#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 0.00 -1.24 1.61 3.41 -1.26 -5.11 113.62 111.03 2kre n SER 1204Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.75 2kre n SER 1204Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2kre n SER 1204CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2kre n HIS 1205N 0.00 -3.12 -1.51 7.33 -0.00 -1.26 -4.30 115.22 112.35 2kre n HIS 1205Ca 0.00 1.25 -0.24 0.00 -0.00 0.00 0.00 57.72 58.72 2kre n HIS 1205Cb 0.00 -2.24 -0.17 0.00 -0.00 0.00 0.00 29.99 27.58 2kre n HIS 1205CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 2kre n LYS 1206N -3.44 0.17 -0.09 -0.41 2.85 -1.26 -4.67 118.16 111.30 2kre n LYS 1206Ca 0.01 -0.16 -0.23 0.00 -1.05 0.00 0.00 58.31 56.87 2kre n LYS 1206Cb 0.46 -1.75 -0.12 0.00 -0.65 0.00 0.00 35.03 32.98 2kre n LYS 1206CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2kre n PHE 1207N 9.52 0.83 -1.70 5.58 3.01 -1.26 -4.91 117.46 128.52 2kre n PHE 1207Ca 0.62 0.31 -0.44 0.00 1.01 0.00 0.00 57.45 58.96 2kre n PHE 1207Cb 0.20 -1.09 -0.03 0.00 -0.01 0.00 0.00 39.48 38.55 2kre n PHE 1207CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2kre n ALA 1208N -3.50 1.94 -2.56 4.37 0.00 -1.26 -4.99 120.51 114.51 2kre n ALA 1208Ca -0.37 0.40 -0.33 0.00 0.00 0.00 0.00 53.44 53.14 2kre n ALA 1208Cb 0.79 -2.40 -0.12 0.00 0.00 0.00 0.00 19.45 17.72 2kre n ALA 1208CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2kre s GLU 1209N 0.12 2.68 -0.93 0.00 2.12 -1.26 -4.73 118.70 116.70 2kre s GLU 1209Ca 0.70 -0.62 -0.10 0.00 0.36 0.00 0.00 54.97 55.32 2kre s GLU 1209Cb -0.58 -2.50 0.01 0.00 0.26 0.00 0.00 34.13 31.31 2kre s GLU 1209CO 0.44 0.62 0.66 1.63 -0.54 0.00 0.00 175.26 178.07 2kre n LYS 1210N 2.34 -1.22 -1.53 4.30 4.76 -1.26 -4.61 118.16 120.94 2kre n LYS 1210Ca -0.18 0.69 -0.28 0.00 -2.87 0.00 0.00 58.31 55.68 2kre n LYS 1210Cb 0.53 -3.10 -0.10 0.00 -1.84 0.00 0.00 35.03 30.51 2kre n LYS 1210CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2kre n VAL 1211N -3.19 -0.03 -0.78 -0.18 0.24 -1.26 -4.66 118.33 108.47 2kre n VAL 1211Ca -0.20 -0.49 -0.20 0.00 -2.04 0.00 0.00 64.34 61.40 2kre n VAL 1211Cb 0.63 -1.57 -0.08 0.00 -1.47 0.00 0.00 33.84 31.34 2kre n VAL 1211CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2kre n GLU 1212N 8.19 0.00 0.00 7.34 1.02 -1.26 -4.68 120.64 131.25 2kre n GLU 1212Ca 0.52 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.76 2kre n GLU 1212Cb 0.33 -0.75 0.07 0.00 -0.02 0.00 0.00 31.44 31.08 2kre n GLU 1212CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2kre n GLU 1213N 4.23 1.83 -1.27 3.49 0.28 -1.26 -4.56 120.64 123.38 2kre n GLU 1213Ca 0.34 -1.63 -0.44 0.00 -0.16 0.00 0.00 57.16 55.28 2kre n GLU 1213Cb 0.02 -1.40 -0.03 0.00 1.43 0.00 0.00 31.44 31.46 2kre n GLU 1213CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2kre n ILE 1214N 1.00 1.59 -2.24 3.84 -0.00 -1.26 -4.91 119.36 117.37 2kre n ILE 1214Ca 0.12 -0.40 -0.29 0.00 -0.00 0.00 0.00 62.75 62.18 2kre n ILE 1214Cb 0.51 0.00 0.02 0.00 -0.00 0.00 0.00 39.64 40.16 2kre n ILE 1214CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 2kre s VAL 1215N -0.79 4.31 -0.29 1.39 0.11 -1.26 -5.07 120.40 118.79 2kre s VAL 1215Ca 0.60 0.38 -0.28 0.00 -2.93 0.00 0.00 61.98 59.76 2kre s VAL 1215Cb -0.87 -3.70 0.19 0.00 -1.53 0.00 0.00 36.38 30.47 2kre s VAL 1215CO 0.50 -0.80 1.41 0.00 -3.33 0.00 0.00 175.10 172.88 2kre s ALA 1216N -3.02 -2.17 0.31 1.54 0.00 -1.26 -5.17 