#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p3b n ARG 1230N 0.00 -1.74 -2.42 4.33 -4.01 -1.26 -4.86 116.66 106.70 1p3b n ARG 1230Ca 0.00 1.26 -0.43 0.00 -1.04 0.00 0.00 57.85 57.64 1p3b n ARG 1230Cb 0.00 -3.21 -0.02 0.00 -3.04 0.00 0.00 32.46 26.19 1p3b n ARG 1230CO 0.00 0.00 0.00 -1.59 -3.04 0.00 0.00 177.63 173.00 1p3b s LYS 1231N -3.56 4.25 0.75 2.89 -2.85 -1.26 -5.01 119.74 114.95 1p3b s LYS 1231Ca 0.15 1.68 -0.11 0.00 -1.00 0.00 0.00 55.97 56.69 1p3b s LYS 1231Cb -0.02 -3.73 0.04 0.00 -2.06 0.00 0.00 37.83 32.06 1p3b s LYS 1231CO 0.85 -0.66 1.08 -1.21 0.10 0.00 0.00 175.35 175.51 1p3b s GLU 1232N 3.25 2.51 0.32 1.78 2.02 -1.26 -5.09 118.70 122.24 1p3b s GLU 1232Ca 0.55 0.75 -0.14 0.00 0.02 0.00 0.00 54.97 56.14 1p3b s GLU 1232Cb -0.23 -1.96 0.03 0.00 0.10 0.00 0.00 34.13 32.07 1p3b s GLU 1232CO 0.16 -1.35 0.66 0.45 0.02 0.00 0.00 175.26 175.20 1p3b s SER 1233N -3.91 0.06 0.00 -0.19 0.15 -1.26 -5.04 113.70 103.51 1p3b s SER 1233Ca 0.59 -1.01 0.14 0.00 0.70 0.00 0.00 55.95 56.37 1p3b s SER 1233Cb -0.14 0.74 -0.01 0.00 -1.71 0.00 0.00 66.02 64.90 1p3b s SER 1233CO 0.54 -1.42 0.76 -1.22 1.20 0.00 0.00 173.24 173.10 1p3b n TYR 1234N -0.49 0.00 -0.39 3.44 4.02 -1.26 -4.72 117.16 117.76 1p3b n TYR 1234Ca -0.04 0.00 0.31 0.00 -0.01 0.00 0.00 57.90 58.16 1p3b n TYR 1234Cb 0.60 0.00 0.59 0.00 -0.02 0.00 0.00 39.34 40.51 1p3b n TYR 1234CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1p3b h ALA 1235N 2.35 2.49 -0.07 -0.72 0.00 -1.96 0.29 119.26 121.63 1p3b h ALA 1235Ca 0.00 0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1p3b h ALA 1235Cb 0.46 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1p3b h ALA 1235CO 0.00 -1.05 -0.62 -0.84 0.00 0.00 0.00 179.25 176.74 1p3b h ILE 1236N 0.20 1.39 -0.09 0.00 3.07 -1.99 -1.00 117.51 119.09 1p3b h ILE 1236Ca 0.74 -2.02 -0.22 0.00 1.55 0.00 0.00 64.86 64.91 1p3b h ILE 1236Cb 2.14 2.02 0.01 0.00 -0.27 0.00 0.00 36.82 40.73 1p3b h ILE 1236CO -0.41 0.60 -0.82 1.88 -1.05 0.00 0.00 178.15 178.35 1p3b h TYR 1237N 0.19 1.00 -0.10 0.16 -1.99 -0.89 -1.19 116.97 114.14 1p3b h TYR 1237Ca -0.01 -0.48 0.03 0.00 2.00 0.00 0.00 58.73 60.27 1p3b h TYR 1237Cb 1.14 -0.14 -0.03 0.00 2.00 0.00 0.00 36.73 39.70 1p3b h TYR 1237CO 0.02 1.31 -0.09 0.28 -0.00 0.00 0.00 178.16 179.69 1p3b h VAL 1238N 0.41 0.74 -0.79 -2.88 2.07 -0.87 -1.38 116.25 113.55 1p3b h VAL 1238Ca -0.08 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.56 1p3b h VAL 1238Cb 1.47 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 31.90 1p3b h VAL 1238CO 0.17 0.00 0.41 0.22 0.02 0.00 0.00 177.57 178.38 1p3b h TYR 1239N -0.10 0.72 0.72 1.57 3.20 -1.02 0.75 116.97 122.81 1p3b h TYR 1239Ca 0.07 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 1p3b h TYR 1239Cb 0.21 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 1p3b h TYR 1239CO -0.20 0.23 -0.45 0.87 -1.64 0.00 0.00 178.16 176.97 1p3b h LYS 1240N 0.64 -1.05 -0.79 1.82 1.57 -0.37 -0.32 116.57 118.07 1p3b h LYS 1240Ca 0.41 0.07 0.19 0.00 -1.87 0.00 0.00 60.65 59.45 1p3b h LYS 1240Cb 0.49 0.24 -0.13 0.00 0.08 0.00 0.00 32.23 32.91 1p3b h LYS 1240CO -0.31 -0.70 0.13 0.28 -0.57 0.00 0.00 179.45 178.28 1p3b h VAL 1241N -1.09 0.38 -0.38 0.50 2.07 -0.46 0.34 116.25 117.60 1p3b h VAL 1241Ca -0.10 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.44 