#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 -1.97 -4.76 1.61 3.41 -1.26 -4.94 113.62 105.71 2kre n SER 1204Ca 0.00 0.97 -0.33 0.00 -0.26 0.00 0.00 58.87 59.25 2kre n SER 1204Cb 0.00 -0.93 -0.07 0.00 -0.26 0.00 0.00 64.21 62.94 2kre n SER 1204CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2kre s HIS 1205N -1.35 3.25 0.13 7.33 3.76 -1.26 -4.97 115.29 122.18 2kre s HIS 1205Ca 0.62 0.19 0.00 0.00 -0.15 0.00 0.00 55.06 55.72 2kre s HIS 1205Cb -0.77 -1.73 0.00 0.00 1.11 0.00 0.00 32.58 31.19 2kre s HIS 1205CO 0.59 0.54 0.00 1.63 -0.85 0.00 0.00 174.74 176.65 2kre n LYS 1206N 1.26 -1.25 -1.77 1.40 5.02 -1.26 -4.73 118.16 116.83 2kre n LYS 1206Ca -0.14 0.92 -0.04 0.00 -2.02 0.00 0.00 58.31 57.04 2kre n LYS 1206Cb 0.53 -1.03 0.03 0.00 -0.02 0.00 0.00 35.03 34.54 2kre n LYS 1206CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2kre n PHE 1207N -0.72 -0.95 -1.99 2.13 -0.00 -1.26 -4.93 117.46 109.73 2kre n PHE 1207Ca 0.00 -0.99 0.00 0.00 -0.00 0.00 0.00 57.45 56.46 2kre n PHE 1207Cb 0.00 0.98 0.00 0.00 -0.00 0.00 0.00 39.48 40.46 2kre n PHE 1207CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2kre n ALA 1208N -0.71 1.99 -1.78 3.13 0.00 -1.26 -5.11 120.51 116.77 2kre n ALA 1208Ca -0.19 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.48 2kre n ALA 1208Cb 0.74 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.81 2kre n ALA 1208CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2kre n GLU 1209N 0.00 1.77 -2.35 0.00 1.02 -1.26 -5.04 120.64 114.79 2kre n GLU 1209Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 2kre n GLU 1209Cb 0.65 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 32.08 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 -0.28 3.24 -4.58 3.49 3.00 -1.26 -5.04 118.16 116.73 2kre n LYS 1210Ca 0.00 -4.24 -0.27 0.00 -0.00 0.00 0.00 58.31 53.80 2kre n LYS 1210Cb 0.00 -2.15 -0.14 0.00 0.00 0.00 0.00 35.03 32.74 2kre n LYS 1210CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2kre s VAL 1211N -4.93 1.93 -0.44 3.15 0.11 -1.26 -5.01 120.40 113.96 2kre s VAL 1211Ca 0.46 -1.45 0.04 0.00 -2.93 0.00 0.00 61.98 58.11 2kre s VAL 1211Cb 0.40 -1.69 0.57 0.00 -1.53 0.00 0.00 36.38 34.13 2kre s VAL 1211CO -0.08 0.16 1.76 1.21 -3.33 0.00 0.00 175.10 174.83 2kre n GLU 1212N 1.46 2.31 -3.70 1.54 4.07 -1.26 -4.93 120.64 120.12 2kre n GLU 1212Ca -0.18 -3.20 -0.14 0.00 -0.06 0.00 0.00 57.16 53.59 2kre n GLU 1212Cb 0.53 -2.10 -0.09 0.00 -0.06 0.00 0.00 31.44 29.71 2kre n GLU 1212CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 2kre s GLU 1213N -3.41 0.60 0.40 5.31 -6.30 -1.26 -5.06 118.70 108.97 2kre s GLU 1213Ca 0.55 0.54 -0.26 0.00 -2.50 0.00 0.00 54.97 53.29 2kre s GLU 1213Cb 0.46 0.29 -0.09 0.00 0.00 0.00 0.00 34.13 34.79 2kre s GLU 1213CO 0.05 -0.10 1.33 -1.50 0.02 0.00 0.00 175.26 175.06 2kre s ILE 1214N -0.03 2.55 0.00 -3.70 2.07 -1.26 -5.00 121.20 115.83 2kre s ILE 1214Ca -0.02 0.50 0.00 0.00 -1.41 0.00 0.00 60.65 59.72 2kre s ILE 1214Cb -0.03 -3.30 0.00 0.00 0.13 0.00 0.00 42.46 39.26 2kre s ILE 1214CO 0.02 0.08 0.00 0.55 -1.91 0.00 0.00 174.94 173.68 2kre n VAL 1215N 0.22 0.00 0.00 4.00 3.14 -1.26 -5.13 118.33 119.30 2kre n VAL 1215Ca 0.03 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.41 2kre n VAL 1215Cb 0.43 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.21 2kre n VAL 1215CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kre n ALA 1216N 