#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lql h ASP 1202N 0.00 -0.09 -2.95 7.83 3.32 -2.12 -3.43 116.42 118.98 1lql h ASP 1202Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.49 1lql h ASP 1202Cb 0.00 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 1lql h ASP 1202CO 0.00 -0.06 0.92 -0.54 -1.72 0.00 0.00 179.24 177.84 1lql s LYS 1203N -2.95 4.17 0.17 3.56 -0.14 -1.26 -5.04 119.74 118.26 1lql s LYS 1203Ca -0.02 1.59 0.05 0.00 -1.36 0.00 0.00 55.97 56.23 1lql s LYS 1203Cb 0.00 -3.79 -0.04 0.00 -1.68 0.00 0.00 37.83 32.32 1lql s LYS 1203CO 0.05 -0.79 0.17 0.15 -0.76 0.00 0.00 175.35 174.17 1lql s LYS 1204N 3.64 3.01 -0.03 1.68 -0.14 -1.26 -5.12 119.74 121.52 1lql s LYS 1204Ca 0.55 -0.84 0.02 0.00 -1.36 0.00 0.00 55.97 54.34 1lql s LYS 1204Cb -0.21 -2.70 0.01 0.00 -1.68 0.00 0.00 37.83 33.25 1lql s LYS 1204CO 0.16 0.48 -0.06 0.71 -0.76 0.00 0.00 175.35 175.89 1lql s TYR 1205N -1.79 0.72 -0.27 3.18 2.02 -1.26 -5.11 117.35 114.83 1lql s TYR 1205Ca 0.32 -0.17 -0.01 0.00 -0.37 0.00 0.00 57.07 56.84 1lql s TYR 1205Cb -0.10 -0.57 0.08 0.00 -0.40 0.00 0.00 41.96 40.98 1lql s TYR 1205CO 0.25 -0.11 0.06 0.34 -1.57 0.00 0.00 175.55 174.51 1lql s ASP 1206N 0.44 3.77 0.18 2.29 -1.08 -1.26 -5.12 116.67 115.89 1lql s ASP 1206Ca -0.06 -1.39 0.10 0.00 -0.52 0.00 0.00 52.55 50.68 1lql s ASP 1206Cb -0.10 -0.89 -0.04 0.00 -1.46 0.00 0.00 42.92 40.43 1lql s ASP 1206CO 0.00 -0.36 -0.22 -0.63 0.52 0.00 0.00 175.17 174.49 1lql s ILE 1207N 1.60 2.11 -0.04 4.11 1.09 -1.26 -4.62 121.20 124.18 1lql s ILE 1207Ca 0.05 -1.96 -0.05 0.00 -1.10 0.00 0.00 60.65 57.58 1lql s ILE 1207Cb -0.18 -1.98 0.01 0.00 -1.06 0.00 0.00 42.46 39.25 1lql s ILE 1207CO -0.17 -0.19 0.14 0.42 -0.10 0.00 0.00 174.94 175.03 1lql s THR 1208N -1.80 0.02 -0.04 2.92 -4.23 -1.13 -5.01 115.64 106.37 1lql s THR 1208Ca 0.18 -0.15 0.04 0.00 -1.18 0.00 0.00 61.69 60.58 1lql s THR 1208Cb -0.07 -0.25 -0.00 0.00 1.34 0.00 0.00 72.50 73.52 1lql s THR 1208CO 0.08 -0.08 -0.14 0.00 -0.54 0.00 0.00 174.62 173.94 1lql s ALA 1209N -0.23 1.27 0.01 3.99 0.00 -1.26 -1.26 121.76 124.28 1lql s ALA 1209Ca -0.03 -0.55 0.06 0.00 0.00 0.00 0.00 51.96 51.44 1lql s ALA 1209Cb -0.02 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 1lql s ALA 1209CO 0.00 0.22 -0.16 0.08 0.00 0.00 0.00 175.76 175.90 1lql s VAL 1210N 0.13 2.90 -0.42 0.00 1.01 -0.68 -4.95 120.40 118.40 1lql s VAL 1210Ca -0.04 -1.02 -0.18 0.00 0.00 0.00 0.00 61.98 60.74 1lql s VAL 1210Cb -0.11 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 34.10 1lql s VAL 1210CO 0.02 0.42 0.46 -0.22 0.00 0.00 0.00 175.10 175.78 1lql s LEU 1211N -1.21 4.77 0.79 3.92 2.96 -1.26 -1.64 118.68 127.01 1lql s LEU 1211Ca 0.14 -0.58 -0.08 0.00 -0.22 0.00 0.00 54.13 53.39 1lql s LEU 1211Cb -0.11 -2.43 0.12 0.00 0.50 0.00 0.00 46.19 44.27 1lql s LEU 1211CO 0.04 -0.59 1.11 0.20 -1.32 0.00 0.00 176.35 175.79 1lql s ASN 1212N 1.83 4.19 1.29 3.68 0.01 0.22 -5.01 114.94 121.15 1lql s ASN 1212Ca 0.14 0.22 -0.20 0.00 -0.71 0.00 0.00 52.86 52.30 1lql s ASN 1212Cb -0.17 -0.62 0.30 0.00 0.41 0.00 0.00 41.25 41.18 1lql s ASN 1212CO 0.14 -2.00 0.97 -0.62 -1.51 0.00 0.00 177.10 174.08 1lql n GLU 1213N -3.16 -3.43 -1.62 -0.60 1.02 -1.26 -3.05 120.64 108.53 1lql n GLU 1213Ca 0.12 -1.57 -0.17 0.00 -0.02 0.00 0.00 57.16 55.52 1lql n GLU 1213Cb 0.60 -1.59 -0.06 0.00 -0.02 0.00 0.00 31.44 30.37 1lql n GLU 1213CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1lql n ASP 1214N -4.98 -4.45 0.00 1.62 5.68 -1.26 -2.93 116.55 110.23 1lql n ASP 1214Ca 0.14 0.36 0.00 0.00 -0.50 0.00 0.00 54.79 54.79 1lql n ASP 1214Cb 0.55 -3.99 0.00 0.00 -1.14 0.00 0.00 41.12 36.55 1lql n ASP 1214CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1lql n SER 1215N -1.04 -2.15 -4.82 -1.12 3.41 -1.17 -4.94 113.62 101.79 1lql n SER 1215Ca -0.17 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.10 1lql n SER 1215Cb 0.56 -1.93 -0.07 0.00 -0.26 0.00 0.00 64.21 62.52 1lql n SER 1215CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1lql s SER 1216N -1.15 7.00 0.24 4.04 1.04 -1.15 -4.62 113.70 119.10 1lql s SER 1216Ca 0.00 1.57 0.10 0.00 0.48 0.00 0.00 55.95 58.11 1lql s SER 1216Cb 0.00 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 63.59 1lql s SER 1216CO 0.00 -0.20 -0.11 -0.04 0.98 0.00 0.00 173.24 173.87 1lql s MET 1217N -2.71 1.97 -0.05 4.02 -1.94 -0.17 -0.61 119.30 119.81 1lql s MET 1217Ca 0.55 -1.50 0.00 0.00 -1.71 0.00 0.00 55.69 53.03 1lql s MET 1217Cb -0.12 -2.01 0.02 0.00 2.01 0.00 0.00 34.83 34.73 1lql s MET 1217CO 0.18 0.37 -0.02 0.95 -0.01 0.00 0.00 175.02 176.49 1lql s THR 1218N -2.16 0.45 0.01 2.05 -4.23 -0.65 -0.09 115.64 111.02 1lql s THR 1218Ca 0.28 -0.01 -0.04 0.00 -1.18 0.00 0.00 61.69 60.74 1lql s THR 1218Cb -0.07 -0.53 -0.04 0.00 1.34 0.00 0.00 72.50 73.20 1lql s THR 1218CO 