#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kre n SER 1204N 0.00 -5.12 -4.78 1.61 7.64 -1.26 -4.92 113.62 106.79 2kre n SER 1204Ca 0.00 -0.44 -0.35 0.00 1.01 0.00 0.00 58.87 59.08 2kre n SER 1204Cb 0.00 -4.14 -0.01 0.00 -1.01 0.00 0.00 64.21 59.05 2kre n SER 1204CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2kre s HIS 1205N -3.14 2.77 -0.25 1.43 5.65 -1.26 -4.43 115.29 116.06 2kre s HIS 1205Ca 0.44 1.55 -0.02 0.00 0.25 0.00 0.00 55.06 57.27 2kre s HIS 1205Cb -0.21 -3.28 0.01 0.00 -1.18 0.00 0.00 32.58 27.92 2kre s HIS 1205CO 0.54 -1.45 0.05 1.63 -0.65 0.00 0.00 174.74 174.86 2kre n LYS 1206N -1.04 -3.36 0.00 2.88 4.76 -1.26 -5.07 118.16 115.07 2kre n LYS 1206Ca 0.10 2.70 0.00 0.00 -2.87 0.00 0.00 58.31 58.24 2kre n LYS 1206Cb 0.50 -4.82 0.00 0.00 -1.84 0.00 0.00 35.03 28.87 2kre n LYS 1206CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2kre n PHE 1207N 0.99 0.00 -2.92 2.13 -0.00 -1.26 -5.11 117.46 111.29 2kre n PHE 1207Ca -0.08 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 56.97 2kre n PHE 1207Cb 0.17 0.00 -0.04 0.00 -0.00 0.00 0.00 39.48 39.61 2kre n PHE 1207CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2kre s ALA 1208N -2.00 3.29 0.00 3.13 0.00 -1.26 -5.00 121.76 119.91 2kre s ALA 1208Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.26 2kre s ALA 1208Cb 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2kre s ALA 1208CO 0.00 -0.10 0.00 0.39 0.00 0.00 0.00 175.76 176.05 2kre n GLU 1209N 3.58 0.00 -1.20 0.00 1.02 -1.26 -5.07 120.64 117.71 2kre n GLU 1209Ca 0.01 0.07 0.13 0.00 -0.02 0.00 0.00 57.16 57.35 2kre n GLU 1209Cb 0.51 -0.45 -0.06 0.00 -0.02 0.00 0.00 31.44 31.42 2kre n GLU 1209CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2kre n LYS 1210N -1.04 -2.37 0.00 3.49 4.81 -1.26 -5.03 118.16 116.75 2kre n LYS 1210Ca 0.00 1.87 0.00 0.00 -0.87 0.00 0.00 58.31 59.31 2kre n LYS 1210Cb 0.00 -2.94 0.00 0.00 0.02 0.00 0.00 35.03 32.11 2kre n LYS 1210CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2kre n VAL 1211N -3.85 0.00 -0.08 3.15 0.31 -1.26 -5.08 118.33 111.52 2kre n VAL 1211Ca -0.05 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.13 2kre n VAL 1211Cb 0.57 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.38 2kre n VAL 1211CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2kre h GLU 1212N 0.00 0.00 -2.64 5.55 4.81 -2.06 -3.51 114.58 116.73 2kre h GLU 1212Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2kre h GLU 1212Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2kre h GLU 1212CO 0.00 0.92 -0.63 0.39 -0.73 0.00 0.00 179.01 178.97 2kre n GLU 1213N -4.57 -3.32 0.00 1.92 4.71 -1.26 -5.04 120.64 113.08 2kre n GLU 1213Ca -0.15 2.42 0.00 0.00 -0.01 0.00 0.00 57.16 59.42 2kre n GLU 1213Cb 0.50 -2.69 0.00 0.00 -1.01 0.00 0.00 31.44 28.24 2kre n GLU 1213CO 0.00 0.00 0.00 0.44 0.09 0.00 0.00 177.13 177.66 2kre n ILE 1214N -0.26 0.00 0.00 -3.67 -6.64 -1.26 -5.03 119.36 102.50 2kre n ILE 1214Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 2kre n ILE 1214Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 2kre n ILE 1214CO 0.00 0.00 0.00 1.33 -1.77 0.00 0.00 176.55 176.11 2kre n VAL 1215N -0.71 0.00 -0.60 7.28 0.24 -1.26 -4.78 118.33 118.50 2kre n VAL 1215Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2kre n VAL 1215Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2kre n VAL 1215CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kre n ALA 1216N 2.64 0.00 -3.49 2.33 