0.00 0.84 -1.43 1.55 0.00 -1.26 -4.90 120.51 115.31 2kre n ALA 1216Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2kre n ALA 1216Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2kre n ALA 1216CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2kre n LYS 1217N -0.31 -1.54 -2.98 0.00 4.81 -1.26 -3.10 118.16 113.78 2kre n LYS 1217Ca 0.00 0.06 -0.01 0.00 -0.87 0.00 0.00 58.31 57.48 2kre n LYS 1217Cb 0.00 -4.21 -0.01 0.00 0.02 0.00 0.00 35.03 30.83 2kre n LYS 1217CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2kre n ASN 1218N 0.23 -5.99 -4.90 3.14 5.03 -1.26 -4.95 115.26 106.57 2kre n ASN 1218Ca -0.01 0.97 -0.30 0.00 0.87 0.00 0.00 54.58 56.10 2kre n ASN 1218Cb 0.16 -2.57 -0.04 0.00 -1.02 0.00 0.00 39.78 36.31 2kre n ASN 1218CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2kre s ALA 1219N -0.44 3.66 0.00 5.41 0.00 -1.18 -5.04 121.76 124.17 2kre s ALA 1219Ca -0.06 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.41 2kre s ALA 1219Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.85 2kre s ALA 1219CO 0.22 0.44 0.00 0.54 0.00 0.00 0.00 175.76 176.96 2kre n ARG 1220N -0.43 0.00 -3.47 0.00 1.74 -1.26 -5.00 116.66 108.23 2kre n ARG 1220Ca -0.01 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.76 2kre n ARG 1220Cb 0.53 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.90 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 -2.52 4.08 -3.67 7.54 0.00 -1.26 -5.03 120.51 119.65 2kre n ALA 1221Ca 0.00 -4.72 -0.00 0.00 0.00 0.00 0.00 53.44 48.71 2kre n ALA 1221Cb 0.00 -1.20 0.02 0.00 0.00 0.00 0.00 19.45 18.28 2kre n ALA 1221CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2kre n GLU 1222N 1.24 0.92 -0.11 0.00 -0.00 -1.26 -5.03 120.64 116.41 2kre n GLU 1222Ca 0.27 -1.82 0.12 0.00 -0.00 0.00 0.00 57.16 55.72 2kre n GLU 1222Cb 0.38 2.28 0.16 0.00 -0.00 0.00 0.00 31.44 34.27 2kre n GLU 1222CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2kre n ILE 1223N -0.46 0.30 0.00 3.84 5.41 -1.26 -4.93 119.36 122.26 2kre n ILE 1223Ca -0.07 -0.65 0.00 0.00 1.00 0.00 0.00 62.75 63.03 2kre n ILE 1223Cb 0.50 1.18 0.00 0.00 -0.71 0.00 0.00 39.64 40.61 2kre n ILE 1223CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2kre n ASP 1224N 1.39 0.00 -0.22 4.38 5.75 -1.26 -4.83 116.55 121.77 2kre n ASP 1224Ca 0.17 0.00 0.07 0.00 -0.01 0.00 0.00 54.79 55.01 2kre n ASP 1224Cb 0.59 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.65 2kre n ASP 1224CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2kre n TYR 1225N -1.94 0.00 0.00 2.11 0.18 -1.26 -4.49 117.16 111.76 2kre n TYR 1225Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 2kre n TYR 1225Cb 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 38.96 2kre n TYR 1225CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 2kre n SER 1226N -0.52 0.00 -3.67 9.48 7.64 -1.26 -3.88 113.62 121.42 2kre n SER 1226Ca 0.05 0.13 -0.16 0.00 1.01 0.00 0.00 58.87 59.90 2kre n SER 1226Cb 0.26 -0.13 -0.15 0.00 -1.01 0.00 0.00 64.21 63.19 2kre n SER 1226CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kre s ASP 1227N -2.06 0.61 0.27 6.43 2.15 -1.26 -4.89 116.67 117.91 2kre s ASP 1227Ca 0.00 0.43 0.09 0.00 0.43 0.00 0.00 52.55 53.50 2kre s ASP 1227Cb 0.00 0.43 -0.04 0.00 -0.30 0.00 0.00 42.92 43.01 2kre s ASP 1227CO 0.00 -0.24 0.04 0.00 -0.17 0.00 0.00 175.17 174.80 2kre s ALA 1228N 2.34 3.26 0.00 3.66 0.00 -1.25 -5.07 121.76 124.69 2kre s ALA 