LYS 961 Cb 0.31 -3.06 -0.12 0.00 0.02 0.00 0.00 35.03 32.19 1ppq n LYS 961 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1ppq s SER 962 N -5.47 4.92 -0.08 3.14 0.01 -1.26 -4.15 113.70 110.81 1ppq s SER 962 Ca 0.00 -0.13 -0.15 0.00 1.31 0.00 0.00 55.95 56.99 1ppq s SER 962 Cb 0.00 -1.82 -0.05 0.00 0.21 0.00 0.00 66.02 64.36 1ppq s SER 962 CO 0.00 0.13 0.38 0.00 0.41 0.00 0.00 173.24 174.16 1ppq n LYS 964 N 2.80 1.98 -2.20 0.00 2.85 -1.26 -4.76 118.16 117.57 1ppq n LYS 964 Ca -0.12 0.56 -0.38 0.00 -1.05 0.00 0.00 58.31 57.33 1ppq n LYS 964 Cb 0.52 -3.17 -0.01 0.00 -0.65 0.00 0.00 35.03 31.72 1ppq n LYS 964 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1ppq s THR 965 N 7.93 2.97 0.23 0.58 -4.23 -1.26 -4.81 115.64 117.05 1ppq s THR 965 Ca 1.00 0.77 -0.30 0.00 -1.18 0.00 0.00 61.69 61.98 1ppq s THR 965 Cb -0.38 -3.41 -0.09 0.00 1.34 0.00 0.00 72.50 69.97 1ppq s THR 965 CO 0.37 0.03 1.03 -2.16 -0.54 0.00 0.00 174.62 173.34 1ppq s PRO 966 N -2.56 4.72 0.64 3.99 0.04 -1.26 -5.05 135.00 135.52 1ppq s PRO 966 Ca 0.62 1.65 -0.14 0.00 0.04 0.00 0.00 61.00 63.16 1ppq s PRO 966 Cb -0.31 -3.25 -0.01 0.00 0.04 0.00 0.00 34.50 30.96 1ppq s PRO 966 CO 0.38 0.30 1.07 -1.25 0.04 0.00 0.00 177.00 177.55 1ppq s PRO 967 N -1.05 3.04 -0.21 0.56 0.04 -1.26 -4.93 135.00 131.19 1ppq s PRO 967 Ca 0.44 1.21 -0.30 0.00 0.04 0.00 0.00 61.00 62.39 1ppq s PRO 967 Cb -0.29 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.19 1ppq s PRO 967 CO 0.36 -1.04 2.18 -0.25 0.04 0.00 0.00 177.00 178.29 1ppq n ASP 968 N -2.43 3.15 -4.71 6.66 8.00 -1.26 -4.92 116.55 121.04 1ppq n ASP 968 Ca 0.09 0.34 -0.35 0.00 0.71 0.00 0.00 54.79 55.58 1ppq n ASP 968 Cb 0.53 -1.49 0.10 0.00 -0.02 0.00 0.00 41.12 40.24 1ppq n ASP 968 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1ppq n PRO 969 N 8.43 0.63 -2.06 -0.24 -0.02 -1.26 -4.93 135.00 135.54 1ppq n PRO 969 Ca 0.31 0.28 -0.42 0.00 -2.02 0.00 0.00 63.50 61.65 1ppq n PRO 969 Cb 0.40 -2.48 -0.03 0.00 -0.02 0.00 0.00 33.50 31.36 1ppq n PRO 969 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ppq s VAL 970 N -1.77 3.05 -1.30 -1.45 0.11 -1.26 -2.10 120.40 115.68 1ppq s VAL 970 Ca 0.78 0.73 0.00 0.00 -2.93 0.00 0.00 61.98 60.55 1ppq s VAL 970 Cb -0.33 -3.46 0.00 0.00 -1.53 0.00 0.00 36.38 31.05 1ppq s VAL 970 CO 0.46 0.05 0.00 0.59 -3.33 0.00 0.00 175.10 172.86 1ppq n ASN 971 N 4.18 -4.31 -1.58 3.54 3.02 -1.26 -4.84 115.26 114.00 1ppq n ASN 971 Ca 0.13 0.18 -0.05 0.00 -0.03 0.00 0.00 54.58 54.81 1ppq n ASN 971 Cb 0.41 -3.70 -0.02 0.00 -0.61 0.00 0.00 39.78 35.86 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 -0.75 3.32 3.64 7.41 0.00 -0.89 -0.74 105.19 117.18 1ppq n GLY 972 Ca -0.17 -1.59 -0.04 0.00 0.00 0.00 0.00 46.02 44.22 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 -2.30 0.48 0.22 1.61 0.23 -0.37 -4.40 119.30 114.77 1ppq s MET 973 Ca 0.10 0.81 -0.21 0.00 -1.03 0.00 0.00 55.69 55.35 1ppq s MET 973 Cb 0.00 0.11 -0.08 0.00 -1.53 0.00 0.00 34.83 33.33 1ppq s MET 973 CO 0.07 -0.10 0.75 0.54 -2.03 0.00 0.00 175.02 174.25 1ppq s VAL 974 N 1.32 4.51 -0.10 5.16 0.11 -1.26 -3.15 120.40 126.99 1ppq s VAL 974 Ca -0.08 1.39 -0.11 0.00 -2.93 0.00 0.00 61.98 60.25 1ppq s VAL 974 Cb -0.04 -3.91 -0.27 0.00 -1.53 0.00 0.00 36.38 30.62 1ppq s VAL 974 CO -0.15 0.26 0.47 0.45 -3.33 0.00 0.00 175.10 172.80 1ppq h HIS 975 N 3.57 0.51 -5.78 1.54 3.86 -1.73 -3.50 115.15 113.61 1ppq h HIS 975 Ca -0.48 -0.37 -0.02 0.00 -1.16 0.00 0.00 60.37 58.34 1ppq h HIS 975 Cb 1.20 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.65 1ppq h HIS 975 CO 0.64 1.69 -0.99 0.28 0.86 0.00 0.00 177.93 180.42 1ppq n VAL 976 N -3.67 -7.06 0.00 2.45 0.31 -1.26 -4.96 118.33 104.14 1ppq n VAL 976 Ca -0.29 1.10 0.00 0.00 -0.01 0.00 0.00 64.34 65.14 1ppq n VAL 976 Cb 1.00 -5.01 0.00 0.00 -0.91 0.00 0.00 33.84 28.92 1ppq n VAL 976 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1ppq n ILE 977 N 0.87 0.00 -0.05 2.52 -0.00 -1.26 -4.78 119.36 116.65 1ppq n ILE 977 Ca 0.00 1.04 -0.08 0.00 -0.00 0.00 0.00 62.75 63.71 1ppq n ILE 977 Cb 0.29 -1.99 -0.03 0.00 -0.00 0.00 0.00 39.64 37.91 1ppq n ILE 977 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 1ppq n THR 978 N -1.77 1.33 -3.64 1.39 -2.24 -1.26 -5.12 114.28 102.97 1ppq n THR 978 Ca 0.00 0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1ppq n THR 978 Cb 0.00 -2.02 0.00 0.00 -2.10 0.00 0.00 70.33 66.21 1ppq n THR 978 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ppq n ASP 979 N -4.06 0.00 -1.55 3.42 8.00 -1.26 -5.09 116.55 116.01 1ppq n ASP 979 Ca -0.14 -0.84 0.01 0.00 0.71 0.00 0.00 54.79 54.54 1ppq n ASP 979 Cb 0.41 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.51 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 0.11 -3.46 0.53 -6.64 -1.26 -4.69 119.36 103.95 1ppq n ILE 980 Ca 0.00 -0.98 0.00 0.00 -1.77 0.00 0.00 62.75 60.00 1ppq n ILE 980 Cb 0.00 0.93 0.00 0.00 -1.44 0.00 0.00 39.64 39.13 1ppq n ILE 980 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1ppq n GLN 981 N 0.25 2.46 -1.77 6.28 10.64 -1.26 -3.60 117.38 130.38 1ppq n GLN 981 Ca -0.01 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.74 1ppq n GLN 981 Cb 1.03 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 30.38 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 0.01 