#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbr s ALA 1111N 0.00 3.65 0.05 4.61 0.00 -1.26 -5.11 121.76 123.70 2wbr s ALA 1111Ca 0.00 -0.85 0.08 0.00 0.00 0.00 0.00 51.96 51.19 2wbr s ALA 1111Cb 0.00 -1.64 -0.03 0.00 0.00 0.00 0.00 23.12 21.45 2wbr s ALA 1111CO 0.00 0.70 -0.19 -1.64 0.00 0.00 0.00 175.76 174.63 2wbr s MET 1112N -1.77 1.98 0.49 0.00 1.00 -1.26 -5.12 119.30 114.62 2wbr s MET 1112Ca 0.24 -1.03 -0.20 0.00 0.00 0.00 0.00 55.69 54.69 2wbr s MET 1112Cb -0.12 -2.14 -0.08 0.00 0.00 0.00 0.00 34.83 32.48 2wbr s MET 1112CO 0.15 0.53 1.04 0.00 0.00 0.00 0.00 175.02 176.73 2wbr s ALA 1113N -0.94 2.87 0.12 3.03 0.00 -1.26 -5.07 121.76 120.52 2wbr s ALA 1113Ca 0.15 0.61 0.04 0.00 0.00 0.00 0.00 51.96 52.76 2wbr s ALA 1113Cb -0.10 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 2wbr s ALA 1113CO 0.05 -0.31 -0.11 1.67 0.00 0.00 0.00 175.76 177.06 2wbr s TRP 1114N -1.98 1.21 0.27 0.00 -2.14 -1.26 -5.17 118.94 109.88 2wbr s TRP 1114Ca 0.67 -0.68 0.02 0.00 2.66 0.00 0.00 56.10 58.78 2wbr s TRP 1114Cb -0.16 -0.64 -0.05 0.00 -3.10 0.00 0.00 33.47 29.52 2wbr s TRP 1114CO 0.20 0.06 0.07 0.20 -2.66 0.00 0.00 176.95 174.82 2wbr s GLY 1115N -2.75 1.79 0.11 3.67 0.00 -1.26 -5.16 107.32 103.72 2wbr s GLY 1115Ca 0.11 -1.90 0.10 0.00 0.00 0.00 0.00 44.72 43.03 2wbr s GLY 1115CO 0.01 -1.67 -0.24 -0.56 0.00 0.00 0.00 173.10 170.64 2wbr s SER 1116N -3.36 3.50 -0.22 1.64 0.01 -1.26 -4.87 113.70 109.15 2wbr s SER 1116Ca 0.35 -0.66 -0.19 0.00 1.31 0.00 0.00 55.95 56.77 2wbr s SER 1116Cb 0.08 -0.35 -0.03 0.00 0.21 0.00 0.00 66.02 65.93 2wbr s SER 1116CO 0.13 0.19 0.54 -0.94 0.41 0.00 0.00 173.24 173.57 2wbr s SER 1117N -1.97 6.54 -0.01 2.44 1.04 -1.26 -4.87 113.70 115.61 2wbr s SER 1117Ca 0.15 0.65 0.04 0.00 0.48 0.00 0.00 55.95 57.27 2wbr s SER 1117Cb -0.10 -2.30 -0.01 0.00 0.10 0.00 0.00 66.02 63.71 2wbr s SER 1117CO 0.07 -0.23 -0.12 0.26 0.98 0.00 0.00 173.24 174.19 2wbr s TRP 1118N 1.92 1.13 -0.04 5.02 0.52 -1.26 -2.44 118.94 123.78 2wbr s TRP 1118Ca 0.24 -0.23 0.03 0.00 0.02 0.00 0.00 56.10 56.16 2wbr s TRP 1118Cb -0.15 -0.74 0.01 0.00 -1.15 0.00 0.00 33.47 31.43 2wbr s TRP 1118CO 0.09 -0.04 -0.11 -0.51 0.02 0.00 0.00 176.95 176.40 2wbr s LEU 1119N -0.22 1.72 -0.18 2.99 1.43 -1.01 -4.80 118.68 118.61 2wbr s LEU 1119Ca 0.03 -0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 52.88 2wbr s LEU 1119Cb -0.06 -0.72 0.01 0.00 0.03 0.00 0.00 46.19 45.46 2wbr s LEU 1119CO -0.00 0.06 -0.16 -0.22 0.23 0.00 0.00 176.35 176.26 2wbr s LEU 1120N 0.39 2.33 -0.13 1.79 2.96 -0.92 -2.12 118.68 122.99 2wbr s LEU 1120Ca -0.08 -0.57 -0.07 0.00 -0.22 0.00 0.00 54.13 53.19 2wbr s LEU 1120Cb -0.12 -1.54 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 2wbr s LEU 1120CO 0.02 0.01 0.12 -0.76 -1.32 0.00 0.00 176.35 174.42 2wbr s LEU 1121N 1.24 4.27 0.28 -0.68 1.43 -0.55 -1.79 118.68 122.88 2wbr s LEU 1121Ca 0.03 0.39 0.02 0.00 -1.03 0.00 0.00 54.13 53.54 2wbr s LEU 1121Cb -0.14 