#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ljm s LEU 1062N 0.00 3.38 0.19 4.31 1.43 -1.26 -4.01 118.68 122.72 1ljm s LEU 1062Ca 0.00 -0.26 0.11 0.00 -1.03 0.00 0.00 54.13 52.95 1ljm s LEU 1062Cb 0.00 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1ljm s LEU 1062CO 0.00 0.15 -0.22 0.68 0.23 0.00 0.00 176.35 177.19 1ljm s VAL 1063N -1.42 2.21 0.44 -1.59 -7.23 -0.50 -4.95 120.40 107.35 1ljm s VAL 1063Ca 0.26 -2.01 -0.06 0.00 -1.81 0.00 0.00 61.98 58.36 1ljm s VAL 1063Cb -0.11 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 1ljm s VAL 1063CO 0.18 -0.18 0.74 0.00 -0.31 0.00 0.00 175.10 175.53 1ljm s ARG 1064N -2.72 3.60 0.00 4.82 1.70 -1.26 -1.49 118.95 123.60 1ljm s ARG 1064Ca 0.20 0.20 0.00 0.00 -0.47 0.00 0.00 55.73 55.66 1ljm s ARG 1064Cb -0.07 -2.42 0.00 0.00 -0.57 0.00 0.00 34.95 31.88 1ljm s ARG 1064CO 0.09 -0.10 0.00 0.25 -1.08 0.00 0.00 175.30 174.46 1ljm n THR 1065N -1.89 0.00 1.76 4.99 -2.24 -1.18 -4.27 114.28 111.45 1ljm n THR 1065Ca 0.00 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.89 1ljm n THR 1065Cb 0.55 -0.85 0.54 0.00 -2.10 0.00 0.00 70.33 68.47 1ljm n THR 1065CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ljm n ASP 1066N -1.81 0.53 -4.21 3.42 5.75 -1.00 -4.62 116.55 114.61 1ljm n ASP 1066Ca 0.00 -1.47 -0.33 0.00 -0.01 0.00 0.00 54.79 52.98 1ljm n ASP 1066Cb 0.00 -0.03 -0.16 0.00 -1.03 0.00 0.00 41.12 39.90 1ljm n ASP 1066CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1ljm s SER 1067N -1.63 3.45 0.47 -1.12 0.15 -1.26 -4.93 113.70 108.82 1ljm s SER 1067Ca 0.31 -0.54 0.32 0.00 0.70 0.00 0.00 55.95 56.74 1ljm s SER 1067Cb 0.15 -1.53 1.46 0.00 -1.71 0.00 0.00 66.02 64.39 1ljm s SER 1067CO 0.25 0.05 1.95 1.55 1.20 0.00 0.00 173.24 178.24 1ljm h PRO 1068N 7.54 0.00 -0.01 5.44 0.13 -1.99 -2.67 132.00 140.44 1ljm h PRO 1068Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1ljm h PRO 1068Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1ljm h PRO 1068CO 0.59 0.00 -0.11 0.09 -0.23 0.00 0.00 178.00 178.34 1ljm n ASN 1069N -2.76 0.65 -3.94 1.44 5.03 -1.26 -4.88 115.26 109.54 1ljm n ASN 1069Ca 0.00 -0.78 -0.12 0.00 0.87 0.00 0.00 54.58 54.55 1ljm n ASN 1069Cb 0.20 -0.02 -0.13 0.00 -1.02 0.00 0.00 39.78 38.81 1ljm n ASN 1069CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1ljm s PHE 1070N -2.38 0.21 0.25 3.10 0.40 -1.01 -1.46 117.98 117.10 1ljm s PHE 1070Ca 0.31 -0.24 0.06 0.00 -0.60 0.00 0.00 56.93 56.46 1ljm s PHE 1070Cb 0.20 -0.14 -0.05 0.00 0.51 0.00 0.00 43.02 43.54 1ljm s PHE 1070CO 0.45 -0.07 -0.05 -0.51 0.70 0.00 0.00 175.22 175.74 1ljm s LEU 1071N -0.66 2.42 0.13 -0.37 1.02 -0.56 -3.10 118.68 117.55 1ljm s LEU 1071Ca -0.06 -1.17 -0.23 0.00 0.02 0.00 0.00 54.13 52.68 1ljm s LEU 1071Cb -0.05 -0.54 0.07 0.00 0.02 0.00 0.00 46.19 45.70 1ljm s LEU 1071CO -0.00 -0.37 0.60 0.00 0.02 0.00 0.00 176.35 176.59 1ljm s SER 1073N -2.57 3.10 0.07 0.00 1.04 -0.84 -1.41 113.70 113.08 1ljm s SER 1073Ca -0.00 1.99 -0.29 0.00 0.48 0.00 0.00 55.95 58.13 1ljm s SER 1073Cb -0.01 -2.50 -0.05 0.00 0.10 0.00 0.00 66.02 63.56 1ljm s SER 1073CO -0.10 -2.96 0.93 -0.69 0.98 0.00 0.00 173.24 171.40 1ljm s VAL 1074N -2.71 4.65 0.15 5.02 1.01 -1.26 -4.76 120.40 122.51 1ljm s VAL 1074Ca 0.65 1.99 0.06 0.00 0.00 0.00 0.00 61.98 64.69 1ljm s VAL 1074Cb -0.21 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 1ljm s VAL 1074CO 0.58 0.28 0.03 -0.76 0.00 0.00 0.00 175.10 175.23 1ljm s LEU 1075N 0.29 3.45 0.85 3.92 1.43 -1.26 -4.78 118.68 122.57 1ljm s LEU 1075Ca 0.47 -0.28 -0.10 0.00 -1.03 0.00 0.00 54.13 53.18 1ljm s LEU 1075Cb -0.22 -2.12 0.10 0.00 0.03 0.00 0.00 46.19 43.98 1ljm s LEU 1075CO 0.28 0.11 1.12 -2.84 0.23 0.00 0.00 176.35 175.25 1ljm s PRO 1076N -2.82 1.60 0.11 1.29 0.02 -1.26 -4.94 135.00 129.00 1ljm s PRO 1076Ca 0.28 1.39 0.14 0.00 0.02 0.00 