0.00 -1.26 -5.08 120.51 115.65 2kre n ALA 1216Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2kre n ALA 1216Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2kre n ALA 1216CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2kre s LYS 1217N 3.87 1.09 0.00 0.00 2.20 -1.26 -4.71 119.74 120.94 2kre s LYS 1217Ca 0.00 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.58 2kre s LYS 1217Cb 0.00 0.51 0.00 0.00 -1.51 0.00 0.00 37.83 36.83 2kre s LYS 1217CO 0.00 -0.40 0.00 0.09 -0.36 0.00 0.00 175.35 174.68 2kre n ASN 1218N 0.39 0.00 -3.31 1.43 3.02 -1.26 -5.18 115.26 110.35 2kre n ASN 1218Ca -0.17 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.25 2kre n ASN 1218Cb 0.60 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.74 2kre n ASN 1218CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kre s ALA 1219N 0.00 0.24 0.00 5.41 0.00 -1.26 -4.91 121.76 121.24 2kre s ALA 1219Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.73 2kre s ALA 1219Cb 0.00 1.03 0.00 0.00 0.00 0.00 0.00 23.12 24.15 2kre s ALA 1219CO 0.00 -0.85 0.00 0.54 0.00 0.00 0.00 175.76 175.45 2kre n ARG 1220N -0.52 0.00 0.00 0.00 1.74 -1.26 -4.97 116.66 111.65 2kre n ARG 1220Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2kre n ARG 1220Cb 0.61 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.05 2kre n ARG 1220CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2kre n ALA 1221N -3.00 -0.36 -1.33 7.54 0.00 -1.26 -4.82 120.51 117.28 2kre n ALA 1221Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2kre n ALA 1221Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2kre n ALA 1221CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2kre n GLU 1222N -1.93 3.38 -4.03 0.00 -0.58 -1.26 -5.13 120.64 111.09 2kre n GLU 1222Ca 0.00 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.66 2kre n GLU 1222Cb 0.00 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 30.76 2kre n GLU 1222CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2kre s ILE 1223N 1.08 0.16 0.15 -3.67 1.01 -1.26 -4.77 121.20 113.91 2kre s ILE 1223Ca 0.00 -1.30 -0.30 0.00 0.00 0.00 0.00 60.65 59.06 2kre s ILE 1223Cb 0.00 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 2kre s ILE 1223CO 0.00 -0.71 1.55 -2.24 0.00 0.00 0.00 174.94 173.54 2kre h ASP 1224N 4.01 -1.78 0.00 3.58 2.03 -2.00 0.67 116.42 122.93 2kre h ASP 1224Ca -0.33 0.26 0.00 0.00 -0.73 0.00 0.00 57.03 56.23 2kre h ASP 1224Cb 1.18 0.77 0.00 0.00 -0.83 0.00 0.00 39.33 40.45 2kre h ASP 1224CO 0.52 -0.35 0.00 0.00 -1.03 0.00 0.00 179.24 178.38 2kre n TYR 1225N -5.37 0.00 -0.53 4.15 0.18 -1.26 -3.86 117.16 110.47 2kre n TYR 1225Ca -0.00 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.72 2kre n TYR 1225Cb 0.33 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.22 2kre n TYR 1225CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 2kre n SER 1226N -0.56 3.36 0.11 9.48 3.41 0.23 -3.38 113.62 126.27 2kre n SER 1226Ca 0.00 -2.05 0.00 0.00 -0.26 0.00 0.00 58.87 56.56 2kre n SER 1226Cb 0.00 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 2kre n SER 1226CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2kre n ASP 1227N 2.36 -1.93 -0.11 4.04 2.03 -1.25 -4.91 116.55 116.77 2kre n ASP 1227Ca 0.19 0.59 0.01 0.00 0.52 0.00 0.00 54.79 56.10 2kre n ASP 1227Cb 0.50 2.02 -0.01 0.00 -0.72 0.00 0.00 41.12 42.91 2kre n ASP 1227CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kre n ALA 1228N -3.06 -0.29 -1.00 -1.67 0.00 -1.22 -4.35 120.51 