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2wbr s LEU 1121CO -0.09 0.36 0.15 -0.54 0.23 0.00 0.00 176.35 176.46 2wbr s LYS 1122N -0.75 1.51 -0.56 1.70 1.02 -0.50 -1.16 119.74 121.00 2wbr s LYS 1122Ca 0.13 -1.84 -0.01 0.00 0.02 0.00 0.00 55.97 54.27 2wbr s LYS 1122Cb -0.12 -0.07 0.00 0.00 -0.52 0.00 0.00 37.83 37.12 2wbr s LYS 1122CO 0.03 -0.41 0.47 -1.71 -0.92 0.00 0.00 175.35 172.81 2wbr n ASN 1123N -0.76 -2.53 -4.84 2.83 5.15 -0.78 -2.58 115.26 111.75 2wbr n ASN 1123Ca 0.01 -0.27 -0.37 0.00 -0.60 0.00 0.00 54.58 53.36 2wbr n ASN 1123Cb 0.65 -2.57 -0.07 0.00 -0.53 0.00 0.00 39.78 37.27 2wbr n ASN 1123CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2wbr s LEU 1124N -3.93 4.31 0.55 1.20 1.43 -0.81 -4.69 118.68 116.75 2wbr s LEU 1124Ca 0.07 0.41 -0.18 0.00 -1.03 0.00 0.00 54.13 53.40 2wbr s LEU 1124Cb -0.03 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.08 2wbr s LEU 1124CO 0.33 0.37 1.07 0.42 0.23 0.00 0.00 176.35 178.77 2wbr s THR 1125N -0.78 3.63 0.66 5.49 -4.23 -1.26 -3.84 115.64 115.31 2wbr s THR 1125Ca 0.14 0.90 0.42 0.00 -1.18 0.00 0.00 61.69 61.96 2wbr s THR 1125Cb -0.12 -3.36 0.42 0.00 1.34 0.00 0.00 72.50 70.78 2wbr s THR 1125CO 0.03 -0.34 2.27 0.00 -0.54 0.00 0.00 174.62 176.04 2wbr h ALA 1126N 0.92 1.07 -0.19 3.99 0.00 -1.81 -1.58 119.26 121.67 2wbr h ALA 1126Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2wbr h ALA 1126Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2wbr h ALA 1126CO 0.58 -0.07 0.00 1.04 0.00 0.00 0.00 179.25 180.79 2wbr n GLN 1127N -3.03 1.82 -2.54 0.00 6.02 -1.26 -4.53 117.38 113.86 2wbr n GLN 1127Ca -0.03 -0.83 -0.43 0.00 -0.01 0.00 0.00 57.00 55.71 2wbr n GLN 1127Cb 0.14 -1.46 -0.02 0.00 1.02 0.00 0.00 30.24 29.92 2wbr n GLN 1127CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2wbr s ILE 1128N -1.60 4.45 -0.14 5.09 -1.09 -0.59 -5.01 121.20 122.30 2wbr s ILE 1128Ca 0.15 1.75 -0.19 0.00 -2.23 0.00 0.00 60.65 60.13 2wbr s ILE 1128Cb 0.10 -4.13 -0.04 0.00 -1.58 0.00 0.00 42.46 36.81 2wbr s ILE 1128CO 0.07 -0.06 0.52 -1.81 -1.23 0.00 0.00 174.94 172.42 2wbr s ASP 1129N 1.46 6.68 -0.64 3.58 1.01 -1.26 -4.67 116.67 122.83 2wbr s ASP 1129Ca 0.52 0.81 0.06 0.00 0.71 0.00 0.00 52.55 54.65 2wbr s ASP 1129Cb -0.21 -2.30 0.26 0.00 1.01 0.00 0.00 42.92 41.68 2wbr s ASP 1129CO 0.17 -0.07 0.78 0.61 0.21 0.00 0.00 175.17 176.87 2wbr n GLY 1130N 3.45 4.93 0.10 0.21 0.00 -1.26 -4.66 105.19 107.95 2wbr n GLY 1130Ca -0.06 -2.78 -0.18 0.00 0.00 0.00 0.00 46.02 43.00 2wbr n GLY 1130CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wbr h PRO 1131N 4.05 0.08 -0.77 1.61 0.13 -1.98 -2.80 132.00 132.32 2wbr h PRO 1131Ca 0.19 -0.13 -0.02 0.00 -0.87 0.00 0.00 66.00 65.18 2wbr h PRO 1131Cb 0.64 0.05 -0.04 0.00 0.13 0.00 0.00 31.00 31.78 2wbr h PRO 1131CO 0.85 1.06 0.42 1.15 -0.23 0.00 0.00 178.00 181.24 2wbr h THR 1132N -0.80 1.23 -0.15 1.56 2.02 -1.99 -0.85 112.91 113.92 2wbr h THR 1132Ca -0.18 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.41 