#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iv3 s ILE 1203N 0.00 1.53 0.03 0.55 2.07 -1.26 -0.97 121.20 123.15 1iv3 s ILE 1203Ca 0.00 -1.63 0.01 0.00 -1.41 0.00 0.00 60.65 57.61 1iv3 s ILE 1203Cb 0.00 -1.53 -0.02 0.00 0.13 0.00 0.00 42.46 41.03 1iv3 s ILE 1203CO 0.00 -0.24 -0.05 -0.83 -1.91 0.00 0.00 174.94 171.92 1iv3 s GLY 1204N -2.20 0.35 -0.04 1.50 0.00 -0.46 -4.21 107.32 102.25 1iv3 s GLY 1204Ca 0.08 -0.70 0.02 0.00 0.00 0.00 0.00 44.72 44.12 1iv3 s GLY 1204CO 0.04 -0.76 -0.09 -0.47 0.00 0.00 0.00 173.10 171.81 1iv3 s TYR 1205N -1.63 1.09 0.02 1.90 5.04 -1.26 -0.71 117.35 121.80 1iv3 s TYR 1205Ca -0.12 -0.33 -0.01 0.00 -2.44 0.00 0.00 57.07 54.17 1iv3 s TYR 1205Cb -0.09 -0.81 -0.02 0.00 0.35 0.00 0.00 41.96 41.39 1iv3 s TYR 1205CO -0.01 -0.17 -0.01 0.20 -1.34 0.00 0.00 175.55 174.21 1iv3 s GLY 1206N 0.48 0.20 0.06 8.97 0.00 -0.33 -4.27 107.32 112.43 1iv3 s GLY 1206Ca -0.09 -0.50 0.01 0.00 0.00 0.00 0.00 44.72 44.15 1iv3 s GLY 1206CO 0.01 -0.57 -0.06 -0.54 0.00 0.00 0.00 173.10 171.94 1iv3 s GLU 1207N -1.33 0.61 0.08 2.90 2.02 -1.26 -0.96 118.70 120.77 1iv3 s GLU 1207Ca -0.15 -0.99 -0.23 0.00 0.02 0.00 0.00 54.97 53.62 1iv3 s GLU 1207Cb -0.09 -0.14 0.06 0.00 0.10 0.00 0.00 34.13 34.06 1iv3 s GLU 1207CO -0.01 -0.01 0.56 0.34 0.02 0.00 0.00 175.26 176.16 1iv3 s ASP 1208N -2.23 -0.49 -0.08 -0.19 2.15 -0.15 -4.50 116.67 111.18 1iv3 s ASP 1208Ca -0.01 0.13 -0.21 0.00 0.43 0.00 0.00 52.55 52.89 1iv3 s ASP 1208Cb -0.02 0.54 0.05 0.00 -0.30 0.00 0.00 42.92 43.18 1iv3 s ASP 1208CO -0.03 -0.81 0.48 -0.94 -0.17 0.00 0.00 175.17 173.70 1iv3 s SER 1209N -2.25 -0.44 0.03 -0.34 1.04 -1.26 0.11 113.70 110.59 1iv3 s SER 1209Ca -0.03 0.55 0.02 0.00 0.48 0.00 0.00 55.95 56.97 1iv3 s SER 1209Cb -0.00 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.69 1iv3 s SER 1209CO -0.05 -0.42 -0.06 -1.00 0.98 0.00 0.00 173.24 172.68 1iv3 s HIS 1210N -0.84 0.54 0.38 5.02 3.76 0.02 -4.96 115.29 119.21 1iv3 s HIS 1210Ca -0.09 -0.41 -0.27 0.00 -0.15 0.00 0.00 55.06 54.14 1iv3 s HIS 1210Cb -0.03 -0.33 -0.10 0.00 1.11 0.00 0.00 32.58 33.23 1iv3 s HIS 1210CO 0.05 -0.08 1.36 0.50 -0.85 0.00 0.00 174.74 175.72 1iv3 s ARG 1211N -1.23 4.09 -0.22 1.40 3.52 -1.26 0.20 118.95 125.45 1iv3 s ARG 1211Ca -0.08 2.31 -0.05 0.00 -0.13 0.00 0.00 55.73 57.77 1iv3 s ARG 1211Cb -0.08 -2.90 -0.02 0.00 -1.56 0.00 0.00 34.95 30.39 1iv3 s ARG 1211CO 0.00 -0.44 0.00 -0.51 -0.81 0.00 0.00 175.30 173.54 1iv3 s LEU 1212N -2.18 3.16 -0.08 -0.88 1.43 0.11 -0.25 118.68 119.99 1iv3 s LEU 1212Ca 0.54 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 53.39 1iv3 s LEU 1212Cb -0.41 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 1iv3 s LEU 1212CO 0.55 0.00 -0.15 -0.70 0.23 0.00 0.00 176.35 176.27 1iv3 s GLU 1213N 1.36 2.80 0.25 1.70 2.56 0.15 -4.83 118.70 122.69 1iv3 s GLU 1213Ca 0.04 -0.72 -0.29 0.00 0.00 0.00 0.00 54.97 54.00 1iv3 s GLU 1213Cb -0.15 -2.43 -0.15 0.00 2.00 0.00 0.00 34.13 33.41 1iv3 s GLU 1213CO 0.00 0.45 0.96 -1.91 -0.56 0.00 0.00 175.26 174.20 1iv3 n GLU 1214N 2.80 1.08 -2.13 4.30 4.07 -1.26 -1.23 120.64 128.28 1iv3 n GLU 1214Ca -0.18 0.38 -0.16 0.00 -0.06 0.00 0.00 57.16 57.15 1iv3 n GLU 1214Cb 0.52 -1.71 -0.02 0.00 -0.06 0.00 0.00 31.44 30.17 1iv3 n GLU 1214CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1iv3 n GLY 1215N 1.50 0.11 3.50 8.31 0.00 -0.55 -4.83 105.19 113.23 1iv3 n GLY 1215Ca 0.12 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 1iv3 n GLY 1215CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iv3 s ARG 1216N -4.49 1.79 0.25 1.61 1.81 -1.10 -4.93 118.95 113.89 1iv3 s ARG 1216Ca 0.00 -1.48 -0.30 0.00 -1.72 0.00 0.00 55.73 52.23 1iv3 s ARG 1216Cb 0.00 -1.96 -0.09 0.00 -0.45 0.00 0.00 34.95 32.45 1iv3 s ARG 1216CO 0.00 0.39 1.32 -2.14 -0.68 0.00 0.00 175.30 174.19 1iv3 s PRO 1217N -2.98 4.37 -0.25 3.54 0.02 -1.26 -1.88 135.00 136.56 1iv3 s PRO 1217Ca 0.25 2.13 -0.07 0.00 0.02 0.00 0.00 61.00 63.33 1iv3 s PRO 1217Cb -0.07 -3.15 -0.02 0.00 0.02 0.00 0.00 34.50 31.28 1iv3 s PRO 1217CO 0.13 -0.24 0.05 -1.17 -0.33 0.00 0.00 177.00 175.44 1iv3 s LEU 1218N -0.68 3.35 -0.16 -5.54 2.96 -1.26 -2.47 118.68 114.89 1iv3 s LEU 1218Ca 0.54 -0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.14 1iv3 s LEU 1218Cb -0.38 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.41 1iv3 s LEU 1218CO 0.43 -0.04 -0.06 -0.31 -1.32 0.00 0.00 176.35 175.05 1iv3 s TYR 1219N 1.58 2.96 -0.03 5.38 2.02 -1.26 -0.78 117.35 127.22 1iv3 s TYR 1219Ca 0.06 -0.47 0.00 0.00 -0.37 0.00 0.00 57.07 56.29 1iv3 s TYR 1219Cb -0.15 -1.95 0.03 0.00 -0.40 0.00 0.00 41.96 39.49 1iv3 s TYR 1219CO 0.02 -0.15 0.02 -0.51 -1.57 0.00 0.00 175.55 173.36 1iv3 s LEU 1220N 0.50 1.10 -1.96 -1.29 1.43 -0.41 -4.11 118.68 113.95 1iv3 s LEU 1220Ca -0.05 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1iv3 s LEU 1220Cb -0.15 -0.15 0.00 0.00 0.03 0.00 0.00 46.19 45.93 1iv3 s LEU 1220CO 0.03 -0.12 0.00 0.00 0.23 0.00 0.00 176.35 176.49 1iv3 n GLY 1222N -0.79 1.43 3.68 0.00 0.00 -1.26 -4.53 105.19 103.72 1iv3 n GLY 1222Ca -0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 1iv3 n GLY 