0.16 0.23 0.23 0.00 -0.54 0.00 0.00 174.62 174.71 1lql s ALA 1219N 1.34 3.91 -0.08 3.99 0.00 0.15 -1.68 121.76 129.39 1lql s ALA 1219Ca -0.05 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.25 1lql s ALA 1219Cb -0.13 -1.97 0.02 0.00 0.00 0.00 0.00 23.12 21.03 1lql s ALA 1219CO -0.02 0.71 -0.11 0.42 0.00 0.00 0.00 175.76 176.76 1lql s ILE 1220N -1.34 1.07 -0.14 0.00 1.09 -0.39 -1.31 121.20 120.17 1lql s ILE 1220Ca 0.29 -0.41 -0.02 0.00 -1.10 0.00 0.00 60.65 59.41 1lql s ILE 1220Cb -0.13 -1.01 0.04 0.00 -1.06 0.00 0.00 42.46 40.31 1lql s ILE 1220CO 0.18 0.35 0.01 -0.55 -0.10 0.00 0.00 174.94 174.83 1lql s SER 1221N 0.93 2.37 1.23 3.58 0.15 -0.71 -2.83 113.70 118.43 1lql s SER 1221Ca -0.10 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.05 1lql s SER 1221Cb -0.15 -0.58 0.00 0.00 -1.71 0.00 0.00 66.02 63.58 1lql s SER 1221CO 0.01 -0.24 0.00 0.47 1.20 0.00 0.00 173.24 174.67 1lql n ASP 1222N 5.06 0.00 -1.25 5.45 8.00 -1.26 -0.43 116.55 132.12 1lql n ASP 1222Ca -0.09 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.45 1lql n ASP 1222Cb 0.48 0.00 0.23 0.00 -0.02 0.00 0.00 41.12 41.81 1lql n ASP 1222CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lql n GLN 1223N 14.00 3.13 -4.24 -1.24 6.02 -1.26 -4.91 117.38 128.88 1lql n GLN 1223Ca 0.00 -1.78 -0.26 0.00 -0.01 0.00 0.00 57.00 54.95 1lql n GLN 1223Cb 0.00 -1.89 -0.08 0.00 1.02 0.00 0.00 30.24 29.29 1lql n GLN 1223CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1lql s PHE 1224N -1.96 2.77 -0.00 1.08 0.08 0.43 -5.14 117.98 115.25 1lql s PHE 1224Ca 0.31 -0.17 -0.01 0.00 0.12 0.00 0.00 56.93 57.18 1lql s PHE 1224Cb 0.23 -1.33 -0.00 0.00 -0.57 0.00 0.00 43.02 41.35 1lql s PHE 1224CO 0.10 0.53 0.02 -0.65 -0.10 0.00 0.00 175.22 175.12 1lql s GLN 1225N -3.02 0.16 -0.01 0.44 -0.21 -1.26 -1.73 119.66 114.04 1lql s GLN 1225Ca 0.27 -0.20 0.02 0.00 0.02 0.00 0.00 55.36 55.47 1lql s GLN 1225Cb -0.09 0.06 -0.00 0.00 1.00 0.00 0.00 33.01 33.98 1lql s GLN 1225CO 0.18 -0.03 -0.05 0.42 -2.12 0.00 0.00 175.29 173.69 1lql s ILE 1226N -0.57 0.42 -0.31 1.08 1.09 -0.43 -4.98 121.20 117.51 1lql s ILE 1226Ca -0.06 -0.22 -0.08 0.00 -1.10 0.00 0.00 60.65 59.19 1lql s ILE 1226Cb -0.04 -0.36 0.01 0.00 -1.06 0.00 0.00 42.46 41.01 1lql s ILE 1226CO -0.00 0.12 0.11 0.42 -0.10 0.00 0.00 174.94 175.49 1lql s THR 1227N -0.08 4.15 0.42 2.92 -4.23 -1.26 0.29 115.64 117.86 1lql s THR 1227Ca 0.01 -0.70 0.05 0.00 -1.18 0.00 0.00 61.69 59.87 1lql s THR 1227Cb -0.03 -3.18 0.01 0.00 1.34 0.00 0.00 72.50 70.64 1lql s THR 1227CO -0.00 0.01 0.59 -0.76 -0.54 0.00 0.00 174.62 173.92 1lql s LEU 1228N 1.52 3.69 -0.28 4.79 1.02 0.87 -3.53 118.68 126.76 1lql s LEU 1228Ca 0.02 -0.14 -0.17 0.00 0.02 0.00 0.00 54.13 53.86 1lql s LEU 1228Cb -0.18 -2.82 0.11 0.00 0.02 0.00 0.00 46.19 43.32 1lql s LEU 1228CO 0.04 -0.71 0.83 -0.62 0.02 0.00 0.00 176.35 175.91 1lql s ASP 1229N -4.28 -0.72 0.00 2.29 -1.08 0.83 -1.00 116.67 112.71 1lql s ASP 1229Ca 0.51 1.18 0.24 0.00 -0.52 0.00 0.00 52.55 53.96 1lql s ASP 1229Cb -0.10 1.28 0.23 0.00 -1.46 0.00 0.00 42.92 42.87 1lql s ASP 1229CO 0.34 -0.19 1.24 0.00 0.52 0.00 0.00 175.17 177.08 1lql n ALA 1230N 3.77 3.39 -1.02 3.66 0.00 -1.26 -3.61 120.51 125.45 1lql n ALA 1230Ca -0.18 -0.57 -0.32 0.00 0.00 0.00 0.00 53.44 52.36 1lql n ALA 1230Cb 0.58 -0.90 0.13 0.00 0.00 0.00 0.00 19.45 19.26 1lql n ALA 1230CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1lql s ARG 1231N -2.47 1.62 0.92 0.00 0.52 -1.26 -4.97 118.95 113.30 1lql s ARG 1231Ca 0.21 1.55 -0.11 0.00 -0.52 0.00 0.00 55.73 56.85 1lql s ARG 1231Cb 0.18 -1.79 0.14 0.00 0.52 0.00 0.00 34.95 34.00 1lql s ARG 1231CO 0.55 -2.19 1.10 -2.14 0.02 0.00 0.00 175.30 172.64 1lql s PRO 1232N -4.45 1.05 0.28 3.54 0.02 -1.26 -4.50 135.00 129.69 1lql s PRO 1232Ca 0.68 1.11 -0.06 0.00 0.02 0.00 0.00 61.00 62.75 1lql s PRO 1232Cb -0.24 -1.76 0.52 0.00 0.02 0.00 0.00 34.50 33.04 1lql s PRO 1232CO 0.53 -2.47 1.54 1.63 -0.33 0.00 0.00 177.00 177.91 1lql n LYS 1233N -4.08 -0.09 0.27 5.54 5.02 -1.26 -1.07 118.16 122.50 1lql n LYS 1233Ca 0.08 1.53 -0.11 0.00 -2.02 0.00 0.00 58.31 57.79 1lql n LYS 1233Cb 0.54 -2.31 -0.05 0.00 -0.02 0.00 0.00 35.03 33.18 1lql n LYS 1233CO 0.00 0.00 0.00 1.12 -0.52 0.00 0.00 177.40 178.00 1lql h HIS 1234N 0.00 -0.64 -0.20 2.13 2.07 -2.04 -3.26 115.15 113.21 1lql h HIS 1234Ca 0.50 -0.02 0.05 0.00 -2.85 0.00 0.00 60.37 58.06 1lql h HIS 1234Cb 0.84 0.21 -0.07 0.00 2.57 0.00 0.00 27.41 30.95 1lql h HIS 1234CO -0.70 -0.40 -0.41 1.15 -3.07 0.00 0.00 177.93 174.50 1lql h THR 1235N -0.75 0.15 0.00 6.12 2.02 -1.81 -3.47 112.91 115.17 1lql h THR 1235Ca -0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.11 1lql h THR 1235Cb 0.53 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1lql h THR 1235CO 0.12 