2wbr h THR 1132Cb 1.30 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 2wbr h THR 1132CO -0.04 0.26 0.05 0.25 0.37 0.00 0.00 175.52 176.42 2wbr h LEU 1133N 1.08 0.22 -0.48 2.58 5.85 -1.84 -1.46 115.31 121.26 2wbr h LEU 1133Ca 0.27 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2wbr h LEU 1133Cb 0.04 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2wbr h LEU 1133CO -0.04 0.34 0.32 -0.09 -0.34 0.00 0.00 178.44 178.62 2wbr h ARG 1134N 0.08 0.63 -0.89 1.25 2.43 -1.31 -2.56 114.38 114.01 2wbr h ARG 1134Ca 0.05 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2wbr h ARG 1134Cb 0.20 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 2wbr h ARG 1134CO -0.00 0.42 0.51 1.79 -1.51 0.00 0.00 179.97 181.17 2wbr h THR 1135N 0.65 1.25 -0.72 0.20 1.35 -1.01 -2.13 112.91 112.50 2wbr h THR 1135Ca 0.18 -0.60 0.03 0.00 -0.55 0.00 0.00 66.41 65.47 2wbr h THR 1135Cb -0.07 0.03 -0.05 0.00 -1.73 0.00 0.00 68.15 66.33 2wbr h THR 1135CO -0.04 0.28 0.46 0.25 -0.25 0.00 0.00 175.52 176.21 2wbr h LEU 1136N 1.24 0.75 -0.64 3.87 5.85 -0.96 -1.84 115.31 123.57 2wbr h LEU 1136Ca 0.32 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 2wbr h LEU 1136Cb -0.00 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 2wbr h LEU 1136CO -0.05 0.52 0.28 0.00 -0.34 0.00 0.00 178.44 178.85 2wbr h MET 1138N 0.90 1.18 -0.73 0.00 2.86 -1.03 -2.15 114.93 115.96 2wbr h MET 1138Ca 0.22 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.65 2wbr h MET 1138Cb 0.16 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 2wbr h MET 1138CO -0.02 0.90 0.30 1.96 1.06 0.00 0.00 176.91 181.11 2wbr h GLN 1139N 1.17 1.07 -0.62 1.72 4.20 -0.96 -2.58 115.11 119.10 2wbr h GLN 1139Ca 0.29 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.73 2wbr h GLN 1139Cb 0.10 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 2wbr h GLN 1139CO -0.04 0.86 0.03 0.45 -0.67 0.00 0.00 178.83 179.46 2wbr h HIS 1140N 1.05 1.14 -1.74 2.96 3.86 -1.00 -3.46 115.15 117.96 2wbr h HIS 1140Ca 0.25 -0.18 0.13 0.00 -1.16 0.00 0.00 60.37 59.40 2wbr h HIS 1140Cb 0.18 -0.30 -0.20 0.00 1.06 0.00 0.00 27.41 28.14 2wbr h HIS 1140CO 0.02 0.99 0.60 0.20 0.86 0.00 0.00 177.93 180.60 2wbr s GLY 1141N -3.58 -0.31 0.22 2.45 0.00 -0.85 -4.98 107.32 100.27 2wbr s GLY 1141Ca -0.11 1.69 -0.30 0.00 0.00 0.00 0.00 44.72 45.99 2wbr s GLY 1141CO 0.85 0.73 1.43 2.56 0.00 0.00 0.00 173.10 178.67 2wbr s PRO 1142N -1.96 4.29 -0.22 2.90 0.04 -1.25 -4.05 135.00 134.75 2wbr s PRO 1142Ca 0.03 2.24 -0.05 0.00 0.04 0.00 0.00 61.00 63.26 2wbr s PRO 1142Cb -0.01 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.37 2wbr s PRO 1142CO -0.03 -0.41 0.01 -0.51 0.04 0.00 0.00 177.00 176.09 2wbr s LEU 1143N 0.02 3.20 0.13 -3.56 1.43 -1.26 -4.13 118.68 114.51 2wbr s LEU 1143Ca 0.61 -0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.33 2wbr s LEU 1143Cb -0.41 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 2wbr s LEU 1143CO 0.39 0.01 1.49 0.58 