1222CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iv3 s LEU 1223N 0.00 3.75 -0.19 0.99 1.43 -0.48 -5.07 118.68 119.11 1iv3 s LEU 1223Ca 0.00 0.15 -0.29 0.00 -1.03 0.00 0.00 54.13 52.96 1iv3 s LEU 1223Cb 0.00 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 1iv3 s LEU 1223CO 0.00 0.30 1.60 -0.22 0.23 0.00 0.00 176.35 178.26 1iv3 s LEU 1224N -0.40 3.99 -0.31 1.79 0.20 -1.26 -1.28 118.68 121.41 1iv3 s LEU 1224Ca 0.09 1.74 -0.13 0.00 0.69 0.00 0.00 54.13 56.52 1iv3 s LEU 1224Cb -0.12 -3.53 -0.03 0.00 -0.43 0.00 0.00 46.19 42.08 1iv3 s LEU 1224CO 0.02 -1.16 0.24 -0.63 -0.29 0.00 0.00 176.35 174.53 1iv3 s ILE 1225N 4.87 5.28 -0.21 6.68 -1.09 0.04 -5.00 121.20 131.76 1iv3 s ILE 1225Ca 0.70 0.00 -0.39 0.00 -2.23 0.00 0.00 60.65 58.74 1iv3 s ILE 1225Cb -0.26 -3.66 -0.15 0.00 -1.58 0.00 0.00 42.46 36.81 1iv3 s ILE 1225CO 0.28 0.09 1.72 -2.65 -1.23 0.00 0.00 174.94 173.15 1iv3 n PRO 1226N 5.13 1.30 -3.59 2.79 -0.02 -1.26 -4.37 135.00 134.98 1iv3 n PRO 1226Ca -0.13 0.48 -0.13 0.00 -2.02 0.00 0.00 63.50 61.70 1iv3 n PRO 1226Cb 0.51 -2.18 -0.06 0.00 -0.02 0.00 0.00 33.50 31.75 1iv3 n PRO 1226CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1iv3 s SER 1227N 3.29 -0.54 0.54 2.55 0.15 -1.26 -4.87 113.70 113.56 1iv3 s SER 1227Ca 0.96 0.81 0.35 0.00 0.70 0.00 0.00 55.95 58.77 1iv3 s SER 1227Cb -1.01 0.74 1.55 0.00 -1.71 0.00 0.00 66.02 65.60 1iv3 s SER 1227CO 0.62 -0.34 2.03 1.55 1.20 0.00 0.00 173.24 178.30 1iv3 h PRO 1228N 3.59 0.00 -4.46 5.44 0.13 -1.92 -3.45 132.00 131.34 1iv3 h PRO 1228Ca -0.25 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.66 1iv3 h PRO 1228Cb 1.16 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.11 1iv3 h PRO 1228CO 0.22 0.00 -0.71 0.14 -0.23 0.00 0.00 178.00 177.43 1iv3 s VAL 1229N -3.73 0.48 0.12 1.56 -7.23 -1.26 -1.49 120.40 108.85 1iv3 s VAL 1229Ca 0.00 -1.43 -0.00 0.00 -1.81 0.00 0.00 61.98 58.74 1iv3 s VAL 1229Cb 0.10 -1.02 -0.04 0.00 0.56 0.00 0.00 36.38 35.97 1iv3 s VAL 1229CO 0.49 -0.64 0.03 -0.83 -0.31 0.00 0.00 175.10 173.83 1iv3 s GLY 1230N -2.21 0.93 0.12 2.32 0.00 -0.37 -4.40 107.32 103.70 1iv3 s GLY 1230Ca -0.02 -1.44 -0.30 0.00 0.00 0.00 0.00 44.72 42.96 1iv3 s GLY 1230CO -0.03 -1.38 1.03 0.00 0.00 0.00 0.00 173.10 172.72 1iv3 s ALA 1231N -3.95 3.29 -0.29 3.20 0.00 -1.03 0.32 121.76 123.30 1iv3 s ALA 1231Ca 0.21 0.68 -0.24 0.00 0.00 0.00 0.00 51.96 52.61 1iv3 s ALA 1231Cb 0.07 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.87 1iv3 s ALA 1231CO -0.00 -0.15 0.81 -1.17 0.00 0.00 0.00 175.76 175.25 1iv3 s LEU 1232N 0.09 4.08 -0.18 0.00 2.96 0.65 -4.82 118.68 121.45 1iv3 s LEU 1232Ca 0.49 0.78 -0.35 0.00 -0.22 0.00 0.00 54.13 54.84 1iv3 s LEU 1232Cb -0.26 -3.12 0.14 0.00 0.50 0.00 0.00 46.19 43.45 1iv3 s LEU 1232CO 0.31 -0.59 1.26 0.00 -1.32 0.00 0.00 176.35 176.02 1iv3 s ALA 1233N 2.94 -2.14 0.05 5.97 0.00 -1.26 -4.36 121.76 122.96 1iv3 s ALA 1233Ca 0.33 1.50 -0.36 0.00 0.00 0.00 0.00 51.96 53.43 1iv3 s ALA 1233Cb -0.14 -0.08 -0.20 0.00 0.00 0.00 0.00 23.12 22.69 1iv3 s ALA 1233CO 0.11 -0.68 1.49 0.45 0.00 0.00 0.00 175.76 177.13 1iv3 h HIS 1234N 2.00 -1.19 -2.45 0.00 3.86 -2.03 -3.46 115.15 111.89 1iv3 h HIS 1234Ca -0.12 -0.03 -0.17 0.00 -1.16 0.00 0.00 60.37 58.89 1iv3 h HIS 1234Cb 1.16 0.40 0.08 0.00 1.06 0.00 0.00 27.41 30.11 1iv3 h HIS 1234CO 0.29 -0.74 0.09 -1.13 0.86 0.00 0.00 177.93 177.30 1iv3 n SER 1235N -5.60 -1.01 0.00 2.45 3.41 -1.26 -4.91 113.62 106.70 1iv3 n SER 1235Ca -0.16 -0.91 0.06 0.00 -0.26 0.00 0.00 58.87 57.60 1iv3 n SER 1235Cb 0.51 -0.43 0.37 0.00 -0.26 0.00 0.00 64.21 64.40 1iv3 n SER 1235CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1iv3 n ASP 1236N -3.67 0.00 -1.41 4.04 3.85 -1.26 -4.85 116.55 113.25 1iv3 n ASP 1236Ca 0.07 -0.32 -0.16 0.00 -0.71 0.00 0.00 54.79 53.67 1iv3 n ASP 1236Cb 0.25 -0.05 -0.04 0.00 -1.35 0.00 0.00 41.12 39.93 1iv3 n ASP 1236CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1iv3 n GLY 1237N -0.21 0.87 3.55 6.12 0.00 -1.26 -4.37 105.19 109.90 1iv3 n GLY 1237Ca 0.09 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1iv3 n GLY 1237CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iv3 s ASP 1238N -2.63 6.32 0.33 1.61 -1.08 -1.26 -4.79 116.67 115.17 1iv3 s ASP 1238Ca 0.00 -0.95 0.03 0.00 -0.52 0.00 0.00 52.55 51.11 1iv3 s ASP 1238Cb 0.00 -2.55 0.58 0.00 -1.46 0.00 0.00 42.92 39.49 1iv3 s ASP 1238CO 0.00 -1.65 1.88 0.00 0.52 0.00 0.00 175.17 175.92 1iv3 h ALA 1239N 9.87 1.37 0.36 3.66 0.00 -1.92 -1.47 119.26 131.12 1iv3 h ALA 1239Ca -0.07 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1iv3 h ALA 1239Cb 1.03 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1iv3 h ALA 1239CO 1.33 0.45 -0.17 0.00 0.00 0.00 0.00 179.25 180.85 1iv3 h ALA 1240N 1.49 -0.48 -0.78 0.00 0.00 -1.88 -0.73 119.26 116.88 1iv3 h ALA 1240Ca 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1iv3 h ALA 1240Cb 0.28 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1iv3 h ALA 1240CO 0.00 -0.74 0.45 0.52 0.00 0.00 0.00 179.25 179.48 1iv3 h MET 1241N -0.55 1.08 -0.46 0.00 2.86 -1.88 -1.62 114.93 114.36 1iv3 h MET 1241Ca -0.05 -0.11 -0.04 0.00 -2.06 0.00 0.00 