0.00 61.00 62.83 1ljm s PRO 1076Cb -0.10 -1.81 -0.11 0.00 0.02 0.00 0.00 34.50 32.50 1ljm s PRO 1076CO 0.19 -2.17 1.04 1.79 -0.33 0.00 0.00 177.00 177.52 1ljm h THR 1077N -1.49 0.86 -3.21 0.99 1.35 -1.91 -3.44 112.91 106.07 1ljm h THR 1077Ca -0.43 -2.42 -0.24 0.00 -0.55 0.00 0.00 66.41 62.77 1ljm h THR 1077Cb 1.25 2.34 -0.31 0.00 -1.73 0.00 0.00 68.15 69.70 1ljm h THR 1077CO 0.46 0.49 -0.58 -2.28 -0.25 0.00 0.00 175.52 173.36 1ljm s HIS 1078N -2.84 -0.19 0.10 4.73 5.65 -1.26 0.39 115.29 121.86 1ljm s HIS 1078Ca -0.01 0.54 -0.08 0.00 0.25 0.00 0.00 55.06 55.77 1ljm s HIS 1078Cb 0.08 -0.07 -0.01 0.00 -1.18 0.00 0.00 32.58 31.41 1ljm s HIS 1078CO 0.80 -0.18 0.17 -0.46 -0.65 0.00 0.00 174.74 174.42 1ljm s TRP 1079N 1.23 0.24 0.35 3.88 -0.00 0.01 -4.51 118.94 120.15 1ljm s TRP 1079Ca -0.09 -0.68 -0.25 0.00 -0.00 0.00 0.00 56.10 55.08 1ljm s TRP 1079Cb -0.11 -0.11 -0.10 0.00 -0.00 0.00 0.00 33.47 33.15 1ljm s TRP 1079CO -0.06 -0.55 0.96 0.50 -0.00 0.00 0.00 176.95 177.80 1ljm s ARG 1080N -3.89 4.48 0.29 5.86 3.52 -1.26 -2.23 118.95 125.73 1ljm s ARG 1080Ca 0.07 1.32 -0.30 0.00 -0.13 0.00 0.00 55.73 56.70 1ljm s ARG 1080Cb 0.05 -2.68 -0.12 0.00 -1.56 0.00 0.00 34.95 30.64 1ljm s ARG 1080CO -0.09 0.18 1.47 0.00 -0.81 0.00 0.00 175.30 176.06 1ljm n ASN 1082N 1.79 -5.10 -4.82 0.00 5.15 0.15 -4.95 115.26 107.48 1ljm n ASN 1082Ca 0.08 0.09 -0.38 0.00 -0.60 0.00 0.00 54.58 53.77 1ljm n ASN 1082Cb 0.35 -3.32 -0.06 0.00 -0.53 0.00 0.00 39.78 36.22 1ljm n ASN 1082CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1ljm s LYS 1083N -2.08 4.07 0.49 1.20 2.20 -1.05 -4.92 119.74 119.66 1ljm s LYS 1083Ca 0.00 0.57 -0.23 0.00 -0.36 0.00 0.00 55.97 55.95 1ljm s LYS 1083Cb 0.00 -3.24 -0.07 0.00 -1.51 0.00 0.00 37.83 33.01 1ljm s LYS 1083CO 0.00 0.64 1.29 2.41 -0.36 0.00 0.00 175.35 179.33 1ljm n THR 1084N 1.88 3.19 -2.60 3.43 -1.04 -1.26 -4.64 114.28 113.23 1ljm n THR 1084Ca -0.12 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.05 1ljm n THR 1084Cb 0.52 -1.60 -0.04 0.00 -1.82 0.00 0.00 70.33 67.38 1ljm n THR 1084CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1ljm s LEU 1085N -2.51 3.92 0.47 -4.42 1.43 -1.26 -4.95 118.68 111.36 1ljm s LEU 1085Ca 0.67 1.90 0.25 0.00 -1.03 0.00 0.00 54.13 55.92 1ljm s LEU 1085Cb -0.46 -4.48 1.13 0.00 0.03 0.00 0.00 46.19 42.41 1ljm s LEU 1085CO 0.53 -0.64 1.92 1.55 0.23 0.00 0.00 176.35 179.95 1ljm h PRO 1086N 1.82 0.00 -3.65 1.29 0.13 -1.96 -3.41 132.00 126.22 1ljm h PRO 1086Ca -0.49 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.19 1ljm h PRO 1086Cb 1.21 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.96 1ljm h PRO 1086CO 0.60 0.19 -0.77 0.42 -0.23 0.00 0.00 178.00 178.22 1ljm s ILE 1087N -3.87 0.37 0.09 -3.56 1.01 -1.26 -5.11 121.20 108.87 1ljm s ILE 1087Ca -0.01 0.03 -0.35 0.00 0.00 0.00 0.00 60.65 60.31 1ljm s ILE 1087Cb 0.11 -0.60 -0.15 0.00 0.01 0.00 0.00 42.46 41.84 1ljm s ILE 1087CO 0.62 0.18 1.52 0.00 0.00 0.00 0.00 174.94 177.25 1ljm n ALA 1088N 5.14 0.32 -2.16 9.38 0.00 -1.26 -4.92 120.51 127.02 1ljm n ALA 1088Ca -0.07 0.46 -0.40 0.00 0.00 0.00 0.00 53.44 53.42 1ljm n ALA 1088Cb 0.50 -2.25 -0.05 0.00 0.00 0.00 0.00 19.45 17.65 1ljm n ALA 1088CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ljm s PHE 1089N 1.13 3.84 0.02 0.00 5.36 -1.26 -4.88 117.98 122.20 1ljm s PHE 1089Ca 0.83 1.75 -0.15 0.00 -0.96 0.00 0.00 56.93 58.40 1ljm s PHE 1089Cb -0.81 -2.97 0.02 0.00 -0.34 0.00 0.00 43.02 38.92 1ljm s PHE 1089CO 0.44 0.30 0.33 -1.59 -1.46 0.00 0.00 175.22 173.24 1ljm s LYS 1090N -0.36 0.77 -0.16 10.12 -2.85 -1.26 -0.93 119.74 125.07 1ljm s LYS 1090Ca 0.43 -0.34 -0.00 0.00 -1.00 0.00 0.00 55.97 55.06 1ljm s LYS 1090Cb -0.23 0.34 -0.00 0.00 -2.06 0.00 0.00 37.83 35.87 1ljm s LYS 1090CO 0.29 -0.24 -0.14 0.08 0.10 0.00 0.00 175.35 175.45 1ljm