0.23 0.00 0.00 176.35 179.05 2wbr h VAL 1144N 5.52 1.28 -2.56 -1.59 2.07 -1.92 -3.45 116.25 115.60 2wbr h VAL 1144Ca -0.38 -1.42 -0.10 0.00 0.82 0.00 0.00 66.70 65.62 2wbr h VAL 1144Cb 1.17 1.34 -0.26 0.00 -1.52 0.00 0.00 31.29 32.03 2wbr h VAL 1144CO 0.60 0.47 -0.25 -0.55 0.02 0.00 0.00 177.57 177.87 2wbr s SER 1145N -6.65 -0.57 -0.07 0.57 0.15 -1.26 -5.06 113.70 100.81 2wbr s SER 1145Ca -0.12 0.98 -0.16 0.00 0.70 0.00 0.00 55.95 57.35 2wbr s SER 1145Cb 0.11 0.87 0.03 0.00 -1.71 0.00 0.00 66.02 65.32 2wbr s SER 1145CO 0.85 -0.20 0.38 0.72 1.20 0.00 0.00 173.24 176.20 2wbr s PHE 1146N 1.33 -0.32 -0.28 3.44 -0.12 -1.26 -1.61 117.98 119.16 2wbr s PHE 1146Ca -0.09 0.64 -0.00 0.00 -0.05 0.00 0.00 56.93 57.43 2wbr s PHE 1146Cb -0.07 0.15 0.08 0.00 -0.63 0.00 0.00 43.02 42.55 2wbr s PHE 1146CO -0.13 -0.35 0.05 -1.01 -0.05 0.00 0.00 175.22 173.73 2wbr s HIS 1147N -0.77 2.06 -0.18 3.49 3.76 -0.18 -4.99 115.29 118.48 2wbr s HIS 1147Ca -0.09 -1.79 -0.23 0.00 -0.15 0.00 0.00 55.06 52.80 2wbr s HIS 1147Cb -0.04 -1.75 -0.02 0.00 1.11 0.00 0.00 32.58 31.88 2wbr s HIS 1147CO 0.04 -0.82 0.75 -1.25 -0.85 0.00 0.00 174.74 172.60 2wbr s PRO 1148N 1.50 4.27 -0.19 8.40 0.04 -1.26 -2.40 135.00 145.35 2wbr s PRO 1148Ca 0.05 0.85 -0.04 0.00 0.04 0.00 0.00 61.00 61.90 2wbr s PRO 1148Cb -0.18 -3.57 -0.02 0.00 0.04 0.00 0.00 34.50 30.77 2wbr s PRO 1148CO -0.16 -0.29 -0.02 0.71 0.04 0.00 0.00 177.00 177.29 2wbr s TYR 1149N 2.03 3.02 0.05 0.56 1.51 0.29 -4.97 117.35 119.84 2wbr s TYR 1149Ca 0.34 -0.48 -0.15 0.00 -1.01 0.00 0.00 57.07 55.77 2wbr s TYR 1149Cb -0.16 -2.04 -0.28 0.00 -0.11 0.00 0.00 41.96 39.37 2wbr s TYR 1149CO 0.12 -0.22 1.11 1.37 -1.11 0.00 0.00 175.55 176.82 2wbr h LEU 1150N 7.32 0.85 0.10 -1.29 8.10 -1.83 -2.72 115.31 125.84 2wbr h LEU 1150Ca -0.35 -0.81 0.01 0.00 0.11 0.00 0.00 57.88 56.84 2wbr h LEU 1150Cb 1.18 -0.26 -0.01 0.00 -0.44 0.00 0.00 40.66 41.12 2wbr h LEU 1150CO 0.61 1.56 -0.12 0.78 -4.11 0.00 0.00 178.44 177.16 2wbr h ASN 1151N 0.24 -0.33 1.48 0.17 4.21 -1.85 -1.04 115.58 118.45 2wbr h ASN 1151Ca -0.17 0.04 -0.00 0.00 1.21 0.00 0.00 56.30 57.38 2wbr h ASN 1151Cb 1.81 0.12 -0.00 0.00 -1.12 0.00 0.00 38.32 39.13 2wbr h ASN 1151CO 0.22 -0.19 -0.01 1.56 -1.29 0.00 0.00 177.43 177.72 2wbr h GLN 1152N -0.26 0.00 -0.31 0.81 4.20 -1.92 -3.42 115.11 114.20 2wbr h GLN 1152Ca 0.01 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 2wbr h GLN 1152Cb 0.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.04 2wbr h GLN 1152CO -0.05 0.01 -0.03 0.41 -0.67 0.00 0.00 178.83 178.51 2wbr n GLY 1153N 0.55 0.42 3.08 3.46 0.00 -0.39 -4.88 105.19 107.42 2wbr n GLY 1153Ca 0.02 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 2wbr n GLY 1153CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wbr s ILE 1154N -2.21 0.55 -0.03 -0.61 -4.36 -1.03 -1.86 121.20 111.66 2wbr s ILE 1154Ca 0.00 -1.20 -0.01 0.00 -0.26 0.00 0.00 60.65 59.19 2wbr s ILE 1154Cb -0.00 -0.76 0.03 0.00 1.25 0.00 0.00 