59.70 57.44 1iv3 h MET 1241Cb 0.41 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1iv3 h MET 1241CO 0.08 0.78 0.15 0.45 1.06 0.00 0.00 176.91 179.43 1iv3 h HIS 1242N 1.08 0.74 -0.49 -0.22 3.86 -1.16 -0.10 115.15 118.86 1iv3 h HIS 1242Ca 0.28 -0.07 -0.01 0.00 -1.16 0.00 0.00 60.37 59.41 1iv3 h HIS 1242Cb -0.00 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.23 1iv3 h HIS 1242CO -0.00 0.65 0.26 0.00 0.86 0.00 0.00 177.93 179.70 1iv3 h ALA 1243N 1.00 0.63 -0.57 2.45 0.00 -0.88 -0.50 119.26 121.40 1iv3 h ALA 1243Ca 0.15 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1iv3 h ALA 1243Cb 0.25 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1iv3 h ALA 1243CO -0.01 0.15 0.14 -0.07 0.00 0.00 0.00 179.25 179.47 1iv3 h LEU 1244N 0.65 0.82 -0.05 0.00 3.38 -1.12 -0.85 115.31 118.14 1iv3 h LEU 1244Ca 0.17 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1iv3 h LEU 1244Cb 0.06 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1iv3 h LEU 1244CO -0.03 0.80 0.01 0.74 0.09 0.00 0.00 178.44 180.05 1iv3 h THR 1245N 0.84 1.22 -0.88 0.22 2.02 -0.43 -1.00 112.91 114.91 1iv3 h THR 1245Ca 0.18 -0.68 0.08 0.00 0.77 0.00 0.00 66.41 66.77 1iv3 h THR 1245Cb 0.30 1.59 -0.07 0.00 -1.74 0.00 0.00 68.15 68.23 1iv3 h THR 1245CO -0.00 0.18 0.54 0.44 0.37 0.00 0.00 175.52 177.05 1iv3 h ASP 1246N -0.18 0.82 -0.45 4.18 3.32 -1.01 -1.02 116.42 122.07 1iv3 h ASP 1246Ca 0.01 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.10 1iv3 h ASP 1246Cb 0.29 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1iv3 h ASP 1246CO 0.00 0.49 0.29 0.00 -1.72 0.00 0.00 179.24 178.30 1iv3 h ALA 1247N 1.45 0.58 -0.19 3.45 0.00 -0.85 0.32 119.26 124.01 1iv3 h ALA 1247Ca 0.41 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 1iv3 h ALA 1247Cb 0.28 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1iv3 h ALA 1247CO -0.21 0.00 0.11 -0.07 0.00 0.00 0.00 179.25 179.08 1iv3 h LEU 1248N 0.59 0.24 -0.68 0.00 3.38 -0.66 -2.01 115.31 116.17 1iv3 h LEU 1248Ca 0.17 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1iv3 h LEU 1248Cb -0.04 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 1iv3 h LEU 1248CO -0.05 0.25 0.41 -0.07 0.09 0.00 0.00 178.44 179.07 1iv3 h LEU 1249N 0.21 0.65 -1.62 1.67 3.38 -0.90 -2.42 115.31 116.28 1iv3 h LEU 1249Ca 0.07 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1iv3 h LEU 1249Cb 0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1iv3 h LEU 1249CO -0.01 0.44 -0.02 -1.28 0.09 0.00 0.00 178.44 177.66 1iv3 h SER 1250N 0.78 0.19 0.24 -0.43 0.87 -0.17 -1.38 113.55 113.65 1iv3 h SER 1250Ca 0.28 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1iv3 h SER 1250Cb 0.07 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1iv3 h SER 1250CO -0.13 0.26 0.00 0.00 -0.53 0.00 0.00 176.83 176.43 1iv3 h ALA 1251N 1.77 1.00 0.00 6.23 0.00 -0.84 -1.79 119.26 125.64 1iv3 h ALA 1251Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1iv3 h ALA 1251Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1iv3 h ALA 1251CO 0.01 0.00 -0.01 0.66 0.00 0.00 0.00 179.25 179.91 1iv3 n TYR 1252N -2.98 0.00 -2.43 0.00 4.02 -0.72 -4.75 117.16 110.29 1iv3 n TYR 1252Ca -0.02 -0.67 -0.20 0.00 -0.01 0.00 0.00 57.90 57.00 1iv3 n TYR 1252Cb 0.12 -0.09 -0.01 0.00 -0.02 0.00 0.00 39.34 39.35 1iv3 n TYR 1252CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1iv3 n GLY 1253N -0.84 -0.50 0.04 2.72 0.00 -0.67 -4.89 105.19 101.05 1iv3 n GLY 1253Ca 0.06 0.01 0.15 0.00 0.00 0.00 0.00 46.02 46.23 1iv3 n GLY 1253CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iv3 n LEU 1254N -3.04 0.16 0.00 0.99 4.77 -0.60 -5.00 117.00 114.27 1iv3 n LEU 1254Ca -0.23 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1iv3 n LEU 1254Cb 0.68 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1iv3 n LEU 1254CO 0.29 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1iv3 n GLY 1255N 1.26 0.09 3.62 -0.72 0.00 -1.26 -4.94 105.19 103.24 1iv3 n GLY 1255Ca 0.15 -1.80 -0.11 0.00 0.00 0.00 0.00 46.02 44.26 1iv3 n GLY 1255CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1iv3 s ASP 1256N -4.00 0.28 0.46 1.61 1.47 -1.26 -4.26 116.67 110.96 1iv3 s ASP 1256Ca 0.00 -1.16 0.21 0.00 1.18 0.00 0.00 52.55 52.78 1iv3 s ASP 1256Cb 0.00 0.68 1.11 0.00 -0.34 0.00 0.00 42.92 44.37 1iv3 s ASP 1256CO 0.00 -1.34 1.96 0.16 0.68 0.00 0.00 175.17 176.63 1iv3 h ILE 1257N 2.13 0.84 -0.33 2.11 3.07 -1.93 -0.42 117.51 122.98 1iv3 h ILE 1257Ca -0.28 -0.85 -0.13 0.00 1.55 0.00 0.00 64.86 65.15 1iv3 h ILE 1257Cb 1.25 1.50 -0.01 0.00 -0.27 0.00 0.00 36.82 39.29 1iv3 h ILE 1257CO 0.37 0.21 -0.31 1.23 -1.05 0.00 0.00 178.15 178.60 1iv3 h GLY 1258N 1.06 0.78 0.41 0.16 0.00 -1.96 0.56 103.07 104.08 1iv3 h GLY 1258Ca -0.00 -0.73 -0.00 0.00 0.00 0.00 0.00 47.33 46.60 1iv3 h GLY 1258CO 0.03 0.66 -0.01 -2.00 0.00 0.00 0.00 176.54 175.22 1iv3 h LEU 1259N 0.61 -0.02 0.00 3.11 5.85 -1.80 -3.37 115.31 119.69 1iv3 h LEU 1259Ca 0.07 -0.56 -0.06 0.00 0.84 0.00 0.00 57.88 58.17 1iv3 h LEU 1259Cb 0.83 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1iv3 h LEU 1259CO 0.07 0.56 -0.78 -0.07 -0.34 0.00 0.00 178.44 177.88 1iv3 h LEU 