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.01 1lql n ALA 1236N -2.96 -1.01 0.00 6.16 0.00 -0.23 -5.01 120.51 117.47 1lql n ALA 1236Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1lql n ALA 1236Cb 0.36 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.58 1lql n ALA 1236CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1lql n LYS 1237N -0.22 0.00 -3.99 0.00 5.02 -1.26 -5.02 118.16 112.69 1lql n LYS 1237Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 1lql n LYS 1237Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.02 1lql n LYS 1237CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1lql s GLY 1238N 0.00 -0.25 0.72 0.72 0.00 -1.24 -4.87 107.32 102.40 1lql s GLY 1238Ca 0.00 0.24 -0.16 0.00 0.00 0.00 0.00 44.72 44.80 1lql s GLY 1238CO 0.00 6.24 0.76 0.69 0.00 0.00 0.00 173.10 180.80 1lql n PHE 1239N -0.94 -0.01 -2.19 1.90 0.99 -1.23 -4.01 117.46 111.97 1lql n PHE 1239Ca 0.05 0.38 -0.30 0.00 -0.00 0.00 0.00 57.45 57.58 1lql n PHE 1239Cb 0.59 -2.01 0.00 0.00 -1.00 0.00 0.00 39.48 37.06 1lql n PHE 1239CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1lql s GLY 1240N -1.56 1.65 0.16 1.37 0.00 -1.24 -0.12 107.32 107.59 1lql s GLY 1240Ca 0.70 -0.21 -0.25 0.00 0.00 0.00 0.00 44.72 44.96 1lql s GLY 1240CO 0.54 0.03 1.59 -2.55 0.00 0.00 0.00 173.10 172.70 1lql h PRO 1241N 0.01 -0.29 0.00 2.90 0.11 -1.94 -1.51 132.00 131.29 1lql h PRO 1241Ca -0.45 0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1lql h PRO 1241Cb 1.19 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1lql h PRO 1241CO 0.62 -0.19 -0.21 -0.07 -0.21 0.00 0.00 178.00 177.94 1lql h LEU 1242N -0.30 0.00 -0.56 2.35 3.38 -1.96 -2.02 115.31 116.21 1lql h LEU 1242Ca 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1lql h LEU 1242Cb 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1lql h LEU 1242CO -0.54 0.21 0.07 0.00 0.09 0.00 0.00 178.44 178.27 1lql h ALA 1243N 1.79 0.74 0.71 1.53 0.00 -1.69 -1.23 119.26 121.11 1lql h ALA 1243Ca -0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1lql h ALA 1243Cb 0.37 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1lql h ALA 1243CO 0.03 0.50 -0.39 0.00 0.00 0.00 0.00 179.25 179.38 1lql h ALA 1244N 0.99 -1.04 -0.72 0.00 0.00 -0.66 0.69 119.26 118.52 1lql h ALA 1244Ca 0.17 -0.21 0.16 0.00 0.00 0.00 0.00 54.91 55.02 1lql h ALA 1244Cb 0.44 0.46 -0.12 0.00 0.00 0.00 0.00 17.79 18.57 1lql h ALA 1244CO 0.01 -1.09 0.05 1.25 0.00 0.00 0.00 179.25 179.47 1lql h LEU 1245N -1.02 -0.24 -1.38 0.00 6.46 -1.26 0.62 115.31 118.48 1lql h LEU 1245Ca -0.09 0.17 -0.04 0.00 -0.12 0.00 0.00 57.88 57.80 1lql h LEU 1245Cb 0.81 0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 41.03 1lql h LEU 1245CO 0.12 -0.13 -0.20 -0.07 -0.62 0.00 0.00 178.44 177.54 1lql h LEU 1246N 0.14 0.00 -0.01 2.25 3.38 -0.99 -0.88 115.31 119.21 1lql h LEU 1246Ca 0.39 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.11 1lql h LEU 1246Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1lql h LEU 1246CO -0.60 0.20 -1.11 0.28 0.09 0.00 0.00 178.44 177.30 1lql h SER 1247N 0.00 0.43 -0.55 -0.43 0.02 0.24 -1.61 113.55 111.64 1lql h SER 1247Ca -0.00 -0.41 -0.06 0.00 -0.84 0.00 0.00 61.79 60.48 1lql h SER 1247Cb 0.62 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.99 1lql h SER 1247CO 0.03 1.27 0.15 1.23 -1.14 0.00 0.00 176.83 178.36 1lql h GLY 1248N 1.55 0.99 0.78 -3.77 0.00 0.45 0.20 103.07 103.28 1lql h GLY 1248Ca -0.11 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 1lql h GLY 1248CO 0.18 0.55 -0.07 -2.00 0.00 0.00 0.00 176.54 175.20 1lql h LEU 1249N 0.89 -0.15 -0.84 3.11 6.46 -1.07 -2.23 115.31 121.47 1lql h LEU 1249Ca 0.19 -0.18 0.06 0.00 -0.12 0.00 0.00 57.88 57.84 1lql h LEU 1249Cb 0.31 0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 40.22 1lql h LEU 1249CO -0.00 0.09 0.52 0.00 -0.62 0.00 0.00 178.44 178.43 1lql h ALA 1250N 0.43 1.15 -0.53 1.25 0.00 -0.98 -0.56 119.26 120.02 1lql h ALA 1250Ca -0.02 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1lql h ALA 1250Cb 0.32 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1lql h ALA 1250CO 0.03 0.27 -0.01 0.00 0.00 0.00 0.00 179.25 179.54 1lql h ALA 1251N 1.40 0.99 -0.12 0.00 0.00 -0.51 -0.36 119.26 120.66 1lql h ALA 1251Ca 0.37 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1lql h ALA 1251Cb 0.16 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1lql h ALA 1251CO -0.17 0.62 0.01 0.00 0.00 0.00 0.00 179.25 179.71 1lql h GLU 1253N -0.05 -0.85 0.07 0.00 4.39 -0.93 0.23 114.58 117.44 1lql h GLU 1253Ca 0.03 0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.80 1lql h GLU 1253Cb 0.33 0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 1lql h GLU 1253CO 0.00 -0.57 -0.45 -0.07 -1.16 0.00 0.00 179.01 176.77 1lql h LEU 1254N -0.88 -1.36 -0.73 1.33 3.38 -0.93 0.14 115.31 116.26 1lql h