1p3b h VAL 1241Cb 0.88 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.76 1p3b h VAL 1241CO 0.09 0.03 -0.08 0.25 0.02 0.00 0.00 177.57 177.89 1p3b h LEU 1242N 0.18 -0.32 -2.17 2.57 5.85 0.12 0.16 115.31 121.70 1p3b h LEU 1242Ca 0.46 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 59.28 1p3b h LEU 1242Cb 0.84 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1p3b h LEU 1242CO -0.62 -0.11 -0.03 0.11 -0.34 0.00 0.00 178.44 177.45 1p3b h LYS 1243N 0.02 0.00 -0.10 1.25 1.79 0.14 -1.44 116.57 118.22 1p3b h LYS 1243Ca 0.18 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 1p3b h LYS 1243Cb 0.28 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.92 1p3b h LYS 1243CO -0.38 0.03 -0.09 1.96 -1.08 0.00 0.00 179.45 179.89 1p3b h GLN 1244N 0.00 0.23 -0.01 3.15 4.20 0.25 -2.70 115.11 120.23 1p3b h GLN 1244Ca -0.00 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1p3b h GLN 1244Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1p3b h GLN 1244CO 0.00 0.64 -0.04 -0.39 -0.67 0.00 0.00 178.83 178.38 1p3b h VAL 1245N -0.18 1.54 -2.75 -0.54 -1.51 -0.81 -3.40 116.25 108.61 1p3b h VAL 1245Ca 0.02 -1.64 -0.60 0.00 -1.23 0.00 0.00 66.70 63.24 1p3b h VAL 1245Cb 0.60 2.63 -0.40 0.00 -2.13 0.00 0.00 31.29 31.99 1p3b h VAL 1245CO 0.02 0.43 -0.78 -1.00 -1.23 0.00 0.00 177.57 175.01 1p3b s HIS 1246N -3.46 2.18 0.66 5.19 3.76 -0.60 -5.00 115.29 118.03 1p3b s HIS 1246Ca -0.17 -2.72 0.28 0.00 -0.15 0.00 0.00 55.06 52.30 1p3b s HIS 1246Cb 0.00 -1.76 1.54 0.00 1.11 0.00 0.00 32.58 33.47 1p3b s HIS 1246CO 0.69 -0.71 1.87 -1.35 -0.85 0.00 0.00 174.74 174.39 1p3b h PRO 1247N 5.75 0.00 -0.16 8.40 0.11 -1.64 -1.04 132.00 143.41 1p3b h PRO 1247Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1p3b h PRO 1247Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1p3b h PRO 1247CO 0.52 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.06 1p3b n ASP 1248N -2.90 2.31 -4.88 -2.05 8.00 -1.26 -4.94 116.55 110.83 1p3b n ASP 1248Ca -0.01 -1.77 -0.37 0.00 0.71 0.00 0.00 54.79 53.35 1p3b n ASP 1248Cb 0.43 -0.11 -0.06 0.00 -0.02 0.00 0.00 41.12 41.36 1p3b n ASP 1248CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1p3b s THR 1249N -0.88 5.44 0.50 -3.53 2.01 -0.40 -5.11 115.64 113.68 1p3b s THR 1249Ca 0.14 0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.41 1p3b s THR 1249Cb 0.08 -3.46 0.03 0.00 0.01 0.00 0.00 72.50 69.16 1p3b s THR 1249CO 0.11 0.57 0.27 0.61 -0.69 0.00 0.00 174.62 175.48 1p3b n GLY 1250N 1.80 3.02 2.78 4.40 0.00 -1.26 -4.81 105.19 111.12 1p3b n GLY 1250Ca -0.18 -2.31 -0.15 0.00 0.00 0.00 0.00 46.02 43.38 1p3b n GLY 1250CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1p3b s ILE 1251N -2.60 -0.04 0.85 -0.61 2.07 -1.26 -5.15 121.20 114.47 1p3b s ILE 1251Ca 0.20 0.19 -0.11 0.00 -1.41 0.00 0.00 60.65 59.52 1p3b s ILE 1251Cb -0.02 -0.09 0.11 0.00 0.13 0.00 0.00 42.46 42.60 1p3b s ILE 1251CO 0.13 0.08 1.10 -0.94 -1.91 0.00 0.00 174.94 173.40 1p3b s SER 1252N 0.96 3.70 0.20 4.50 1.04 -1.26 -4.80 113.70 118.04 1p3b s SER 1252Ca -0.08 1.84 -0.09 0.00 0.48 0.00 0.00 55.95 58.10 1p3b s SER 1252Cb -0.12 -2.45 0.12 0.00 0.10 0.00 0.00 66.02 63.68 1p3b s SER 1252CO -0.03 -2.55 1.74 0.77 0.98 0.00 0.00 173.24 174.15 1p3b h SER 1253N -1.49 1.06 -0.37 7.02 4.64 -2.01 -0.44 