1260N -0.61 0.00 -5.43 2.25 3.38 -1.07 -3.39 115.31 110.44 1iv3 h LEU 1260Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 1iv3 h LEU 1260Cb 0.58 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.92 1iv3 h LEU 1260CO 0.00 0.22 -0.86 0.49 0.09 0.00 0.00 178.44 178.39 1iv3 n PHE 1261N -2.92 2.61 -2.62 1.13 3.72 0.18 -5.06 117.46 114.50 1iv3 n PHE 1261Ca -0.01 -3.80 -0.33 0.00 -0.05 0.00 0.00 57.45 53.26 1iv3 n PHE 1261Cb 0.64 -0.42 -0.05 0.00 -0.94 0.00 0.00 39.48 38.71 1iv3 n PHE 1261CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1iv3 s PRO 1262N -3.13 3.97 0.00 -1.08 0.04 -1.26 -4.84 135.00 128.70 1iv3 s PRO 1262Ca 0.45 1.21 0.17 0.00 0.04 0.00 0.00 61.00 62.87 1iv3 s PRO 1262Cb 0.32 -2.13 0.83 0.00 0.04 0.00 0.00 34.50 33.56 1iv3 s PRO 1262CO -0.12 -0.27 1.52 -0.40 0.04 0.00 0.00 177.00 177.78 1iv3 n ASP 1263N -0.95 0.00 0.27 6.66 5.68 -1.26 -1.05 116.55 125.90 1iv3 n ASP 1263Ca 0.08 0.18 0.17 0.00 -0.50 0.00 0.00 54.79 54.72 1iv3 n ASP 1263Cb 0.53 -0.35 0.62 0.00 -1.14 0.00 0.00 41.12 40.78 1iv3 n ASP 1263CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1iv3 h THR 1264N 0.00 0.00 -3.70 2.12 1.35 -1.99 -3.43 112.91 107.27 1iv3 h THR 1264Ca 0.00 -0.57 -0.62 0.00 -0.55 0.00 0.00 66.41 64.67 1iv3 h THR 1264Cb 0.20 1.57 -0.15 0.00 -1.73 0.00 0.00 68.15 68.05 1iv3 h THR 1264CO 0.00 0.00 -0.34 -0.62 -0.25 0.00 0.00 175.52 174.31 1iv3 s ASP 1265N -5.75 6.21 0.61 5.36 -1.08 -0.21 -4.94 116.67 116.86 1iv3 s ASP 1265Ca 0.02 0.23 0.33 0.00 -0.52 0.00 0.00 52.55 52.60 1iv3 s ASP 1265Cb 0.08 -2.17 1.92 0.00 -1.46 0.00 0.00 42.92 41.29 1iv3 s ASP 1265CO 0.56 -0.09 2.25 1.55 0.52 0.00 0.00 175.17 179.96 1iv3 h PRO 1266N 7.96 0.00 -0.78 4.34 0.13 -1.87 -0.93 132.00 140.85 1iv3 h PRO 1266Ca -0.34 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.84 1iv3 h PRO 1266Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 1iv3 h PRO 1266CO 0.64 0.00 0.51 -0.09 -0.23 0.00 0.00 178.00 178.83 1iv3 h ARG 1267N 0.00 0.88 0.00 0.86 2.43 -1.93 -3.32 114.38 113.30 1iv3 h ARG 1267Ca 0.01 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 58.97 1iv3 h ARG 1267Cb 0.09 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1iv3 h ARG 1267CO -0.00 0.58 -1.74 0.91 -1.51 0.00 0.00 179.97 178.21 1iv3 n TRP 1268N -4.47 0.00 -1.76 2.20 5.03 -0.65 -4.82 117.44 112.98 1iv3 n TRP 1268Ca 0.11 0.00 -0.42 0.00 3.03 0.00 0.00 57.50 60.22 1iv3 n TRP 1268Cb 0.16 -0.50 -0.03 0.00 -1.03 0.00 0.00 31.31 29.91 1iv3 n TRP 1268CO 0.00 0.00 0.00 0.50 -0.03 0.00 0.00 177.69 178.16 1iv3 s ARG 1269N -2.43 4.14 0.00 -0.99 3.52 -0.45 -1.36 118.95 121.38 1iv3 s ARG 1269Ca -0.05 2.57 0.00 0.00 -0.13 0.00 0.00 55.73 58.12 1iv3 s ARG 1269Cb 0.05 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 30.27 1iv3 s ARG 1269CO 0.49 -0.75 0.00 0.41 -0.81 0.00 0.00 175.30 174.64 1iv3 n GLY 1270N 3.99 2.01 3.78 8.12 0.00 -1.26 -4.97 105.19 116.86 1iv3 n GLY 1270Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1iv3 n GLY 1270CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iv3 s GLU 1271N -0.20 4.34 0.63 1.61 0.41 -0.47 -5.03 118.70 120.00 1iv3 s GLU 1271Ca 0.00 1.51 -0.16 0.00 -0.41 0.00 0.00 54.97 55.91 1iv3 s GLU 1271Cb 0.00 -2.71 -0.01 0.00 -1.78 0.00 0.00 34.13 29.63 1iv3 s GLU 1271CO 0.00 0.02 1.11 1.03 -0.49 0.00 0.00 175.26 176.93 1iv3 s ARG 1272N -2.22 2.94 0.57 1.61 1.81 -1.26 -4.73 118.95 117.67 1iv3 s ARG 1272Ca 0.54 1.41 0.27 0.00 -1.72 0.00 0.00 55.73 56.22 1iv3 s ARG 1272Cb -0.23 -1.97 1.69 0.00 -0.45 0.00 0.00 34.95 34.00 1iv3 s ARG 1272CO 0.29 -1.14 2.23 0.77 -0.68 0.00 0.00 175.30 176.77 1iv3 h SER 1273N 0.27 0.00 0.19 0.23 0.02 -1.96 -0.09 113.55 112.21 1iv3 h SER 1273Ca -0.47 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.46 1iv3 h SER 1273Cb 1.25 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.78 1iv3 h SER 1273CO 0.55 0.00 -0.08 1.05 -1.14 0.00 0.00 176.83 177.21 1iv3 h GLU 1274N 0.00 0.00 -0.60 3.45 4.11 -1.96 -0.94 114.58 118.63 1iv3 h GLU 1274Ca -0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 1iv3 h GLU 1274Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1iv3 h GLU 1274CO 0.00 0.08 0.25 0.28 0.07 0.00 0.00 179.01 179.70 1iv3 h VAL 1275N 0.00 1.23 -0.39 -1.06 2.07 -1.35 -0.76 116.25 115.98 1iv3 h VAL 1275Ca -0.00 -0.69 -0.14 0.00 0.82 0.00 0.00 66.70 66.69 1iv3 h VAL 1275Cb 0.20 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1iv3 h VAL 1275CO 0.01 0.27 -0.30 -0.26 0.02 0.00 0.00 177.57 177.31 1iv3 h PHE 1276N 0.83 1.00 -0.50 1.57 0.04 -1.32 -2.25 116.94 116.33 1iv3 h PHE 1276Ca 0.20 -0.27 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1iv3 h PHE 1276Cb 0.18 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.08 1iv3 h PHE 1276CO 0.01 1.05 0.32 1.25 -0.60 0.00 0.00 178.31 180.34 1iv3 h LEU 1277N 0.73 0.58 -1.18 1.54 5.85 -1.25 0.10 115.31 121.67 1iv3 h LEU 1277Ca 0.08 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 1iv3 h LEU 1277Cb 0.86 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1iv3 h LEU 1277CO 0.08 0.44 -0.31 0.03 -0.34 0.00 0.00 178.44 178.34 1iv3 h ARG 1278N 0.67 0.17 -0.28 1.25 2.47 -1.01 0.47 