42.46 42.98 2wbr s ILE 1154CO 0.01 -0.46 0.03 0.00 0.24 0.00 0.00 174.94 174.76 2wbr s ALA 1155N -1.71 0.21 -0.12 2.27 0.00 -0.30 -0.54 121.76 121.56 2wbr s ALA 1155Ca -0.07 0.22 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 2wbr s ALA 1155Cb -0.08 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.60 2wbr s ALA 1155CO -0.00 -0.26 -0.07 -1.17 0.00 0.00 0.00 175.76 174.26 2wbr s LEU 1156N 1.50 3.07 -0.00 0.00 2.96 -1.01 -1.48 118.68 123.71 2wbr s LEU 1156Ca -0.03 -0.16 -0.03 0.00 -0.22 0.00 0.00 54.13 53.69 2wbr s LEU 1156Cb -0.13 -1.70 -0.00 0.00 0.50 0.00 0.00 46.19 44.85 2wbr s LEU 1156CO -0.03 0.22 0.05 0.00 -1.32 0.00 0.00 176.35 175.28 2wbr s LYS 1158N -0.78 3.67 0.29 0.00 2.47 -0.63 -2.39 119.74 122.37 2wbr s LYS 1158Ca -0.09 0.11 0.08 0.00 -1.56 0.00 0.00 55.97 54.51 2wbr s LYS 1158Cb -0.05 -3.17 -0.03 0.00 -1.46 0.00 0.00 37.83 33.11 2wbr s LYS 1158CO 0.00 0.71 0.19 0.71 0.16 0.00 0.00 175.35 177.12 2wbr s TYR 1159N -1.12 2.94 0.12 4.03 1.51 -1.02 -3.76 117.35 120.04 2wbr s TYR 1159Ca 0.22 -0.22 -0.12 0.00 -1.01 0.00 0.00 57.07 55.93 2wbr s TYR 1159Cb -0.14 -1.53 -0.10 0.00 -0.11 0.00 0.00 41.96 40.08 2wbr s TYR 1159CO 0.10 0.41 1.39 1.79 -1.11 0.00 0.00 175.55 178.13 2wbr h THR 1160N 1.48 1.28 -3.91 -0.71 1.35 -1.88 -3.40 112.91 107.12 2wbr h THR 1160Ca -0.46 -1.71 -0.46 0.00 -0.55 0.00 0.00 66.41 63.24 2wbr h THR 1160Cb 1.25 1.66 -0.21 0.00 -1.73 0.00 0.00 68.15 69.12 2wbr h THR 1160CO 0.60 0.55 -0.79 0.42 -0.25 0.00 0.00 175.52 176.05 2wbr s THR 1161N -4.12 1.32 0.20 6.82 -4.23 -1.26 -4.82 115.64 109.54 2wbr s THR 1161Ca -0.11 -1.42 -0.10 0.00 -1.18 0.00 0.00 61.69 58.89 2wbr s THR 1161Cb 0.10 -1.26 0.14 0.00 1.34 0.00 0.00 72.50 72.81 2wbr s THR 1161CO 0.88 -0.19 1.81 0.03 -0.54 0.00 0.00 174.62 176.61 2wbr h ARG 1162N 4.16 1.04 -0.63 3.99 3.08 -1.89 -2.62 114.38 121.51 2wbr h ARG 1162Ca -0.42 -0.13 -0.09 0.00 0.07 0.00 0.00 59.98 59.40 2wbr h ARG 1162Cb 1.19 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 31.02 2wbr h ARG 1162CO 0.41 0.79 0.04 0.93 -1.07 0.00 0.00 179.97 181.07 2wbr h GLU 1163N 1.03 1.08 -0.84 0.04 3.07 -1.99 -2.42 114.58 114.55 2wbr h GLU 1163Ca 0.26 -0.32 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 2wbr h GLU 1163Cb 0.06 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 27.82 2wbr h GLU 1163CO -0.04 1.03 0.46 1.49 -1.40 0.00 0.00 179.01 180.55 2wbr h GLU 1164N 0.99 1.17 -0.27 2.33 4.81 -1.94 -2.68 114.58 118.99 2wbr h GLU 1164Ca 0.18 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2wbr h GLU 1164Cb 0.51 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2wbr h GLU 1164CO 0.02 0.86 0.16 0.00 -0.73 0.00 0.00 179.01 179.33 2wbr h ALA 1165N 1.24 0.34 -0.84 2.92 0.00 -1.09 -2.34 119.26 119.49 2wbr h ALA 1165Ca 0.29 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.18 2wbr h ALA 1165Cb 0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2wbr h ALA 1165CO -0.05 -0.15 0.55 -0.91 0.00 0.00 0.00 179.25 