121.76 111.99 2kre s ALA 1216Ca 0.53 1.82 -0.05 0.00 0.00 0.00 0.00 51.96 54.25 2kre s ALA 1216Cb -0.11 -1.64 -0.05 0.00 0.00 0.00 0.00 23.12 21.32 2kre s ALA 1216CO 0.49 -0.18 0.59 0.15 0.00 0.00 0.00 175.76 176.80 2kre s LYS 1217N -0.63 3.64 0.00 0.00 -0.14 -1.26 -4.93 119.74 116.42 2kre s LYS 1217Ca 0.09 0.04 0.00 0.00 -1.36 0.00 0.00 55.97 54.74 2kre s LYS 1217Cb -0.02 -2.61 0.00 0.00 -1.68 0.00 0.00 37.83 33.52 2kre s LYS 1217CO -0.11 0.17 0.00 0.09 -0.76 0.00 0.00 175.35 174.73 2kre n ASN 1218N -1.08 0.00 -3.66 2.83 3.02 -1.26 -5.04 115.26 110.07 2kre n ASN 1218Ca -0.01 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.33 2kre n ASN 1218Cb 0.54 0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.84 2kre n ASN 1218CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kre n ALA 1219N -1.80 -1.67 -2.57 5.41 0.00 -1.26 -4.88 120.51 113.73 2kre n ALA 1219Ca 0.00 -0.27 -0.19 0.00 0.00 0.00 0.00 53.44 52.98 2kre n ALA 1219Cb 0.00 -0.82 -0.12 0.00 0.00 0.00 0.00 19.45 18.51 2kre n ALA 1219CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2kre s ARG 1220N -5.76 0.98 0.66 0.00 6.06 -1.26 -5.13 118.95 114.49 2kre s ARG 1220Ca 0.11 -1.13 -0.18 0.00 -2.50 0.00 0.00 55.73 52.03 2kre s ARG 1220Cb -0.06 -0.97 -0.00 0.00 0.06 0.00 0.00 34.95 33.97 2kre s ARG 1220CO 0.53 0.21 1.27 0.00 -2.50 0.00 0.00 175.30 174.80 2kre s ALA 1221N -1.67 2.34 0.53 6.12 0.00 -1.26 -4.69 121.76 123.13 2kre s ALA 1221Ca 0.05 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.14 2kre s ALA 1221Cb -0.08 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2kre s ALA 1221CO 0.03 -1.61 0.00 0.39 0.00 0.00 0.00 175.76 174.57 2kre n GLU 1222N -2.03 -4.85 -2.56 0.00 1.02 -1.26 -4.95 120.64 106.01 2kre n GLU 1222Ca 0.15 3.60 -0.27 0.00 -0.02 0.00 0.00 57.16 60.62 2kre n GLU 1222Cb 0.49 -4.04 0.01 0.00 -0.02 0.00 0.00 31.44 27.87 2kre n GLU 1222CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2kre s ILE 1223N -3.33 4.59 0.19 -3.67 1.01 -1.26 -4.94 121.20 113.79 2kre s ILE 1223Ca 0.00 0.16 -0.12 0.00 0.00 0.00 0.00 60.65 60.69 2kre s ILE 1223Cb 0.00 -3.76 0.13 0.00 0.01 0.00 0.00 42.46 38.84 2kre s ILE 1223CO 0.00 -0.76 1.70 -2.24 0.00 0.00 0.00 174.94 173.64 2kre h ASP 1224N 0.12 -0.08 0.30 3.58 2.03 -1.92 0.38 116.42 120.84 2kre h ASP 1224Ca -0.46 0.11 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 2kre h ASP 1224Cb 1.22 0.16 0.00 0.00 -0.83 0.00 0.00 39.33 39.88 2kre h ASP 1224CO 0.61 -0.02 0.00 0.00 -1.03 0.00 0.00 179.24 178.81 2kre n TYR 1225N -5.16 0.00 0.33 4.15 0.18 -1.26 -3.12 117.16 112.28 2kre n TYR 1225Ca 0.07 0.00 0.08 0.00 1.88 0.00 0.00 57.90 59.93 2kre n TYR 1225Cb 0.28 -0.35 0.43 0.00 -0.38 0.00 0.00 39.34 39.32 2kre n TYR 1225CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2kre h SER 1226N 0.00 0.00 -2.88 9.48 4.64 -0.59 -3.21 113.55 120.99 2kre h SER 1226Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2kre h SER 1226Cb 0.15 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.84 2kre h SER 1226CO 0.00 0.00 -0.77 -0.62 -0.87 0.00 0.00 176.83 174.57 2kre s ASP 1227N -3.74 3.45 1.23 4.97 2.15 -1.18 -4.96 116.67 118.59 2kre s ASP 1227Ca -0.02 -1.24 -0.20 0.00 0.43 0.00 0.00 52.55 51.52 2kre s ASP 1227Cb 0.05 -0.41 0.30 0.00 -0.30 0.00 0.00 42.92 42.55 2kre s ASP 1227CO 0.14 -0.42 1.10 0.00 -0.17 0.00 0.00 175.17 175.82 2kre s ALA 1228N 2.04 0.50 0.00 3.66 0.00 -1.22 -4.85 121.76 121.89 2kre s ALA 1228Ca 0.08 