114.38 118.12 1iv3 h ARG 1278Ca 0.18 -0.06 -0.18 0.00 -1.26 0.00 0.00 59.98 58.66 1iv3 h ARG 1278Cb -0.05 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.25 1iv3 h ARG 1278CO -0.04 0.47 -0.54 1.49 0.56 0.00 0.00 179.97 181.91 1iv3 h GLU 1279N 0.15 0.83 -0.61 0.04 4.57 -0.96 0.11 114.58 118.72 1iv3 h GLU 1279Ca 0.02 -0.52 0.05 0.00 -1.18 0.00 0.00 59.36 57.72 1iv3 h GLU 1279Cb 0.62 0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.23 1iv3 h GLU 1279CO 0.05 1.16 0.35 0.00 -1.18 0.00 0.00 179.01 179.38 1iv3 h ALA 1280N 0.74 0.80 -0.74 2.92 0.00 -0.13 0.42 119.26 123.26 1iv3 h ALA 1280Ca 0.02 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1iv3 h ALA 1280Cb 1.14 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1iv3 h ALA 1280CO 0.12 0.04 0.48 0.52 0.00 0.00 0.00 179.25 180.41 1iv3 h MET 1281N 0.66 0.92 -0.35 0.00 2.86 -0.67 -1.32 114.93 117.03 1iv3 h MET 1281Ca 0.26 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1iv3 h MET 1281Cb 0.12 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 1iv3 h MET 1281CO -0.15 0.61 0.21 -0.09 1.06 0.00 0.00 176.91 178.55 1iv3 h ARG 1282N 0.95 0.47 -0.72 1.72 2.43 -0.25 -0.03 114.38 118.96 1iv3 h ARG 1282Ca 0.29 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.36 1iv3 h ARG 1282Cb -0.03 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 1iv3 h ARG 1282CO -0.09 0.36 0.23 -0.07 -1.51 0.00 0.00 179.97 178.89 1iv3 h LEU 1283N 0.45 1.04 -0.19 3.80 3.38 -0.50 -0.89 115.31 122.41 1iv3 h LEU 1283Ca 0.13 -0.21 -0.22 0.00 0.09 0.00 0.00 57.88 57.67 1iv3 h LEU 1283Cb 0.01 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 1iv3 h LEU 1283CO -0.02 0.97 -0.94 -0.37 0.09 0.00 0.00 178.44 178.17 1iv3 h VAL 1284N 1.06 1.43 -0.87 1.22 -1.51 -1.09 -3.02 116.25 113.47 1iv3 h VAL 1284Ca 0.23 -2.53 0.05 0.00 -1.23 0.00 0.00 66.70 63.22 1iv3 h VAL 1284Cb 0.30 2.46 -0.06 0.00 -2.13 0.00 0.00 31.29 31.87 1iv3 h VAL 1284CO -0.01 0.75 0.55 -0.33 -1.23 0.00 0.00 177.57 177.30 1iv3 h GLU 1285N 0.19 1.01 0.00 5.19 5.08 -0.82 -0.66 114.58 124.58 1iv3 h GLU 1285Ca -0.07 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1iv3 h GLU 1285Cb 1.58 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1iv3 h GLU 1285CO 0.16 0.67 0.00 0.00 -1.00 0.00 0.00 179.01 178.84 1iv3 h ALA 1286N 1.38 1.00 -0.60 3.43 0.00 -1.04 0.52 119.26 123.94 1iv3 h ALA 1286Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1iv3 h ALA 1286Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1iv3 h ALA 1286CO -0.14 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.65 1iv3 n ARG 1287N -2.74 3.53 -0.26 0.00 1.74 -0.39 -4.92 116.66 113.63 1iv3 n ARG 1287Ca -0.01 -2.63 0.00 0.00 -0.77 0.00 0.00 57.85 54.44 1iv3 n ARG 1287Cb 0.17 -1.85 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 1iv3 n ARG 1287CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iv3 n GLY 1288N 1.08 0.70 3.77 -0.13 0.00 0.17 -5.05 105.19 105.73 1iv3 n GLY 1288Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1iv3 n GLY 1288CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iv3 s ALA 1289N -2.58 3.50 -0.37 4.61 0.00 -0.43 -4.97 121.76 121.53 1iv3 s ALA 1289Ca 0.00 1.25 0.02 0.00 0.00 0.00 0.00 51.96 53.23 1iv3 s ALA 1289Cb 0.00 -3.48 0.10 0.00 0.00 0.00 0.00 23.12 19.75 1iv3 s ALA 1289CO 0.00 -0.63 0.10 0.15 0.00 0.00 0.00 175.76 175.38 1iv3 s LYS 1290N -1.71 1.64 0.26 0.00 3.01 -1.26 -4.36 119.74 117.31 1iv3 s LYS 1290Ca 0.49 -1.90 -0.31 0.00 -1.01 0.00 0.00 55.97 53.25 1iv3 s LYS 1290Cb -0.40 -3.31 -0.12 0.00 -1.01 0.00 0.00 37.83 32.99 1iv3 s LYS 1290CO 0.52 -0.98 1.65 -0.11 0.51 0.00 0.00 175.35 176.94 1iv3 n LEU 1291N 4.29 4.24 -0.05 3.17 7.94 -1.26 0.05 117.00 135.38 1iv3 n LEU 1291Ca 0.02 1.11 -0.08 0.00 -1.11 0.00 0.00 56.01 55.95 1iv3 n LEU 1291Cb 0.41 -1.59 -0.05 0.00 0.53 0.00 0.00 43.42 42.73 1iv3 n LEU 1291CO 0.25 0.17 -0.86 -0.11 -1.11 0.00 0.00 177.39 175.73 1iv3 n LEU 1292N 2.85 2.56 -3.54 -1.96 7.94 0.19 -4.83 117.00 120.21 1iv3 n LEU 1292Ca 0.11 -0.02 -0.16 0.00 -1.11 0.00 0.00 56.01 54.83 1iv3 n LEU 1292Cb 0.36 -0.37 -0.06 0.00 0.53 0.00 0.00 43.42 43.88 1iv3 n LEU 1292CO 0.64 0.60 0.38 -1.58 -1.11 0.00 0.00 177.39 176.31 1iv3 s GLN 1293N -2.22 1.05 -0.05 1.96 0.74 -0.77 -4.88 119.66 115.49 1iv3 s GLN 1293Ca -0.15 0.08 0.00 0.00 0.05 0.00 0.00 55.36 55.34 1iv3 s GLN 1293Cb 0.04 0.49 0.02 0.00 1.10 0.00 0.00 33.01 34.66 1iv3 s GLN 1293CO 0.24 -0.35 -0.03 0.00 -0.55 0.00 0.00 175.29 174.60 1iv3 s ALA 1294N -1.64 0.70 -0.12 1.58 0.00 -0.67 -1.58 121.76 120.03 1iv3 s ALA 1294Ca -0.09 -0.09 0.01 0.00 0.00 0.00 0.00 51.96 51.79 1iv3 s ALA 1294Cb -0.01 -0.54 0.02 0.00 0.00 0.00 0.00 23.12 22.59 1iv3 s ALA 1294CO 0.06 -0.17 -0.14 0.45 0.00 0.00 0.00 175.76 175.96 1iv3 s SER 1295N 1.28 2.49 0.10 0.00 0.15 -0.35 -0.76 113.70 116.61 1iv3 s SER 1295Ca -0.05 -0.43 -0.06 0.00 0.70 0.00 0.00 55.95 56.11 1iv3 s SER 1295Cb -0.14 -1.08 -0.02 0.00 -1.71 0.00 0.00 66.02 63.07 1iv3 s SER 1295CO -0.02 -0.03 0.14 -1.48 1.20 0.00 0.00 173.24 173.04 1iv3 s LEU 1296N 1.30 1.62 -0.10 3.45 2.34 0.29 -1.03 118.68 126.54 1iv3 s LEU 1296Ca -0.00 -0.87 0.02 0.00 0.06 