LEU 1254Ca -0.03 0.15 0.16 0.00 0.09 0.00 0.00 57.88 58.24 1lql h LEU 1254Cb 0.81 0.51 -0.12 0.00 0.09 0.00 0.00 40.66 41.95 1lql h LEU 1254CO -0.13 -0.46 0.10 0.00 0.09 0.00 0.00 178.44 178.03 1lql h ALA 1255N -0.67 0.86 -0.21 1.53 0.00 0.14 0.35 119.26 121.26 1lql h ALA 1255Ca -0.00 0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.94 1lql h ALA 1255Cb 0.63 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1lql h ALA 1255CO -0.26 -0.38 -0.54 1.79 0.00 0.00 0.00 179.25 179.85 1lql h THR 1256N 0.19 1.31 -0.54 0.00 1.35 -0.12 -0.19 112.91 114.90 1lql h THR 1256Ca 0.40 -1.78 0.07 0.00 -0.55 0.00 0.00 66.41 64.55 1lql h THR 1256Cb 0.70 1.74 -0.06 0.00 -1.73 0.00 0.00 68.15 68.80 1lql h THR 1256CO -0.57 0.56 0.22 0.00 -0.25 0.00 0.00 175.52 175.49 1lql h ALA 1257N 0.93 0.69 -0.21 6.62 0.00 0.42 0.12 119.26 127.83 1lql h ALA 1257Ca 0.01 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1lql h ALA 1257Cb 1.10 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1lql h ALA 1257CO 0.11 -0.16 -0.21 -0.97 0.00 0.00 0.00 179.25 178.01 1lql h ASN 1258N 0.43 0.36 1.18 0.00 -0.73 -0.63 0.83 115.58 117.02 1lql h ASN 1258Ca 0.26 -0.10 -0.11 0.00 1.87 0.00 0.00 56.30 58.21 1lql h ASN 1258Cb 0.26 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.74 1lql h ASN 1258CO -0.24 0.58 -0.52 -0.07 -0.37 0.00 0.00 177.43 176.81 1lql h LEU 1259N 0.33 0.00 0.00 0.34 3.38 0.53 -3.29 115.31 116.61 1lql h LEU 1259Ca 0.06 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.80 1lql h LEU 1259Cb 0.56 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1lql h LEU 1259CO 0.04 0.52 -1.60 0.23 0.09 0.00 0.00 178.44 177.72 1lql n MET 1260N -3.36 0.63 -0.33 1.13 2.81 0.27 -4.49 117.12 113.77 1lql n MET 1260Ca 0.01 0.22 -0.05 0.00 -1.81 0.00 0.00 57.70 56.08 1lql n MET 1260Cb 0.68 -1.78 -0.02 0.00 -0.71 0.00 0.00 33.22 31.39 1lql n MET 1260CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1lql n ALA 1261N -2.47 -0.30 0.06 3.04 0.00 0.26 -2.01 120.51 119.09 1lql n ALA 1261Ca -0.14 0.77 -0.15 0.00 0.00 0.00 0.00 53.44 53.92 1lql n ALA 1261Cb 0.93 -0.26 -0.09 0.00 0.00 0.00 0.00 19.45 20.03 1lql n ALA 1261CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1lql h PRO 1262N 0.00 -0.64 -0.15 0.00 0.11 -1.79 -1.29 132.00 128.25 1lql h PRO 1262Ca 0.22 0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.42 1lql h PRO 1262Cb 0.43 0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 1lql h PRO 1262CO -0.80 -0.43 0.24 0.00 -0.21 0.00 0.00 178.00 176.80 1lql h ALA 1263N -0.35 1.64 -0.02 -0.75 0.00 -1.69 0.22 119.26 118.32 1lql h ALA 1263Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1lql h ALA 1263Cb 0.72 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1lql h ALA 1263CO -0.35 -0.31 -0.34 1.63 0.00 0.00 0.00 179.25 179.88 1lql n LYS 1264N -3.50 1.35 -1.73 0.00 4.76 -0.72 -4.96 118.16 113.36 1lql n LYS 1264Ca 0.01 -1.06 -0.11 0.00 -2.87 0.00 0.00 58.31 54.28 1lql n LYS 1264Cb 0.34 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 32.03 1lql n LYS 1264CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1lql n MET 1265N 0.10 -0.85 -3.38 1.97 2.81 0.06 -5.00 117.12 112.84 1lql n MET 1265Ca 0.11 0.75 -0.38 0.00 -1.81 0.00 0.00 57.70 56.37 1lql n MET 1265Cb 0.46 -4.80 -0.07 0.00 -0.71 0.00 0.00 33.22 28.10 1lql n MET 1265CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1lql s ILE 1266N -2.49 5.20 -0.14 2.02 1.09 -0.64 -5.02 121.20 121.22 1lql s ILE 1266Ca 0.00 0.75 -0.06 0.00 -1.10 0.00 0.00 60.65 60.24 1lql s ILE 1266Cb 0.00 -3.74 -0.04 0.00 -1.06 0.00 0.00 42.46 37.62 1lql s ILE 1266CO 0.00 0.27 0.09 0.42 -0.10 0.00 0.00 174.94 175.62 1lql s THR 1267N 1.15 5.07 -0.13 2.92 -4.23 -1.26 -4.38 115.64 114.78 1lql s THR 1267Ca 0.20 0.05 0.02 0.00 -1.18 0.00 0.00 61.69 60.79 1lql s THR 1267Cb -0.15 -3.23 0.01 0.00 1.34 0.00 0.00 72.50 70.48 1lql s THR 1267CO 0.08 0.55 -0.20 -0.63 -0.54 0.00 0.00 174.62 173.88 1lql s ILE 1268N -0.48 1.91 -0.21 2.99 1.01 -1.26 -4.29 121.20 120.87 1lql s ILE 1268Ca 0.11 -0.89 0.08 0.00 0.00 0.00 0.00 60.65 59.95 1lql s ILE 1268Cb -0.12 -1.70 -0.21 0.00 0.01 0.00 0.00 42.46 40.44 1lql s ILE 1268CO 0.02 0.52 0.01 0.59 0.00 0.00 0.00 174.94 176.08 1lql n ASN 1269N 4.10 1.14 -3.88 3.58 4.13 0.55 -4.98 115.26 119.91 1lql n ASN 1269Ca -0.20 -0.01 -0.11 0.00 1.68 0.00 0.00 54.58 55.94 1lql n ASN 1269Cb 0.51 0.12 -0.10 0.00 -1.54 0.00 0.00 39.78 38.78 1lql n ASN 1269CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1lql s LYS 1270N -2.52 0.52 -0.30 3.52 -0.14 -1.20 -4.98 119.74 114.65 1lql s LYS 1270Ca -0.22 -0.47 -0.10 0.00 -1.36 0.00 0.00 55.97 53.82 1lql s LYS 1270Cb 0.08 0.22 0.14 0.00 -1.68 0.00 0.00 37.83 36.58 1lql s LYS 1270CO 0.72 -0.13 0.70 -1.17 -0.76 0.00 0.00 175.35 174.71 1lql s LEU 1271N -1.56 -1.08 0.08 3.17 0.20 -1.26 -1.31 118.68 116.92 1lql s LEU 1271Ca -0.13 1.42 -0.04 0.00 0.69 0.00 0.00 54.13 56.07 1lql s LEU 1271Cb -0.06 2.21 -0.02 0.00 -0.43 0.00 0.00 46.19 47.88 1lql s LEU 1271CO 0.00 -0.21 0.08 -1.48 -0.29 0.00 0.00 176.35 174.46 1lql s LEU 1272N 2.84 1.93 -0.03 -0.68 0.05 -1.02 -5.02 118.68 116.75 1lql s LEU 1272Ca -0.04 -0.88 -0.01 0.00 0.05 0.00 0.00 54.13 53.25 1lql s LEU 1272Cb -0.11 0.58 0.03 0.00 -2.05 0.00 0.00 46.19 44.64 1lql s LEU 1272CO -0.19 -0.68 0.05 -0.32 -0.55 0.00 0.00 176.35 174.66 1lql s MET 1273N -3.91 -0.04 -0.16 1.48 1.75 -1.26 -1.47 119.30 115.70 1lql s MET 1273Ca 0.08 0.25 -0.08 0.00 -1.25 0.00 0.00 55.69 54.69 1lql s MET 1273Cb 0.06 -0.30 -0.04 0.00 2.84 0.00 0.00 34.83 37.40 1lql s MET 1273CO -0.09 -0.20 0.12 1.21 -0.65 0.00 0.00 175.02 175.41 1lql s ASN 1274N 1.33 6.14 -0.08 1.11 3.84 -0.46 -4.93 114.94 121.88 1lql s ASN 1274Ca -0.06 0.30 0.02 0.00 0.21 0.00 0.00 52.86 53.33 1lql s ASN 1274Cb -0.13 -2.02 0.02 0.00 -0.55 0.00 0.00 41.25 38.57 1lql s ASN 1274CO -0.03 0.29 -0.11 -0.69 -2.79 0.00 0.00 177.10 173.77 1lql s VAL 1275N -0.30 1.09 0.25 -5.21 1.01 -1.26 -0.51 120.40 115.46 1lql s VAL 1275Ca 0.11 -0.42 0.10 0.00 0.00 0.00 0.00 61.98 61.77 1lql s VAL 1275Cb -0.12 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 1lql s VAL 1275CO 0.01 0.35 -0.18 0.42 0.00 0.00 0.00 175.10 175.71 1lql s THR 1276N 0.95 2.19 0.01 3.92 -4.23 -0.56 -4.96 115.64 112.95 1lql s THR 1276Ca -0.09 -2.32 -0.29 0.00 -1.18 0.00 0.00 61.69 57.81 1lql s THR 1276Cb -0.15 -2.19 0.10 0.00 1.34 0.00 0.00 72.50 71.60 1lql s THR 1276CO 0.00 -0.47 0.94 -0.83 -0.54 0.00 0.00 174.62 173.72 1lql s GLY 1277N -3.41 -0.41 0.14 3.99 0.00 -1.26 0.84 107.32 107.22 1lql s GLY 1277Ca 0.27 0.89 -0.11 0.00 0.00 0.00 0.00 44.72 45.77 1lql s GLY 1277CO 0.12 0.28 0.30 -1.35 0.00 0.00 0.00 173.10 172.45 1lql s SER 1278N -2.56 -0.01 0.16 1.64 1.04 -0.94 -5.02 113.70 108.02 1lql s SER 1278Ca 0.07 -0.67 -0.13 0.00 0.48 0.00 0.00 55.95 55.70 1lql s SER 1278Cb -0.01 0.43 0.01 0.00 0.10 0.00 0.00 66.02 66.55 1lql s SER 1278CO -0.07 -0.85 0.38 0.00 0.98 0.00 0.00 173.24 173.69 1lql s ARG 1279N -3.90 1.20 0.01 4.02 1.70 -1.26 -2.06 118.95 118.66 1lql s ARG 1279Ca 0.10 -0.97 -0.17 0.00 -0.47 0.00 0.00 55.73 54.22 1lql s ARG 1279Cb 0.03 0.44 -0.06 0.00 -0.57 0.00 0.00 34.95 34.79 1lql s ARG 1279CO -0.06 -0.47 0.47 -1.12 -1.08 0.00 0.00 175.30 173.04 1lql s SER 1280N -2.90 6.87 0.01 -2.89 0.01 -1.26 -4.97 113.70 108.57 1lql s SER 1280Ca 0.11 1.04 0.13 0.00 1.31 0.00 0.00 55.95 58.54 1lql s SER 1280Cb 0.02 -2.29 -0.19 0.00 0.21 0.00 0.00 66.02 63.76 1lql s SER 1280CO -0.04 0.27 0.78 0.71 0.41 0.00 0.00 173.24 175.37 1lql h THR 1281N 3.79 0.82 -2.48 1.44 1.35 -1.94 -3.41 112.91 112.50 1lql h THR 1281Ca -0.50 -2.56 -0.59 0.00 -0.55 0.00 0.00 66.41 62.21 1lql h THR 1281Cb 1.21 2.35 -0.39 0.00 -1.73 0.00 0.00 68.15 69.59 1lql h THR 1281CO 0.64 0.47 -0.87 -3.20 -0.25 0.00 0.00 175.52 172.31 1lql n ASN 1282N -3.03 0.71 -4.83 5.36 5.15 -1.26 -5.08 115.26 112.28 1lql n ASN 1282Ca -0.13 -2.68 -0.33 0.00 -0.60 0.00 0.00 54.58 50.84 1lql n ASN 1282Cb 0.98 -0.62 -0.06 0.00 -0.53 0.00 0.00 39.78 39.55 1lql n ASN 1282CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1lql s PRO 1283N -0.64 4.10 0.02 1.20 0.04 -1.26 -5.00 135.00 133.46 1lql s PRO 1283Ca 0.32 0.93 0.15 0.00 0.04 0.00 0.00 61.00 62.43 1lql s PRO 1283Cb 0.04 -2.26 -0.17 0.00 0.04 0.00 0.00 34.50 32.15 1lql s PRO 1283CO -0.17 -0.01 0.78 1.15 0.04 0.00 0.00 177.00 178.79 1lql h THR 1284N 1.75 0.67 -0.15 1.26 2.02 -1.99 -3.34 112.91 113.13 1lql h THR 1284Ca -0.48 -2.32 -0.02 0.00 0.77 0.00 0.00 66.41 64.35 1lql h THR 1284Cb 1.18 2.22 -0.01 0.00 -1.74 0.00 0.00 68.15 69.80 1lql h THR 1284CO 0.62 0.38 0.01 0.44 0.37 0.00 0.00 175.52 177.35 1lql h ASP 1285N 0.00 0.25 0.00 4.18 3.32 -2.04 -3.46 116.42 118.68 1lql h ASP 1285Ca -0.21 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1lql h ASP 1285Cb 1.76 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.25 1lql h ASP 1285CO 0.06 0.48 0.00 0.61 -1.72 0.00 0.00 179.24 178.68 1lql n GLY 1286N -0.33 1.03 3.44 2.75 0.00 -1.25 -5.05 105.19 105.77 1lql n GLY 1286Ca -0.05 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.53 1lql n GLY 1286CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1lql s TYR 1287N -2.00 2.99 -0.76 1.61 5.04 -1.26 -4.87 117.35 118.10 1lql s TYR 1287Ca 0.00 -0.54 0.24 0.00 -2.44 0.00 0.00 57.07 54.33 1lql s TYR 1287Cb 0.00 -3.72 0.33 0.00 0.35 0.00 0.00 41.96 38.92 1lql s TYR 1287CO 0.00 -1.15 1.28 1.19 -1.34 0.00 0.00 175.55 175.54 1lql n PHE 1288N 6.43 0.29 -0.90 4.97 3.72 -1.26 -4.66 117.46 126.06 1lql n PHE 1288Ca -0.06 0.08 -0.29 0.00 -0.05 0.00 0.00 57.45 57.13 1lql n PHE 1288Cb 0.45 -0.46 0.23 0.00 -0.94 0.00 0.00 39.48 38.76 1lql n PHE 