1228Ca 0.02 -1.63 0.00 0.00 0.00 0.00 0.00 51.96 50.36 2kre s ALA 1228Cb -0.12 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2kre s ALA 1228CO -0.07 0.24 0.00 -2.30 0.00 0.00 0.00 175.76 173.64 2kre n PRO 1229N -0.96 0.00 -0.68 0.00 -0.02 -1.26 -4.80 135.00 127.28 2kre n PRO 1229Ca -0.06 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.42 2kre n PRO 1229Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.07 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 0.00 0.16 -0.87 2.55 8.00 -1.26 -4.83 116.55 120.30 2kre n ASP 1230Ca 0.00 -1.92 0.05 0.00 0.71 0.00 0.00 54.79 53.62 2kre n ASP 1230Cb 0.00 -0.19 0.09 0.00 -0.02 0.00 0.00 41.12 40.99 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 0.09 0.62 0.00 -1.24 1.02 -1.26 -4.72 120.64 115.14 2kre n GLU 1231Ca 0.01 -2.25 0.00 0.00 -0.02 0.00 0.00 57.16 54.89 2kre n GLU 1231Cb 0.76 -0.75 0.00 0.00 -0.02 0.00 0.00 31.44 31.44 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 -0.31 0.00 -4.20 -0.32 3.01 -1.26 -4.98 117.46 109.40 2kre n PHE 1232Ca 0.10 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.25 2kre n PHE 1232Cb 0.87 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 40.25 2kre n PHE 1232CO 0.00 0.00 0.00 -0.98 1.01 0.00 0.00 176.76 176.79 2kre s ARG 1233N -0.49 2.64 0.33 -1.08 1.70 -1.26 -0.84 118.95 119.95 2kre s ARG 1233Ca 0.00 -0.75 -0.28 0.00 -0.47 0.00 0.00 55.73 54.22 2kre s ARG 1233Cb 0.00 -2.59 -0.10 0.00 -0.57 0.00 0.00 34.95 31.69 2kre s ARG 1233CO 0.00 0.57 1.25 0.34 -1.08 0.00 0.00 175.30 176.38 2kre s ASP 1234N -2.01 6.85 -1.02 -2.89 2.15 -1.22 -4.81 116.67 113.72 2kre s ASP 1234Ca 0.23 2.56 -0.14 0.00 0.43 0.00 0.00 52.55 55.64 2kre s ASP 1234Cb -0.12 -2.64 -0.08 0.00 -0.30 0.00 0.00 42.92 39.78 2kre s ASP 1234CO 0.15 -0.46 2.15 -0.81 -0.17 0.00 0.00 175.17 176.02 2kre n PRO 1235N 0.81 2.14 0.00 4.34 -0.04 -1.26 -2.60 135.00 138.40 2kre n PRO 1235Ca 0.00 -1.86 0.00 0.00 -0.04 0.00 0.00 63.50 61.60 2kre n PRO 1235Cb 0.43 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.09 2kre n PRO 1235CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 2kre n LEU 1236N 5.71 0.00 -0.17 1.53 -0.00 -1.26 -4.73 117.00 118.08 2kre n LEU 1236Ca 0.51 0.00 0.03 0.00 -0.00 0.00 0.00 56.01 56.55 2kre n LEU 1236Cb 0.29 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.72 2kre n LEU 1236CO 0.88 0.00 0.26 0.80 -0.00 0.00 0.00 177.39 179.33 2kre n MET 1237N -0.20 1.04 -3.95 1.47 0.00 -1.19 -5.03 117.12 109.27 2kre n MET 1237Ca 0.00 -0.64 -0.29 0.00 0.00 0.00 0.00 57.70 56.77 2kre n MET 1237Cb 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 33.22 32.19 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 -0.01 -1.44 -3.65 6.12 5.75 -1.07 -4.98 116.55 117.27 2kre n ASP 1238Ca 0.03 -1.06 -0.10 0.00 -0.01 0.00 0.00 54.79 53.64 2kre n ASP 1238Cb 0.12 -2.84 -0.08 0.00 -1.03 0.00 0.00 41.12 37.30 2kre n ASP 1238CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2kre s THR 1239N -3.88 -0.00 0.00 2.12 2.01 -1.26 -4.95 115.64 109.68 2kre s THR 1239Ca 0.13 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.14 2kre s THR 1239Cb -0.06 -0.94 0.00 0.00 0.01 0.00 0.00 72.50 71.51 2kre s THR 1239CO 0.90 0.00 0.00 -0.11 -0.69 0.00 0.00 174.62 174.73 2kre n LEU 1240N 3.60 0.00 -4.79 4.42 7.94 -1.26 -3.45 117.00 123.46 2kre n LEU 1240Ca -0.18 0.00 -0.36 0.00 -1.11 0.00 0.00 56.01 54.36 2kre n LEU 1240Cb 0.57 