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.07 2kre s ALA 1228Cb -0.16 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 20.08 2kre s ALA 1228CO -0.32 -3.70 0.81 -2.30 0.00 0.00 0.00 175.76 170.26 2kre n PRO 1229N -4.85 0.78 -3.44 0.00 -0.02 -1.26 -4.72 135.00 121.49 2kre n PRO 1229Ca 0.14 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.43 2kre n PRO 1229Cb 0.60 -1.11 0.08 0.00 -0.02 0.00 0.00 33.50 33.05 2kre n PRO 1229CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2kre n ASP 1230N 0.65 -3.65 0.03 2.55 8.00 -1.26 -4.91 116.55 117.95 2kre n ASP 1230Ca 0.00 -0.56 0.00 0.00 0.71 0.00 0.00 54.79 54.94 2kre n ASP 1230Cb 0.39 -4.88 0.00 0.00 -0.02 0.00 0.00 41.12 36.61 2kre n ASP 1230CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2kre n GLU 1231N -4.31 0.00 -0.21 -1.24 1.02 -1.26 -4.74 120.64 109.91 2kre n GLU 1231Ca -0.17 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 56.95 2kre n GLU 1231Cb 0.62 -0.36 0.04 0.00 -0.02 0.00 0.00 31.44 31.73 2kre n GLU 1231CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2kre n PHE 1232N -3.10 0.51 -3.50 -0.32 3.72 -1.26 -4.87 117.46 108.64 2kre n PHE 1232Ca 0.00 -0.57 -0.32 0.00 -0.05 0.00 0.00 57.45 56.51 2kre n PHE 1232Cb 0.22 -0.32 -0.05 0.00 -0.94 0.00 0.00 39.48 38.39 2kre n PHE 1232CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2kre s ARG 1233N -0.80 3.75 0.21 -1.08 3.00 -1.26 -3.13 118.95 119.64 2kre s ARG 1233Ca 0.10 0.17 -0.27 0.00 0.00 0.00 0.00 55.73 55.73 2kre s ARG 1233Cb 0.08 -2.73 -0.09 0.00 0.00 0.00 0.00 34.95 32.21 2kre s ARG 1233CO 0.02 0.38 0.85 0.34 0.00 0.00 0.00 175.30 176.89 2kre s ASP 1234N -2.33 7.47 0.33 0.23 -1.08 -1.20 -4.89 116.67 115.21 2kre s ASP 1234Ca 0.44 1.77 0.06 0.00 -0.52 0.00 0.00 52.55 54.30 2kre s ASP 1234Cb -0.12 -2.55 0.71 0.00 -1.46 0.00 0.00 42.92 39.51 2kre s ASP 1234CO 0.22 0.16 1.87 1.55 0.52 0.00 0.00 175.17 179.49 2kre h PRO 1235N 4.12 0.79 0.00 4.34 0.13 -1.95 -0.21 132.00 139.22 2kre h PRO 1235Ca -0.46 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2kre h PRO 1235Cb 1.20 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2kre h PRO 1235CO 0.67 0.52 -0.36 -0.11 -0.23 0.00 0.00 178.00 178.49 2kre n LEU 1236N -4.57 0.76 -0.26 1.56 7.94 -1.26 -4.63 117.00 116.54 2kre n LEU 1236Ca 0.17 0.13 0.02 0.00 -1.11 0.00 0.00 56.01 55.22 2kre n LEU 1236Cb 0.40 -0.55 0.10 0.00 0.53 0.00 0.00 43.42 43.90 2kre n LEU 1236CO 0.29 -0.43 0.74 0.24 -1.11 0.00 0.00 177.39 177.12 2kre h MET 1237N -0.36 0.02 0.00 1.96 2.86 -1.99 -3.44 114.93 113.98 2kre h MET 1237Ca 0.00 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2kre h MET 1237Cb 0.36 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.02 2kre h MET 1237CO 0.00 0.01 0.00 -0.40 1.06 0.00 0.00 176.91 177.58 2kre n ASP 1238N -5.46 -0.99 -4.54 1.22 5.75 -0.09 -4.91 116.55 107.52 2kre n ASP 1238Ca 0.11 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.60 2kre n ASP 1238Cb 0.40 -0.17 -0.10 0.00 -1.03 0.00 0.00 41.12 40.23 2kre n ASP 1238CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2kre s THR 1239N -3.33 3.13 -0.30 2.12 -1.32 -1.26 -4.47 115.64 110.21 2kre s THR 1239Ca 0.00 -1.47 -0.43 0.00 -1.21 0.00 0.00 61.69 58.57 2kre s THR 1239Cb 0.00 -2.48 -0.19 0.00 -1.51 0.00 0.00 72.50 68.32 2kre s THR 1239CO 0.00 0.04 1.52 -0.11 -2.21 0.00 0.00 174.62 173.86 2kre n LEU 1240N 0.53 1.34 -4.79 9.08 0.00 -1.26 -3.25 117.00 118.64 2kre n LEU 1240Ca -0.13 1.15 -0.35 0.00 0.00 