113.55 121.96 1p3b h SER 1253Ca -0.45 -0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 60.64 1p3b h SER 1253Cb 1.26 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 1p3b h SER 1253CO 0.49 0.99 0.19 0.11 -0.87 0.00 0.00 176.83 177.74 1p3b h LYS 1254N 1.08 0.53 -0.73 4.77 1.57 -1.99 0.67 116.57 122.48 1p3b h LYS 1254Ca 0.23 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.99 1p3b h LYS 1254Cb 0.31 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.47 1p3b h LYS 1254CO -0.01 0.47 0.43 0.00 -0.57 0.00 0.00 179.45 179.77 1p3b h ALA 1255N 1.04 0.98 -0.58 3.86 0.00 -1.83 0.11 119.26 122.83 1p3b h ALA 1255Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1p3b h ALA 1255Cb 0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1p3b h ALA 1255CO -0.02 0.15 0.22 1.98 0.00 0.00 0.00 179.25 181.58 1p3b h MET 1256N 0.80 0.85 0.29 0.00 1.85 -0.44 -0.58 114.93 117.70 1p3b h MET 1256Ca 0.31 -0.14 -0.01 0.00 -0.61 0.00 0.00 59.70 59.26 1p3b h MET 1256Cb 0.14 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 1p3b h MET 1256CO -0.16 0.70 -0.19 1.03 -0.40 0.00 0.00 176.91 177.89 1p3b h SER 1257N 0.83 -0.48 -0.58 1.39 0.87 0.15 0.12 113.55 115.85 1p3b h SER 1257Ca 0.20 0.03 0.10 0.00 -1.23 0.00 0.00 61.79 60.88 1p3b h SER 1257Cb 0.18 0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 62.21 1p3b h SER 1257CO -0.02 -0.30 0.18 0.40 -0.53 0.00 0.00 176.83 176.56 1p3b h ILE 1258N -0.47 0.73 -0.83 2.23 5.03 -0.68 1.00 117.51 124.51 1p3b h ILE 1258Ca -0.03 -0.11 0.08 0.00 -0.12 0.00 0.00 64.86 64.68 1p3b h ILE 1258Cb 0.39 0.37 -0.06 0.00 -3.03 0.00 0.00 36.82 34.49 1p3b h ILE 1258CO 0.02 0.06 0.54 0.24 -0.68 0.00 0.00 178.15 178.33 1p3b h MET 1259N 0.33 0.83 -0.34 2.37 2.86 -0.55 0.31 114.93 120.75 1p3b h MET 1259Ca 0.30 -0.05 -0.15 0.00 -2.06 0.00 0.00 59.70 57.74 1p3b h MET 1259Cb 0.39 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.86 1p3b h MET 1259CO -0.33 0.55 -0.36 -0.97 1.06 0.00 0.00 176.91 176.86 1p3b h ASN 1260N 0.86 0.90 -0.92 1.22 -1.24 0.16 -2.13 115.58 114.42 1p3b h ASN 1260Ca 0.37 -0.47 -0.01 0.00 0.71 0.00 0.00 56.30 56.90 1p3b h ASN 1260Cb 0.33 -0.25 -0.04 0.00 0.73 0.00 0.00 38.32 39.08 1p3b h ASN 1260CO -0.14 1.19 0.52 0.28 -1.29 0.00 0.00 177.43 177.99 1p3b h SER 1261N 0.63 1.13 0.44 1.15 0.02 0.19 -2.67 113.55 114.44 1p3b h SER 1261Ca 0.05 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1p3b h SER 1261Cb 0.94 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 1p3b h SER 1261CO 0.09 0.90 -0.46 0.15 -1.14 0.00 0.00 176.83 176.37 1p3b h PHE 1262N 1.28 -1.27 -0.36 3.45 3.57 -0.13 -1.78 116.94 121.70 1p3b h PHE 1262Ca 0.33 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.91 1p3b h PHE 1262Cb -0.00 0.50 -0.08 0.00 2.79 0.00 0.00 35.95 39.15 1p3b h PHE 1262CO 0.01 -0.60 -0.19 0.28 -2.23 0.00 0.00 178.31 175.57 1p3b h VAL 1263N -0.90 0.44 -0.73 1.41 2.07 -1.25 -1.65 116.25 115.64 1p3b h VAL 1263Ca -0.06 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.49 1p3b h VAL 1263Cb 0.79 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 1p3b h VAL 1263CO -0.06 0.00 0.48 0.78 0.02 0.00 0.00 177.57 178.79 1p3b h ASN 1264N -0.14 0.78 0.87 0.57 2.35 -1.43 0.13 115.58 118.72 1p3b h ASN 1264Ca 0.18 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.87 1p3b h ASN 