s VAL 1091N -1.99 2.81 -0.24 1.79 1.01 -0.35 -1.99 120.40 121.43 1ljm s VAL 1091Ca -0.09 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 1ljm s VAL 1091Cb -0.03 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1ljm s VAL 1091CO 0.00 0.51 0.07 -0.69 0.00 0.00 0.00 175.10 174.99 1ljm s VAL 1092N 0.82 4.37 -0.01 2.92 1.01 0.32 -0.84 120.40 128.99 1ljm s VAL 1092Ca -0.05 -0.16 -0.21 0.00 0.00 0.00 0.00 61.98 61.57 1ljm s VAL 1092Cb -0.15 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.15 1ljm s VAL 1092CO 0.00 0.36 0.61 0.00 0.00 0.00 0.00 175.10 176.07 1ljm s ALA 1093N 1.39 3.47 -0.17 5.51 0.00 0.28 -1.50 121.76 130.74 1ljm s ALA 1093Ca 0.05 0.05 0.13 0.00 0.00 0.00 0.00 51.96 52.19 1ljm s ALA 1093Cb -0.15 -2.76 -0.24 0.00 0.00 0.00 0.00 23.12 19.97 1ljm s ALA 1093CO 0.03 0.15 0.18 1.28 0.00 0.00 0.00 175.76 177.40 1ljm n LEU 1094N 2.78 0.75 0.00 0.00 4.77 -0.53 -4.80 117.00 119.96 1ljm n LEU 1094Ca -0.06 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1ljm n LEU 1094Cb 0.51 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1ljm n LEU 1094CO 0.44 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1ljm n GLY 1095N 1.79 1.91 3.58 -0.72 0.00 -1.25 -5.02 105.19 105.46 1ljm n GLY 1095Ca -0.31 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.41 1ljm n GLY 1095CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ljm s ASP 1096N -1.00 6.43 -0.31 1.61 2.15 -1.26 -4.95 116.67 119.34 1ljm s ASP 1096Ca 0.00 0.06 -0.02 0.00 0.43 0.00 0.00 52.55 53.02 1ljm s ASP 1096Cb 0.00 -2.55 0.12 0.00 -0.30 0.00 0.00 42.92 40.19 1ljm s ASP 1096CO 0.00 -1.49 0.17 -0.69 -0.17 0.00 0.00 175.17 172.99 1ljm s VAL 1097N 4.97 -0.03 0.44 1.11 1.01 -1.26 -5.06 120.40 121.57 1ljm s VAL 1097Ca 0.42 -1.04 -0.23 0.00 0.00 0.00 0.00 61.98 61.14 1ljm s VAL 1097Cb -0.08 -1.01 -0.11 0.00 0.00 0.00 0.00 36.38 35.19 1ljm s VAL 1097CO 0.25 -0.79 0.82 -2.65 0.00 0.00 0.00 175.10 172.73 1ljm n PRO 1098N 4.86 0.99 -1.93 2.72 -0.02 -1.26 -4.58 135.00 135.78 1ljm n PRO 1098Ca 0.00 0.36 -0.41 0.00 -2.02 0.00 0.00 63.50 61.43 1ljm n PRO 1098Cb 0.41 -1.85 -0.01 0.00 -0.02 0.00 0.00 33.50 32.03 1ljm n PRO 1098CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ljm s ASP 1099N -0.88 6.52 0.00 2.55 1.01 -1.26 -2.45 116.67 122.16 1ljm s ASP 1099Ca 0.65 2.89 0.00 0.00 0.71 0.00 0.00 52.55 56.80 1ljm s ASP 1099Cb -0.56 -2.66 0.00 0.00 1.01 0.00 0.00 42.92 40.71 1ljm s ASP 1099CO 0.56 -0.74 0.00 0.61 0.21 0.00 0.00 175.17 175.81 1ljm n GLY 1100N 0.74 0.59 3.69 0.21 0.00 0.61 -4.96 105.19 106.07 1ljm n GLY 1100Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1ljm n GLY 1100CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ljm s THR 1101N -2.30 3.26 0.45 2.61 2.01 -1.03 -4.65 115.64 115.99 1ljm s THR 1101Ca 0.00 0.70 -0.23 0.00 0.31 0.00 0.00 61.69 62.47 1ljm s THR 1101Cb 0.00 -3.45 -0.08 0.00 0.01 0.00 0.00 72.50 68.98 1ljm s THR 1101CO 0.00 0.00 1.10 -0.76 -0.69 0.00 0.00 174.62 174.27 1ljm s LEU 1102N 2.47 4.01 -0.04 4.42 1.02 -1.26 -0.95 118.68 128.34 1ljm s LEU 1102Ca 0.70 2.13 0.00 0.00 0.02 0.00 0.00 54.13 56.98 1ljm s LEU 1102Cb -0.37 -4.30 0.03 0.00 0.02 0.00 0.00 46.19 41.56 1ljm s LEU 1102CO 0.30 -0.76 -0.01 -0.69 0.02 0.00 0.00 176.35 175.22 1ljm s VAL 1103N -1.68 0.27 0.16 -1.59 1.01 0.06 -0.49 120.40 118.14 1ljm s VAL 1103Ca 0.63 0.06 0.11 0.00 0.00 0.00 0.00 61.98 62.78 1ljm s VAL 1103Cb -0.24 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 1ljm s VAL 1103CO 0.29 0.18 -0.25 0.42 0.00 0.00 0.00 175.10 175.74 1ljm s THR 1104N 1.19 2.33 -0.03 3.92 -4.23 -0.70 -1.45 115.64 116.66 1ljm s THR 1104Ca -0.07 -1.89 0.07 0.00 -1.18 0.00 0.00 61.69 58.62 1ljm s THR 1104Cb -0.13 -2.08 -0.02 0.00 1.34 0.00 0.00 72.50 71.61 1ljm s THR 1104CO -0.02 -0.02 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.11 