178.69 2wbr h ASN 1166N 0.34 0.93 -0.61 0.00 2.35 -1.17 -1.47 115.58 115.96 2wbr h ASN 1166Ca 0.10 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 2wbr h ASN 1166Cb 0.01 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.13 2wbr h ASN 1166CO -0.02 0.66 0.30 0.50 -1.65 0.00 0.00 177.43 177.22 2wbr h LYS 1167N 1.09 0.87 -0.91 0.81 3.64 -1.31 -2.32 116.57 118.44 2wbr h LYS 1167Ca 0.32 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.56 2wbr h LYS 1167Cb -0.07 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.55 2wbr h LYS 1167CO -0.09 0.69 0.50 0.00 -2.27 0.00 0.00 179.45 178.29 2wbr h ALA 1168N 1.13 1.16 -0.57 5.00 0.00 -0.78 -2.65 119.26 122.55 2wbr h ALA 1168Ca 0.21 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2wbr h ALA 1168Cb 0.11 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2wbr h ALA 1168CO -0.03 0.66 0.16 0.37 0.00 0.00 0.00 179.25 180.41 2wbr h GLN 1169N 1.27 0.90 -0.89 0.00 4.15 -0.96 -1.58 115.11 118.00 2wbr h GLN 1169Ca 0.32 -0.21 -0.01 0.00 0.77 0.00 0.00 58.65 59.53 2wbr h GLN 1169Cb 0.01 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.54 2wbr h GLN 1169CO -0.05 0.83 0.53 0.52 -1.93 0.00 0.00 178.83 178.73 2wbr h MET 1170N 0.81 1.21 -0.13 1.69 2.86 -1.08 0.31 114.93 120.60 2wbr h MET 1170Ca 0.18 -0.11 -0.12 0.00 -2.06 0.00 0.00 59.70 57.59 2wbr h MET 1170Cb 0.32 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.73 2wbr h MET 1170CO -0.00 0.85 -0.39 0.00 1.06 0.00 0.00 176.91 178.43 2wbr h ALA 1171N 1.29 0.22 -0.04 6.32 0.00 -1.36 -3.31 119.26 122.39 2wbr h ALA 1171Ca 0.32 -0.45 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 2wbr h ALA 1171Cb -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2wbr h ALA 1171CO -0.06 0.32 -0.77 -0.07 0.00 0.00 0.00 179.25 178.67 2wbr h LEU 1172N 0.10 0.35 -9.89 0.00 3.38 -1.02 -3.42 115.31 104.80 2wbr h LEU 1172Ca -0.01 -0.24 -0.52 0.00 0.09 0.00 0.00 57.88 57.19 2wbr h LEU 1172Cb 1.01 -0.10 0.06 0.00 0.09 0.00 0.00 40.66 41.72 2wbr h LEU 1172CO 0.08 0.99 0.60 0.21 0.09 0.00 0.00 178.44 180.41 2wbr s ASN 1173N -6.95 6.71 -1.49 -0.43 2.47 0.10 -3.03 114.94 112.32 2wbr s ASN 1173Ca -0.04 2.60 -0.06 0.00 0.42 0.00 0.00 52.86 55.78 2wbr s ASN 1173Cb 0.11 -2.64 0.02 0.00 -1.45 0.00 0.00 41.25 37.29 2wbr s ASN 1173CO 0.83 -0.57 0.61 0.59 -3.72 0.00 0.00 177.10 174.84 2wbr n ASN 1174N 0.62 -5.60 -4.60 -4.21 3.02 -1.17 -4.84 115.26 98.49 2wbr n ASN 1174Ca 0.01 -0.33 -0.35 0.00 -0.03 0.00 0.00 54.58 53.88 2wbr n ASN 1174Cb 0.43 -4.53 -0.10 0.00 -0.61 0.00 0.00 39.78 34.96 2wbr n ASN 1174CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wbr s VAL 1176N 0.72 4.21 0.36 0.00 1.01 -1.26 -1.11 120.40 124.33 2wbr s VAL 1176Ca 0.04 -0.24 0.09 0.00 0.00 0.00 0.00 61.98 61.86 2wbr s VAL 1176Cb -0.13 -2.87 -0.07 0.00 0.00 0.00 0.00 36.38 33.31 2wbr s VAL 1176CO 0.02 0.48 -0.07 -0.76 0.00 0.00 0.00 175.10 174.77 2wbr s LEU 1177N 0.40 2.75 -0.47 3.92 1.43 -0.52 -5.01 118.68 121.18 2wbr s LEU 