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.45 2kre n LEU 1240CO 0.02 0.00 -0.12 -0.04 -1.11 0.00 0.00 177.39 176.14 2kre s MET 1241N 0.00 3.90 0.01 1.96 -1.94 -0.02 -4.70 119.30 118.52 2kre s MET 1241Ca 0.00 -0.08 -0.18 0.00 -1.71 0.00 0.00 55.69 53.73 2kre s MET 1241Cb 0.00 -3.32 -0.32 0.00 2.01 0.00 0.00 34.83 33.20 2kre s MET 1241CO 0.00 0.50 1.00 1.79 -0.01 0.00 0.00 175.02 178.30 2kre h THR 1242N 4.34 1.36 -2.07 2.05 1.35 -1.91 -3.42 112.91 114.61 2kre h THR 1242Ca -0.47 -2.55 -0.48 0.00 -0.55 0.00 0.00 66.41 62.36 2kre h THR 1242Cb 1.19 2.98 -0.33 0.00 -1.73 0.00 0.00 68.15 70.26 2kre h THR 1242CO 0.68 0.75 -0.83 -0.62 -0.25 0.00 0.00 175.52 175.25 2kre s ASP 1243N -7.31 1.01 -0.30 5.36 2.15 -1.26 -5.06 116.67 111.25 2kre s ASP 1243Ca -0.11 -2.51 -0.28 0.00 0.43 0.00 0.00 52.55 50.09 2kre s ASP 1243Cb 0.03 0.15 -0.04 0.00 -0.30 0.00 0.00 42.92 42.76 2kre s ASP 1243CO 0.90 -0.18 2.15 -2.84 -0.17 0.00 0.00 175.17 175.04 2kre s PRO 1244N 0.52 2.99 0.03 4.34 0.02 -1.25 -2.50 135.00 139.15 2kre s PRO 1244Ca 0.28 1.75 0.09 0.00 0.02 0.00 0.00 61.00 63.14 2kre s PRO 1244Cb -0.03 -4.37 -0.03 0.00 0.02 0.00 0.00 34.50 30.10 2kre s PRO 1244CO -0.12 -2.27 -0.26 0.14 -0.33 0.00 0.00 177.00 174.16 2kre s VAL 1245N 8.68 2.06 -0.13 3.83 -7.23 0.26 -2.43 120.40 125.42 2kre s VAL 1245Ca 0.95 -1.31 -0.15 0.00 -1.81 0.00 0.00 61.98 59.65 2kre s VAL 1245Cb -0.27 -1.75 -0.05 0.00 0.56 0.00 0.00 36.38 34.87 2kre s VAL 1245CO 0.33 0.38 0.37 -0.60 -0.31 0.00 0.00 175.10 175.27 2kre s ARG 1246N -1.11 4.26 0.33 4.82 3.00 0.72 -2.11 118.95 128.87 2kre s ARG 1246Ca 0.11 0.25 0.05 0.00 -1.00 0.00 0.00 55.73 55.13 2kre s ARG 1246Cb -0.10 -3.42 -0.01 0.00 0.00 0.00 0.00 34.95 31.42 2kre s ARG 1246CO 0.01 0.24 0.48 -0.48 0.00 0.00 0.00 175.30 175.56 2kre s LEU 1247N 0.42 3.99 0.31 -0.88 -0.00 -1.00 0.59 118.68 122.12 2kre s LEU 1247Ca 0.20 -0.03 0.08 0.00 -0.00 0.00 0.00 54.13 54.38 2kre s LEU 1247Cb -0.14 -2.87 0.86 0.00 -0.00 0.00 0.00 46.19 44.05 2kre s LEU 1247CO 0.07 -0.40 1.67 1.55 -0.00 0.00 0.00 176.35 179.25 2kre h PRO 1248N 0.86 0.32 -0.96 1.48 0.13 -1.92 0.92 132.00 132.83 2kre h PRO 1248Ca -0.47 -0.02 0.26 0.00 -0.87 0.00 0.00 66.00 64.90 2kre h PRO 1248Cb 1.25 -0.07 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 2kre h PRO 1248CO 0.56 0.21 0.50 1.03 -0.23 0.00 0.00 178.00 180.07 2kre h SER 1249N 0.33 0.46 0.00 1.44 0.87 -1.95 -3.45 113.55 111.25 2kre h SER 1249Ca 0.63 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 61.35 2kre h SER 1249Cb 1.30 0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.38 2kre h SER 1249CO -0.59 -0.03 0.00 0.61 -0.53 0.00 0.00 176.83 176.28 2kre n GLY 1250N -1.32 1.24 3.43 5.77 0.00 0.32 -5.14 105.19 109.49 2kre n GLY 1250Ca 0.27 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.00 1.15 -0.05 2.61 2.01 -1.25 -4.98 115.64 113.14 2kre s THR 1251Ca 0.00 -2.01 0.06 0.00 0.31 0.00 0.00 61.69 60.05 2kre s THR 1251Cb 0.00 -2.74 -0.01 0.00 0.01 0.00 0.00 72.50 69.76 2kre s THR 1251CO 0.00 -0.04 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.02 2kre s ILE 1252N -3.33 2.16 0.27 1.82 -1.09 -1.26 -2.36 121.20 117.42 2kre s ILE 1252Ca 0.36 -1.03 -0.20 0.00 -2.23 0.00 0.00 60.65 57.54 2kre s ILE 1252Cb 0.08 -1.78 0.05 0.00 -1.58 0.00 0.00 42.46 39.23 2kre s ILE 1252CO 0.15 0.57 0.85 0.00 -1.23 0.00 0.00 174.94 175.28 2kre s MET 1253N -0.25 1.74 -0.40 2.79 0.23 -0.89 -4.04 119.30 118.47 2kre