108.92 2kre n ALA 1228Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2kre n ALA 1228Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.33 2kre n ALA 1228CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2kre n PRO 1229N -2.41 0.00 -3.18 0.00 -0.02 -1.26 -4.85 135.00 123.29 2kre n PRO 1229Ca -0.01 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.24 2kre n PRO 1229Cb 0.05 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.48 2kre n PRO 1229CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kre n ASP 1230N 0.00 2.13 0.00 2.55 5.68 -1.26 -4.81 116.55 120.84 2kre n ASP 1230Ca 0.00 -3.18 0.00 0.00 -0.50 0.00 0.00 54.79 51.11 2kre n ASP 1230Cb 0.00 -0.62 0.00 0.00 -1.14 0.00 0.00 41.12 39.36 2kre n ASP 1230CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 2kre n GLU 1231N 0.57 0.00 0.00 0.11 4.07 -1.26 -4.91 120.64 119.22 2kre n GLU 1231Ca 0.26 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.37 2kre n GLU 1231Cb 0.51 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 31.91 2kre n GLU 1231CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 2kre n PHE 1232N -2.06 0.00 -4.75 4.31 3.72 -1.26 -4.70 117.46 112.72 2kre n PHE 1232Ca 0.00 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.09 2kre n PHE 1232Cb 0.00 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.41 2kre n PHE 1232CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 2kre s ARG 1233N -2.00 2.02 0.02 -1.08 3.03 -1.26 -2.69 118.95 116.98 2kre s ARG 1233Ca 0.01 -1.00 -0.30 0.00 2.03 0.00 0.00 55.73 56.46 2kre s ARG 1233Cb 0.00 -2.14 -0.06 0.00 -1.03 0.00 0.00 34.95 31.72 2kre s ARG 1233CO 0.01 0.54 1.52 0.34 -1.13 0.00 0.00 175.30 176.57 2kre s ASP 1234N -1.33 6.74 0.27 -2.89 2.15 -0.92 -4.72 116.67 115.97 2kre s ASP 1234Ca 0.14 2.26 -0.09 0.00 0.43 0.00 0.00 52.55 55.28 2kre s ASP 1234Cb -0.10 -2.56 0.43 0.00 -0.30 0.00 0.00 42.92 40.39 2kre s ASP 1234CO 0.04 -0.81 1.56 -0.65 -0.17 0.00 0.00 175.17 175.15 2kre h PRO 1235N 8.21 -0.00 0.00 4.34 0.11 -1.92 1.32 132.00 144.06 2kre h PRO 1235Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2kre h PRO 1235Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2kre h PRO 1235CO 0.92 -0.00 0.00 1.47 -0.21 0.00 0.00 178.00 180.18 2kre n LEU 1236N -5.60 0.00 0.26 2.35 -0.00 -1.26 -3.43 117.00 109.31 2kre n LEU 1236Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.16 2kre n LEU 1236Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.90 2kre n LEU 1236CO -0.11 0.00 0.85 0.80 -0.00 0.00 0.00 177.39 178.93 2kre n MET 1237N 0.00 0.02 -4.00 1.47 0.00 -1.23 -4.69 117.12 108.70 2kre n MET 1237Ca 0.00 0.74 -0.33 0.00 0.00 0.00 0.00 57.70 58.11 2kre n MET 1237Cb 0.00 -2.26 -0.01 0.00 0.00 0.00 0.00 33.22 30.94 2kre n MET 1237CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 2kre n ASP 1238N -2.12 -2.10 -3.54 6.12 5.68 0.45 -4.93 116.55 116.11 2kre n ASP 1238Ca 0.00 -1.14 -0.15 0.00 -0.50 0.00 0.00 54.79 53.00 2kre n ASP 1238Cb 0.85 -2.50 -0.06 0.00 -1.14 0.00 0.00 41.12 38.27 2kre n ASP 1238CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2kre s THR 1239N -3.83 0.00 0.08 2.12 2.01 -1.23 -4.85 115.64 109.94 2kre s THR 1239Ca 0.23 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 62.02 2kre s THR 1239Cb -0.10 -1.00 -0.12 0.00 0.01 0.00 0.00 72.50 71.29 2kre s THR 1239CO 0.93 0.00 0.46 -0.11 -0.69 0.00 0.00 174.62 175.21 2kre n LEU 1240N 0.88 -0.52 -4.79 4.42 7.94 -1.26 -2.17 117.00 121.50 2kre n LEU 1240Ca -0.16 