1ljm s VAL 1105N -1.38 2.18 0.00 2.29 1.01 -0.55 -1.03 120.40 122.92 1ljm s VAL 1105Ca 0.18 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 61.11 1ljm s VAL 1105Cb -0.09 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 1ljm s VAL 1105CO 0.08 0.58 -0.04 -0.32 0.00 0.00 0.00 175.10 175.40 1ljm s MET 1106N -0.55 0.35 0.00 2.72 1.75 -0.56 -4.88 119.30 118.13 1ljm s MET 1106Ca 0.08 -0.24 0.07 0.00 -1.25 0.00 0.00 55.69 54.35 1ljm s MET 1106Cb -0.11 -0.30 -0.02 0.00 2.84 0.00 0.00 34.83 37.25 1ljm s MET 1106CO -0.00 0.08 -0.20 0.00 -0.65 0.00 0.00 175.02 174.24 1ljm s ALA 1107N -0.30 1.70 0.00 4.11 0.00 -1.26 -0.07 121.76 125.93 1ljm s ALA 1107Ca -0.01 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1ljm s ALA 1107Cb -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.69 1ljm s ALA 1107CO -0.00 0.40 0.00 0.41 0.00 0.00 0.00 175.76 176.57 1ljm n GLY 1108N 2.34 -0.49 0.00 0.00 0.00 -1.14 -0.23 105.19 105.67 1ljm n GLY 1108Ca -0.16 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1ljm n GLY 1108CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ljm n ASN 1109N 0.00 0.00 -0.19 1.61 0.23 0.36 -0.24 115.26 117.02 1ljm n ASN 1109Ca 0.00 -0.28 -0.06 0.00 -0.53 0.00 0.00 54.58 53.71 1ljm n ASN 1109Cb 0.00 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 37.73 1ljm n ASN 1109CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1ljm h ASP 1110N 0.00 0.63 0.34 0.53 3.32 -1.97 -3.06 116.42 116.22 1ljm h ASP 1110Ca 0.00 -0.01 -0.27 0.00 0.02 0.00 0.00 57.03 56.76 1ljm h ASP 1110Cb 0.00 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.41 1ljm h ASP 1110CO 0.00 0.45 -1.17 -0.33 -1.72 0.00 0.00 179.24 176.47 1ljm h GLU 1111N 0.75 0.45 -4.85 3.56 3.07 -1.97 -3.43 114.58 112.17 1ljm h GLU 1111Ca 0.21 -0.62 -0.68 0.00 -0.50 0.00 0.00 59.36 57.78 1ljm h GLU 1111Cb -0.07 0.21 -0.33 0.00 -0.84 0.00 0.00 28.75 27.72 1ljm h GLU 1111CO -0.06 1.26 -0.74 1.21 -1.40 0.00 0.00 179.01 179.28 1ljm s ASN 1112N -7.26 4.53 0.01 1.42 3.84 -1.16 -5.01 114.94 111.32 1ljm s ASN 1112Ca -0.07 -1.11 -0.25 0.00 0.21 0.00 0.00 52.86 51.64 1ljm s ASN 1112Cb 0.07 -1.66 -0.16 0.00 -0.55 0.00 0.00 41.25 38.95 1ljm s ASN 1112CO 0.90 -0.19 1.23 0.22 -2.79 0.00 0.00 177.10 176.48 1ljm h TYR 1113N 7.96 -0.38 -2.98 0.43 3.20 -1.84 1.04 116.97 124.40 1ljm h TYR 1113Ca -0.26 -0.01 -0.52 0.00 3.14 0.00 0.00 58.73 61.08 1ljm h TYR 1113Cb 1.08 0.13 -0.40 0.00 1.54 0.00 0.00 36.73 39.07 1ljm h TYR 1113CO 0.60 -0.05 -0.77 0.45 -1.64 0.00 0.00 178.16 176.76 1ljm s SER 1114N -5.08 3.20 0.55 -2.11 0.15 -1.26 -4.13 113.70 105.02 1ljm s SER 1114Ca -0.14 -1.09 -0.17 0.00 0.70 0.00 0.00 55.95 55.25 1ljm s SER 1114Cb 0.02 -0.43 -0.06 0.00 -1.71 0.00 0.00 66.02 63.85 1ljm s SER 1114CO 0.54 -0.39 1.04 0.00 1.20 0.00 0.00 173.24 175.63 1ljm s ALA 1115N 2.01 2.84 0.04 5.45 0.00 0.68 -4.97 121.76 127.80 1ljm s ALA 1115Ca 0.06 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.10 1ljm s ALA 1115Cb -0.16 -3.21 -0.07 0.00 0.00 0.00 0.00 23.12 19.67 1ljm s ALA 1115CO -0.24 -0.58 1.57 -2.00 0.00 0.00 0.00 175.76 174.51 1ljm s GLU 1116N -3.90 4.22 0.27 0.00 2.12 -1.26 -4.60 118.70 115.55 1ljm s GLU 1116Ca 0.63 2.20 0.08 0.00 0.36 0.00 0.00 54.97 58.25 1ljm s GLU 1116Cb -0.15 -3.61 -0.06 0.00 0.26 0.00 0.00 34.13 30.58 1ljm s GLU 1116CO 0.32 -0.69 -0.10 -0.51 -0.54 0.00 0.00 175.26 173.74 1ljm s LEU 1117N 2.63 2.56 -0.06 2.70 1.43 -1.26 -1.38 118.68 125.30 1ljm s LEU 1117Ca 0.71 -1.13 0.05 0.00 -1.03 0.00 0.00 54.13 52.72 1ljm s LEU 1117Cb -0.37 -0.77 -0.00 0.00 0.03 0.00 0.00 46.19 45.07 1ljm s LEU 1117CO 0.30 -0.22 -0.21 -0.60 0.23 0.00 0.00 176.35 175.85 1ljm s ARG 1118N -3.66 2.31 -1.16 1.70 6.06 0.19 -4.76 118.95 119.63 1ljm s ARG 1118Ca 0.28 -0.76 -0.05 0.00 -2.50 0.00 0.00 55.73 52.71 1ljm s ARG 1118Cb 0.01 -1.91 -0.03 