#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gf9 h GLU 1179N 0.00 0.00 0.45 0.38 4.57 -1.99 0.31 114.58 118.30 3gf9 h GLU 1179Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 3gf9 h GLU 1179Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3gf9 h GLU 1179CO 0.00 0.00 -0.22 -0.09 -1.18 0.00 0.00 179.01 177.52 3gf9 h ARG 1180N 0.00 -0.59 0.18 1.92 9.65 -2.00 -2.71 114.38 120.83 3gf9 h ARG 1180Ca 0.00 0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.92 3gf9 h ARG 1180Cb 0.27 0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 3gf9 h ARG 1180CO 0.00 -0.28 -0.20 0.87 2.80 0.00 0.00 179.97 183.15 3gf9 h LYS 1181N -0.91 -0.37 -0.67 0.20 1.57 -1.45 -2.87 116.57 112.07 3gf9 h LYS 1181Ca -0.06 0.03 0.15 0.00 -1.87 0.00 0.00 60.65 58.89 3gf9 h LYS 1181Cb 0.58 0.08 -0.13 0.00 0.08 0.00 0.00 32.23 32.85 3gf9 h LYS 1181CO 0.10 -0.25 -0.12 -2.13 -0.57 0.00 0.00 179.45 176.48 3gf9 n ARG 1182N -3.58 -0.06 -0.11 3.15 0.63 0.90 0.88 116.66 118.48 3gf9 n ARG 1182Ca -0.05 1.03 -0.02 0.00 -0.92 0.00 0.00 57.85 57.90 3gf9 n ARG 1182Cb 0.18 -1.57 0.22 0.00 0.45 0.00 0.00 32.46 31.74 3gf9 n ARG 1182CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 3gf9 h GLN 1183N 0.00 0.78 -0.05 -0.14 1.08 -1.27 -0.24 115.11 115.28 3gf9 h GLN 1183Ca 0.34 -0.15 -0.19 0.00 -1.45 0.00 0.00 58.65 57.20 3gf9 h GLN 1183Cb 0.57 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.87 3gf9 h GLN 1183CO -0.68 0.70 -0.78 0.78 -0.95 0.00 0.00 178.83 177.90 3gf9 h GLY 1184N 0.94 0.42 1.82 3.46 0.00 0.68 -0.43 103.07 109.96 3gf9 h GLY 1184Ca 0.17 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 3gf9 h GLY 1184CO -0.00 0.57 -0.44 -0.97 0.00 0.00 0.00 176.54 175.69 3gf9 h TYR 1185N 0.25 0.24 -0.17 5.60 0.99 -1.03 -0.15 116.97 122.69 3gf9 h TYR 1185Ca -0.04 -0.07 -0.16 0.00 2.00 0.00 0.00 58.73 60.46 3gf9 h TYR 1185Cb 1.37 -0.05 -0.01 0.00 1.00 0.00 0.00 36.73 39.05 3gf9 h TYR 1185CO 0.05 0.61 -0.56 0.82 -0.00 0.00 0.00 178.16 179.08 3gf9 h ILE 1186N 0.17 1.33 -0.37 -2.88 2.04 -0.93 -2.64 117.51 114.23 3gf9 h ILE 1186Ca 0.01 -1.82 -0.15 0.00 1.00 0.00 0.00 64.86 63.90 3gf9 h ILE 1186Cb 0.85 1.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.72 3gf9 h ILE 1186CO 0.07 0.56 -0.36 -0.74 0.00 0.00 0.00 178.15 177.68 3gf9 h HIS 1187N 0.41 1.02 -0.03 1.37 2.76 -0.83 -2.47 115.15 117.38 3gf9 h HIS 1187Ca 0.01 -0.30 -0.09 0.00 -2.20 0.00 0.00 60.37 57.79 3gf9 h HIS 1187Cb 1.10 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.83 3gf9 h HIS 1187CO 0.04 1.09 -0.41 1.49 -1.30 0.00 0.00 177.93 178.84 3gf9 h GLU 1188N 0.71 0.07 -0.31 5.26 4.81 -1.03 0.31 114.58 124.39 3gf9 h GLU 1188Ca 0.06 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 3gf9 h GLU 1188Cb 0.93 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 3gf9 h GLU 1188CO 0.09 0.47 -0.19 1.25 -0.73 0.00 0.00 179.01 179.91 3gf9 h LEU 1189N 0.06 0.71 -0.30 1.64 5.85 -1.33 -2.16 115.31 119.76 3gf9 h LEU 1189Ca 0.00 -0.42 -0.20 0.00 0.84 0.00 0.00 57.88 58.10 3gf9 h LEU 1189Cb 0.76 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3gf9 h LEU 1189CO 0.06 0.98 -0.85 0.40 -0.34 0.00 0.00 178.44 178.68 3gf9 h ILE 