0.00 0.00 54.13 53.34 1iv3 s LEU 1296Cb -0.14 0.76 0.01 0.00 -0.56 0.00 0.00 46.19 46.26 1iv3 s LEU 1296CO -0.06 -0.74 -0.17 -0.69 -1.06 0.00 0.00 176.35 173.63 1iv3 s VAL 1297N -3.93 1.62 -0.18 1.48 1.01 -0.25 -1.30 120.40 118.86 1iv3 s VAL 1297Ca 0.11 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 1iv3 s VAL 1297Cb 0.06 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 1iv3 s VAL 1297CO -0.06 0.46 -0.03 -0.76 0.00 0.00 0.00 175.10 174.71 1iv3 s LEU 1298N 0.75 3.18 -0.15 3.92 1.43 -0.61 -1.98 118.68 125.24 1iv3 s LEU 1298Ca -0.11 -0.19 0.02 0.00 -1.03 0.00 0.00 54.13 52.82 1iv3 s LEU 1298Cb -0.16 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.29 1iv3 s LEU 1298CO 0.02 0.11 -0.21 -0.89 0.23 0.00 0.00 176.35 175.61 1iv3 s THR 1299N 0.70 2.04 -0.22 5.49 2.01 -0.19 -0.91 115.64 124.57 1iv3 s THR 1299Ca -0.02 -0.96 -0.28 0.00 0.31 0.00 0.00 61.69 60.75 1iv3 s THR 1299Cb -0.14 -1.81 0.13 0.00 0.01 0.00 0.00 72.50 70.68 1iv3 s THR 1299CO 0.02 0.55 1.04 -1.48 -0.69 0.00 0.00 174.62 174.06 1iv3 s LEU 1300N 0.91 -0.38 0.21 4.42 2.34 -0.25 -1.10 118.68 124.83 1iv3 s LEU 1300Ca -0.05 0.58 0.14 0.00 0.06 0.00 0.00 54.13 54.86 1iv3 s LEU 1300Cb -0.15 1.82 -0.02 0.00 -0.56 0.00 0.00 46.19 47.28 1iv3 s LEU 1300CO -0.04 -0.24 1.31 0.44 -1.06 0.00 0.00 176.35 176.76 1iv3 h ASP 1301N 3.29 0.00 -4.80 1.48 5.19 -1.83 -3.36 116.42 116.39 1iv3 h ASP 1301Ca -0.23 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.17 1iv3 h ASP 1301Cb 1.17 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 40.50 1iv3 h ASP 1301CO 0.21 0.61 0.29 0.00 -3.12 0.00 0.00 179.24 177.23 1iv3 s ARG 1302N -2.90 0.99 0.32 3.56 1.70 -1.26 -4.76 118.95 116.60 1iv3 s ARG 1302Ca 0.02 0.04 -0.04 0.00 -0.47 0.00 0.00 55.73 55.28 1iv3 s ARG 1302Cb 0.08 0.47 0.07 0.00 -0.57 0.00 0.00 34.95 35.00 1iv3 s ARG 1302CO 0.77 -0.35 0.44 -0.35 -1.08 0.00 0.00 175.30 174.72 1iv3 n PRO 1303N 0.52 -0.24 -2.31 3.89 -0.04 -1.26 -4.92 135.00 130.63 1iv3 n PRO 1303Ca -0.16 -0.78 -0.41 0.00 -0.04 0.00 0.00 63.50 62.11 1iv3 n PRO 1303Cb 0.59 -0.41 -0.03 0.00 -0.04 0.00 0.00 33.50 33.61 1iv3 n PRO 1303CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1iv3 s LYS 1304N -3.84 4.49 0.07 0.54 1.02 -1.26 -4.96 119.74 115.79 1iv3 s LYS 1304Ca 0.26 1.97 0.22 0.00 0.02 0.00 0.00 55.97 58.44 1iv3 s LYS 1304Cb -0.01 -3.17 -0.11 0.00 -0.52 0.00 0.00 37.83 34.02 1iv3 s LYS 1304CO 0.18 -0.04 0.84 1.28 -0.92 0.00 0.00 175.35 176.68 1iv3 n LEU 1305N 1.64 0.49 -0.24 3.17 4.77 -1.26 -4.57 117.00 121.00 1iv3 n LEU 1305Ca 0.02 0.07 0.04 0.00 -0.03 0.00 0.00 56.01 56.11 1iv3 n LEU 1305Cb 0.44 -0.05 0.14 0.00 -2.33 0.00 0.00 43.42 41.62 1iv3 n LEU 1305CO 0.56 -0.03 0.85 1.23 -1.33 0.00 0.00 177.39 178.67 1iv3 h GLY 1306N 4.21 0.82 2.00 -0.72 0.00 -1.99 0.28 103.07 107.67 1iv3 h GLY 1306Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1iv3 h GLY 1306CO 0.00 -0.24 0.00 -1.05 0.00 0.00 0.00 176.54 175.25 1iv3 n PRO 1307N -5.27 0.13 -0.22 4.80 -0.02 -1.26 -2.05 135.00 131.10 1iv3 n PRO 1307Ca 0.12 0.56 0.07 0.00 -2.02 0.00 0.00 63.50 62.23 1iv3 n PRO 1307Cb 0.43 -1.88 0.18 0.00 -0.02 0.00 0.00 33.50 32.21 1iv3 n PRO 1307CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1iv3 n HIS 1308N -2.15 0.57 -0.25 6.00 8.25 0.98 -4.68 115.22 123.93 1iv3 n HIS 1308Ca -0.00 -0.52 0.01 0.00 -0.26 0.00 0.00 57.72 56.95 1iv3 n HIS 1308Cb 0.08 -0.04 0.13 0.00 1.12 0.00 0.00 29.99 31.29 1iv3 n HIS 1308CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1iv3 h ARG 1309N 2.38 0.64 -0.49 -0.41 2.43 -1.20 0.63 114.38 118.36 1iv3 h ARG 1309Ca 0.00 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.01 1iv3 h ARG 1309Cb 0.81 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 1iv3 h ARG 1309CO 0.01 0.43 -0.18 -0.22 -1.51 0.00 0.00 179.97 178.49 1iv3 h LYS 1310N 0.66 0.98 -0.35 0.20 3.11 -1.84 -0.23 116.57 119.11 1iv3 h LYS 1310Ca 0.35 -0.41 -0.13 0.00 -2.81 0.00 0.00 60.65 57.65 1iv3 h LYS 1310Cb 0.32 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.50 1iv3 h LYS 1310CO -0.24 1.08 -0.30 0.00 -2.81 0.00 0.00 179.45 177.18 1iv3 h ALA 1311N 0.87 0.80 -0.14 5.00 0.00 -1.82 -0.00 119.26 123.98 1iv3 h ALA 1311Ca 0.11 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1iv3 h ALA 1311Cb 0.76 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1iv3 h ALA 1311CO 0.06 0.65 0.01 -0.07 0.00 0.00 0.00 179.25 179.89 1iv3 h LEU 1312N 0.65 0.23 -0.83 0.00 3.38 -0.62 -1.52 115.31 116.60 1iv3 h LEU 1312Ca 0.07 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 1iv3 h LEU 1312Cb 0.83 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1iv3 h LEU 1312CO 0.07 0.47 0.24 0.58 0.09 0.00 0.00 178.44 179.89 1iv3 h VAL 1313N -0.01 1.26 -0.38 1.22 2.07 -0.99 -2.44 116.25 116.97 1iv3 h VAL 1313Ca 0.04 -0.86 -0.06 0.00 0.82 0.00 0.00 66.70 66.63 1iv3 h VAL 1313Cb 0.35 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1iv3 h VAL 1313CO 0.01 0.34 -0.03 0.44 0.02 0.00 0.00 177.57 178.34 1iv3 h ASP 1314N 1.07 0.58 -0.17 0.57 3.32 -0.91 -0.06 116.42 120.82 1iv3 h ASP 1314Ca 0.24 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1iv3 h ASP 1314Cb 