2.13 0.00 -0.39 1.01 -1.26 -1.85 120.40 120.05 1ppq s VAL 982 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1ppq s VAL 982 Cb 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1ppq s VAL 982 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.72 1ppq n GLY 983 N 3.61 1.10 3.52 4.51 0.00 -1.26 -4.57 105.19 112.10 1ppq n GLY 983 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1ppq n GLY 983 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ppq s SER 984 N -2.80 5.29 -0.21 1.61 1.04 -0.77 -5.06 113.70 112.79 1ppq s SER 984 Ca 0.00 -0.09 -0.07 0.00 0.48 0.00 0.00 55.95 56.27 1ppq s SER 984 Cb 0.00 -1.93 -0.03 0.00 0.10 0.00 0.00 66.02 64.16 1ppq s SER 984 CO 0.00 0.06 0.04 -0.60 0.98 0.00 0.00 173.24 173.72 1ppq s ARG 985 N 1.05 3.74 0.46 4.02 3.52 -1.26 -4.22 118.95 126.25 1ppq s ARG 985 Ca 0.04 -0.45 0.07 0.00 -0.13 0.00 0.00 55.73 55.25 1ppq s ARG 985 Cb -0.14 -3.20 -0.01 0.00 -1.56 0.00 0.00 34.95 30.03 1ppq s ARG 985 CO 0.03 0.03 0.31 0.96 -0.81 0.00 0.00 175.30 175.81 1ppq s ILE 986 N 1.00 2.16 0.01 4.11 -4.36 -1.13 -4.49 121.20 118.51 1ppq s ILE 986 Ca 0.03 -1.53 0.04 0.00 -0.26 0.00 0.00 60.65 58.93 1ppq s ILE 986 Cb -0.14 -2.70 -0.01 0.00 1.25 0.00 0.00 42.46 40.86 1ppq s ILE 986 CO 0.03 0.00 -0.12 0.42 0.24 0.00 0.00 174.94 175.50 1ppq s THR 987 N -2.63 0.96 0.10 8.37 -4.23 -1.26 -2.77 115.64 114.18 1ppq s THR 987 Ca 0.40 -0.73 0.05 0.00 -1.18 0.00 0.00 61.69 60.23 1ppq s THR 987 Cb -0.00 -0.84 -0.04 0.00 1.34 0.00 0.00 72.50 72.95 1ppq s THR 987 CO 0.23 0.11 -0.02 -0.31 -0.54 0.00 0.00 174.62 174.08 1ppq s TYR 988 N -0.58 2.93 -0.17 3.99 1.51 -1.22 -1.74 117.35 122.07 1ppq s TYR 988 Ca 0.02 -0.06 -0.09 0.00 -1.01 0.00 0.00 57.07 55.93 1ppq s TYR 988 Cb -0.06 -1.51 0.06 0.00 -0.11 0.00 0.00 41.96 40.34 1ppq s TYR 988 CO 0.00 0.47 0.41 -1.12 -1.11 0.00 0.00 175.55 174.20 1ppq s SER 989 N -2.31 -0.51 0.45 2.29 0.01 -1.19 -4.71 113.70 107.73 1ppq s SER 989 Ca 0.25 0.88 0.07 0.00 1.31 0.00 0.00 55.95 58.46 1ppq s SER 989 Cb -0.11 0.77 -0.02 0.00 0.21 0.00 0.00 66.02 66.86 1ppq s SER 989 CO 0.17 -0.19 0.29 0.00 0.41 0.00 0.00 173.24 173.92 1ppq n THR 991 N -1.46 4.56 -2.00 0.00 -2.24 0.08 -4.92 114.28 108.31 1ppq n THR 991 Ca -0.00 -0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 60.88 1ppq n THR 991 Cb 0.64 -1.38 -0.02 0.00 -2.10 0.00 0.00 70.33 67.47 1ppq n THR 991 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1ppq s THR 992 N -1.44 2.49 0.00 4.28 -1.32 -1.26 -2.93 115.64 115.45 1ppq s THR 992 Ca 0.81 0.48 0.00 0.00 -1.21 0.00 0.00 61.69 61.77 1ppq s THR 992 Cb -0.39 -3.30 0.00 0.00 -1.51 0.00 0.00 72.50 67.30 1ppq s THR 