0.00 0.00 56.01 56.67 2kre n LEU 1240Cb 0.53 -0.98 -0.04 0.00 0.00 0.00 0.00 43.42 42.93 2kre n LEU 1240CO 0.32 -0.94 0.71 -0.04 0.00 0.00 0.00 177.39 177.44 2kre s MET 1241N 2.39 4.07 -0.09 1.96 -1.94 -1.18 -4.96 119.30 119.56 2kre s MET 1241Ca 0.99 1.40 0.08 0.00 -1.71 0.00 0.00 55.69 56.45 2kre s MET 1241Cb -1.30 -2.36 -0.24 0.00 2.01 0.00 0.00 34.83 32.94 2kre s MET 1241CO 0.70 -0.20 0.49 0.25 -0.01 0.00 0.00 175.02 176.26 2kre n THR 1242N -0.41 1.62 -3.20 2.05 -2.24 -1.26 -4.70 114.28 106.15 2kre n THR 1242Ca 0.07 -0.76 -0.20 0.00 -2.27 0.00 0.00 64.05 60.88 2kre n THR 1242Cb 0.51 -1.16 -0.07 0.00 -2.10 0.00 0.00 70.33 67.52 2kre n THR 1242CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2kre s ASP 1243N -6.27 0.55 -0.22 3.42 1.01 -1.26 -5.09 116.67 108.80 2kre s ASP 1243Ca -0.11 -2.67 -0.29 0.00 0.71 0.00 0.00 52.55 50.20 2kre s ASP 1243Cb 0.07 0.26 -0.04 0.00 1.01 0.00 0.00 42.92 44.23 2kre s ASP 1243CO 0.80 -0.13 1.90 -2.84 0.21 0.00 0.00 175.17 175.11 2kre s PRO 1244N 0.30 3.50 0.17 8.23 0.02 -1.25 -2.37 135.00 143.61 2kre s PRO 1244Ca 0.32 1.84 0.10 0.00 0.02 0.00 0.00 61.00 63.28 2kre s PRO 1244Cb 0.03 -4.20 -0.04 0.00 0.02 0.00 0.00 34.50 30.30 2kre s PRO 1244CO -0.15 -1.67 -0.23 0.14 -0.33 0.00 0.00 177.00 174.76 2kre s VAL 1245N 6.56 2.13 -0.17 3.83 -7.23 0.21 -2.22 120.40 123.51 2kre s VAL 1245Ca 0.85 -1.92 -0.04 0.00 -1.81 0.00 0.00 61.98 59.06 2kre s VAL 1245Cb -0.29 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.65 2kre s VAL 1245CO 0.34 -0.14 -0.02 -0.60 -0.31 0.00 0.00 175.10 174.37 2kre s ARG 1246N -2.55 3.65 0.41 4.82 3.00 0.17 -2.07 118.95 126.39 2kre s ARG 1246Ca 0.17 -0.52 0.08 0.00 -1.00 0.00 0.00 55.73 54.46 2kre s ARG 1246Cb -0.08 -2.98 -0.03 0.00 0.00 0.00 0.00 34.95 31.86 2kre s ARG 1246CO 0.08 0.15 0.30 -0.51 0.00 0.00 0.00 175.30 175.32 2kre s LEU 1247N 0.61 3.29 0.22 -0.88 2.01 -1.08 -0.72 118.68 122.14 2kre s LEU 1247Ca -0.02 -0.86 -0.08 0.00 0.01 0.00 0.00 54.13 53.18 2kre s LEU 1247Cb -0.14 -1.83 0.32 0.00 0.01 0.00 0.00 46.19 44.55 2kre s LEU 1247CO 0.02 -0.60 1.75 -0.65 1.01 0.00 0.00 176.35 177.89 2kre h PRO 1248N 1.19 0.45 -0.53 1.29 0.11 -1.89 -1.06 132.00 131.55 2kre h PRO 1248Ca -0.42 -0.03 0.15 0.00 0.11 0.00 0.00 66.00 65.82 2kre h PRO 1248Cb 1.26 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2kre h PRO 1248CO 0.62 0.30 1.11 -1.13 -0.21 0.00 0.00 178.00 178.69 2kre n SER 1249N -4.97 0.00 0.00 -2.05 3.41 -1.26 -4.63 113.62 104.12 2kre n SER 1249Ca 0.10 0.63 0.00 0.00 -0.26 0.00 0.00 58.87 59.34 2kre n SER 1249Cb 0.30 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 2kre n SER 1249CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kre n GLY 1250N -1.61 0.75 4.01 5.00 0.00 -0.40 -5.03 105.19 107.91 2kre n GLY 1250Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 2kre n GLY 1250CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2kre n THR 1251N -2.14 0.00 -3.76 2.61 -2.24 -1.25 -4.94 114.28 102.55 2kre n THR 1251Ca 0.00 -1.99 -0.13 0.00 -2.27 0.00 0.00 64.05 59.66 2kre n THR 1251Cb 0.00 -0.49 -0.11 0.00 -2.10 0.00 0.00 70.33 67.63 2kre n THR 1251CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2kre s ILE 1252N -2.69 -0.00 0.00 2.28 1.01 -1.26 -2.63 121.20 117.90 2kre s ILE 1252Ca 0.62 0.01 0.00 0.00 0.00 0.00 0.00 60.65 61.28 2kre s ILE 1252Cb -0.05 -0.42 0.00 0.00 0.01 0.00 0.00 42.46 42.00 2kre s ILE 1252CO 0.39 0.01 0.00 1.15 0.00 0.00 0.00 174.94 176.49 