0.74 -0.38 0.00 -1.11 0.00 0.00 56.01 55.10 2kre n LEU 1240Cb 0.57 -0.61 -0.06 0.00 0.53 0.00 0.00 43.42 43.85 2kre n LEU 1240CO 0.21 -1.68 0.13 -0.04 -1.11 0.00 0.00 177.39 174.89 2kre s MET 1241N -0.41 4.09 0.08 1.96 -1.94 -1.10 -4.76 119.30 117.21 2kre s MET 1241Ca 0.48 0.42 0.23 0.00 -1.71 0.00 0.00 55.69 55.10 2kre s MET 1241Cb -0.68 -3.30 -0.06 0.00 2.01 0.00 0.00 34.83 32.79 2kre s MET 1241CO 0.36 0.50 0.90 0.25 -0.01 0.00 0.00 175.02 177.02 2kre n THR 1242N 2.48 0.27 -3.17 2.05 -2.24 -1.26 -4.68 114.28 107.73 2kre n THR 1242Ca -0.12 -0.40 -0.13 0.00 -2.27 0.00 0.00 64.05 61.14 2kre n THR 1242Cb 0.52 -0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 2kre n THR 1242CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2kre s ASP 1243N -4.51 0.07 -0.22 3.42 1.47 -1.26 -5.07 116.67 110.57 2kre s ASP 1243Ca -0.00 -1.87 -0.29 0.00 1.18 0.00 0.00 52.55 51.56 2kre s ASP 1243Cb 0.13 0.92 -0.02 0.00 -0.34 0.00 0.00 42.92 43.62 2kre s ASP 1243CO 0.83 -0.16 1.42 -2.16 0.68 0.00 0.00 175.17 175.77 2kre s PRO 1244N 0.99 3.97 -0.01 2.11 0.04 -1.25 -2.01 135.00 138.85 2kre s PRO 1244Ca 0.24 1.55 0.07 0.00 0.04 0.00 0.00 61.00 62.90 2kre s PRO 1244Cb -0.05 -3.91 -0.02 0.00 0.04 0.00 0.00 34.50 30.56 2kre s PRO 1244CO -0.08 -1.06 -0.21 0.14 0.04 0.00 0.00 177.00 175.84 2kre s VAL 1245N 4.40 1.64 -0.34 -0.36 -7.23 0.97 -2.51 120.40 116.97 2kre s VAL 1245Ca 0.62 -0.94 -0.21 0.00 -1.81 0.00 0.00 61.98 59.64 2kre s VAL 1245Cb -0.22 -1.38 0.00 0.00 0.56 0.00 0.00 36.38 35.35 2kre s VAL 1245CO 0.24 0.42 0.67 -0.60 -0.31 0.00 0.00 175.10 175.51 2kre s ARG 1246N -0.60 3.77 0.42 4.82 3.52 0.94 -1.55 118.95 130.27 2kre s ARG 1246Ca 0.08 0.20 -0.01 0.00 -0.13 0.00 0.00 55.73 55.87 2kre s ARG 1246Cb -0.08 -3.78 -0.02 0.00 -1.56 0.00 0.00 34.95 29.51 2kre s ARG 1246CO -0.00 -0.71 0.65 -0.48 -0.81 0.00 0.00 175.30 173.95 2kre s LEU 1247N 2.77 3.76 0.00 -0.88 2.34 -0.38 -0.40 118.68 125.89 2kre s LEU 1247Ca 0.26 0.46 0.00 0.00 0.06 0.00 0.00 54.13 54.91 2kre s LEU 1247Cb -0.14 -3.34 0.00 0.00 -0.56 0.00 0.00 46.19 42.15 2kre s LEU 1247CO 0.14 -0.55 0.90 -2.65 -1.06 0.00 0.00 176.35 173.14 2kre n PRO 1248N -2.02 0.00 -0.07 1.48 -0.02 -1.26 -1.26 135.00 131.85 2kre n PRO 1248Ca -0.01 0.82 0.07 0.00 -2.02 0.00 0.00 63.50 62.36 2kre n PRO 1248Cb 0.57 -1.40 0.13 0.00 -0.02 0.00 0.00 33.50 32.77 2kre n PRO 1248CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2kre n SER 1249N -2.46 0.07 0.00 2.55 7.64 -1.26 -4.55 113.62 115.60 2kre n SER 1249Ca 0.00 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.23 2kre n SER 1249Cb 0.00 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 2kre n SER 1249CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kre n GLY 1250N -1.06 0.90 3.08 0.23 0.00 -0.39 -5.15 105.19 102.81 2kre n GLY 1250Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 2kre n GLY 1250CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kre s THR 1251N -1.28 0.12 -0.10 2.61 2.01 -1.23 -4.98 115.64 112.80 2kre s THR 1251Ca 0.00 -0.97 -0.06 0.00 0.31 0.00 0.00 61.69 60.97 2kre s THR 1251Cb 0.00 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.81 2kre s THR 1251CO 0.00 -0.54 0.14 -0.63 -0.69 0.00 0.00 174.62 172.91 2kre s ILE 1252N -2.07 5.43 0.36 1.82 1.09 -1.26 -1.25 121.20 125.32 2kre s ILE 1252Ca -0.10 0.12 -0.05 0.00 -1.10 0.00 0.00 60.65 59.52 2kre s ILE 1252Cb -0.04 -3.39 0.01 0.00 -1.06 0.00 0.00 42.46 37.98 2kre s ILE 1252CO -0.02 0.57 0.54 0.00 -0.10 0.00 