1177Ca -0.01 -1.24 -0.35 0.00 -1.03 0.00 0.00 54.13 51.49 2wbr s LEU 1177Cb -0.14 -0.96 -0.14 0.00 0.03 0.00 0.00 46.19 44.99 2wbr s LEU 1177CO 0.02 -0.27 2.27 0.00 0.23 0.00 0.00 176.35 178.59 2wbr n ALA 1178N -0.83 0.81 -0.94 4.21 0.00 -1.26 -1.26 120.51 121.24 2wbr n ALA 1178Ca -0.05 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2wbr n ALA 1178Cb 0.64 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.60 2wbr n ALA 1178CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2wbr n ASN 1179N 10.10 -2.30 -4.01 0.00 0.23 -1.26 -4.98 115.26 113.04 2wbr n ASN 1179Ca 0.46 0.00 -0.08 0.00 -0.53 0.00 0.00 54.58 54.43 2wbr n ASN 1179Cb 0.19 -1.11 -0.11 0.00 -2.08 0.00 0.00 39.78 36.67 2wbr n ASN 1179CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2wbr s THR 1180N -2.29 0.14 -0.05 5.53 -1.32 -0.39 -5.16 115.64 112.11 2wbr s THR 1180Ca 0.00 -1.17 0.05 0.00 -1.21 0.00 0.00 61.69 59.36 2wbr s THR 1180Cb 0.00 -0.66 -0.01 0.00 -1.51 0.00 0.00 72.50 70.33 2wbr s THR 1180CO 0.00 -0.65 -0.22 -0.89 -2.21 0.00 0.00 174.62 170.65 2wbr s THR 1181N -2.22 1.84 -0.13 5.08 2.01 -1.26 -1.44 115.64 119.53 2wbr s THR 1181Ca -0.09 -0.95 0.00 0.00 0.31 0.00 0.00 61.69 60.97 2wbr s THR 1181Cb -0.04 -1.57 -0.01 0.00 0.01 0.00 0.00 72.50 70.88 2wbr s THR 1181CO -0.04 0.52 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.64 2wbr s ILE 1182N -0.08 3.00 0.15 1.82 1.01 -0.27 -4.75 121.20 122.09 2wbr s ILE 1182Ca -0.04 -0.68 0.09 0.00 0.00 0.00 0.00 60.65 60.02 2wbr s ILE 1182Cb -0.13 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 2wbr s ILE 1182CO 0.03 0.53 -0.15 -0.36 0.00 0.00 0.00 174.94 174.99 2wbr s PHE 1183N 0.34 2.56 -0.04 3.97 0.08 -1.07 -1.95 117.98 121.87 2wbr s PHE 1183Ca -0.11 -0.25 0.03 0.00 0.12 0.00 0.00 56.93 56.72 2wbr s PHE 1183Cb -0.16 -1.30 0.00 0.00 -0.57 0.00 0.00 43.02 40.99 2wbr s PHE 1183CO 0.06 0.46 -0.14 0.00 -0.10 0.00 0.00 175.22 175.50 2wbr s ALA 1184N -1.45 1.26 0.11 5.36 0.00 -1.26 -1.41 121.76 124.37 2wbr s ALA 1184Ca 0.21 -0.52 -0.00 0.00 0.00 0.00 0.00 51.96 51.65 2wbr s ALA 1184Cb -0.10 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 2wbr s ALA 1184CO 0.12 0.20 0.02 -1.21 0.00 0.00 0.00 175.76 174.89 2wbr s GLU 1185N 0.21 0.86 -0.60 0.00 2.02 -0.74 -4.76 118.70 115.69 2wbr s GLU 1185Ca -0.06 -1.39 -0.01 0.00 0.02 0.00 0.00 54.97 53.54 2wbr s GLU 1185Cb -0.11 0.13 0.15 0.00 0.10 0.00 0.00 34.13 34.40 2wbr s GLU 1185CO 0.02 -0.18 0.39 -1.54 0.02 0.00 0.00 175.26 173.97 2wbr s SER 1186N -3.03 4.95 0.70 -0.19 1.04 -1.26 -2.16 113.70 113.75 2wbr s SER 1186Ca 0.19 -2.94 -0.16 0.00 0.48 0.00 0.00 55.95 53.52 2wbr s SER 1186Cb 0.07 -1.79 0.02 0.00 0.10 0.00 0.00 66.02 64.43 2wbr s SER 1186CO -0.02 -0.32 1.21 -2.16 0.98 0.00 0.00 173.24 172.93 2wbr s PRO 1187N -0.18 2.33 0.80 4.02 0.04 -1.26 -4.98 135.00 135.76 2wbr s PRO 1187Ca 0.17 1.76 -0.11 0.00 0.04 0.00 0.00 61.00 62.87 2wbr s PRO 1187Cb -0.22 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.54 