2kre n MET 1253N 3.06 0.00 -3.02 2.79 0.00 -0.88 -4.32 117.12 114.75 2kre n MET 1253Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 57.70 57.13 2kre n MET 1253Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.74 2kre n MET 1253CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2kre s ASP 1254N 0.64 6.37 0.11 3.17 -1.08 -1.26 0.66 116.67 125.28 2kre s ASP 1254Ca 0.00 -0.22 0.02 0.00 -0.52 0.00 0.00 52.55 51.83 2kre s ASP 1254Cb 0.00 -2.36 0.12 0.00 -1.46 0.00 0.00 42.92 39.23 2kre s ASP 1254CO 0.00 -0.87 0.78 -2.11 0.52 0.00 0.00 175.17 173.49 2kre n ARG 1255N 6.54 0.02 0.11 4.34 -4.01 -1.00 0.30 116.66 122.96 2kre n ARG 1255Ca 0.01 0.28 -0.02 0.00 -1.04 0.00 0.00 57.85 57.07 2kre n ARG 1255Cb 0.48 -1.96 0.05 0.00 -3.04 0.00 0.00 32.46 27.99 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 0.00 0.52 2.89 0.02 -1.90 -2.67 113.55 112.42 2kre h SER 1256Ca 0.00 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.66 2kre h SER 1256Cb 0.81 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.32 2kre h SER 1256CO 0.00 0.74 -1.56 0.40 -1.14 0.00 0.00 176.83 175.27 2kre h ILE 1257N 0.00 1.07 0.00 3.27 1.08 0.42 -3.25 117.51 120.10 2kre h ILE 1257Ca -0.01 -2.82 0.00 0.00 -0.39 0.00 0.00 64.86 61.65 2kre h ILE 1257Cb 1.40 2.62 0.00 0.00 -3.07 0.00 0.00 36.82 37.76 2kre h ILE 1257CO 0.10 0.73 0.00 -0.38 -0.69 0.00 0.00 178.15 177.90 2kre n ILE 1258N -3.28 0.89 0.02 -0.67 2.08 -0.97 -1.72 119.36 115.70 2kre n ILE 1258Ca -0.15 0.24 -0.12 0.00 0.56 0.00 0.00 62.75 63.27 2kre n ILE 1258Cb 1.03 -1.11 -0.09 0.00 -0.75 0.00 0.00 39.64 38.72 2kre n ILE 1258CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 2kre h LEU 1259N 0.00 -0.11 -0.77 1.39 7.12 -1.51 -2.74 115.31 118.69 2kre h LEU 1259Ca 0.00 -0.46 -0.07 0.00 0.13 0.00 0.00 57.88 57.47 2kre h LEU 1259Cb 0.33 0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.47 2kre h LEU 1259CO 0.00 0.47 -0.34 0.08 -0.13 0.00 0.00 178.44 178.51 2kre h ARG 1260N -0.76 0.00 0.84 1.25 0.11 -1.67 -3.27 114.38 110.88 2kre h ARG 1260Ca -0.01 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.03 2kre h ARG 1260Cb 0.57 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.66 2kre h ARG 1260CO 0.02 0.34 -0.40 1.25 0.10 0.00 0.00 179.97 181.28 2kre h HIS 1261N 0.00 -1.05 -0.33 4.08 2.76 -1.36 -2.79 115.15 116.47 2kre h HIS 1261Ca -0.00 -0.02 0.10 0.00 -2.20 0.00 0.00 60.37 58.24 2kre h HIS 1261Cb 0.96 0.35 -0.01 0.00 1.55 0.00 0.00 27.41 30.25 2kre h HIS 1261CO 0.00 -0.65 0.41 1.37 -1.30 0.00 0.00 177.93 177.76 2kre h LEU 1262N -1.25 0.00 -0.54 0.26 8.10 -1.57 -1.41 115.31 118.89 2kre h LEU 1262Ca -0.12 0.00 0.11 0.00 0.11 0.00 0.00 57.88 57.98 2kre h LEU 1262Cb 0.87 0.00 -0.11 0.00 -0.44 0.00 0.00 40.66 40.98 2kre h LEU 1262CO 0.19 0.00 -0.21 0.25 -4.11 0.00 0.00 178.44 174.56 2kre h LEU 1263N 0.00 -0.73 -4.71 0.17 7.12 -1.54 -3.00 115.31 112.62 2kre h LEU 1263Ca 0.16 0.19 -0.40 0.00 0.13 0.00 0.00 57.88 57.95 2kre h LEU 1263Cb 0.98 0.42 -0.41 0.00 -0.53 0.00 0.00 40.66 41.12 2kre h LEU 1263CO -0.00 -0.24 -0.99 -0.46 -0.13 0.00 0.00 178.44 176.62 2kre n ASN 1264N -5.42 3.02 0.00 1.25 6.94 -0.75 -4.82 115.26 115.49 2kre n ASN 1264Ca 0.05 -2.88 0.00 0.00 -0.02 0.00 0.00 54.58 51.73 2kre n ASN 1264Cb 0.32 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.30 2kre n ASN 1264CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2kre n SER 1265N -0.55 0.00 0.27 0.53 3.41 -0.61 -5.00 113.62 