992 CO 0.42 0.11 0.00 0.61 -2.21 0.00 0.00 174.62 173.55 1ppq n GLY 993 N 0.95 0.74 3.08 6.08 0.00 -1.26 -5.07 105.19 109.70 1ppq n GLY 993 Ca 0.02 -0.38 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 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 1.12 -0.44 1.61 4.02 -1.15 -4.47 115.29 113.98 1ppq s HIS 994 Ca 0.00 -0.22 -0.21 0.00 1.02 0.00 0.00 55.06 55.65 1ppq s HIS 994 Cb 0.00 -0.72 0.02 0.00 -1.02 0.00 0.00 32.58 30.86 1ppq s HIS 994 CO 0.00 -0.02 0.65 1.03 1.02 0.00 0.00 174.74 177.42 1ppq s ARG 995 N -0.33 3.28 0.15 1.40 1.81 -1.26 -4.91 118.95 119.09 1ppq s ARG 995 Ca 0.05 -0.36 -0.31 0.00 -1.72 0.00 0.00 55.73 53.38 1ppq s ARG 995 Cb -0.05 -3.95 -0.09 0.00 -0.45 0.00 0.00 34.95 30.41 1ppq s ARG 995 CO -0.00 -1.02 1.49 -1.17 -0.68 0.00 0.00 175.30 173.92 1ppq s LEU 996 N 2.84 4.37 -0.22 2.53 1.98 -1.26 -1.35 118.68 127.57 1ppq s LEU 996 Ca 0.23 2.50 -0.12 0.00 -2.89 0.00 0.00 54.13 53.85 1ppq s LEU 996 Cb -0.14 -3.59 -0.05 0.00 0.66 0.00 0.00 46.19 43.07 1ppq s LEU 996 CO 0.19 -0.75 0.21 -0.63 -1.89 0.00 0.00 176.35 173.48 1ppq s ILE 997 N 1.06 5.34 0.00 6.68 1.01 -1.15 -4.75 121.20 129.39 1ppq s ILE 997 Ca 0.67 0.30 0.00 0.00 0.00 0.00 0.00 60.65 61.62 1ppq s ILE 997 Cb -0.41 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 38.52 1ppq s ILE 997 CO 0.31 0.34 0.00 0.61 0.00 0.00 0.00 174.94 176.21 1ppq n GLY 998 N 4.05 1.09 0.27 6.18 0.00 -1.26 -3.28 105.19 112.24 1ppq n GLY 998 Ca -0.14 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1ppq n GLY 998 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ppq n HIS 999 N 0.00 0.00 -1.18 1.61 -0.00 -1.26 -4.87 115.22 109.52 1ppq n HIS 999 Ca 0.00 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.09 1ppq n HIS 999 Cb 0.00 0.20 -0.04 0.00 -0.12 0.00 0.00 29.99 30.03 1ppq n HIS 999 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1ppq n SER 1000N 0.00 -4.65 -3.56 0.26 2.88 -1.26 -4.84 113.62 102.44 1ppq n SER 1000Ca 0.00 0.23 -0.06 0.00 -1.33 0.00 0.00 58.87 57.71 1ppq n SER 1000Cb 0.36 -3.54 -0.02 0.00 -0.75 0.00 0.00 64.21 60.26 1ppq n SER 1000CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1ppq s SER 1001N -2.07 -0.23 -0.05 -3.46 0.15 -1.26 -3.40 113.70 103.37 1ppq s SER 1001Ca 0.00 -0.00 -0.13 0.00 0.70 0.00 0.00 55.95 56.52 1ppq s SER 1001Cb 0.00 0.25 0.02 0.00 -1.71 0.00 0.00 66.02 64.58 1ppq s SER 1001CO 0.00 -0.40 0.30 0.00 1.20 0.00 0.00 173.24 174.34 1ppq s ALA 1002N -2.72 -0.75 -0.07 5.45 0.00 -1.11 -4.43 121.76 118.12 1ppq s ALA 1002Ca 0.08 0.50 -0.01 0.00 0.00 0.00 0.00 51.96 52.52 1ppq s ALA 1002Cb -0.01 -0.14 0.03 0.00 0.00 0.00 0.00 23.12 22.99 1ppq s ALA 