0.00 0.06 0.00 0.00 34.95 33.08 1ljm s ARG 1118CO 0.12 0.27 0.87 0.09 -2.50 0.00 0.00 175.30 174.15 1ljm n ASN 1119N 3.19 -3.91 -1.78 -2.12 4.13 -1.26 -1.58 115.26 111.93 1ljm n ASN 1119Ca -0.18 -0.76 -0.02 0.00 1.68 0.00 0.00 54.58 55.30 1ljm n ASN 1119Cb 0.52 -4.65 0.31 0.00 -1.54 0.00 0.00 39.78 34.42 1ljm n ASN 1119CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ljm n ALA 1120N -3.86 4.27 -2.77 5.41 0.00 -1.26 -4.32 120.51 117.98 1ljm n ALA 1120Ca -0.19 -2.36 -0.22 0.00 0.00 0.00 0.00 53.44 50.67 1ljm n ALA 1120Cb 0.64 -1.12 -0.15 0.00 0.00 0.00 0.00 19.45 18.82 1ljm n ALA 1120CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ljm s THR 1121N -2.97 1.07 0.24 0.00 2.01 -1.26 -1.48 115.64 113.25 1ljm s THR 1121Ca 0.53 -0.55 -0.13 0.00 0.31 0.00 0.00 61.69 61.84 1ljm s THR 1121Cb 0.42 -0.91 -0.00 0.00 0.01 0.00 0.00 72.50 72.02 1ljm s THR 1121CO 0.12 0.31 0.49 0.00 -0.69 0.00 0.00 174.62 174.85 1ljm s ALA 1122N -0.11 -0.33 -0.01 7.40 0.00 -0.53 -4.81 121.76 123.37 1ljm s ALA 1122Ca 0.01 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.21 1ljm s ALA 1122Cb -0.07 1.04 -0.01 0.00 0.00 0.00 0.00 23.12 24.07 1ljm s ALA 1122CO 0.00 -0.86 -0.15 0.00 0.00 0.00 0.00 175.76 174.76 1ljm s ALA 1123N -4.00 1.24 0.28 0.00 0.00 -1.26 -0.76 121.76 117.25 1ljm s ALA 1123Ca 0.21 -0.63 -0.30 0.00 0.00 0.00 0.00 51.96 51.24 1ljm s ALA 1123Cb -0.01 -0.33 -0.10 0.00 0.00 0.00 0.00 23.12 22.68 1ljm s ALA 1123CO 0.08 0.29 1.43 -1.64 0.00 0.00 0.00 175.76 175.92 1ljm s MET 1124N -0.30 4.26 -0.22 0.00 -1.94 -0.13 -4.48 119.30 116.49 1ljm s MET 1124Ca 0.05 2.33 -0.04 0.00 -1.71 0.00 0.00 55.69 56.32 1ljm s MET 1124Cb -0.06 -3.08 0.10 0.00 2.01 0.00 0.00 34.83 33.79 1ljm s MET 1124CO -0.00 -0.39 0.21 0.21 -0.01 0.00 0.00 175.02 175.03 1ljm s LYS 1125N -0.88 0.19 -1.26 2.03 2.20 0.78 -0.29 119.74 122.53 1ljm s LYS 1125Ca 0.57 0.06 -0.01 0.00 -0.36 0.00 0.00 55.97 56.22 1ljm s LYS 1125Cb -0.42 -1.22 -0.00 0.00 -1.51 0.00 0.00 37.83 34.67 1ljm s LYS 1125CO 0.48 -0.74 0.79 0.09 -0.36 0.00 0.00 175.35 175.61 1ljm n ASN 1126N 5.31 -1.91 0.00 1.43 3.02 -1.26 -2.22 115.26 119.62 1ljm n ASN 1126Ca -0.05 -0.77 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1ljm n ASN 1126Cb 0.48 -4.37 0.00 0.00 -0.61 0.00 0.00 39.78 35.29 1ljm n ASN 1126CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ljm n GLN 1127N -4.16 -0.26 -4.42 3.52 1.13 -1.26 -5.00 117.38 106.93 1ljm n GLN 1127Ca -0.27 0.06 -0.21 0.00 -1.94 0.00 0.00 57.00 54.64 1ljm n GLN 1127Cb 0.67 -3.25 -0.16 0.00 0.11 0.00 0.00 30.24 27.62 1ljm n GLN 1127CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1ljm s VAL 1128N -2.46 0.82 -0.31 5.09 1.01 -0.94 0.10 120.40 123.71 1ljm s VAL 1128Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 61.63 1ljm s VAL 1128Cb 0.00 -0.74 0.08 0.00 0.00 0.00 0.00 36.38 35.73 1ljm s VAL 1128CO 0.00 0.26 0.00 0.00 0.00 0.00 0.00 175.10 175.36 1ljm s ALA 1129N 0.22 2.80 -0.12 5.51 0.00 -0.02 -0.15 121.76 129.99 1ljm s ALA 1129Ca -0.04 -2.22 -0.15 0.00 0.00 0.00 0.00 51.96 49.56 1ljm s ALA 1129Cb -0.09 -1.87 -0.05 0.00 0.00 0.00 0.00 23.12 21.11 1ljm s ALA 1129CO 0.01 -1.50 0.35 1.03 0.00 0.00 0.00 175.76 175.64 1ljm s ARG 1130N 1.01 4.18 -0.27 0.00 0.52 -1.26 -1.21 118.95 121.92 1ljm s ARG 1130Ca 0.03 0.22 -0.12 0.00 -0.52 0.00 0.00 55.73 55.33 1ljm s ARG 1130Cb -0.20 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 31.84 1ljm s ARG 1130CO -0.06 0.32 0.24 -0.06 0.02 0.00 0.00 175.30 175.76 1ljm s PHE 1131N 0.19 3.23 -0.72 -0.53 0.40 -0.11 -4.74 117.98 115.70 1ljm s PHE 1131Ca 0.20 0.21 -0.26 0.00 -0.60 0.00 0.00 56.93 56.48 1ljm s PHE 1131Cb -0.14 -2.43 0.01 0.00 0.51 0.00 0.00 43.02 40.97 1ljm s PHE 1131CO 0.07 -0.17 1.54 1.21 0.70 0.00 0.00 175.22 178.56 1ljm s ASN 1132N 1.70 5.81 -0.98 1.36 3.04 -1.26 -4.25 