111.66 2kre n SER 1265Ca 0.23 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.85 2kre n SER 1265Cb 0.85 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.81 2kre n SER 1265CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2kre n PRO 1266N 0.00 0.03 -3.86 4.33 -0.02 -1.15 -4.11 135.00 130.22 2kre n PRO 1266Ca 0.00 0.83 -0.35 0.00 -2.02 0.00 0.00 63.50 61.95 2kre n PRO 1266Cb 0.00 -2.23 -0.10 0.00 -0.02 0.00 0.00 33.50 31.15 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 -3.62 4.94 0.75 3.45 -4.23 -1.26 -2.48 115.64 113.19 2kre s THR 1267Ca -0.00 0.03 -0.17 0.00 -1.18 0.00 0.00 61.69 60.36 2kre s THR 1267Cb 0.01 -3.26 -0.15 0.00 1.34 0.00 0.00 72.50 70.44 2kre s THR 1267CO 0.02 0.41 -0.45 -0.67 -0.54 0.00 0.00 174.62 173.39 2kre n ASP 1268N 3.90 -4.79 0.07 3.99 -0.08 0.80 -4.75 116.55 115.70 2kre n ASP 1268Ca -0.16 0.43 -0.13 0.00 -1.51 0.00 0.00 54.79 53.42 2kre n ASP 1268Cb 0.52 -0.81 -0.13 0.00 2.34 0.00 0.00 41.12 43.03 2kre n ASP 1268CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2kre h PRO 1269N -0.49 0.15 -4.79 -0.67 0.13 -1.88 -2.78 132.00 121.66 2kre h PRO 1269Ca -0.43 -0.26 -0.73 0.00 -0.87 0.00 0.00 66.00 63.72 2kre h PRO 1269Cb 1.38 0.10 -0.15 0.00 0.13 0.00 0.00 31.00 32.45 2kre h PRO 1269CO 0.33 1.05 1.68 1.19 -0.23 0.00 0.00 178.00 182.01 2kre n PHE 1270N -3.40 4.61 0.00 1.56 3.72 -1.26 -3.47 117.46 119.21 2kre n PHE 1270Ca -0.09 -3.17 0.00 0.00 -0.05 0.00 0.00 57.45 54.14 2kre n PHE 1270Cb 1.01 -2.26 0.00 0.00 -0.94 0.00 0.00 39.48 37.28 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 5.98 0.00 -0.43 4.37 6.94 -1.26 -4.69 115.26 126.17 2kre n ASN 1271Ca 0.40 0.00 -0.03 0.00 -0.02 0.00 0.00 54.58 54.93 2kre n ASN 1271Cb 0.42 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.83 2kre n ASN 1271CO 0.00 0.00 0.00 -2.11 -1.03 0.00 0.00 177.26 174.12 2kre n ARG 1272N -0.11 -1.72 -1.49 -3.83 1.85 -1.05 -4.86 116.66 105.45 2kre n ARG 1272Ca 0.00 0.32 -0.32 0.00 -1.00 0.00 0.00 57.85 56.85 2kre n ARG 1272Cb 0.00 -3.94 0.07 0.00 -1.05 0.00 0.00 32.46 27.54 2kre n ARG 1272CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 2kre s GLN 1273N -1.50 2.52 1.10 2.89 0.74 -1.24 -4.63 119.66 119.53 2kre s GLN 1273Ca 0.00 1.26 -0.19 0.00 0.05 0.00 0.00 55.36 56.48 2kre s GLN 1273Cb 0.00 -1.92 0.07 0.00 1.10 0.00 0.00 33.01 32.26 2kre s GLN 1273CO 0.00 -1.45 -0.13 2.41 -0.55 0.00 0.00 175.29 175.57 2kre n THR 1274N -3.01 0.00 -3.30 -0.34 -1.04 -1.26 -0.14 114.28 105.18 2kre n THR 1274Ca 0.10 -0.27 0.03 0.00 -2.04 0.00 0.00 64.05 61.87 2kre n THR 1274Cb 0.53 -0.54 -0.03 0.00 -1.82 0.00 0.00 70.33 68.47 2kre n THR 1274CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2kre s LEU 1275N -0.30 -0.77 -0.09 -4.42 1.98 -1.03 -3.86 118.68 110.18 2kre s LEU 1275Ca 0.54 0.75 0.04 0.00 -2.89 0.00 0.00 54.13 52.57 2kre s LEU 1275Cb -0.10 1.76 0.00 0.00 0.66 0.00 0.00 46.19 48.51 2kre s LEU 1275CO 0.66 -0.15 -0.21 0.28 -1.89 0.00 0.00 176.35 175.05 2kre s THR 1276N 2.73 1.80 1.19 3.68 -1.32 -1.26 -4.62 115.64 117.83 2kre s THR 1276Ca 0.02 -0.87 -0.15 0.00 -1.21 0.00 0.00 61.69 59.49 2kre s THR 1276Cb -0.10 -1.57 0.29 0.00 -1.51 0.00 0.00 72.50 69.61 2kre s THR 1276CO -0.16 0.50 1.03 -1.83 -2.21 0.00 0.00 174.62 171.94 2kre s GLU 1277N 0.39 -1.09 0.00 7.08 -1.05 -1.26 -2.80 118.70 119.97 2kre s GLU 1277Ca -0.17 0.60 0.00 0.00 -0.15 0.00 0.00 54.97 55.25 2kre s GLU 1277Cb -0.17 -1.55 0.00 0.00 -0.44 0.00 0.00 34.13 