0.00 174.94 175.93 2kre s MET 1253N -1.19 1.99 -0.52 2.79 0.23 -0.59 -4.67 119.30 117.34 2kre s MET 1253Ca 0.17 -1.70 -0.19 0.00 -1.03 0.00 0.00 55.69 52.94 2kre s MET 1253Cb -0.12 0.48 0.07 0.00 -1.53 0.00 0.00 34.83 33.73 2kre s MET 1253CO 0.07 -0.85 0.62 0.34 -2.03 0.00 0.00 175.02 173.16 2kre s ASP 1254N -3.21 6.21 0.00 -1.18 -1.08 -1.25 -0.02 116.67 116.14 2kre s ASP 1254Ca 0.27 -1.09 0.00 0.00 -0.52 0.00 0.00 52.55 51.22 2kre s ASP 1254Cb -0.01 -2.28 0.00 0.00 -1.46 0.00 0.00 42.92 39.16 2kre s ASP 1254CO 0.19 -0.92 0.59 -2.11 0.52 0.00 0.00 175.17 173.44 2kre n ARG 1255N 6.10 0.00 -0.00 4.34 -4.01 -0.85 0.47 116.66 122.71 2kre n ARG 1255Ca -0.08 0.16 -0.20 0.00 -1.04 0.00 0.00 57.85 56.69 2kre n ARG 1255Cb 0.44 -1.72 -0.14 0.00 -3.04 0.00 0.00 32.46 28.01 2kre n ARG 1255CO 0.00 0.00 0.00 0.77 -3.04 0.00 0.00 177.63 175.36 2kre h SER 1256N 0.00 0.32 -0.57 2.89 0.02 -1.90 -2.75 113.55 111.56 2kre h SER 1256Ca 0.00 -0.86 -0.05 0.00 -0.84 0.00 0.00 61.79 60.04 2kre h SER 1256Cb 0.43 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 2kre h SER 1256CO 0.00 1.47 0.16 0.40 -1.14 0.00 0.00 176.83 177.72 2kre h ILE 1257N -0.47 1.24 -0.80 3.27 1.08 -0.39 -2.72 117.51 118.72 2kre h ILE 1257Ca -0.23 -0.84 0.03 0.00 -0.39 0.00 0.00 64.86 63.43 2kre h ILE 1257Cb 1.59 0.71 -0.05 0.00 -3.07 0.00 0.00 36.82 36.01 2kre h ILE 1257CO 0.05 0.31 0.51 0.40 -0.69 0.00 0.00 178.15 178.74 2kre h ILE 1258N 0.80 1.14 -0.94 -0.67 1.08 -1.56 -1.64 117.51 115.72 2kre h ILE 1258Ca 0.18 -0.35 0.27 0.00 -0.39 0.00 0.00 64.86 64.57 2kre h ILE 1258Cb 0.31 0.04 -0.17 0.00 -3.07 0.00 0.00 36.82 33.93 2kre h ILE 1258CO -0.00 0.18 0.15 -0.07 -0.69 0.00 0.00 178.15 177.72 2kre h LEU 1259N 1.01 -0.23 0.11 1.44 -0.00 -1.16 0.60 115.31 117.08 2kre h LEU 1259Ca 0.31 0.25 -0.27 0.00 -0.00 0.00 0.00 57.88 58.17 2kre h LEU 1259Cb -0.02 0.38 -0.00 0.00 -0.00 0.00 0.00 40.66 41.02 2kre h LEU 1259CO -0.10 -0.29 -1.26 0.03 -0.00 0.00 0.00 178.44 176.81 2kre h ARG 1260N 0.08 0.22 -0.82 1.13 3.08 -1.51 -3.30 114.38 113.26 2kre h ARG 1260Ca 0.60 -0.38 0.19 0.00 0.07 0.00 0.00 59.98 60.46 2kre h ARG 1260Cb 1.28 0.14 -0.15 0.00 0.08 0.00 0.00 29.97 31.32 2kre h ARG 1260CO -0.80 1.16 -0.05 1.25 -1.07 0.00 0.00 179.97 180.45 2kre h HIS 1261N 0.06 -0.16 -0.41 3.04 2.76 0.11 0.19 115.15 120.74 2kre h HIS 1261Ca -0.14 0.06 -0.11 0.00 -2.20 0.00 0.00 60.37 57.99 2kre h HIS 1261Cb 1.95 0.20 -0.01 0.00 1.55 0.00 0.00 27.41 31.10 2kre h HIS 1261CO 0.05 -0.31 -0.17 -0.07 -1.30 0.00 0.00 177.93 176.13 2kre h LEU 1262N 0.06 0.86 -1.17 0.26 3.38 -1.51 0.44 115.31 117.63 2kre h LEU 1262Ca 0.44 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2kre h LEU 1262Cb 0.78 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2kre h LEU 1262CO -0.77 1.06 0.25 0.25 0.09 0.00 0.00 178.44 179.33 2kre h LEU 1263N 0.66 0.00 -0.51 1.67 5.85 -0.72 -0.18 115.31 122.08 2kre h LEU 1263Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2kre h LEU 1263Cb 0.72 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.75 2kre h LEU 1263CO 0.05 0.00 0.00 -0.46 -0.34 0.00 0.00 178.44 177.69 2kre n ASN 1264N -2.23 0.51 0.00 1.25 6.94 -0.92 -5.03 115.26 115.79 2kre n ASN 1264Ca -0.01 -0.97 0.00 0.00 -0.02 0.00 0.00 54.58 53.58 2kre n ASN 1264Cb 0.28 0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.72 2kre n ASN 1264CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2kre n SER 1265N -0.02 0.00 -2.07 0.53 7.64 0.15 -5.01 113.62 114.84 