114.94 120.35 1ljm s ASN 1132Ca 0.09 -0.25 -0.07 0.00 0.04 0.00 0.00 52.86 52.67 1ljm s ASN 1132Cb -0.16 -2.55 -0.04 0.00 -1.54 0.00 0.00 41.25 36.96 1ljm s ASN 1132CO 0.10 -2.06 0.83 -0.67 -3.04 0.00 0.00 177.10 172.27 1ljm n ASP 1133N 10.80 -6.65 -4.73 -4.21 2.03 -1.26 -4.77 116.55 107.76 1ljm n ASP 1133Ca 0.13 -0.61 -0.42 0.00 0.52 0.00 0.00 54.79 54.41 1ljm n ASP 1133Cb 0.50 -4.80 -0.03 0.00 -0.72 0.00 0.00 41.12 36.07 1ljm n ASP 1133CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1ljm s LEU 1134N -5.22 4.41 0.02 -2.67 2.96 -1.26 -4.54 118.68 112.38 1ljm s LEU 1134Ca 0.33 2.27 0.01 0.00 -0.22 0.00 0.00 54.13 56.52 1ljm s LEU 1134Cb -0.06 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 1ljm s LEU 1134CO 0.77 -0.49 -0.04 -0.13 -1.32 0.00 0.00 176.35 175.14 1ljm s ARG 1135N 0.27 0.33 -0.52 1.98 0.52 -0.61 -4.20 118.95 116.73 1ljm s ARG 1135Ca 0.57 -0.47 -0.16 0.00 -0.52 0.00 0.00 55.73 55.15 1ljm s ARG 1135Cb -0.34 -0.11 0.11 0.00 0.52 0.00 0.00 34.95 35.13 1ljm s ARG 1135CO 0.35 0.01 0.47 -0.06 0.02 0.00 0.00 175.30 176.09 1ljm s PHE 1136N -0.95 3.24 -0.06 -0.53 0.40 -1.26 -0.64 117.98 118.18 1ljm s PHE 1136Ca -0.08 -1.16 -0.16 0.00 -0.60 0.00 0.00 56.93 54.92 1ljm s PHE 1136Cb -0.07 -3.60 -0.11 0.00 0.51 0.00 0.00 43.02 39.75 1ljm s PHE 1136CO -0.00 -0.95 0.65 0.28 0.70 0.00 0.00 175.22 175.89 1ljm h VAL 1137N 5.85 0.51 -3.98 -0.44 2.07 -1.56 0.43 116.25 119.13 1ljm h VAL 1137Ca -0.29 -1.02 -0.52 0.00 0.82 0.00 0.00 66.70 65.69 1ljm h VAL 1137Cb 1.10 0.88 0.07 0.00 -1.52 0.00 0.00 31.29 31.83 1ljm h VAL 1137CO 0.99 0.14 0.53 -0.83 0.02 0.00 0.00 177.57 178.42 1ljm s GLY 1138N -3.27 2.84 0.30 2.17 0.00 -0.59 -4.13 107.32 104.64 1ljm s GLY 1138Ca -0.09 1.05 -0.20 0.00 0.00 0.00 0.00 44.72 45.47 1ljm s GLY 1138CO 0.34 1.55 0.82 1.09 0.00 0.00 0.00 173.10 176.89 1ljm s ARG 1139N -2.53 4.27 0.46 2.90 1.70 -1.26 -4.86 118.95 119.62 1ljm s ARG 1139Ca 0.62 0.97 0.25 0.00 -0.47 0.00 0.00 55.73 57.10 1ljm s ARG 1139Cb -0.32 -2.64 0.99 0.00 -0.57 0.00 0.00 34.95 32.41 1ljm s ARG 1139CO 0.40 0.24 1.85 0.66 -1.08 0.00 0.00 175.30 177.37 1ljm h SER 1140N 2.84 0.00 -5.00 -2.89 4.64 0.63 -3.48 113.55 110.29 1ljm h SER 1140Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1ljm h SER 1140Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1ljm h SER 1140CO 0.64 0.19 0.00 0.61 -0.87 0.00 0.00 176.83 177.40 1ljm n GLY 1141N 0.13 2.69 3.67 -0.77 0.00 -1.26 -4.49 105.19 105.15 1ljm n GLY 1141Ca 0.00 -1.88 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 1ljm n GLY 1141CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ljm s ARG 1142N -3.30 4.24 -0.48 1.61 3.52 -1.26 -2.64 118.95 120.64 1ljm s ARG 1142Ca 0.00 1.83 0.00 0.00 -0.13 0.00 0.00 55.73 57.43 1ljm s ARG 1142Cb 0.00 -3.76 0.00 0.00 -1.56 0.00 0.00 34.95 29.63 1ljm s ARG 1142CO 0.00 -0.69 0.00 0.41 -0.81 0.00 0.00 175.30 174.21 1ljm n GLY 1143N 3.71 0.72 3.16 8.12 0.00 -1.26 -5.02 105.19 114.63 1ljm n GLY 1143Ca 0.14 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 1ljm n GLY 1143CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ljm s LYS 1144N -2.10 0.82 0.36 1.61 1.02 -1.08 -5.17 119.74 115.20 1ljm s LYS 1144Ca 0.00 -1.33 0.02 0.00 0.02 0.00 0.00 55.97 54.68 1ljm s LYS 1144Cb 0.00 -0.18 -0.01 0.00 -0.52 0.00 0.00 37.83 37.12 1ljm s LYS 1144CO 0.00 -0.02 0.08 0.43 -0.92 0.00 0.00 175.35 174.91 1ljm n SER 1145N -0.03 1.86 -4.52 2.83 7.64 -1.26 -4.38 113.62 115.76 1ljm n SER 1145Ca -0.12 -2.78 -0.31 0.00 1.01 0.00 0.00 58.87 56.67 1ljm n SER 1145Cb 0.61 0.65 -0.11 0.00 -1.01 0.00 0.00 64.21 64.34 1ljm n SER 1145CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ljm s PHE 1146N -2.69 2.68 -0.28 1.43 2.99 0.12 -4.51 117.98 117.73 1ljm s PHE 1146Ca 0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 56.93 56.82 1ljm