31.97 2kre s GLU 1277CO 0.07 -3.77 0.00 0.43 0.95 0.00 0.00 175.26 172.94 2kre n SER 1278N -4.92 0.00 -0.88 0.83 7.64 -1.26 -4.46 113.62 110.57 2kre n SER 1278Ca 0.05 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.96 2kre n SER 1278Cb 0.56 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 63.90 2kre n SER 1278CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2kre n MET 1279N 0.00 2.24 -3.64 1.43 2.81 -1.12 -4.86 117.12 113.98 2kre n MET 1279Ca 0.00 -1.12 -0.21 0.00 -1.81 0.00 0.00 57.70 54.56 2kre n MET 1279Cb 0.00 -1.64 -0.04 0.00 -0.71 0.00 0.00 33.22 30.84 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 -1.02 3.36 -0.04 4.03 0.05 -1.26 -4.62 118.68 119.19 2kre s LEU 1280Ca 0.20 -0.78 0.03 0.00 0.05 0.00 0.00 54.13 53.63 2kre s LEU 1280Cb 0.14 -1.99 0.00 0.00 -2.05 0.00 0.00 46.19 42.30 2kre s LEU 1280CO 0.08 -0.63 -0.12 -1.61 -0.55 0.00 0.00 176.35 173.51 2kre s GLU 1281N -4.10 1.39 0.51 1.48 0.41 0.11 -5.00 118.70 113.50 2kre s GLU 1281Ca 0.47 -0.42 -0.19 0.00 -0.41 0.00 0.00 54.97 54.43 2kre s GLU 1281Cb -0.02 -1.22 -0.07 0.00 -1.78 0.00 0.00 34.13 31.03 2kre s GLU 1281CO 0.27 0.12 1.03 -1.25 -0.49 0.00 0.00 175.26 174.95 2kre s PRO 1282N 0.30 3.72 -0.36 0.39 0.04 -1.26 0.46 135.00 138.28 2kre s PRO 1282Ca -0.07 1.28 -0.00 0.00 0.04 0.00 0.00 61.00 62.24 2kre s PRO 1282Cb -0.12 -2.09 0.09 0.00 0.04 0.00 0.00 34.50 32.43 2kre s PRO 1282CO 0.02 -0.49 0.11 0.08 0.04 0.00 0.00 177.00 176.76 2kre s VAL 1283N -2.16 2.90 0.05 -0.36 1.01 -0.94 -4.78 120.40 116.11 2kre s VAL 1283Ca 0.65 -2.00 0.12 0.00 0.00 0.00 0.00 61.98 60.76 2kre s VAL 1283Cb -0.15 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 2kre s VAL 1283CO 0.25 -0.53 1.43 1.55 0.00 0.00 0.00 175.10 177.80 2kre h PRO 1284N 7.90 0.00 -0.12 2.72 0.13 -1.96 -3.16 132.00 137.51 2kre h PRO 1284Ca -0.12 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.04 2kre h PRO 1284Cb 1.04 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.17 2kre h PRO 1284CO 0.61 0.70 0.15 1.49 -0.23 0.00 0.00 178.00 180.72 2kre h GLU 1285N 0.00 0.00 0.05 0.86 4.81 -1.97 -0.41 114.58 117.92 2kre h GLU 1285Ca -0.01 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.99 2kre h GLU 1285Cb 1.45 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.81 2kre h GLU 1285CO 0.09 0.00 -1.21 1.25 -0.73 0.00 0.00 179.01 178.41 2kre h LEU 1286N 0.00 0.17 -0.51 1.64 7.12 -1.93 -3.29 115.31 118.50 2kre h LEU 1286Ca 0.06 -0.73 0.09 0.00 0.13 0.00 0.00 57.88 57.43 2kre h LEU 1286Cb 0.35 -0.05 -0.07 0.00 -0.53 0.00 0.00 40.66 40.36 2kre h LEU 1286CO -0.00 1.50 0.11 0.11 -0.13 0.00 0.00 178.44 180.03 2kre h LYS 1287N -0.67 0.24 -0.77 1.25 1.57 -1.37 0.16 116.57 116.98 2kre h LYS 1287Ca -0.30 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.54 2kre h LYS 1287Cb 1.49 -0.05 -0.06 0.00 0.08 0.00 0.00 32.23 33.68 2kre h LYS 1287CO -0.07 0.16 0.44 1.05 -0.57 0.00 0.00 179.45 180.46 2kre h GLU 1288N 0.25 0.76 -0.33 3.15 -0.00 -1.27 0.14 114.58 117.27 2kre h GLU 1288Ca 0.26 -0.05 -0.05 0.00 -0.00 0.00 0.00 59.36 59.52 2kre h GLU 1288Cb 0.35 -0.17 -0.01 0.00 -0.00 0.00 0.00 28.75 28.92 2kre h GLU 1288CO -0.33 0.50 -0.00 0.37 -0.00 0.00 0.00 179.01 179.55 2kre h GLN 1289N 0.78 0.59 0.90 1.06 -0.00 -1.25 -0.66 115.11 116.53 2kre h GLN 1289Ca 0.35 -0.19 -0.04 0.00 -0.00 0.00 0.00 58.65 58.77 2kre h GLN 1289Cb 0.25 -0.05 0.01 0.00 0.00 0.00 0.00 27.48 27.68 2kre h GLN 1289CO -0.21 0.72 -0.45 0.82 0.00 