s MET 1253Ca -0.01 -1.05 -0.22 0.00 -1.03 0.00 0.00 55.69 53.38 2kre s MET 1253Cb -0.13 0.53 0.01 0.00 -1.53 0.00 0.00 34.83 33.71 2kre s MET 1253CO 0.03 -0.81 0.71 0.34 -2.03 0.00 0.00 175.02 173.26 2kre s ASP 1254N -3.07 6.43 0.63 -1.18 2.15 -1.26 0.88 116.67 121.26 2kre s ASP 1254Ca 0.15 0.04 0.06 0.00 0.43 0.00 0.00 52.55 53.23 2kre s ASP 1254Cb -0.04 -2.36 0.31 0.00 -0.30 0.00 0.00 42.92 40.53 2kre s ASP 1254CO 0.07 -0.75 1.16 0.08 -0.17 0.00 0.00 175.17 175.56 2kre h ARG 1255N 8.68 0.00 0.02 4.34 0.11 -1.82 0.49 114.38 126.21 2kre h ARG 1255Ca -0.25 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.83 2kre h ARG 1255Cb 1.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.18 2kre h ARG 1255CO 0.90 0.00 -0.01 0.77 0.10 0.00 0.00 179.97 181.73 2kre h SER 1256N 0.00 -0.02 -0.78 0.08 0.02 -1.90 0.29 113.55 111.24 2kre h SER 1256Ca 0.00 0.00 0.23 0.00 -0.84 0.00 0.00 61.79 61.18 2kre h SER 1256Cb 1.69 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 64.20 2kre h SER 1256CO 0.00 -0.01 1.06 0.40 -1.14 0.00 0.00 176.83 177.14 2kre h ILE 1257N -0.05 0.05 0.00 3.27 1.08 -1.32 3.35 117.51 123.89 2kre h ILE 1257Ca -0.00 0.00 -0.18 0.00 -0.39 0.00 0.00 64.86 64.28 2kre h ILE 1257Cb 0.02 0.11 -0.03 0.00 -3.07 0.00 0.00 36.82 33.85 2kre h ILE 1257CO 0.00 0.00 -1.43 0.40 -0.69 0.00 0.00 178.15 176.43 2kre h ILE 1258N 0.00 0.55 -0.10 -0.67 1.08 -1.33 -3.20 117.51 113.84 2kre h ILE 1258Ca 0.37 -2.09 0.04 0.00 -0.39 0.00 0.00 64.86 62.79 2kre h ILE 1258Cb 2.49 2.09 -0.05 0.00 -3.07 0.00 0.00 36.82 38.28 2kre h ILE 1258CO -0.00 0.31 -0.20 0.25 -0.69 0.00 0.00 178.15 177.82 2kre h LEU 1259N 0.00 -0.60 -0.12 1.44 6.46 1.01 -2.69 115.31 120.80 2kre h LEU 1259Ca -0.18 0.10 -0.14 0.00 -0.12 0.00 0.00 57.88 57.55 2kre h LEU 1259Cb 1.64 0.27 0.01 0.00 -0.73 0.00 0.00 40.66 41.84 2kre h LEU 1259CO 0.05 -0.25 -0.46 0.03 -0.62 0.00 0.00 178.44 177.19 2kre h ARG 1260N -0.27 0.52 -0.68 1.25 3.08 -1.72 -3.32 114.38 113.24 2kre h ARG 1260Ca 0.09 -0.40 0.06 0.00 0.07 0.00 0.00 59.98 59.80 2kre h ARG 1260Cb 0.40 0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.44 2kre h ARG 1260CO -0.25 1.03 -0.40 1.58 -1.07 0.00 0.00 179.97 180.86 2kre n HIS 1261N -4.26 -0.29 0.10 3.04 -0.00 -1.04 0.44 115.22 113.20 2kre n HIS 1261Ca -0.08 0.85 0.05 0.00 0.46 0.00 0.00 57.72 59.00 2kre n HIS 1261Cb 0.57 -0.56 0.26 0.00 -0.12 0.00 0.00 29.99 30.15 2kre n HIS 1261CO 0.00 0.00 0.00 1.47 0.46 0.00 0.00 176.34 178.27 2kre n LEU 1262N -4.85 0.25 0.18 0.27 -0.00 -1.05 0.04 117.00 111.84 2kre n LEU 1262Ca 0.02 0.53 0.07 0.00 -0.00 0.00 0.00 56.01 56.62 2kre n LEU 1262Cb 0.18 -0.52 0.14 0.00 -0.00 0.00 0.00 43.42 43.22 2kre n LEU 1262CO -0.11 -0.61 0.63 0.25 -0.00 0.00 0.00 177.39 177.55 2kre h LEU 1263N 0.00 0.00 -1.75 1.47 5.85 0.89 -3.32 115.31 118.45 2kre h LEU 1263Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2kre h LEU 1263Cb 0.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.36 2kre h LEU 1263CO 0.00 0.30 0.00 -0.46 -0.34 0.00 0.00 178.44 177.94 2kre n ASN 1264N -3.21 1.02 0.00 1.25 0.23 0.11 -5.03 115.26 109.63 2kre n ASN 1264Ca 0.02 -1.43 0.00 0.00 -0.53 0.00 0.00 54.58 52.64 2kre n ASN 1264Cb 0.62 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.32 2kre n ASN 1264CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2kre n SER 1265N -0.22 0.00 -0.49 0.53 7.64 0.50 -5.00 113.62 116.59 2kre n SER 