1264Cb 0.41 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 38.61 1p3b h ASN 1264CO -0.44 0.55 -0.42 -0.78 -1.65 0.00 0.00 177.43 174.69 1p3b h ASP 1265N 0.92 -0.99 -0.95 5.81 3.58 -0.41 -0.12 116.42 124.25 1p3b h ASP 1265Ca 0.28 0.03 0.15 0.00 0.42 0.00 0.00 57.03 57.92 1p3b h ASP 1265Cb 0.01 0.25 -0.09 0.00 1.72 0.00 0.00 39.33 41.22 1p3b h ASP 1265CO -0.08 -0.69 0.56 0.58 -2.88 0.00 0.00 179.24 176.74 1p3b h VAL 1266N -1.19 0.80 0.28 2.25 2.07 -1.11 0.57 116.25 119.93 1p3b h VAL 1266Ca -0.12 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 1p3b h VAL 1266Cb 0.89 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1p3b h VAL 1266CO 0.20 0.15 -0.44 0.15 0.02 0.00 0.00 177.57 177.65 1p3b h PHE 1267N 0.81 -1.24 -0.56 1.57 3.57 -0.41 -0.42 116.94 120.25 1p3b h PHE 1267Ca 0.51 0.02 0.11 0.00 3.53 0.00 0.00 57.97 62.14 1p3b h PHE 1267Cb 0.66 0.50 -0.09 0.00 2.79 0.00 0.00 35.95 39.81 1p3b h PHE 1267CO -0.03 -0.54 0.05 0.93 -2.23 0.00 0.00 178.31 176.49 1p3b h GLU 1268N -0.76 0.17 -0.10 1.11 5.08 -0.10 0.75 114.58 120.73 1p3b h GLU 1268Ca -0.03 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1p3b h GLU 1268Cb 0.70 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.87 1p3b h GLU 1268CO -0.14 0.11 -0.11 0.00 -1.00 0.00 0.00 179.01 177.87 1p3b h ARG 1269N 0.17 -0.14 -0.07 2.33 3.08 -0.51 0.49 114.38 119.74 1p3b h ARG 1269Ca 0.29 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.34 1p3b h ARG 1269Cb 0.45 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 1p3b h ARG 1269CO -0.43 -0.09 -0.02 0.82 -1.07 0.00 0.00 179.97 179.18 1p3b h ILE 1270N -0.14 1.30 -0.61 2.04 2.04 -0.65 -1.44 117.51 120.04 1p3b h ILE 1270Ca 0.08 -0.94 0.06 0.00 1.00 0.00 0.00 64.86 65.05 1p3b h ILE 1270Cb 0.25 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.09 1p3b h ILE 1270CO -0.19 0.26 0.40 0.00 0.00 0.00 0.00 178.15 178.63 1p3b h ALA 1271N 0.66 1.78 0.16 1.87 0.00 -0.70 0.24 119.26 123.28 1p3b h ALA 1271Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1p3b h ALA 1271Cb 0.42 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1p3b h ALA 1271CO 0.01 0.12 -0.08 0.78 0.00 0.00 0.00 179.25 180.09 1p3b h GLY 1272N 0.62 -0.22 1.07 0.00 0.00 0.33 0.42 103.07 105.29 1p3b h GLY 1272Ca 0.26 0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.63 1p3b h GLY 1272CO -0.08 -0.08 0.37 0.83 0.00 0.00 0.00 176.54 177.58 1p3b h GLU 1273N -0.43 1.19 0.31 4.80 4.39 -0.69 -1.53 114.58 122.61 1p3b h GLU 1273Ca -0.02 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.49 1p3b h GLU 1273Cb 0.34 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 1p3b h GLU 1273CO 0.04 0.93 -0.48 0.00 -1.16 0.00 0.00 179.01 178.34 1p3b h ALA 1274N 1.23 -0.99 -0.58 3.43 0.00 -0.26 0.30 119.26 122.39 1p3b h ALA 1274Ca 0.28 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1p3b h ALA 1274Cb 0.16 0.75 -0.08 0.00 0.00 0.00 0.00 17.79 18.62 1p3b h ALA 1274CO -0.03 -1.11 -0.40 1.03 0.00 0.00 0.00 179.25 178.74 1p3b h SER 1275N -0.85 -1.43 -0.64 0.00 0.87 0.41 -0.59 113.55 111.33 1p3b h SER 1275Ca -0.03 0.21 0.07 0.00 -1.23 0.00 0.00 61.79 60.82 1p3b h SER 1275Cb 0.79 0.62 -0.06 0.00 -0.44 0.00 0.00 62.40 63.31 1p3b h SER 1275CO -0.16 -0.19 0.32 0.03 -0.53 0.00 0.00 176.83 176.30 1p3b h ARG 1276N -0.07 0.56 -0.15 2.24 3.08 -1.04 -1.37 114.38 117.63 1p3b h ARG 1276Ca 0.09 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.16 1p3b h ARG 1276Cb 0.31 -0.13 -0.07 0.00 0.08 0.00 0.00 29.97 30.17 1p3b h ARG 1276CO -0.58 0.37 -0.39 1.25 -1.07 0.00 0.00 179.97 179.55 1p3b h LEU 1277N 0.58 -1.23 -0.39 3.04 5.85 0.10 0.49 115.31 123.75 1p3b h LEU 1277Ca 0.30 0.17 0.05 0.00 0.84 0.00 0.00 57.88 59.24 1p3b h LEU 1277Cb 0.25 0.51 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 1p3b h LEU 1277CO -0.22 -0.40 0.12 0.00 -0.34 0.00 0.00 178.44 177.59 1p3b h ALA 1278N 0.23 0.45 0.32 1.25 0.00 -0.83 -2.53 119.26 118.14 1p3b h ALA 1278Ca 0.09 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1p3b h ALA 1278Cb 0.60 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1p3b h ALA 1278CO -0.40 -0.28 -0.29 0.45 0.00 0.00 0.00 179.25 178.74 1p3b h HIS 1279N 0.27 -0.78 -0.40 0.00 3.86 -0.09 -0.66 115.15 117.35 1p3b h HIS 1279Ca 0.18 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.51 1p3b h HIS 1279Cb 0.18 0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 1p3b h HIS 1279CO -0.16 -0.42 0.68 1.88 0.86 0.00 0.00 177.93 180.77 1p3b h TYR 1280N -0.63 0.00 -0.22 2.45 0.99 0.33 0.26 116.97 120.15 1p3b h TYR 1280Ca -0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1p3b h TYR 1280Cb 0.57 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.30 1p3b h TYR 1280CO -0.17 0.00 0.00 0.09 -0.00 0.00 0.00 178.16 178.08 1p3b n ASN 1281N -3.22 2.71 -3.07 3.88 3.02 -0.35 -4.97 115.26 113.27 1p3b n ASN 1281Ca 0.08 -1.80 -0.15 0.00 -0.03 0.00 0.00 54.58 52.68 1p3b n ASN 1281Cb 0.83 -0.14 0.08 0.00 -0.61 0.00 0.00 39.78 39.94 1p3b n ASN 1281CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1p3b n LYS 1282N 0.88 -5.70 -5.19 3.52 5.02 0.92 -5.02 118.16 112.59 1p3b n LYS 1282Ca 0.12 0.72 -0.32 0.00 -2.02 0.00 0.00 58.31 56.82 1p3b n LYS 1282Cb 0.43 -5.36 -0.15 0.00 -0.02 0.00 0.00 35.03 29.92 1p3b n LYS 1282CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1p3b s ARG 1283N -5.21 2.35 0.00 1.97 1.81 -0.65 -5.01 118.95 114.21 1p3b s ARG 1283Ca 0.03 -0.87 0.22 0.00 -1.72 0.00 0.00 55.73 53.39 1p3b s ARG 1283Cb -0.01 -2.16 -0.04 0.00 -0.45 0.00 0.00 34.95 32.29 1p3b s ARG 1283CO 0.62 0.52 1.04 -1.13 -0.68 0.00 0.00 175.30 175.66 1p3b n SER 1284N 2.58 1.05 -4.57 0.23 3.41 -1.26 -4.25 113.62 110.81 1p3b n SER 1284Ca -0.17 -0.93 -0.34 0.00 -0.26 0.00 0.00 58.87 57.17 1p3b n SER 1284Cb 0.52 0.77 -0.11 0.00 -0.26 0.00 0.00 64.21 65.13 1p3b n SER 1284CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1p3b s THR 1285N -2.92 3.70 -0.25 6.66 2.01 -1.26 -5.08 115.64 118.50 1p3b s THR 1285Ca 0.10 -0.47 -0.10 0.00 0.31 0.00 0.00 61.69 61.53 1p3b s THR 1285Cb 0.17 -2.52 -0.05 0.00 0.01 0.00 0.00 72.50 70.10 1p3b s THR 1285CO 0.79 0.59 0.16 -0.63 -0.69 0.00 0.00 174.62 174.83 1p3b s ILE 1286N -0.66 5.23 0.45 1.82 1.01 -1.26 -4.89 121.20 122.90 1p3b s ILE 1286Ca 0.10 0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.90 1p3b s ILE 1286Cb -0.11 -3.45 0.01 0.00 0.01 0.00 0.00 42.46 38.91 1p3b s ILE 1286CO 0.02 0.32 0.08 0.35 0.00 0.00 0.00 174.94 175.71 1p3b n THR 1287N 4.55 0.00 0.27 2.92 -2.24 -1.26 -4.97 114.28 113.55 1p3b n THR 1287Ca -0.15 -2.05 0.11 0.00 -2.27 0.00 0.00 64.05 59.69 1p3b n THR 1287Cb 0.52 0.31 0.74 0.00 -2.10 0.00 0.00 70.33 69.80 1p3b n THR 1287CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1p3b h SER 1288N 0.95 0.00 -0.55 3.42 4.64 -1.99 -0.99 113.55 119.03 1p3b h SER 1288Ca -0.35 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.89 1p3b h SER 1288Cb 1.