1288CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1lql s GLY 1289N -3.42 1.54 0.17 1.37 0.00 -1.26 -4.55 107.32 101.16 1lql s GLY 1289Ca 0.07 -0.61 -0.32 0.00 0.00 0.00 0.00 44.72 43.87 1lql s GLY 1289CO 0.73 0.19 1.67 1.08 0.00 0.00 0.00 173.10 176.77 1lql s LEU 1290N -7.00 4.37 -0.11 0.66 1.43 -1.26 -4.56 118.68 112.22 1lql s LEU 1290Ca 0.68 2.72 0.09 0.00 -1.03 0.00 0.00 54.13 56.60 1lql s LEU 1290Cb -0.16 -3.59 -0.24 0.00 0.03 0.00 0.00 46.19 42.24 1lql s LEU 1290CO 0.58 -0.91 0.41 0.54 0.23 0.00 0.00 176.35 177.20 1lql n ARG 1291N 4.37 0.67 -3.79 1.70 1.74 -0.87 -4.14 116.66 116.34 1lql n ARG 1291Ca 0.15 0.21 -0.13 0.00 -0.77 0.00 0.00 57.85 57.32 1lql n ARG 1291Cb 0.37 -1.70 -0.12 0.00 -1.02 0.00 0.00 32.46 30.00 1lql n ARG 1291CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1lql s GLU 1292N -2.56 0.27 -0.09 5.56 2.12 -1.24 0.06 118.70 122.81 1lql s GLU 1292Ca -0.12 0.33 -0.02 0.00 0.36 0.00 0.00 54.97 55.52 1lql s GLU 1292Cb 0.07 0.12 0.03 0.00 0.26 0.00 0.00 34.13 34.62 1lql s GLU 1292CO 0.80 -0.04 0.02 -1.50 -0.54 0.00 0.00 175.26 174.00 1lql s ILE 1293N 0.16 0.29 -0.43 -3.70 -1.16 0.03 -2.20 121.20 114.19 1lql s ILE 1293Ca -0.00 0.05 -0.14 0.00 -0.51 0.00 0.00 60.65 60.05 1lql s ILE 1293Cb -0.02 -0.55 0.05 0.00 0.61 0.00 0.00 42.46 42.55 1lql s ILE 1293CO 0.00 0.14 0.31 0.20 -2.81 0.00 0.00 174.94 172.78 1lql s ASN 1294N 2.00 5.99 -0.02 4.50 0.01 0.25 -1.42 114.94 126.25 1lql s ASN 1294Ca 0.04 -1.15 -0.21 0.00 -0.71 0.00 0.00 52.86 50.84 1lql s ASN 1294Cb -0.13 -2.12 -0.05 0.00 0.41 0.00 0.00 41.25 39.36 1lql s ASN 1294CO -0.06 -0.52 0.59 -0.76 -1.51 0.00 0.00 177.10 174.85 1lql s LEU 1295N 1.61 4.40 -0.19 0.60 1.43 0.40 -1.49 118.68 125.43 1lql s LEU 1295Ca 0.04 1.13 -0.01 0.00 -1.03 0.00 0.00 54.13 54.26 1lql s LEU 1295Cb -0.21 -2.92 0.05 0.00 0.03 0.00 0.00 46.19 43.14 1lql s LEU 1295CO 0.07 0.07 -0.02 -2.28 0.23 0.00 0.00 176.35 174.42 1lql s HIS 1296N -0.03 1.67 0.33 0.29 2.46 0.33 -2.59 115.29 117.75 1lql s HIS 1296Ca 0.31 -1.19 -0.14 0.00 0.47 0.00 0.00 55.06 54.51 1lql s HIS 1296Cb -0.18 -1.29 -0.09 0.00 -0.13 0.00 0.00 32.58 30.90 1lql s HIS 1296CO 0.17 -0.65 0.74 -1.58 -2.47 0.00 0.00 174.74 170.94 1lql s TRP 1297N 1.64 3.38 -0.35 3.88 0.52 -0.11 -1.36 118.94 126.54 1lql s TRP 1297Ca -0.02 1.20 -0.00 0.00 0.02 0.00 0.00 56.10 57.30 1lql s TRP 1297Cb -0.17 -2.52 0.14 0.00 -1.15 0.00 0.00 33.47 29.76 1lql s TRP 1297CO -0.07 0.08 0.20 -2.00 0.02 0.00 0.00 176.95 175.18 1lql s GLU 1298N -3.06 0.58 -0.13 4.98 2.12 -0.54 -1.20 118.70 121.45 1lql s GLU 1298Ca 0.54 -1.30 -0.06 0.00 0.36 0.00 0.00 54.97 54.51 1lql s GLU 1298Cb -0.10 -1.39 -0.04 0.00 0.26 0.00 0.00 34.13 32.86 1lql s GLU 1298CO 0.19 -1.18 0.08 0.42 -0.54 0.00 0.00 175.26 174.22 1lql s ILE 1299N 1.12 4.95 -0.55 -3.70 1.01 -0.62 -2.44 121.20 120.97 1lql s ILE 1299Ca 0.17 0.01 -0.08 0.00 0.00 0.00 0.00 60.65 60.75 1lql s ILE 1299Cb -0.22 -3.16 0.14 0.00 0.01 0.00 0.00 42.46 39.23 1lql s ILE 1299CO -0.03 0.57 0.42 -1.00 0.00 0.00 0.00 174.94 174.89 1lql s HIS 1300N -0.56 3.48 0.05 3.97 3.76 -0.43 0.86 115.29 126.42 1lql s HIS 1300Ca 0.11 -2.14 -0.04 0.00 -0.15 0.00 0.00 55.06 52.84 1lql s HIS 1300Cb -0.12 -3.45 -0.02 0.00 1.11 0.00 0.00 32.58 30.10 1lql s HIS 1300CO 0.02 -0.96 0.06 0.45 -0.85 0.00 0.00 174.74 173.46 1lql s SER 1301N 2.06 0.26 0.15 1.40 0.15 -0.83 -0.33 113.70 116.56 1lql s SER 1301Ca 0.10 -0.67 0.24 0.00 0.70 0.00 0.00 55.95 56.32 1lql s SER 1301Cb -0.22 0.22 0.37 0.00 -1.71 0.00 0.00 66.02 64.67 1lql s SER 1301CO -0.03 -0.54 1.36 1.55 1.20 0.00 0.00 173.24 176.78 1lql h PRO 1302N 3.52 0.00 -7.07 5.44 0.13 -1.83 -3.32 132.00 128.86 1lql h PRO 1302Ca -0.33 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.29 1lql h PRO 1302Cb 1.18 0.00 0.21 0.00 0.13 0.00 0.00 31.00 32.52 1lql h PRO 1302CO 0.54 0.00 -0.14 0.09 -0.23 0.00 0.00 178.00 178.26 1lql n ASN 1303N -2.21 -0.87 -4.86 1.44 3.02 -1.26 -4.99 115.26 105.53 1lql n ASN 1303Ca 0.03 0.26 -0.31 0.00 -0.03 0.00 0.00 54.58 54.53 1lql n ASN 1303Cb 0.45 -1.33 -0.03 0.00 -0.61 0.00 0.00 39.78 38.26 1lql n ASN 1303CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1lql s SER 1304N -2.37 6.54 0.15 6.41 1.04 -1.26 -4.85 113.70 119.37 1lql s SER 1304Ca 0.64 1.38 -0.24 0.00 0.48 0.00 0.00 55.95 58.20 1lql s SER 1304Cb -0.22 -2.43 0.03 0.00 0.10 0.00 0.00 66.02 63.49 1lql s SER 1304CO 0.62 -0.55 1.60 -0.33 0.98 0.00 0.00 173.24 175.56 1lql h GLU 1305N 0.89 -0.30 -0.54 4.02 5.08 -1.98 0.24 114.58 121.99 1lql h GLU 1305Ca -0.47 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.00 1lql h GLU 1305Cb 1.19 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 30.44 1lql h GLU 1305CO 0.62 -0.20 0.18 1.79 -1.00 0.00 0.00 179.01 180.40 1lql h THR 1306N -0.31 0.78 0.02 1.13 1.35 -1.98 0.87 112.91 114.77 1lql