1265Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2kre n SER 1265Cb 0.28 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 2kre n SER 1265CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2kre n PRO 1266N 0.00 0.98 -3.44 1.43 -0.04 -1.26 -3.48 135.00 129.19 2kre n PRO 1266Ca 0.00 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.02 2kre n PRO 1266Cb 0.00 -1.48 -0.05 0.00 -0.04 0.00 0.00 33.50 31.93 2kre n PRO 1266CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2kre s THR 1267N -1.03 4.92 0.19 0.52 -4.23 -1.26 0.22 115.64 114.97 2kre s THR 1267Ca 0.00 -2.25 -0.12 0.00 -1.18 0.00 0.00 61.69 58.15 2kre s THR 1267Cb 0.00 -4.12 -0.08 0.00 1.34 0.00 0.00 72.50 69.64 2kre s THR 1267CO 0.00 -0.92 0.09 -0.67 -0.54 0.00 0.00 174.62 172.57 2kre n ASP 1268N 4.30 -1.32 -0.02 3.99 -0.08 -0.71 -4.58 116.55 118.14 2kre n ASP 1268Ca 0.03 0.45 -0.16 0.00 -1.51 0.00 0.00 54.79 53.60 2kre n ASP 1268Cb 0.43 -0.46 -0.09 0.00 2.34 0.00 0.00 41.12 43.33 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 0.23 0.46 -4.95 -0.67 0.13 -1.94 -3.16 132.00 122.10 2kre h PRO 1269Ca -0.18 -0.41 -0.67 0.00 -0.87 0.00 0.00 66.00 63.87 2kre h PRO 1269Cb 0.74 0.09 -0.17 0.00 0.13 0.00 0.00 31.00 31.79 2kre h PRO 1269CO 0.25 1.05 -0.24 -0.06 -0.23 0.00 0.00 178.00 178.77 2kre s PHE 1270N -3.53 3.20 0.00 1.56 0.40 -1.26 -3.95 117.98 114.39 2kre s PHE 1270Ca -0.13 -0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.10 2kre s PHE 1270Cb 0.05 -2.76 0.00 0.00 0.51 0.00 0.00 43.02 40.82 2kre s PHE 1270CO 0.82 -0.52 0.00 0.27 0.70 0.00 0.00 175.22 176.49 2kre n ASN 1271N 5.48 0.00 -1.87 1.36 2.04 -1.26 -4.87 115.26 116.14 2kre n ASN 1271Ca -0.08 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.06 2kre n ASN 1271Cb 0.49 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.74 2kre n ASN 1271CO 0.00 0.00 0.00 -2.11 -0.44 0.00 0.00 177.26 174.71 2kre n ARG 1272N -2.00 -0.19 -3.65 -3.83 1.85 -1.19 -5.04 116.66 102.60 2kre n ARG 1272Ca 0.00 0.14 -0.02 0.00 -1.00 0.00 0.00 57.85 56.97 2kre n ARG 1272Cb 0.00 -0.65 -0.06 0.00 -1.05 0.00 0.00 32.46 30.71 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 -0.02 0.01 -0.57 2.89 2.00 -1.25 -4.93 119.66 117.79 2kre s GLN 1273Ca 0.00 0.01 -0.15 0.00 -2.00 0.00 0.00 55.36 53.21 2kre s GLN 1273Cb 0.00 0.01 -0.14 0.00 0.80 0.00 0.00 33.01 33.68 2kre s GLN 1273CO 0.00 -0.00 1.59 2.41 -0.50 0.00 0.00 175.29 178.79 2kre n THR 1274N 1.03 0.00 -2.01 -0.34 -1.04 -1.26 -1.73 114.28 108.93 2kre n THR 1274Ca -0.05 -0.22 -0.42 0.00 -2.04 0.00 0.00 64.05 61.32 2kre n THR 1274Cb 0.58 -1.12 -0.03 0.00 -1.82 0.00 0.00 70.33 67.94 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 9.23 4.32 0.59 -4.42 1.98 0.61 -4.94 118.68 126.05 2kre s LEU 1275Ca 0.46 2.25 -0.05 0.00 -2.89 0.00 0.00 54.13 53.89 2kre s LEU 1275Cb -0.02 -3.54 0.02 0.00 0.66 0.00 0.00 46.19 43.31 2kre s LEU 1275CO 0.11 -0.92 0.88 0.42 -1.89 0.00 0.00 176.35 174.96 2kre s THR 1276N 3.92 3.33 -1.53 3.68 -4.23 -1.26 -4.70 115.64 114.85 2kre s THR 1276Ca 0.73 -0.17 0.15 0.00 -1.18 0.00 0.00 61.69 61.22 2kre s THR 1276Cb -0.34 -3.33 0.27 0.00 1.34 0.00 0.00 72.50 70.45 2kre s THR 1276CO 0.30 -0.32 1.17 -1.84 -0.54 0.00 0.00 174.62 173.39 2kre n GLU 1277N -2.57 2.01 0.00 3.99 -0.00 -1.26 -4.56 120.64 118.25 2kre n GLU 1277Ca 0.05 -1.84 0.00 0.00 -0.00 0.00 0.00 57.16 55.37 2kre n GLU 1277Cb 0.58 -1.32 0.00 0.00 -0.00 0.00 0.00 31.44 30.70 2kre n