2kre n SER 1265Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 2kre n SER 1265Cb 0.11 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.29 2kre n SER 1265CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2kre n PRO 1266N 0.00 0.35 -3.76 1.43 -0.02 -1.22 -4.03 135.00 127.74 2kre n PRO 1266Ca 0.00 -0.10 -0.29 0.00 -2.02 0.00 0.00 63.50 61.09 2kre n PRO 1266Cb 0.00 -1.47 -0.16 0.00 -0.02 0.00 0.00 33.50 31.85 2kre n PRO 1266CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2kre s THR 1267N 1.90 0.76 0.18 3.45 -4.23 -1.25 -3.20 115.64 113.25 2kre s THR 1267Ca 0.07 -0.91 -0.14 0.00 -1.18 0.00 0.00 61.69 59.52 2kre s THR 1267Cb 0.03 -1.33 -0.10 0.00 1.34 0.00 0.00 72.50 72.44 2kre s THR 1267CO 0.00 -0.34 0.17 -0.67 -0.54 0.00 0.00 174.62 173.23 2kre n ASP 1268N 4.94 -1.25 0.06 3.99 -0.08 0.28 -4.62 116.55 119.87 2kre n ASP 1268Ca -0.07 0.56 0.13 0.00 -1.51 0.00 0.00 54.79 53.90 2kre n ASP 1268Cb 0.45 -0.54 0.48 0.00 2.34 0.00 0.00 41.12 43.85 2kre n ASP 1268CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2kre n PRO 1269N 0.70 0.13 0.00 -0.67 -0.04 -1.26 -3.39 135.00 130.47 2kre n PRO 1269Ca 0.08 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 2kre n PRO 1269Cb 0.19 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 2kre n PRO 1269CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2kre n PHE 1270N -1.92 0.00 0.20 0.54 3.72 -1.26 -4.72 117.46 114.02 2kre n PHE 1270Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2kre n PHE 1270Cb 0.35 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 2kre n PHE 1270CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2kre n ASN 1271N 0.00 0.07 -2.61 4.37 0.23 -1.26 -4.83 115.26 111.23 2kre n ASN 1271Ca 0.00 -0.26 -0.11 0.00 -0.53 0.00 0.00 54.58 53.68 2kre n ASN 1271Cb 0.00 -0.03 0.01 0.00 -2.08 0.00 0.00 39.78 37.68 2kre n ASN 1271CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2kre n ARG 1272N -0.02 -0.64 -4.07 -3.83 1.74 -1.22 -4.95 116.66 103.67 2kre n ARG 1272Ca 0.00 0.73 -0.16 0.00 -0.77 0.00 0.00 57.85 57.65 2kre n ARG 1272Cb 0.02 -0.99 -0.15 0.00 -1.02 0.00 0.00 32.46 30.32 2kre n ARG 1272CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2kre s GLN 1273N -1.13 0.42 0.16 5.56 -0.21 -1.26 -4.81 119.66 118.40 2kre s GLN 1273Ca 0.11 -0.08 0.00 0.00 0.02 0.00 0.00 55.36 55.40 2kre s GLN 1273Cb -0.01 -0.46 0.00 0.00 1.00 0.00 0.00 33.01 33.54 2kre s GLN 1273CO 0.24 0.00 0.62 2.41 -2.12 0.00 0.00 175.29 176.44 2kre n THR 1274N 3.48 0.00 -2.36 -0.19 -1.04 -1.25 0.10 114.28 113.02 2kre n THR 1274Ca -0.19 0.62 -0.00 0.00 -2.04 0.00 0.00 64.05 62.43 2kre n THR 1274Cb 0.55 -1.62 -0.00 0.00 -1.82 0.00 0.00 70.33 67.44 2kre n THR 1274CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2kre n LEU 1275N -1.36 -2.61 -4.27 -4.42 -0.00 -1.20 -4.15 117.00 98.99 2kre n LEU 1275Ca 0.00 1.38 -0.37 0.00 -0.00 0.00 0.00 56.01 57.03 2kre n LEU 1275Cb 0.62 -1.92 -0.13 0.00 -0.00 0.00 0.00 43.42 41.99 2kre n LEU 1275CO 0.00 -2.24 -0.31 0.28 -0.00 0.00 0.00 177.39 175.13 2kre s THR 1276N -0.14 3.57 -1.74 1.96 -1.32 -1.26 -4.82 115.64 111.89 2kre s THR 1276Ca -0.02 -0.98 0.00 0.00 -1.21 0.00 0.00 61.69 59.48 2kre s THR 1276Cb 0.00 -2.92 0.00 0.00 -1.51 0.00 0.00 72.50 68.07 2kre s THR 1276CO 0.06 0.00 0.65 1.21 -2.21 0.00 0.00 174.62 174.33 2kre n GLU 1277N 4.78 0.75 -0.20 7.08 2.13 -1.26 -2.32 120.64 131.60 2kre n GLU 1277Ca -0.14 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.73 2kre n GLU 