1002CO -0.06 -0.22 0.01 -2.00 0.00 0.00 0.00 175.76 173.49 1ppq s GLU 1003N -0.77 0.52 -0.69 0.00 2.56 -1.26 -2.83 118.70 116.22 1ppq s GLU 1003Ca -0.09 0.14 -0.26 0.00 0.00 0.00 0.00 54.97 54.76 1ppq s GLU 1003Cb -0.04 -0.92 -0.13 0.00 2.00 0.00 0.00 34.13 35.04 1ppq s GLU 1003CO 0.03 -0.31 2.47 0.00 -0.56 0.00 0.00 175.26 176.89 1ppq n ILE 1005N 7.83 0.00 0.00 0.00 -6.64 -0.15 -4.52 119.36 115.88 1ppq n ILE 1005Ca 0.48 -0.03 0.00 0.00 -1.77 0.00 0.00 62.75 61.43 1ppq n ILE 1005Cb 0.38 -1.53 0.00 0.00 -1.44 0.00 0.00 39.64 37.04 1ppq n ILE 1005CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 1ppq n LEU 1006N 0.00 0.00 -2.08 7.28 4.77 -1.26 -3.59 117.00 122.12 1ppq n LEU 1006Ca 0.00 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.81 1ppq n LEU 1006Cb 0.01 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 1ppq n LEU 1006CO 0.01 0.00 -0.20 -1.20 -1.33 0.00 0.00 177.39 174.66 1ppq n SER 1007N 1.85 -4.94 0.00 -1.43 7.64 -0.25 -4.70 113.62 111.79 1ppq n SER 1007Ca 0.00 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1ppq n SER 1007Cb 0.00 -4.25 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 1ppq n SER 1007CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ppq n GLY 1008N -0.71 1.02 0.00 0.23 0.00 -1.26 -4.69 105.19 99.77 1ppq n GLY 1008Ca -0.20 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 45.93 1ppq n GLY 1008CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ppq n ASN 1009N 0.00 0.00 -1.59 1.61 0.23 -1.26 -4.89 115.26 109.36 1ppq n ASN 1009Ca 0.00 0.12 -0.04 0.00 -0.53 0.00 0.00 54.58 54.13 1ppq n ASN 1009Cb 0.00 -0.37 -0.00 0.00 -2.08 0.00 0.00 39.78 37.33 1ppq n ASN 1009CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 1ppq n THR 1010N -1.37 0.00 -3.22 5.53 -1.04 -1.26 -5.18 114.28 107.75 1ppq n THR 1010Ca 0.11 -0.46 0.04 0.00 -2.04 0.00 0.00 64.05 61.69 1ppq n THR 1010Cb 0.26 0.33 -0.04 0.00 -1.82 0.00 0.00 70.33 69.06 1ppq n THR 1010CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ppq s ALA 1011N -1.71 -3.26 0.26 2.41 0.00 -1.26 -1.10 121.76 117.10 1ppq s ALA 1011Ca 0.07 1.74 -0.21 0.00 0.00 0.00 0.00 51.96 53.57 1ppq s ALA 1011Cb -0.01 -2.31 0.05 0.00 0.00 0.00 0.00 23.12 20.86 1ppq s ALA 1011CO 0.05 -1.09 0.88 -3.38 0.00 0.00 0.00 175.76 172.22 1ppq s HIS 1012N 2.34 -0.02 0.27 0.00 -3.43 -1.24 -4.61 115.29 108.61 1ppq s HIS 1012Ca -0.02 -0.45 -0.08 0.00 -0.80 0.00 0.00 55.06 53.71 1ppq s HIS 1012Cb -0.04 0.73 -0.06 0.00 -1.43 0.00 0.00 32.58 31.78 1ppq s HIS 1012CO -0.15 -1.16 0.58 -1.58 -2.00 0.00 0.00 174.74 170.43 1ppq s TRP 1013N -2.88 3.45 -1.66 0.38 0.52 -1.26 -0.98 118.94 116.50 1ppq s TRP 1013Ca 