h THR 1306Ca 0.14 -0.12 0.03 0.00 -0.55 0.00 0.00 66.41 65.91 1lql h THR 1306Cb 0.55 0.41 -0.04 0.00 -1.73 0.00 0.00 68.15 67.34 1lql h THR 1306CO -0.48 0.06 -0.20 -0.33 -0.25 0.00 0.00 175.52 174.32 1lql h GLU 1307N 0.34 -0.32 -0.02 4.72 5.08 -1.45 -0.54 114.58 122.39 1lql h GLU 1307Ca 0.27 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.66 1lql h GLU 1307Cb 0.32 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1lql h GLU 1307CO -0.29 -0.21 -0.05 0.82 -1.00 0.00 0.00 179.01 178.28 1lql h ILE 1308N -0.33 0.87 -0.12 3.13 1.08 0.36 0.74 117.51 123.24 1lql h ILE 1308Ca 0.05 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 1lql h ILE 1308Cb 0.39 0.87 -0.06 0.00 -3.07 0.00 0.00 36.82 34.95 1lql h ILE 1308CO -0.17 0.00 -0.54 0.50 -0.69 0.00 0.00 178.15 177.25 1lql h LYS 1309N -0.08 -0.57 -0.88 2.37 3.11 0.10 0.20 116.57 120.82 1lql h LYS 1309Ca 0.03 0.04 0.11 0.00 -2.81 0.00 0.00 60.65 58.01 1lql h LYS 1309Cb 0.11 0.13 -0.07 0.00 -1.00 0.00 0.00 32.23 31.41 1lql h LYS 1309CO -0.06 -0.38 0.57 0.93 -2.81 0.00 0.00 179.45 177.70 1lql h GLU 1310N -0.59 0.80 0.21 1.90 5.08 -0.89 -1.48 114.58 119.61 1lql h GLU 1310Ca 0.03 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1lql h GLU 1310Cb 0.68 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1lql h GLU 1310CO -0.42 0.53 -0.15 0.35 -1.00 0.00 0.00 179.01 178.31 1lql h PHE 1311N 0.83 -0.40 -0.84 4.33 -0.00 0.16 -0.80 116.94 120.21 1lql h PHE 1311Ca 0.42 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.38 1lql h PHE 1311Cb 0.49 0.15 -0.04 0.00 -0.00 0.00 0.00 35.95 36.55 1lql h PHE 1311CO -0.00 -0.24 0.49 0.82 -0.00 0.00 0.00 178.31 179.38 1lql h ILE 1312N -0.37 1.24 -0.87 1.41 2.04 -0.18 0.14 117.51 120.92 1lql h ILE 1312Ca -0.01 -0.55 0.09 0.00 1.00 0.00 0.00 64.86 65.38 1lql h ILE 1312Cb 0.32 0.07 -0.07 0.00 -0.74 0.00 0.00 36.82 36.41 1lql h ILE 1312CO -0.00 0.26 0.52 0.44 0.00 0.00 0.00 178.15 179.37 1lql h ASP 1313N 1.17 0.78 -0.30 1.72 3.45 -0.99 0.48 116.42 122.73 1lql h ASP 1313Ca 0.30 0.04 -0.09 0.00 0.43 0.00 0.00 57.03 57.71 1lql h ASP 1313Cb -0.02 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 1lql h ASP 1313CO -0.05 0.46 -0.12 0.15 -1.57 0.00 0.00 179.24 178.11 1lql h PHE 1314N 0.90 0.79 0.29 4.55 3.04 -0.02 -2.36 116.94 124.13 1lql h PHE 1314Ca 0.41 -0.14 -0.01 0.00 3.98 0.00 0.00 57.97 62.20 1lql h PHE 1314Cb 0.31 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.62 1lql h PHE 1314CO -0.04 0.80 -0.14 0.28 -2.02 0.00 0.00 178.31 177.19 1lql h VAL 1315N 0.65 0.71 -0.97 1.41 2.07 0.11 -2.14 116.25 118.09 1lql h VAL 1315Ca 0.11 -0.65 0.18 0.00 0.82 0.00 0.00 66.70 67.16 1lql h VAL 1315Cb 0.57 1.03 -0.10 0.00 -1.52 0.00 0.00 31.29 31.28 1lql h VAL 1315CO 0.04 0.12 0.57 0.28 0.02 0.00 0.00 177.57 178.60 1lql h SER 1316N -0.76 0.73 0.46 0.57 0.02 -0.14 0.81 113.55 115.24 1lql h SER 1316Ca -0.04 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1lql h SER 1316Cb 0.50 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1lql h SER 1316CO 0.07 0.27 0.00 0.29 -1.14 0.00 0.00 176.83 176.31 1lql n LYS 1317N -4.79 0.40 -0.06 3.45 5.02 -0.89 -4.04 118.16 117.25 1lql n LYS 1317Ca 0.22 0.04 -0.10 0.00 -2.02 0.00 0.00 58.31 56.45 1lql n LYS 1317Cb 0.54 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 34.00 1lql n LYS 1317CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1lql n ARG 1318N -1.27 0.27 -1.69 1.97 3.00 0.25 -4.93 116.66 114.27 1lql n ARG 1318Ca 0.13 0.08 -0.44 0.00 -0.00 0.00 0.00 57.85 57.63 1lql n ARG 1318Cb 0.20 -1.10 -0.03 0.00 0.00 0.00 0.00 32.46 31.52 1lql n ARG 1318CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1lql h PRO 1320N 8.08 -0.14 -0.87 0.00 0.11 -1.91 -1.02 132.00 136.25 1lql h PRO 1320Ca -0.46 0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.72 1lql h PRO 1320Cb 1.23 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.31 1lql h PRO 1320CO 0.94 -0.09 0.54 0.00 -0.21 0.00 0.00 178.00 179.18 1lql h ALA 1321N 1.11 1.21 -0.55 -0.75 0.00 -1.93 0.26 119.26 118.61 1lql h ALA 1321Ca 0.23 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 1lql h ALA 1321Cb 0.51 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1lql h ALA 1321CO -0.61 0.28 -0.05 1.25 0.00 0.00 0.00 179.25 180.12 1lql h HIS 1322N 0.98 1.11 0.65 0.00 6.17 -1.68 -1.74 115.15 120.64 1lql h HIS 1322Ca 0.38 -0.21 -0.03 0.00 0.71 0.00 0.00 60.37 61.22 1lql h HIS 1322Cb 0.19 -0.28 -0.01 0.00 2.52 0.00 0.00 27.41 29.83 1lql h HIS 1322CO -0.03 1.02 -0.43 -0.91 0.71 0.00 0.00 177.93 178.29 1lql h ASN 1323N 0.89 -1.10 -0.92 3.26 4.21 -0.01 -0.56 115.58 121.34 1lql h ASN 1323Ca 0.15 0.07 0.15 0.00 1.21 0.00 0.00 56.30 57.87 1lql h ASN 1323Cb 0.61 0.33 -0.15 0.00 -1.12 0.00 0.00 38.32 37.99 1lql h ASN 1323CO 0.04 -0.64 -0.36 0.74 -1.29 0.00 0.00 177.43 175.92 1lql h