GLU 1277CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2kre n SER 1278N 0.85 3.54 -2.77 -1.84 2.88 -1.26 -4.79 113.62 110.22 2kre n SER 1278Ca 0.12 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.41 2kre n SER 1278Cb 0.43 0.01 -0.08 0.00 -0.75 0.00 0.00 64.21 63.82 2kre n SER 1278CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 2kre n MET 1279N -2.37 2.70 -4.29 -1.46 1.56 -1.26 -4.86 117.12 107.14 2kre n MET 1279Ca 0.00 -1.56 -0.29 0.00 -0.27 0.00 0.00 57.70 55.58 2kre n MET 1279Cb 0.44 -2.40 -0.10 0.00 2.15 0.00 0.00 33.22 33.30 2kre n MET 1279CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 2kre s LEU 1280N 0.09 2.83 -0.26 -0.89 1.43 -1.26 -4.20 118.68 116.43 2kre s LEU 1280Ca 0.62 -0.55 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2kre s LEU 1280Cb 0.21 -1.61 0.05 0.00 0.03 0.00 0.00 46.19 44.87 2kre s LEU 1280CO -0.03 0.15 -0.09 -0.70 0.23 0.00 0.00 176.35 175.91 2kre s GLU 1281N -2.38 2.47 -0.02 1.70 2.12 0.20 -4.96 118.70 117.83 2kre s GLU 1281Ca 0.21 -1.21 -0.30 0.00 0.36 0.00 0.00 54.97 54.03 2kre s GLU 1281Cb -0.10 -2.92 -0.04 0.00 0.26 0.00 0.00 34.13 31.33 2kre s GLU 1281CO 0.12 -0.51 1.17 -1.25 -0.54 0.00 0.00 175.26 174.25 2kre s PRO 1282N 1.19 4.40 -0.45 4.30 0.04 -1.26 0.26 135.00 143.47 2kre s PRO 1282Ca -0.05 1.66 -0.11 0.00 0.04 0.00 0.00 61.00 62.55 2kre s PRO 1282Cb -0.19 -3.48 0.10 0.00 0.04 0.00 0.00 34.50 30.97 2kre s PRO 1282CO -0.05 -0.34 0.33 0.08 0.04 0.00 0.00 177.00 177.05 2kre s VAL 1283N 1.74 4.44 0.21 -0.36 1.01 -1.02 -4.88 120.40 121.55 2kre s VAL 1283Ca 0.56 -1.49 0.10 0.00 0.00 0.00 0.00 61.98 61.15 2kre s VAL 1283Cb -0.25 -3.79 -0.07 0.00 0.00 0.00 0.00 36.38 32.26 2kre s VAL 1283CO 0.25 -0.63 1.51 1.55 0.00 0.00 0.00 175.10 177.77 2kre h PRO 1284N 8.51 0.00 -0.66 2.72 0.13 -1.95 -3.11 132.00 137.64 2kre h PRO 1284Ca -0.24 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 65.08 2kre h PRO 1284Cb 1.08 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 2kre h PRO 1284CO 0.83 0.72 0.53 1.49 -0.23 0.00 0.00 178.00 181.35 2kre h GLU 1285N 0.00 0.00 0.00 0.86 4.81 -1.96 -1.45 114.58 116.84 2kre h GLU 1285Ca -0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2kre h GLU 1285Cb 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 2kre h GLU 1285CO 0.09 0.00 -0.00 1.25 -0.73 0.00 0.00 179.01 179.62 2kre h LEU 1286N 0.00 -0.00 -0.41 1.64 7.12 -1.91 -3.34 115.31 118.40 2kre h LEU 1286Ca 0.31 -0.46 0.04 0.00 0.13 0.00 0.00 57.88 57.91 2kre h LEU 1286Cb 1.38 0.00 -0.07 0.00 -0.53 0.00 0.00 40.66 41.44 2kre h LEU 1286CO -0.00 0.73 -0.42 0.50 -0.13 0.00 0.00 178.44 179.12 2kre h LYS 1287N -1.00 -0.21 -0.83 1.25 3.64 -1.36 0.28 116.57 118.34 2kre h LYS 1287Ca -0.00 0.01 0.34 0.00 -1.27 0.00 0.00 60.65 59.73 2kre h LYS 1287Cb 0.46 0.05 -0.15 0.00 -0.41 0.00 0.00 32.23 32.18 2kre h LYS 1287CO 0.00 -0.14 0.42 0.39 -2.27 0.00 0.00 179.45 177.85 2kre n GLU 1288N -4.66 -0.05 0.17 1.90 1.02 -0.66 0.86 120.64 119.21 2kre n GLU 1288Ca -0.02 1.15 -0.14 0.00 -0.02 0.00 0.00 57.16 58.14 2kre n GLU 1288Cb 0.24 -2.05 -0.08 0.00 -0.02 0.00 0.00 31.44 29.53 2kre n GLU 1288CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 2kre h GLN 1289N 0.00 -0.43 -0.12 3.49 4.15 -0.58 -1.77 115.11 119.84 2kre h GLN 1289Ca 0.69 0.03 0.04 0.00 0.77 0.00 0.00 58.65 60.18 2kre h GLN 1289Cb 1.81 0.10 -0.07 0.00 0.21 0.00 0.00 27.48 29.53 2kre h GLN 1289CO -0.65 -0.13 -0.48 