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 1p3b h SER 1288CO 0.58 0.05 0.06 -0.09 -0.87 0.00 0.00 176.83 176.56 1p3b h ARG 1289N 0.00 0.97 0.00 4.77 2.43 -1.99 0.60 114.38 121.17 1p3b h ARG 1289Ca -0.00 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1p3b h ARG 1289Cb 0.11 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1p3b h ARG 1289CO 0.01 0.92 0.00 0.93 -1.51 0.00 0.00 179.97 180.32 1p3b h GLU 1290N 0.91 0.00 0.18 0.20 4.39 -1.58 -1.83 114.58 116.85 1p3b h GLU 1290Ca 0.18 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.58 1p3b h GLU 1290Cb 0.45 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.11 1p3b h GLU 1290CO 0.02 0.00 -1.37 0.82 -1.16 0.00 0.00 179.01 177.32 1p3b h ILE 1291N 0.00 1.38 0.61 3.13 1.08 -0.80 -2.68 117.51 120.22 1p3b h ILE 1291Ca 0.00 -2.90 -0.03 0.00 -0.39 0.00 0.00 64.86 61.54 1p3b h ILE 1291Cb 0.88 2.97 0.01 0.00 -3.07 0.00 0.00 36.82 37.60 1p3b h ILE 1291CO 0.00 0.86 -0.29 -0.61 -0.69 0.00 0.00 178.15 177.42 1p3b h GLN 1292N 0.10 -0.78 -0.57 2.37 4.15 -0.67 0.18 115.11 119.90 1p3b h GLN 1292Ca -0.19 0.05 0.11 0.00 0.77 0.00 0.00 58.65 59.39 1p3b h GLN 1292Cb 2.05 0.18 -0.08 0.00 0.21 0.00 0.00 27.48 29.84 1p3b h GLN 1292CO 0.23 -0.48 0.09 1.15 -1.93 0.00 0.00 178.83 177.89 1p3b h THR 1293N -0.97 0.64 -0.25 2.39 2.02 -1.46 -0.76 112.91 114.51 1p3b h THR 1293Ca -0.08 -0.08 0.06 0.00 0.77 0.00 0.00 66.41 67.08 1p3b h THR 1293Cb 0.67 0.40 -0.08 0.00 -1.74 0.00 0.00 68.15 67.40 1p3b h THR 1293CO 0.14 0.04 -0.34 0.00 0.37 0.00 0.00 175.52 175.73 1p3b h ALA 1294N 1.46 -0.32 -0.93 6.16 0.00 -1.12 0.84 119.26 125.35 1p3b h ALA 1294Ca 0.29 0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.36 1p3b h ALA 1294Cb 0.44 0.68 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 1p3b h ALA 1294CO -0.40 -0.78 0.60 0.28 0.00 0.00 0.00 179.25 178.94 1p3b h VAL 1295N -0.34 0.95 0.03 0.00 2.07 0.37 0.85 116.25 120.17 1p3b h VAL 1295Ca 0.13 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1p3b h VAL 1295Cb 0.55 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1p3b h VAL 1295CO -0.44 0.17 -0.01 0.03 0.02 0.00 0.00 177.57 177.33 1p3b h ARG 1296N 0.91 -0.04 -0.77 1.57 2.47 0.34 -0.07 114.38 118.79 1p3b h ARG 1296Ca 0.44 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 59.13 1p3b h ARG 1296Cb 0.45 0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.75 1p3b h ARG 1296CO -0.20 0.19 0.35 -0.07 0.56 0.00 0.00 179.97 180.79 1p3b h LEU 1297N -0.26 1.02 0.04 3.04 3.38 -0.25 -3.33 115.31 118.94 1p3b h LEU 1297Ca -0.00 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1p3b h LEU 1297Cb 0.25 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1p3b h LEU 1297CO 0.01 0.87 -0.40 0.25 0.09 0.00 0.00 178.44 179.26 1p3b h LEU 1298N 1.10 0.12-10.04 1.67 6.46 -0.79 -3.48 115.31 110.35 1p3b h LEU 1298Ca 0.26 -0.92 -0.45 0.00 -0.12 0.00 0.00 57.88 56.65 1p3b h LEU 1298Cb 0.14 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.01 1p3b h LEU 1298CO -0.03 1.17 0.32 -0.76 -0.62 0.00 0.00 178.44 178.52 1p3b s LEU 