1277Cb 0.46 -1.10 0.07 0.00 0.27 0.00 0.00 31.44 31.15 2kre n GLU 1277CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2kre n SER 1278N -0.34 1.44 -0.48 4.31 2.88 -1.26 -4.70 113.62 115.47 2kre n SER 1278Ca 0.00 -2.53 0.00 0.00 -1.33 0.00 0.00 58.87 55.01 2kre n SER 1278Cb 0.05 -0.29 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 2kre n SER 1278CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2kre n MET 1279N -0.81 0.00 -3.26 -1.46 2.81 -0.98 -5.11 117.12 108.31 2kre n MET 1279Ca 0.09 -0.76 -0.20 0.00 -1.81 0.00 0.00 57.70 55.02 2kre n MET 1279Cb 0.62 -0.39 0.00 0.00 -0.71 0.00 0.00 33.22 32.74 2kre n MET 1279CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 2kre s LEU 1280N 0.00 3.82 -0.02 4.03 0.05 -1.24 -4.58 118.68 120.73 2kre s LEU 1280Ca 0.00 -0.10 0.04 0.00 0.05 0.00 0.00 54.13 54.12 2kre s LEU 1280Cb 0.00 -2.84 -0.00 0.00 -2.05 0.00 0.00 46.19 41.30 2kre s LEU 1280CO 0.00 -0.58 -0.13 -1.61 -0.55 0.00 0.00 176.35 173.49 2kre s GLU 1281N -4.32 1.23 0.39 1.48 0.41 0.46 -4.93 118.70 113.42 2kre s GLU 1281Ca 0.48 -0.45 -0.24 0.00 -0.41 0.00 0.00 54.97 54.35 2kre s GLU 1281Cb -0.10 -1.13 -0.10 0.00 -1.78 0.00 0.00 34.13 31.02 2kre s GLU 1281CO 0.33 0.22 0.99 -1.25 -0.49 0.00 0.00 175.26 175.06 2kre s PRO 1282N -0.05 4.28 -0.32 0.39 0.04 -1.26 0.32 135.00 138.40 2kre s PRO 1282Ca -0.00 1.35 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2kre s PRO 1282Cb -0.08 -2.51 0.07 0.00 0.04 0.00 0.00 34.50 32.03 2kre s PRO 1282CO 0.00 -0.01 0.03 0.14 0.04 0.00 0.00 177.00 177.20 2kre s VAL 1283N -1.79 2.73 -0.00 -0.36 -7.23 -1.04 -4.80 120.40 107.90 2kre s VAL 1283Ca 0.57 -1.76 -0.20 0.00 -1.81 0.00 0.00 61.98 58.78 2kre s VAL 1283Cb -0.18 -2.72 -0.25 0.00 0.56 0.00 0.00 36.38 33.79 2kre s VAL 1283CO 0.22 -0.30 1.06 1.55 -0.31 0.00 0.00 175.10 177.33 2kre h PRO 1284N 7.88 0.40 0.00 4.82 0.13 -1.97 -3.18 132.00 140.09 2kre h PRO 1284Ca -0.16 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2kre h PRO 1284Cb 1.05 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2kre h PRO 1284CO 0.55 1.14 0.22 -0.85 -0.23 0.00 0.00 178.00 178.82 2kre n GLU 1285N -4.18 0.00 -0.08 0.86 0.28 -1.26 -0.11 120.64 116.15 2kre n GLU 1285Ca -0.11 0.13 -0.13 0.00 -0.16 0.00 0.00 57.16 56.88 2kre n GLU 1285Cb 0.71 -1.72 -0.08 0.00 1.43 0.00 0.00 31.44 31.79 2kre n GLU 1285CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2kre h LEU 1286N 0.00 0.00 -0.85 -1.84 -0.00 -1.97 -3.29 115.31 107.36 2kre h LEU 1286Ca 0.00 -0.39 0.14 0.00 -0.00 0.00 0.00 57.88 57.63 2kre h LEU 1286Cb 0.43 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 40.95 2kre h LEU 1286CO 0.00 1.10 -0.31 0.29 -0.00 0.00 0.00 178.44 179.51 2kre n LYS 1287N -4.55 -0.18 0.08 1.13 4.76 0.85 -0.79 118.16 119.47 2kre n LYS 1287Ca -0.18 1.31 -0.05 0.00 -2.87 0.00 0.00 58.31 56.52 2kre n LYS 1287Cb 0.46 -1.95 -0.03 0.00 -1.84 0.00 0.00 35.03 31.67 2kre n LYS 1287CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2kre h GLU 1288N 0.00 -0.27 -0.98 1.97 5.08 -1.74 0.37 114.58 119.01 2kre h GLU 1288Ca 0.31 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.84 2kre h GLU 1288Cb 0.53 0.06 -0.16 0.00 0.50 0.00 0.00 28.75 29.68 2kre h GLU 1288CO -0.85 -0.18 -0.39 0.94 -1.00 0.00 0.00 179.01 177.52 2kre n GLN 1289N -3.15 -0.24 0.00 2.33 0.00 -0.19 0.56 117.38 116.70 2kre n GLN 1289Ca -0.03 1.51 0.00 0.00 -0.00 0.00 0.00 57.00 58.48 2kre n GLN 1289Cb 0.13 -2.24 0.00 0.00 0.00 0.00 0.00 30.24 28.13 2kre n