THR 1324N -1.02 0.04 0.00 2.81 2.02 -0.37 0.30 112.91 116.70 1lql h THR 1324Ca -0.09 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1lql h THR 1324Cb 0.82 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1lql h THR 1324CO 0.07 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.14 1lql n LEU 1325N -5.48 0.15 -0.20 2.58 4.77 -0.67 -3.36 117.00 114.79 1lql n LEU 1325Ca 0.10 0.52 -0.09 0.00 -0.03 0.00 0.00 56.01 56.51 1lql n LEU 1325Cb 0.40 -0.49 0.02 0.00 -2.33 0.00 0.00 43.42 41.02 1lql n LEU 1325CO -0.10 -0.17 0.86 -0.61 -1.33 0.00 0.00 177.39 176.04 1lql h GLN 1326N 0.00 0.93 -0.02 3.23 -0.00 0.13 -2.93 115.11 116.45 1lql h GLN 1326Ca 0.00 -0.26 0.00 0.00 -0.00 0.00 0.00 58.65 58.39 1lql h GLN 1326Cb 0.42 -0.10 0.00 0.00 0.00 0.00 0.00 27.48 27.80 1lql h GLN 1326CO 0.00 0.91 0.00 0.41 0.00 0.00 0.00 178.83 180.15 1lql n GLY 1327N -0.51 -0.78 0.13 2.39 0.00 -1.21 -4.24 105.19 100.97 1lql n GLY 1327Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 1lql n GLY 1327CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1lql h VAL 1328N 0.00 0.00 0.00 1.61 2.07 -1.72 -3.47 116.25 114.74 1lql h VAL 1328Ca 0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1lql h VAL 1328Cb 0.01 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 1lql h VAL 1328CO 0.00 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 176.05 1lql n SER 1329N -3.29 0.00 0.00 0.57 3.41 -1.26 -4.63 113.62 108.42 1lql n SER 1329Ca -0.04 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.68 1lql n SER 1329Cb 0.13 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.03 1lql n SER 1329CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lql n GLN 1330N -0.15 0.07 -4.29 4.33 6.02 -1.26 -4.75 117.38 117.36 1lql n GLN 1330Ca 0.00 -0.01 -0.35 0.00 -0.01 0.00 0.00 57.00 56.62 1lql n GLN 1330Cb 0.00 -1.51 -0.09 0.00 1.02 0.00 0.00 30.24 29.66 1lql n GLN 1330CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1lql s LEU 1331N -3.19 3.71 -0.19 1.08 2.96 -1.25 -4.39 118.68 117.40 1lql s LEU 1331Ca 0.07 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.18 1lql s LEU 1331Cb 0.16 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 45.01 1lql s LEU 1331CO 0.84 0.38 -0.18 -0.75 -1.32 0.00 0.00 176.35 175.32 1lql s LYS 1332N -0.86 2.90 -0.44 1.98 2.20 0.11 -4.84 119.74 120.78 1lql s LYS 1332Ca 0.13 -0.90 -0.15 0.00 -0.36 0.00 0.00 55.97 54.69 1lql s LYS 1332Cb -0.11 -2.64 0.05 0.00 -1.51 0.00 0.00 37.83 33.61 1lql s LYS 1332CO 0.02 -0.26 0.35 0.42 -0.36 0.00 0.00 175.35 175.52 1lql s ILE 1333N 1.27 5.23 -0.43 5.43 1.01 -1.26 -0.79 121.20 131.66 1lql s ILE 1333Ca 0.03 -0.89 -0.18 0.00 0.00 0.00 0.00 60.65 59.61 1lql s ILE 1333Cb -0.14 -4.03 0.02 0.00 0.01 0.00 0.00 42.46 38.32 1lql s ILE 1333CO -0.11 -0.46 0.50 0.20 0.00 0.00 0.00 174.94 175.07 1lql s ASN 1334N 2.18 6.23 -0.11 3.58 0.01 -0.51 -4.96 114.94 121.36 1lql s ASN 1334Ca 0.04 -0.61 -0.05 0.00 -0.71 0.00 0.00 52.86 51.53 1lql s ASN 1334Cb -0.22 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.15 1lql s ASN 1334CO 0.08 -0.65 0.07 -0.69 -1.51 0.00 0.00 177.10 174.40 1lql s VAL 1335N 2.33 4.92 -0.09 1.60 1.01 -1.26 -0.45 120.40 128.45 1lql s VAL 1335Ca 0.15 -0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 1lql s VAL 1335Cb -0.16 -3.12 0.07 0.00 0.00 0.00 0.00 36.38 33.17 1lql s VAL 1335CO 0.15 0.60 0.70 0.54 0.00 0.00 0.00 175.10 177.08 1lql s ASN 1336N -0.82 -0.67 0.09 3.32 4.22 -1.07 -5.00 114.94 115.01 1lql s ASN 1336Ca 0.13 0.84 0.07 0.00 -2.14 0.00 0.00 52.86 51.76 1lql s ASN 1336Cb -0.12 0.70 -0.03 0.00 1.28 0.00 0.00 41.25 43.08 1lql s ASN 1336CO 0.03 -0.53 -0.17 0.54 -2.04 0.00 0.00 177.10 174.92 1lql s VAL 1337N -0.90 1.41 -0.22 3.54 0.11 -1.26 -0.94 120.40 122.14 1lql s VAL 1337Ca -0.09 -1.42 -0.02 0.00 -2.93 0.00 0.00 61.98 57.52 1lql s VAL 1337Cb -0.01 -1.31 0.01 0.00 -1.53 0.00 0.00 36.38 33.54 1lql s VAL 1337CO 0.08 -0.14 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.75 1lql s THR 1338N -1.21 2.98 -0.17 5.04 2.01 -0.34 -4.94 115.64 119.01 1lql s THR 1338Ca 0.02 -0.76 -0.15 0.00 0.31 0.00 0.00 61.69 61.11 1lql s THR 1338Cb -0.10 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 1lql s THR 1338CO 0.03 0.36 0.36 -0.22 -0.69 0.00 0.00 174.62 174.46 1lql s LEU 1339N 1.39 4.21 -0.34 4.42 0.20 -1.26 -1.59 118.68 125.71 1lql s LEU 1339Ca 0.04 0.55 0.04 0.00 0.69 0.00 0.00 54.13 55.45 1lql s LEU 1339Cb -0.15 -2.47 0.10 0.00 -0.43 0.00 0.00 46.19 43.24 1lql s LEU 1339CO -0.05 0.02 0.05 -0.69 -0.29 0.00 0.00 176.35 175.38 1lql s VAL 1340N 0.82 2.24 -2.00 1.68 1.01 0.25 -4.97 120.40 119.43 1lql s VAL 1340Ca 0.19 -2.32 0.12 0.00 0.00 0.00 0.00 61.98 59.97 1lql s VAL 1340Cb -0.14 -2.66 0.35 0.00 0.00 0.00 0.00 36.38 33.93 1lql s VAL 1340CO 0.06 -0.60 1.17 1.41 0.00 0.00 0.00 175.10 177.14