0.27 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1iv3 h ASP 1314CO -0.01 0.68 0.03 -1.28 -1.72 0.00 0.00 179.24 176.93 1iv3 h SER 1315N 0.58 0.27 -0.78 6.45 0.87 -0.88 -0.42 113.55 119.63 1iv3 h SER 1315Ca 0.12 -0.26 -0.01 0.00 -1.23 0.00 0.00 61.79 60.41 1iv3 h SER 1315Cb 0.42 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.27 1iv3 h SER 1315CO 0.02 0.46 0.46 -0.07 -0.53 0.00 0.00 176.83 177.16 1iv3 h LEU 1316N 0.07 0.95 -0.47 2.23 3.38 -1.23 0.34 115.31 120.57 1iv3 h LEU 1316Ca 0.05 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 57.99 1iv3 h LEU 1316Cb 0.30 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1iv3 h LEU 1316CO 0.00 0.75 0.22 -1.28 0.09 0.00 0.00 178.44 178.22 1iv3 h SER 1317N 1.07 0.30 0.07 -0.43 0.87 -0.76 0.76 113.55 115.43 1iv3 h SER 1317Ca 0.28 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.87 1iv3 h SER 1317Cb -0.02 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1iv3 h SER 1317CO -0.05 0.21 -0.03 -0.09 -0.53 0.00 0.00 176.83 176.34 1iv3 h ARG 1318N 0.43 -0.09 -0.63 2.24 2.43 -0.71 0.40 114.38 118.45 1iv3 h ARG 1318Ca 0.21 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1iv3 h ARG 1318Cb 0.14 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 1iv3 h ARG 1318CO -0.17 0.28 0.21 -0.07 -1.51 0.00 0.00 179.97 178.72 1iv3 h LEU 1319N -0.48 0.90 -0.99 3.80 -0.00 -0.18 -2.92 115.31 115.44 1iv3 h LEU 1319Ca -0.01 -0.20 0.00 0.00 -0.00 0.00 0.00 57.88 57.67 1iv3 h LEU 1319Cb 0.42 -0.24 0.00 0.00 -0.00 0.00 0.00 40.66 40.84 1iv3 h LEU 1319CO 0.02 0.86 -0.10 0.23 -0.00 0.00 0.00 178.44 179.44 1iv3 n MET 1320N -4.39 1.51 -3.82 1.13 2.81 0.25 -4.96 117.12 109.65 1iv3 n MET 1320Ca 0.04 -0.99 -0.24 0.00 -1.81 0.00 0.00 57.70 54.70 1iv3 n MET 1320Cb 0.20 -1.48 0.01 0.00 -0.71 0.00 0.00 33.22 31.24 1iv3 n MET 1320CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1iv3 n ARG 1321N 0.12 -4.34 -4.55 0.03 1.74 0.03 -5.00 116.66 104.69 1iv3 n ARG 1321Ca 0.16 0.53 -0.29 0.00 -0.77 0.00 0.00 57.85 57.48 1iv3 n ARG 1321Cb 0.40 -4.97 -0.14 0.00 -1.02 0.00 0.00 32.46 26.73 1iv3 n ARG 1321CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1iv3 s LEU 1322N -6.85 2.27 0.75 0.55 1.43 -0.62 -5.04 118.68 111.17 1iv3 s LEU 1322Ca 0.08 -0.69 -0.13 0.00 -1.03 0.00 0.00 54.13 52.36 1iv3 s LEU 1322Cb -0.04 -1.22 0.05 0.00 0.03 0.00 0.00 46.19 45.01 1iv3 s LEU 1322CO 0.84 0.20 1.13 -2.16 0.23 0.00 0.00 176.35 176.59 1iv3 s PRO 1323N -1.78 2.23 0.54 1.29 0.04 -1.26 -4.51 135.00 131.56 1iv3 s PRO 1323Ca 0.13 1.42 0.21 0.00 0.04 0.00 0.00 61.00 62.80 1iv3 s PRO 1323Cb -0.10 -1.88 1.43 0.00 0.04 0.00 0.00 34.50 34.00 1iv3 s PRO 1323CO 0.05 -1.70 2.14 1.96 0.04 0.00 0.00 177.00 179.49 1iv3 h GLN 1324N -0.68 0.00 0.00 4.56 4.20 -1.94 -0.47 115.11 120.77 1iv3 h GLN 1324Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1iv3 h GLN 1324Cb 1.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1iv3 h GLN 1324CO 0.50 0.00 0.00 -0.40 -0.67 0.00 0.00 178.83 178.26 1iv3 n ASP 1325N -4.31 0.00 -0.49 1.46 5.68 -1.26 -2.30 116.55 115.34 1iv3 n ASP 1325Ca -0.00 -0.54 0.05 0.00 -0.50 0.00 0.00 54.79 53.79 1iv3 n ASP 1325Cb 0.20 -0.12 0.11 0.00 -1.14 0.00 0.00 41.12 40.17 1iv3 n ASP 1325CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1iv3 n ARG 1326N -1.12 2.42 -3.58 0.11 5.12 -0.19 -4.80 116.66 114.61 1iv3 n ARG 1326Ca 0.17 -1.78 -0.41 0.00 -1.93 0.00 0.00 57.85 53.90 1iv3 n ARG 1326Cb 0.14 -1.21 -0.10 0.00 -1.16 0.00 0.00 32.46 30.13 1iv3 n ARG 1326CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1iv3 s ILE 1327N -0.95 4.45 -0.61 0.55 -1.09 -0.97 -1.66 121.20 120.92 1iv3 s ILE 1327Ca 0.17 -1.16 -0.09 0.00 -2.23 0.00 0.00 60.65 57.35 1iv3 s ILE 1327Cb 0.09 -3.62 0.16 0.00 -1.58 0.00 0.00 42.46 37.51 1iv3 s ILE 1327CO 0.13 -0.41 0.48 -0.83 -1.23 0.00 0.00 174.94 173.08 1iv3 s GLY 1328N 1.94 2.34 -0.23 6.18 0.00 0.06 -4.99 107.32 112.62 1iv3 s GLY 1328Ca 0.02 -2.96 -0.02 0.00 0.00 0.00 0.00 44.72 41.76 1iv3 s GLY 1328CO 0.04 1.15 -0.07 -2.27 0.00 0.00 0.00 173.10 171.95 1iv3 s LEU 1329N 0.62 2.99 0.17 0.66 2.96 -1.26 0.10 118.68 124.92 1iv3 s LEU 1329Ca 0.12 -0.68 0.10 0.00 -0.22 0.00 0.00 54.13 53.45 1iv3 s LEU 1329Cb -0.20 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1iv3 s LEU 1329CO -0.04 -0.08 -0.22 0.42 -1.32 0.00 0.00 176.35 175.11 1iv3 s THR 1330N 1.38 2.11 -0.06 3.68 -4.23 -0.42 -4.99 115.64 113.10 1iv3 s THR 1330Ca 0.03 -1.90 0.06 0.00 -1.18 0.00 0.00 61.69 58.69 1iv3 s THR 1330Cb -0.15 -1.96 -0.01 0.00 1.34 0.00 0.00 72.50 71.72 1iv3 s THR 1330CO -0.05 -0.14 -0.24 -0.36 -0.54 0.00 0.00 174.62 173.29 1iv3 s PHE 1331N -1.64 2.47 0.07 3.99 0.08 -1.26 -1.57 117.98 120.12 1iv3 s PHE 1331Ca 0.17 -0.74 0.04 0.00 0.12 0.00 0.00 56.93 56.52 1iv3 s PHE 1331Cb -0.08 -1.62 -0.03 0.00 -0.57 0.00 0.00 43.02 40.72 1iv3 s PHE 1331CO 0.08 -0.23 -0.11 0.15 -0.10 0.00 0.00 175.22 175.01 1iv3 s LYS 1332N -0.11 0.74 0.51 0.44 -0.14 -0.08 -4.97 119.74 116.12 1iv3 s LYS 1332Ca -0.05 -0.96 0.02 0.00 -1.36 0.00 0.00 55.97 53.62 1iv3 s LYS 1332Cb -0.14 -0.57 0.02 0.00 -1.68 0.00 0.00 37.83 35.46 1iv3 s LYS 1332CO 0.04 0.11 