1299N -8.07 3.99 0.59 2.25 1.43 -0.05 -5.03 118.68 113.79 1p3b s LEU 1299Ca -0.19 1.67 -0.20 0.00 -1.03 0.00 0.00 54.13 54.38 1p3b s LEU 1299Cb -0.01 -4.45 -0.04 0.00 0.03 0.00 0.00 46.19 41.73 1p3b s LEU 1299CO 0.71 -0.32 1.27 -2.84 0.23 0.00 0.00 176.35 175.40 1p3b s PRO 1300N -3.05 2.96 0.00 1.29 0.02 -1.26 -4.56 135.00 130.40 1p3b s PRO 1300Ca 0.60 1.99 -0.01 0.00 0.02 0.00 0.00 61.00 63.61 1p3b s PRO 1300Cb -0.10 -2.02 -0.00 0.00 0.02 0.00 0.00 34.50 32.39 1p3b s PRO 1300CO 0.14 -1.26 0.33 0.41 -0.33 0.00 0.00 177.00 176.29 1p3b n GLY 1301N 0.67 -0.99 0.17 0.52 0.00 -1.26 -1.59 105.19 102.70 1p3b n GLY 1301Ca 0.13 0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.26 1p3b n GLY 1301CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1p3b h GLU 1302N 0.00 0.50 -0.33 1.61 4.57 -2.00 -2.26 114.58 116.67 1p3b h GLU 1302Ca 0.00 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.16 1p3b h GLU 1302Cb 0.01 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 1p3b h GLU 1302CO -0.02 0.37 0.16 -0.07 -1.18 0.00 0.00 179.01 178.28 1p3b h LEU 1303N 0.48 0.24 -0.47 1.64 3.38 -1.70 -2.02 115.31 116.85 1p3b h LEU 1303Ca 0.13 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.18 1p3b h LEU 1303Cb 0.01 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 1p3b h LEU 1303CO -0.02 0.18 0.15 0.00 0.09 0.00 0.00 178.44 178.83 1p3b h ALA 1304N 1.17 0.56 -0.67 1.53 0.00 -1.18 0.71 119.26 121.38 1p3b h ALA 1304Ca 0.14 0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.23 1p3b h ALA 1304Cb 0.05 0.06 -0.12 0.00 0.00 0.00 0.00 17.79 17.78 1p3b h ALA 1304CO -0.10 -0.25 -0.35 -0.22 0.00 0.00 0.00 179.25 178.34 1p3b h LYS 1305N 0.31 -0.13 0.00 0.00 3.64 -0.77 0.16 116.57 119.78 1p3b h LYS 1305Ca 0.23 0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.44 1p3b h LYS 1305Cb 0.25 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 1p3b h LYS 1305CO -0.25 -0.08 -0.84 0.45 -2.27 0.00 0.00 179.45 176.46 1p3b h HIS 1306N -0.13 0.00 -0.11 1.91 3.86 -0.86 -3.08 115.15 116.74 1p3b h HIS 1306Ca 0.25 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.48 1p3b h HIS 1306Cb 0.56 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.01 1p3b h HIS 1306CO -0.69 0.84 -0.00 0.00 0.86 0.00 0.00 177.93 178.94 1p3b h ALA 1307N 1.16 0.09 -0.73 2.45 0.00 0.21 -1.85 119.26 120.61 1p3b h ALA 1307Ca -0.01 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1p3b h ALA 1307Cb 1.52 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.32 1p3b h ALA 1307CO 0.11 -0.46 0.46 0.28 0.00 0.00 0.00 179.25 179.64 1p3b h VAL 1308N 0.04 1.10 -0.27 0.00 2.07 -0.82 0.58 116.25 118.95 1p3b h VAL 1308Ca 0.05 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.29 1p3b h VAL 1308Cb 0.06 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 1p3b h VAL 1308CO -0.09 0.16 0.11 0.28 0.02 0.00 0.00 177.57 178.05 1p3b h SER 1309N 0.89 0.15 -0.32 0.57 0.02 -1.36 0.84 113.55 114.34 1p3b h SER 1309Ca 0.29 0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 61.14 1p3b h SER 1309Cb 0.02 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1p3b h SER 1309CO -0.11 0.12 -0.24 -0.33 -1.14 0.00 0.00 176.83 175.13 1p3b h GLU 1310N 0.25 0.81 0.84 3.45 4.39 -1.06 -0.15 114.58 123.11 1p3b h GLU 1310Ca 0.11 -0.34 -0.04 0.00 0.34 0.00 0.00 59.36 59.43 1p3b