s PHE 1146Cb 0.01 -1.48 0.02 0.00 0.00 0.00 0.00 43.02 41.56 1ljm s PHE 1146CO 0.08 0.34 0.02 0.99 -0.00 0.00 0.00 175.22 176.64 1ljm s THR 1147N -1.03 3.44 -0.30 0.64 2.01 0.66 -0.99 115.64 120.06 1ljm s THR 1147Ca 0.17 -0.88 -0.28 0.00 0.31 0.00 0.00 61.69 61.01 1ljm s THR 1147Cb -0.11 -2.78 0.01 0.00 0.01 0.00 0.00 72.50 69.64 1ljm s THR 1147CO 0.08 0.11 1.02 -0.22 -0.69 0.00 0.00 174.62 174.93 1ljm s LEU 1148N 1.41 3.98 -0.29 4.42 1.98 -1.26 -2.88 118.68 126.05 1ljm s LEU 1148Ca 0.01 1.02 -0.04 0.00 -2.89 0.00 0.00 54.13 52.24 1ljm s LEU 1148Cb -0.17 -3.46 0.03 0.00 0.66 0.00 0.00 46.19 43.25 1ljm s LEU 1148CO -0.01 -0.80 0.02 -0.89 -1.89 0.00 0.00 176.35 172.78 1ljm s THR 1149N 3.46 3.35 -0.13 3.68 2.01 0.90 -1.22 115.64 127.69 1ljm s THR 1149Ca 0.43 -1.02 -0.16 0.00 0.31 0.00 0.00 61.69 61.25 1ljm s THR 1149Cb -0.13 -2.78 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 1ljm s THR 1149CO 0.13 0.04 0.39 -0.63 -0.69 0.00 0.00 174.62 173.87 1ljm s ILE 1150N 1.37 5.22 -0.25 1.82 1.01 0.12 -1.50 121.20 129.00 1ljm s ILE 1150Ca -0.01 0.77 0.01 0.00 0.00 0.00 0.00 60.65 61.43 1ljm s ILE 1150Cb -0.18 -3.73 0.06 0.00 0.01 0.00 0.00 42.46 38.63 1ljm s ILE 1150CO -0.01 0.37 -0.05 -0.89 0.00 0.00 0.00 174.94 174.37 1ljm s THR 1151N 0.41 1.66 -0.38 2.92 2.01 -0.20 -0.75 115.64 121.31 1ljm s THR 1151Ca 0.22 -1.38 -0.20 0.00 0.31 0.00 0.00 61.69 60.63 1ljm s THR 1151Cb -0.14 -1.94 0.01 0.00 0.01 0.00 0.00 72.50 70.44 1ljm s THR 1151CO 0.08 -0.15 0.61 -0.69 -0.69 0.00 0.00 174.62 173.78 1ljm s VAL 1152N 1.32 4.90 -1.58 3.82 1.01 -0.29 -1.72 120.40 127.85 1ljm s VAL 1152Ca -0.04 0.38 -0.11 0.00 0.00 0.00 0.00 61.98 62.21 1ljm s VAL 1152Cb -0.19 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 1ljm s VAL 1152CO -0.07 -0.38 2.79 0.49 0.00 0.00 0.00 175.10 177.93 1ljm n PHE 1153N 6.04 2.67 -1.88 5.22 3.72 0.35 -1.66 117.46 131.92 1ljm n PHE 1153Ca -0.02 -3.06 -0.17 0.00 -0.05 0.00 0.00 57.45 54.15 1ljm n PHE 1153Cb 0.48 -2.49 0.11 0.00 -0.94 0.00 0.00 39.48 36.65 1ljm n PHE 1153CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1ljm n THR 1154N 3.84 0.00 -3.94 4.37 -2.24 -1.26 -4.52 114.28 110.53 1ljm n THR 1154Ca 0.72 -0.74 -0.33 0.00 -2.27 0.00 0.00 64.05 61.44 1ljm n THR 1154Cb 0.27 -1.48 -0.14 0.00 -2.10 0.00 0.00 70.33 66.88 1ljm n THR 1154CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ljm s ASN 1155N -3.85 4.92 0.69 3.42 3.04 -1.26 -1.35 114.94 120.55 1ljm s ASN 1155Ca 0.45 -2.03 -0.08 0.00 0.04 0.00 0.00 52.86 51.23 1ljm s ASN 1155Cb -0.02 -1.70 0.04 0.00 -1.54 0.00 0.00 41.25 38.04 1ljm s ASN 1155CO 0.31 -0.42 1.03 -2.16 -3.04 0.00 0.00 177.10 172.82 1ljm s PRO 1156N 1.01 2.45 0.51 0.43 0.04 -1.26 -5.13 135.00 133.05 1ljm s PRO 1156Ca 0.08 -0.01 -0.23 0.00 0.04 0.00 0.00 61.00 60.88 1ljm s PRO 1156Cb -0.20 -2.13 -0.06 0.00 0.04 0.00 0.00 34.50 32.14 1ljm s PRO 1156CO -0.06 -1.13 1.34 -2.14 0.04 0.00 0.00 177.00 175.04 1ljm s PRO 1157N -5.26 3.34 -0.10 0.56 0.02 -0.45 -4.99 135.00 128.12 1ljm s PRO 1157Ca 0.59 2.19 0.04 0.00 0.02 0.00 0.00 61.00 63.83 1ljm s PRO 1157Cb -0.11 -2.35 0.00 0.00 0.02 0.00 0.00 34.50 32.06 1ljm s PRO 1157CO 0.47 -1.02 -0.23 -0.65 -0.33 0.00 0.00 177.00 175.24 1ljm s GLN 1158N -2.79 2.91 -0.10 5.54 -0.21 -0.66 -4.90 119.66 119.45 1ljm s GLN 1158Ca 0.68 -0.83 -0.01 0.00 0.02 0.00 0.00 55.36 55.22 1ljm s GLN 1158Cb -0.39 -2.21 -0.03 0.00 1.00 0.00 0.00 33.01 31.38 1ljm s GLN 1158CO 0.47 0.16 -0.05 0.08 -2.12 0.00 0.00 175.29 173.83 1ljm s VAL 1159N 0.38 3.84 0.05 1.09 1.01 -1.26 -1.14 120.40 124.37 1ljm s VAL 1159Ca -0.18 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.43 1ljm s VAL 1159Cb -0.18 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 1ljm s VAL 1159CO 0.08 0.57 -0.12 0.00 0.00 0.00 0.00 175.10 175.63 1ljm s ALA 1160N -0.47 1.01 -0.00 5.51 0.00 0.07 -4.82 121.76 123.05 1ljm s ALA 1160Ca 0.07 -0.86 0.08 0.00 0.00 0.00 0.00 51.96 51.26 1ljm s ALA 1160Cb -0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1ljm s ALA 1160CO 0.02 0.14 -0.26 0.99 0.00 0.00 0.00 175.76 176.66 1ljm s THR 1161N -1.10 2.10 0.25 0.00 2.01 -1.26 0.14 115.64 117.78 1ljm s THR 1161Ca -0.02 -1.17 -0.30 0.00 0.31 0.00 0.00 61.69 60.50 1ljm s THR 1161Cb -0.09 -1.75 -0.11 0.00 0.01 0.00 0.00 72.50 70.57 1ljm s THR 1161CO 0.01 0.52 1.56 -0.47 -0.69 0.00 0.00 174.62 175.56 1ljm s TYR 1162N -0.66 2.90 0.65 4.92 5.04 -0.36 -2.38 117.35 127.46 1ljm s TYR 1162Ca 0.11 0.77 0.27 0.00 -2.44 0.00 0.00 57.07 55.78 1ljm s TYR 1162Cb -0.10 -3.98 1.46 0.00 0.35 0.00 0.00 41.96 39.69 1ljm s TYR 1162CO -0.00 -3.38 1.84 1.12 -1.34 0.00 0.00 175.55 173.79 1ljm h HIS 1163N 5.49 0.00 -4.28 4.97 2.07 -1.90 -3.43 115.15 118.07 1ljm h HIS 1163Ca -0.45 0.00 -0.19 0.00 -2.85 0.00 0.00 60.37 56.88 1ljm h HIS 1163Cb 1.21 0.00 -0.15 0.00 2.57 0.00 0.00 27.41 31.04 1ljm h HIS 1163CO 0.61 0.00 -0.66 0.50 -3.07 0.00 0.00 177.93 175.31 1ljm s ARG 1164N -4.20 0.89 0.44 5.12 3.52 -1.26 -5.06 118.95 118.40 1ljm s ARG 1164Ca -0.03 -1.41 -0.07 0.00 -0.13 0.00 0.00 55.73 54.09 1ljm s ARG 1164Cb 0.09 0.15 -0.05 0.00 -1.56 0.00 0.00 34.95 33.59 1ljm s ARG 1164CO 0.31 -0.20 0.76 0.00 -0.81 0.00 0.00 175.30 175.36 1ljm s ALA 1165N -3.95 3.40 -0.09 6.12 0.00 -1.26 -4.67 121.76 121.31 1ljm s ALA 1165Ca 0.20 -0.40 0.03 0.00 0.00 0.00 0.00 51.96 51.79 1ljm s ALA 1165Cb 0.07 -2.60 0.01 0.00 0.00 0.00 0.00 23.12 20.60 1ljm s ALA 1165CO -0.00 -0.18 -0.17 -1.50 0.00 0.00 0.00 175.76 173.90 1ljm s ILE 1166N -2.56 1.56 -0.12 0.00 2.07 -0.17 -4.77 121.20 117.22 1ljm s ILE 1166Ca 0.48 -0.72 -0.16 0.00 -1.41 0.00 0.00 60.65 58.85 1ljm s ILE 1166Cb -0.10 -1.39 -0.05 0.00 0.13 0.00 0.00 42.46 41.05 1ljm s ILE 1166CO 0.39 0.45 0.38 -0.75 -1.91 0.00 0.00 174.94 173.50 1ljm s LYS 1167N 0.60 4.22 -0.20 3.50 2.20 0.16 0.16 119.74 130.38 1ljm s LYS 1167Ca -0.15 0.29 0.01 0.00 -0.36 0.00 0.00 55.97 55.75 1ljm s LYS 1167Cb -0.16 -3.39 0.04 0.00 -1.51 0.00 0.00 37.83 32.81 1ljm s LYS 1167CO 0.05 0.29 -0.09 0.42 -0.36 0.00 0.00 175.35 175.66 1ljm s ILE 1168N 0.25 1.55 0.28 5.43 -1.09 -1.26 -0.81 121.20 125.55 1ljm s ILE 1168Ca 0.21 -0.98 0.06 0.00 -2.23 0.00 0.00 60.65 57.71 1ljm s ILE 1168Cb -0.14 -1.66 -0.06 0.00 -1.58 0.00 0.00 42.46 39.01 1ljm s ILE 1168CO 0.08 0.12 -0.03 0.42 -1.23 0.00 0.00 174.94 174.31 1ljm s THR 1169N 1.43 1.46 0.13 2.92 -4.23 -0.95 0.12 115.64 116.52 1ljm s THR 1169Ca -0.02 -2.08 -0.20 0.00 -1.18 0.00 0.00 61.69 58.22 1ljm s THR 1169Cb -0.16 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.14 1ljm s THR 1169CO -0.08 -0.25 1.71 0.58 -0.54 0.00 0.00 174.62 176.05 1ljm h VAL 1170N 2.27 0.83 0.00 2.29 2.07 -1.95 -0.61 116.25 121.15 1ljm h VAL 1170Ca -0.40 -0.01 -0.27 0.00 0.82 0.00 0.00 66.70 66.84 1ljm h VAL 1170Cb 1.23 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 1ljm h VAL 1170CO 0.68 0.01 -1.53 0.44 0.02 0.00 0.00 177.57 177.19 1ljm h ASP 1171N 0.04 0.00 -1.96 0.57 3.32 -1.97 -3.36 116.42 113.05 1ljm h ASP 1171Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1ljm h ASP 1171Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1ljm h ASP 1171CO -0.18 0.98 0.00 0.61 -1.72 0.00 0.00 179.24 178.92 1ljm n GLY 1172N 1.50 -1.79 3.68 2.75 0.00 -1.19 -4.70 105.19 105.44 1ljm n GLY 1172Ca -0.13 -1.48 -0.46 0.00 0.00 0.00 0.00 46.02 43.95 1ljm n GLY 1172CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ljm n PRO 1173N 0.00 2.24 0.00 1.61 -0.04 -1.26 -4.94 135.00 132.61 1ljm n PRO 1173Ca 0.00 0.81 0.14 0.00 -0.04 0.00 0.00 63.50 64.41 1ljm n PRO 1173Cb 0.00 -2.62 0.52 0.00 -0.04 0.00 0.00 33.50 31.36 1ljm n PRO 1173CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35