2wbr s PRO 1187CO -0.02 -1.69 1.10 -1.54 0.04 0.00 0.00 177.00 174.88 2wbr s SER 1188N -1.97 4.27 0.35 6.66 1.04 -1.26 -4.72 113.70 118.07 2wbr s SER 1188Ca 0.75 1.82 0.04 0.00 0.48 0.00 0.00 55.95 59.04 2wbr s SER 1188Cb -0.29 -2.49 0.69 0.00 0.10 0.00 0.00 66.02 64.02 2wbr s SER 1188CO 0.43 -2.19 1.98 -0.33 0.98 0.00 0.00 173.24 174.12 2wbr h GLU 1189N -1.23 0.79 -0.82 4.02 5.08 -1.99 0.39 114.58 120.81 2wbr h GLU 1189Ca -0.44 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 57.84 2wbr h GLU 1189Cb 1.24 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 30.27 2wbr h GLU 1189CO 0.51 0.52 0.39 -0.91 -1.00 0.00 0.00 179.01 178.51 2wbr h ASN 1190N 0.81 1.08 0.12 1.42 2.35 -2.00 -2.36 115.58 117.00 2wbr h ASN 1190Ca 0.28 -0.13 -0.11 0.00 -0.55 0.00 0.00 56.30 55.79 2wbr h ASN 1190Cb 0.10 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 2wbr h ASN 1190CO -0.08 0.92 -0.37 -0.33 -1.65 0.00 0.00 177.43 175.92 2wbr h GLU 1191N 1.17 0.34 -0.54 0.81 5.08 -0.77 -2.44 114.58 118.24 2wbr h GLU 1191Ca 0.28 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2wbr h GLU 1191Cb 0.13 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2wbr h GLU 1191CO -0.03 0.67 0.25 0.28 -1.00 0.00 0.00 179.01 179.18 2wbr h VAL 1192N 0.29 1.21 -0.93 3.13 2.07 -0.14 -2.31 116.25 119.57 2wbr h VAL 1192Ca 0.03 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 2wbr h VAL 1192Cb 0.79 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2wbr h VAL 1192CO 0.06 0.23 0.56 1.56 0.02 0.00 0.00 177.57 180.01 2wbr h GLN 1193N 0.73 1.26 -0.95 1.57 1.08 -1.18 -2.19 115.11 115.43 2wbr h GLN 1193Ca 0.19 -0.11 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2wbr h GLN 1193Cb 0.14 -0.26 -0.05 0.00 -0.05 0.00 0.00 27.48 27.26 2wbr h GLN 1193CO -0.02 0.88 0.61 0.77 -0.95 0.00 0.00 178.83 180.12 2wbr h SER 1194N 1.28 1.11 -0.38 1.46 0.02 -1.04 -1.66 113.55 114.34 2wbr h SER 1194Ca 0.33 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.21 2wbr h SER 1194Cb -0.05 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.19 2wbr h SER 1194CO -0.06 0.82 0.14 0.40 -1.14 0.00 0.00 176.83 176.99 2wbr h ILE 1195N 1.30 1.20 -0.50 3.27 2.04 -0.96 -2.70 117.51 121.16 2wbr h ILE 1195Ca 0.35 -0.65 0.03 0.00 1.00 0.00 0.00 64.86 65.59 2wbr h ILE 1195Cb -0.12 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 2wbr h ILE 1195CO -0.07 0.23 0.33 0.24 0.00 0.00 0.00 178.15 178.88 2wbr h MET 1196N 0.47 0.54 -6.03 2.37 2.86 -0.85 -3.40 114.93 110.90 2wbr h MET 1196Ca 0.13 -0.03 -0.56 0.00 -2.06 0.00 0.00 59.70 57.17 2wbr h MET 1196Cb 0.23 -0.12 -0.05 0.00 0.06 0.00 0.00 31.60 31.71 2wbr h MET 1196CO -0.01 0.36 0.10 -1.14 1.06 0.00 0.00 176.91 177.29 2wbr s GLN 1197N -5.50 4.43 0.00 1.72 0.74 -0.67 -5.12 119.66 115.25 2wbr s GLN 1197Ca -0.08 0.89 0.31 0.00 0.05 0.00 0.00 55.36 56.52 2wbr s GLN 1197Cb 0.18 -3.45 1.68 0.00 1.10 0.00 0.00 33.01 32.51 2wbr s GLN 1197CO 0.74 0.04 2.10 0.72 -0.55 0.00 0.00 175.29 178.34