h GLU 1310Cb 0.06 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1p3b h GLU 1310CO -0.10 0.97 -0.40 0.78 -1.16 0.00 0.00 179.01 179.10 1p3b h GLY 1311N 0.94 -1.18 0.46 -3.84 0.00 -0.23 0.23 103.07 99.45 1p3b h GLY 1311Ca 0.09 0.44 0.12 0.00 0.00 0.00 0.00 47.33 47.98 1p3b h GLY 1311CO 0.06 -0.43 0.63 -0.84 0.00 0.00 0.00 176.54 175.97 1p3b h THR 1312N -1.27 0.91 -0.60 4.70 2.02 0.66 -1.79 112.91 117.54 1p3b h THR 1312Ca -0.12 -0.34 -0.03 0.00 0.77 0.00 0.00 66.41 66.70 1p3b h THR 1312Cb 0.87 -0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1p3b h THR 1312CO 0.19 0.18 0.25 0.50 0.37 0.00 0.00 175.52 177.01 1p3b h LYS 1313N 0.98 0.89 -0.16 6.66 3.64 -0.69 -2.16 116.57 125.74 1p3b h LYS 1313Ca 0.50 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.68 1p3b h LYS 1313Cb 0.51 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1p3b h LYS 1313CO -0.27 0.76 -0.05 0.00 -2.27 0.00 0.00 179.45 177.62 1p3b h ALA 1314N 1.09 0.22 0.06 5.00 0.00 0.28 -2.82 119.26 123.08 1p3b h ALA 1314Ca 0.20 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1p3b h ALA 1314Cb 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1p3b h ALA 1314CO -0.02 -0.01 -0.37 0.28 0.00 0.00 0.00 179.25 179.13 1p3b h VAL 1315N 0.00 0.00 -0.54 0.00 2.07 -1.28 0.01 116.25 116.52 1p3b h VAL 1315Ca 0.04 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.66 1p3b h VAL 1315Cb 0.50 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.16 1p3b h VAL 1315CO 0.02 0.00 -0.22 0.74 0.02 0.00 0.00 177.57 178.13 1p3b h THR 1316N -0.51 0.33 -0.45 2.57 2.02 -1.46 0.37 112.91 115.77 1p3b h THR 1316Ca -0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1p3b h THR 1316Cb 0.53 0.33 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 1p3b h THR 1316CO -0.22 0.00 0.13 0.50 0.37 0.00 0.00 175.52 176.30 1p3b h LYS 1317N -0.09 0.28 -0.90 6.66 3.64 -1.19 0.12 116.57 125.08 1p3b h LYS 1317Ca 0.25 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.63 1p3b h LYS 1317Cb 0.48 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 1p3b h LYS 1317CO -0.60 0.19 0.60 -0.92 -2.27 0.00 0.00 179.45 176.44 1p3b h TYR 1318N 0.29 1.13 -0.21 1.91 3.20 0.68 -2.55 116.97 121.41 1p3b h TYR 1318Ca 0.22 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 62.02 1p3b h TYR 1318Cb 0.24 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 1p3b h TYR 1318CO -0.18 0.70 -0.30 1.15 -1.64 0.00 0.00 178.16 177.89 1p3b h THR 1319N 1.21 1.27 0.00 1.81 2.02 0.79 -3.08 112.91 116.92 1p3b h THR 1319Ca 0.34 -1.33 -0.12 0.00 0.77 0.00 0.00 66.41 66.07 1p3b h THR 1319Cb -0.11 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1p3b h THR 1319CO -0.08 0.41 -0.55 0.77 0.37 0.00 0.00 175.52 176.44 1p3b h SER 1320N 0.37 0.00 -3.56 4.18 4.64 -0.41 -3.44 113.55 115.33 1p3b h SER 1320Ca 0.05 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.85 1p3b h SER 1320Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1p3b h SER 1320CO 0.05 0.55 0.46 0.00 -0.87 0.00 0.00 176.83 177.03 1p3b s ALA 1321N -3.45 3.35 0.00 5.18 0.00 -1.02 -5.11 121.76 120.71 1p3b s ALA 1321Ca -0.00 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.74 1p3b s ALA 1321Cb 0.11 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.89 1p3b s ALA 1321CO 0.74 -0.18 0.00 1.17 0.00 0.00 0.00 175.76 177.49