GLN 1289CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 2kre n ILE 1290N -5.43 0.00 0.16 1.69 5.41 0.03 -2.32 119.36 118.90 2kre n ILE 1290Ca 0.10 1.20 0.04 0.00 1.00 0.00 0.00 62.75 65.09 2kre n ILE 1290Cb 0.39 -2.17 0.21 0.00 -0.71 0.00 0.00 39.64 37.36 2kre n ILE 1290CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2kre n GLN 1291N -1.71 0.06 0.00 0.38 6.02 0.13 -2.29 117.38 119.96 2kre n GLN 1291Ca 0.00 0.53 0.00 0.00 -0.01 0.00 0.00 57.00 57.52 2kre n GLN 1291Cb 0.00 -2.17 0.00 0.00 1.02 0.00 0.00 30.24 29.09 2kre n GLN 1291CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2kre n ALA 1292N -1.43 0.00 -0.25 -1.58 0.00 0.19 -1.50 120.51 115.94 2kre n ALA 1292Ca -0.01 -0.00 0.31 0.00 0.00 0.00 0.00 53.44 53.74 2kre n ALA 1292Cb 0.50 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.49 2kre n ALA 1292CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 2kre h TRP 1293N 0.00 0.00 0.02 0.00 7.01 -1.21 2.01 115.95 123.78 2kre h TRP 1293Ca 0.00 0.00 -0.30 0.00 2.11 0.00 0.00 58.89 60.70 2kre h TRP 1293Cb 0.00 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 27.02 2kre h TRP 1293CO 0.00 0.00 -1.70 0.00 -2.79 0.00 0.00 178.44 173.95 2kre h MET 1294N 0.00 0.04 -0.57 2.65 -0.00 -1.61 -3.35 114.93 112.09 2kre h MET 1294Ca 0.52 -0.06 -0.05 0.00 -0.00 0.00 0.00 59.70 60.11 2kre h MET 1294Cb 2.80 0.02 -0.03 0.00 -0.00 0.00 0.00 31.60 34.40 2kre h MET 1294CO -0.01 0.61 0.14 0.00 -0.00 0.00 0.00 176.91 177.66 2kre h ARG 1295N 0.01 0.87 0.00 -0.10 2.47 0.43 -1.30 114.38 116.76 2kre h ARG 1295Ca -0.29 -0.18 0.00 0.00 -1.26 0.00 0.00 59.98 58.26 2kre h ARG 1295Cb 2.00 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 30.19 2kre h ARG 1295CO 0.09 0.78 0.00 -0.85 0.56 0.00 0.00 179.97 180.54 2kre n GLU 1296N -4.27 0.41 0.00 0.04 0.28 -0.68 -0.91 120.64 115.51 2kre n GLU 1296Ca 0.04 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.05 2kre n GLU 1296Cb 0.23 -1.31 0.01 0.00 1.43 0.00 0.00 31.44 31.79 2kre n GLU 1296CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2kre n LYS 1297N -0.81 0.36 -3.54 3.44 5.02 -0.50 -4.84 118.16 117.29 2kre n LYS 1297Ca 0.06 -0.56 -0.11 0.00 -2.02 0.00 0.00 58.31 55.68 2kre n LYS 1297Cb 0.03 -0.99 -0.04 0.00 -0.02 0.00 0.00 35.03 34.02 2kre n LYS 1297CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 2kre s GLN 1298N -0.36 1.15 -0.46 1.97 -2.07 -0.08 -4.59 119.66 115.22 2kre s GLN 1298Ca 0.03 -0.57 0.06 0.00 -1.82 0.00 0.00 55.36 53.05 2kre s GLN 1298Cb 0.02 0.52 0.19 0.00 -1.09 0.00 0.00 33.01 32.65 2kre s GLN 1298CO 0.04 -0.47 0.56 0.27 -1.32 0.00 0.00 175.29 174.36 2kre n ASN 1299N -0.24 -1.83 -2.55 12.60 0.23 -1.26 -4.69 115.26 117.52 2kre n ASN 1299Ca -0.17 -2.69 -0.02 0.00 -0.53 0.00 0.00 54.58 51.17 2kre n ASN 1299Cb 0.64 0.56 -0.01 0.00 -2.08 0.00 0.00 39.78 38.89 2kre n ASN 1299CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2kre n SER 1300N 2.67 0.05 -0.36 0.53 3.41 -1.26 -4.60 113.62 114.05 2kre n SER 1300Ca 0.23 -0.10 0.30 0.00 -0.26 0.00 0.00 58.87 59.05 2kre n SER 1300Cb 0.53 -0.12 0.62 0.00 -0.26 0.00 0.00 64.21 64.97 2kre n SER 1300CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2kre h ASP 1301N 0.70 0.26 0.00 4.04 5.19 -1.97 -3.56 116.42 121.08 2kre h ASP 1301Ca -0.05 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2kre h ASP 1301Cb 0.11 0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.65 2kre h ASP 1301CO 0.06 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.18