0.82 -1.93 0.00 0.00 178.83 176.46 2kre h ILE 1290N -0.74 0.08 -0.11 2.39 2.04 1.00 0.12 117.51 122.28 2kre h ILE 1290Ca -0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.85 2kre h ILE 1290Cb 0.50 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2kre h ILE 1290CO 0.08 0.00 0.10 1.56 0.00 0.00 0.00 178.15 179.88 2kre h GLN 1291N -0.54 0.00 0.00 2.37 1.08 -1.39 -2.09 115.11 114.54 2kre h GLN 1291Ca 0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 2kre h GLN 1291Cb 0.66 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 2kre h GLN 1291CO -0.41 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.47 2kre n ALA 1292N -2.44 0.00 -0.25 3.87 0.00 0.26 -0.91 120.51 121.04 2kre n ALA 1292Ca -0.00 0.00 0.32 0.00 0.00 0.00 0.00 53.44 53.76 2kre n ALA 1292Cb 0.21 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.30 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 -1.17 1.28 115.95 123.07 2kre h TRP 1293Ca 0.00 0.00 -0.23 0.00 2.11 0.00 0.00 58.89 60.77 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 -1.49 0.00 -2.79 0.00 0.00 178.44 174.16 2kre h MET 1294N 0.00 0.00 -0.25 2.65 -0.00 -1.49 -3.33 114.93 112.51 2kre h MET 1294Ca 0.51 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 60.16 2kre h MET 1294Cb 2.51 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 34.09 2kre h MET 1294CO -0.01 0.47 -0.08 -0.09 -0.00 0.00 0.00 176.91 177.20 2kre h ARG 1295N 0.00 0.39 -0.65 -0.10 2.43 0.35 -1.32 114.38 115.49 2kre h ARG 1295Ca -0.21 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 2kre h ARG 1295Cb 1.82 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.32 2kre h ARG 1295CO 0.07 0.49 0.00 -0.85 -1.51 0.00 0.00 179.97 178.17 2kre n GLU 1296N -4.26 0.90 -2.70 0.20 0.28 -0.83 -3.53 120.64 110.70 2kre n GLU 1296Ca 0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.93 2kre n GLU 1296Cb 0.27 -1.33 0.11 0.00 1.43 0.00 0.00 31.44 31.93 2kre n GLU 1296CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 2kre n LYS 1297N -0.10 1.18 -3.60 3.44 2.85 -0.50 -4.80 118.16 116.63 2kre n LYS 1297Ca 0.00 -1.89 -0.08 0.00 -1.05 0.00 0.00 58.31 55.30 2kre n LYS 1297Cb 0.16 -0.18 -0.05 0.00 -0.65 0.00 0.00 35.03 34.31 2kre n LYS 1297CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 2kre s GLN 1298N 0.08 0.42 -0.09 -1.58 -2.07 -1.20 -4.74 119.66 110.49 2kre s GLN 1298Ca 0.22 0.14 0.11 0.00 -1.82 0.00 0.00 55.36 54.01 2kre s GLN 1298Cb 0.39 0.20 -0.16 0.00 -1.09 0.00 0.00 33.01 32.35 2kre s GLN 1298CO -0.08 -0.13 0.11 0.27 -1.32 0.00 0.00 175.29 174.14 2kre n ASN 1299N 0.80 2.10 0.00 12.60 0.23 -1.26 -4.94 115.26 124.79 2kre n ASN 1299Ca -0.08 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.97 2kre n ASN 1299Cb 0.58 1.02 0.00 0.00 -2.08 0.00 0.00 39.78 39.30 2kre n ASN 1299CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2kre n SER 1300N -2.29 0.00 -3.23 0.53 7.64 -1.26 -4.76 113.62 110.25 2kre n SER 1300Ca -0.14 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.63 2kre n SER 1300Cb 0.72 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.91 2kre n SER 1300CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2kre s ASP 1301N -4.00 0.30 0.00 6.43 1.11 -1.26 -5.34 116.67 113.91 2kre s ASP 1301Ca 0.00 -1.20 0.00 0.00 0.18 0.00 0.00 52.55 51.53 2kre s ASP 1301Cb 0.00 0.75 0.00 0.00 1.07 0.00 0.00 42.92 44.74 2kre s ASP 1301CO 0.00 -1.47 0.00 0.00 1.18 0.00 0.00 175.17 174.88