0.72 0.95 -0.76 0.00 0.00 175.35 176.41 1iv3 s THR 1333N -1.69 2.98 -2.27 2.17 -4.23 -1.26 -1.09 115.64 110.25 1iv3 s THR 1333Ca -0.02 -0.70 0.20 0.00 -1.18 0.00 0.00 61.69 59.99 1iv3 s THR 1333Cb -0.08 -3.09 0.43 0.00 1.34 0.00 0.00 72.50 71.11 1iv3 s THR 1333CO 0.01 -0.06 1.47 -1.54 -0.54 0.00 0.00 174.62 173.96 1iv3 n SER 1334N -2.20 2.12 -3.82 3.99 3.41 -1.26 -4.75 113.62 111.10 1iv3 n SER 1334Ca 0.07 -1.82 -0.30 0.00 -0.26 0.00 0.00 58.87 56.56 1iv3 n SER 1334Cb 0.59 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1iv3 n SER 1334CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1iv3 n GLU 1335N 0.63 -4.29 -0.44 4.33 -0.58 -1.26 -1.27 120.64 117.77 1iv3 n GLU 1335Ca 0.16 0.51 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 1iv3 n GLU 1335Cb 0.39 -5.32 0.00 0.00 -0.57 0.00 0.00 31.44 25.94 1iv3 n GLU 1335CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1iv3 n GLY 1336N -1.46 1.52 0.19 0.62 0.00 -1.26 -4.88 105.19 99.91 1iv3 n GLY 1336Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 1iv3 n GLY 1336CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1iv3 h LEU 1337N 0.00 0.61 -5.99 0.99 5.85 -1.60 -3.39 115.31 111.78 1iv3 h LEU 1337Ca 0.00 -0.42 -0.49 0.00 0.84 0.00 0.00 57.88 57.81 1iv3 h LEU 1337Cb 0.00 -0.18 -0.39 0.00 0.37 0.00 0.00 40.66 40.45 1iv3 h LEU 1337CO 0.00 1.18 -1.17 0.00 -0.34 0.00 0.00 178.44 178.10 1iv3 n ALA 1338N -2.54 2.03 0.90 1.25 0.00 -1.26 -4.98 120.51 115.92 1iv3 n ALA 1338Ca -0.06 -3.37 0.10 0.00 0.00 0.00 0.00 53.44 50.11 1iv3 n ALA 1338Cb 0.74 -0.91 0.50 0.00 0.00 0.00 0.00 19.45 19.78 1iv3 n ALA 1338CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1iv3 n PRO 1339N 0.48 0.20 -0.05 0.00 -0.04 -1.26 -2.75 135.00 131.57 1iv3 n PRO 1339Ca 0.24 0.11 0.05 0.00 -0.04 0.00 0.00 63.50 63.86 1iv3 n PRO 1339Cb 0.64 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.68 1iv3 n PRO 1339CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1iv3 n SER 1340N -1.36 2.26 -4.06 3.54 7.64 -1.26 -4.78 113.62 115.60 1iv3 n SER 1340Ca 0.08 -2.58 -0.11 0.00 1.01 0.00 0.00 58.87 57.27 1iv3 n SER 1340Cb 0.19 -0.24 -0.11 0.00 -1.01 0.00 0.00 64.21 63.04 1iv3 n SER 1340CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1iv3 s HIS 1341N -2.01 0.61 -0.09 1.43 3.76 -1.11 0.04 115.29 117.92 1iv3 s HIS 1341Ca 0.18 -0.62 -0.02 0.00 -0.15 0.00 0.00 55.06 54.45 1iv3 s HIS 1341Cb 0.15 -0.37 -0.03 0.00 1.11 0.00 0.00 32.58 33.44 1iv3 s HIS 1341CO 0.02 -0.14 0.00 0.54 -0.85 0.00 0.00 174.74 174.31 1iv3 s VAL 1342N -1.98 4.31 0.05 -0.90 0.11 0.13 -4.59 120.40 117.52 1iv3 s VAL 1342Ca -0.06 -0.25 0.06 0.00 -2.93 0.00 0.00 61.98 58.80 1iv3 s VAL 1342Cb -0.06 -2.82 -0.02 0.00 -1.53 0.00 0.00 36.38 31.95 1iv3 s VAL 1342CO -0.02 0.60 -0.17 -1.10 -3.33 0.00 0.00 175.10 171.09 1iv3 s GLN 1343N -0.80 1.07 0.00 1.54 -0.21 -0.26 -0.80 119.66 120.20 1iv3 s GLN 1343Ca 0.12 -0.86 0.01 0.00 0.02 0.00 0.00 55.36 54.65 1iv3 s GLN 1343Cb -0.11 -1.14 -0.01 0.00 1.00 0.00 0.00 33.01 32.75 1iv3 s GLN 1343CO 0.02 0.28 -0.03 0.00 -2.12 0.00 0.00 175.29 173.45 1iv3 s ALA 1344N -0.90 0.21 -0.02 6.09 0.00 0.12 -1.02 121.76 126.24 1iv3 s ALA 1344Ca 0.03 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.79 1iv3 s ALA 1344Cb -0.08 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.03 1iv3 s ALA 1344CO 0.02 0.01 -0.05 1.03 0.00 0.00 0.00 175.76 176.77 1iv3 s ARG 1345N -0.36 0.61 0.00 0.00 0.52 -0.84 -0.97 118.95 117.92 1iv3 s ARG 1345Ca -0.02 -0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.05 1iv3 s ARG 1345Cb -0.03 -0.63 -0.00 0.00 0.52 0.00 0.00 34.95 34.81 1iv3 s ARG 1345CO -0.00 0.02 -0.01 0.00 0.02 0.00 0.00 175.30 175.33 1iv3 s ALA 1346N 0.41 0.06 -0.05 2.13 0.00 -0.13 -1.09 121.76 123.08 1iv3 s ALA 1346Ca -0.05 -0.14 0.05 0.00 0.00 0.00 0.00 51.96 51.82 1iv3 s ALA 1346Cb -0.09 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 1iv3 s ALA 1346CO -0.00 -0.03 -0.21 0.08 0.00 0.00 0.00 175.76 175.61 1iv3 s VAL 1347N -0.32 2.49 0.10 0.00 1.01 -0.20 -1.19 120.40 122.30 1iv3 s VAL 1347Ca -0.03 -0.93 0.09 0.00 0.00 0.00 0.00 61.98 61.10 1iv3 s VAL 1347Cb -0.02 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1iv3 s VAL 1347CO -0.00 0.58 -0.22 0.68 0.00 0.00 0.00 175.10 176.14 1iv3 s VAL 1348N -0.48 1.78 -0.08 2.92 -7.23 0.11 -1.21 120.40 116.21 1iv3 s VAL 1348Ca 0.06 -1.55 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 1iv3 s VAL 1348Cb -0.11 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.22 1iv3 s VAL 1348CO 0.01 -0.03 -0.19 -0.22 -0.31 0.00 0.00 175.10 174.37 1iv3 s LEU 1349N -1.89 1.89 0.01 1.32 2.96 -0.61 -1.36 118.68 120.99 1iv3 s LEU 1349Ca 0.07 -0.43 0.05 0.00 -0.22 0.00 0.00 54.13 53.60 1iv3 s LEU 1349Cb -0.10 -1.13 -0.01 0.00 0.50 0.00 0.00 46.19 45.44 1iv3 s LEU 1349CO 0.04 0.11 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.27 1iv3 s LEU 1350N 0.46 2.07 0.00 -0.68 1.02 -0.14 -0.64 118.68 120.78 1iv3 s LEU 1350Ca -0.16 -0.32 0.00 0.00 0.02 0.00 0.00 54.13 53.67 1iv3 s LEU 1350Cb -0.17 -0.71 0.00 0.00 0.02 0.00 0.00 46.19 45.34 1iv3 s LEU 1350CO 0.06 0.13 0.00 0.47 0.02 0.00 0.00 176.35 177.04