0.15 0.83 0.30 0.00 0.02 0.00 0.00 56.10 57.40 1ppq s TRP 1013Cb -0.04 -2.24 1.56 0.00 -1.15 0.00 0.00 33.47 31.60 1ppq s TRP 1013CO 0.07 0.18 2.06 -1.13 0.02 0.00 0.00 176.95 178.15 1ppq n SER 1014N -0.56 0.14 -4.83 2.95 3.41 -1.26 -4.82 113.62 108.66 1ppq n SER 1014Ca 0.00 -0.51 -0.33 0.00 -0.26 0.00 0.00 58.87 57.77 1ppq n SER 1014Cb 0.53 -0.15 -0.05 0.00 -0.26 0.00 0.00 64.21 64.27 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 -2.38 4.40 0.04 6.66 -4.23 -1.26 -4.84 115.64 114.04 1ppq s THR 1015Ca 0.34 1.36 -0.15 0.00 -1.18 0.00 0.00 61.69 62.07 1ppq s THR 1015Cb 0.21 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 70.35 1ppq s THR 1015CO 0.44 -0.46 0.45 -0.54 -0.54 0.00 0.00 174.62 173.97 1ppq s LYS 1016N -3.53 3.95 0.26 3.99 3.01 -1.26 -5.00 119.74 121.17 1ppq s LYS 1016Ca 0.61 0.45 -0.03 0.00 -1.01 0.00 0.00 55.97 55.99 1ppq s LYS 1016Cb -0.10 -3.17 0.54 0.00 -1.01 0.00 0.00 37.83 34.10 1ppq s LYS 1016CO 0.21 0.64 1.66 -1.35 0.51 0.00 0.00 175.35 177.02 1ppq h PRO 1017N 4.43 0.20 -0.88 -1.68 0.11 -1.97 -2.14 132.00 130.07 1ppq h PRO 1017Ca -0.51 -0.01 0.21 0.00 0.11 0.00 0.00 66.00 65.80 1ppq h PRO 1017Cb 1.21 -0.04 -0.16 0.00 0.11 0.00 0.00 31.00 32.12 1ppq h PRO 1017CO 0.63 0.13 -0.03 -1.35 -0.21 0.00 0.00 178.00 177.16 1ppq h PRO 1018N 0.20 0.05 0.00 1.05 0.11 -1.94 -3.46 132.00 128.01 1ppq h PRO 1018Ca 0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 1ppq h PRO 1018Cb 0.86 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1ppq h PRO 1018CO -0.61 0.03 0.00 1.51 -0.21 0.00 0.00 178.00 178.72 1ppq n ILE 1019N -5.45 0.00 -1.25 4.15 0.13 -0.81 -4.60 119.36 111.54 1ppq n ILE 1019Ca 0.17 0.00 -0.49 0.00 -1.10 0.00 0.00 62.75 61.34 1ppq n ILE 1019Cb 0.58 0.00 -0.07 0.00 -0.84 0.00 0.00 39.64 39.31 1ppq n ILE 1019CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1ppq n GLN 1021N 2.10 0.69 -2.06 0.00 7.27 -0.45 -4.84 117.38 120.10 1ppq n GLN 1021Ca 0.20 0.23 0.00 0.00 0.07 0.00 0.00 57.00 57.49 1ppq n GLN 1021Cb 0.01 -1.69 0.00 0.00 2.41 0.00 0.00 30.24 30.97 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 -3.22 -4.69 -3.95 3.69 0.63 -1.26 -4.98 116.66 102.87 1ppq n ARG 1022Ca -0.29 3.43 -0.34 0.00 -0.92 0.00 0.00 57.85 59.73 1ppq n ARG 1022Cb 1.05 -4.02 -0.06 0.00 0.45 0.00 0.00 32.46 29.89 1ppq n ARG 1022CO 0.00 0.00 0.00 0.96 -2.51 0.00 0.00 177.63 176.08 1ppq s ILE 1023N -0.50 5.27 -1.64 5.15 -4.36 -1.26 -4.99 121.20 118.87 1ppq s ILE 1023Ca 0.00 -0.15 0.00 0.00 -0.26 0.00 0.00 60.65 60.24 1ppq s ILE 1023Cb 0.00 -3.42 0.00 0.00 1.25 0.00 0.00 42.46 40.29 1ppq s ILE 1023CO 0.00 0.39 0.41 -2.65 0.24 0.00 0.00 174.94 173.33