0.00 0.00 178.83 179.72 2kre h ILE 1290N 0.39 0.09 -0.06 2.39 2.04 -0.01 -1.78 117.51 120.57 2kre h ILE 1290Ca 0.09 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.97 2kre h ILE 1290Cb 0.46 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2kre h ILE 1290CO 0.02 0.00 0.06 1.56 0.00 0.00 0.00 178.15 179.79 2kre h GLN 1291N -1.22 0.00 0.00 2.37 4.20 -0.80 -2.10 115.11 117.56 2kre h GLN 1291Ca -0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2kre h GLN 1291Cb 0.95 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.73 2kre h GLN 1291CO 0.19 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.35 2kre n ALA 1292N -2.40 0.00 -0.26 3.87 0.00 -0.26 -1.10 120.51 120.36 2kre n ALA 1292Ca -0.01 0.00 0.33 0.00 0.00 0.00 0.00 53.44 53.75 2kre n ALA 1292Cb 0.16 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.32 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 0.00 0.00 7.01 -1.41 1.13 115.95 122.68 2kre h TRP 1293Ca 0.00 0.00 -0.10 0.00 2.11 0.00 0.00 58.89 60.90 2kre h TRP 1293Cb 0.00 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.04 2kre h TRP 1293CO 0.00 0.00 -0.88 0.00 -2.79 0.00 0.00 178.44 174.77 2kre h MET 1294N 0.00 0.00 -0.26 2.65 -0.00 -1.50 -3.32 114.93 112.50 2kre h MET 1294Ca 0.51 0.00 -0.16 0.00 -0.00 0.00 0.00 59.70 60.05 2kre h MET 1294Cb 2.25 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.84 2kre h MET 1294CO -0.01 0.29 -0.48 0.00 -0.00 0.00 0.00 176.91 176.71 2kre h ARG 1295N 0.00 0.71 -0.07 -0.10 2.47 0.29 -2.72 114.38 114.96 2kre h ARG 1295Ca -0.06 -0.41 0.00 0.00 -1.26 0.00 0.00 59.98 58.24 2kre h ARG 1295Cb 1.36 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.71 2kre h ARG 1295CO 0.04 1.03 0.00 -0.85 0.56 0.00 0.00 179.97 180.75 2kre n GLU 1296N -4.01 0.45 -2.74 0.04 -0.00 -0.85 -2.37 120.64 111.16 2kre n GLU 1296Ca -0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 57.16 57.11 2kre n GLU 1296Cb 0.58 -1.04 0.09 0.00 -0.00 0.00 0.00 31.44 31.08 2kre n GLU 1296CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 2kre n LYS 1297N -0.38 1.50 -0.17 3.44 2.85 -1.03 -4.47 118.16 119.91 2kre n LYS 1297Ca 0.00 -2.25 0.00 0.00 -1.05 0.00 0.00 58.31 55.01 2kre n LYS 1297Cb 0.02 -0.49 0.00 0.00 -0.65 0.00 0.00 35.03 33.91 2kre n LYS 1297CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2kre n GLN 1298N -1.07 0.00 0.16 -1.58 1.13 -1.00 -4.78 117.38 110.24 2kre n GLN 1298Ca -0.06 -0.03 -0.14 0.00 -1.94 0.00 0.00 57.00 54.83 2kre n GLN 1298Cb 0.84 -0.02 -0.07 0.00 0.11 0.00 0.00 30.24 31.11 2kre n GLN 1298CO 0.00 0.00 0.00 -2.95 -1.44 0.00 0.00 177.06 172.67 2kre h ASN 1299N 0.00 -0.87 0.00 1.08 -1.07 -1.88 -3.45 115.58 109.38 2kre h ASN 1299Ca 0.00 0.09 0.00 0.00 0.07 0.00 0.00 56.30 56.46 2kre h ASN 1299Cb 1.01 0.31 0.00 0.00 -2.07 0.00 0.00 38.32 37.57 2kre h ASN 1299CO 0.00 -0.42 0.00 -1.20 0.07 0.00 0.00 177.43 175.88 2kre n SER 1300N -5.42 0.00 0.00 6.14 7.64 -1.26 -5.06 113.62 115.66 2kre n SER 1300Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.80 2kre n SER 1300Cb 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 2kre n SER 1300CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2kre n ASP 1301N 0.00 0.00 -0.67 6.43 -0.08 -1.26 -5.02 116.55 115.95 2kre n ASP 1301Ca 0.00 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.41 2kre n ASP 1301Cb 0.00 0.05 0.35 0.00 2.34 0.00 0.00 41.12 43.86 2kre n ASP 1301CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73