1190N 0.44 1.45 0.37 4.05 2.04 -1.12 -2.14 117.51 122.61 3gf9 h ILE 1190Ca 0.07 -2.48 -0.02 0.00 1.00 0.00 0.00 64.86 63.43 3gf9 h ILE 1190Cb 0.73 2.38 0.00 0.00 -0.74 0.00 0.00 36.82 39.19 3gf9 h ILE 1190CO 0.05 0.73 -0.18 -0.61 0.00 0.00 0.00 178.15 178.14 3gf9 h GLN 1191N 0.16 -0.48 -0.88 2.37 5.75 -0.98 -1.34 115.11 119.71 3gf9 h GLN 1191Ca -0.05 0.03 0.11 0.00 -0.15 0.00 0.00 58.65 58.59 3gf9 h GLN 1191Cb 1.47 0.11 -0.06 0.00 1.07 0.00 0.00 27.48 30.06 3gf9 h GLN 1191CO 0.14 -0.17 0.57 1.79 -2.65 0.00 0.00 178.83 178.50 3gf9 h THR 1192N -0.83 0.93 -0.18 2.39 1.35 -1.44 -0.23 112.91 114.91 3gf9 h THR 1192Ca -0.05 -0.28 -0.01 0.00 -0.55 0.00 0.00 66.41 65.52 3gf9 h THR 1192Cb 0.53 0.05 -0.01 0.00 -1.73 0.00 0.00 68.15 66.99 3gf9 h THR 1192CO 0.08 0.15 0.09 -0.08 -0.25 0.00 0.00 175.52 175.51 3gf9 h GLU 1193N 0.82 0.26 -0.40 4.72 4.57 -1.28 0.47 114.58 123.73 3gf9 h GLU 1193Ca 0.41 -0.04 0.08 0.00 -1.18 0.00 0.00 59.36 58.64 3gf9 h GLU 1193Cb 0.49 -0.05 -0.09 0.00 -0.16 0.00 0.00 28.75 28.94 3gf9 h GLU 1193CO -0.18 0.28 -0.22 0.93 -1.18 0.00 0.00 179.01 178.64 3gf9 h GLU 1194N 0.17 -0.14 -0.58 1.92 4.39 -0.27 -0.16 114.58 119.91 3gf9 h GLU 1194Ca 0.06 0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.71 3gf9 h GLU 1194Cb 0.10 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3gf9 h GLU 1194CO -0.01 -0.10 0.12 -0.09 -1.16 0.00 0.00 179.01 177.78 3gf9 h ARG 1195N -0.15 0.94 -0.77 2.33 9.65 -0.73 -1.83 114.38 123.82 3gf9 h ARG 1195Ca 0.19 -0.24 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 3gf9 h ARG 1195Cb 0.45 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.87 3gf9 h ARG 1195CO -0.49 0.88 0.50 -0.92 2.80 0.00 0.00 179.97 182.74 3gf9 h TYR 1196N 0.84 0.99 -0.51 2.20 3.20 0.25 -0.71 116.97 123.23 3gf9 h TYR 1196Ca 0.18 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.98 3gf9 h TYR 1196Cb 0.37 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.29 3gf9 h TYR 1196CO 0.03 0.63 -0.03 1.98 -1.64 0.00 0.00 178.16 179.12 3gf9 h MET 1197N 1.05 0.89 -0.48 1.82 4.05 -0.78 -1.33 114.93 120.16 3gf9 h MET 1197Ca 0.28 -0.27 -0.01 0.00 -0.28 0.00 0.00 59.70 59.42 3gf9 h MET 1197Cb -0.10 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 30.59 3gf9 h MET 1197CO -0.06 0.91 0.25 0.00 0.23 0.00 0.00 176.91 178.23 3gf9 h ALA 1198N 1.14 0.61 -0.97 0.39 0.00 -0.82 -1.95 119.26 117.66 3gf9 h ALA 1198Ca 0.15 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.03 3gf9 h ALA 1198Cb 0.53 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 3gf9 h ALA 1198CO 0.03 0.15 0.63 -0.44 0.00 0.00 0.00 179.25 179.62 3gf9 h ASP 1199N 0.63 0.97 -0.18 0.00 3.32 -0.87 0.28 116.42 120.57 3gf9 h ASP 1199Ca 0.17 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3gf9 h ASP 1199Cb 0.08 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 3gf9 h ASP 1199CO -0.02 0.61 0.05 -0.07 -1.72 0.00 0.00 179.24 178.08 3gf9 h LEU 1200N 1.10 0.27 -0.13 1.55 3.38 -0.82 -2.87 115.31 117.79 3gf9 h LEU 1200Ca 0.43 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 3gf9 h LEU 1200Cb 0.23 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3gf9 h LEU 1200CO -0.17 0.42 -0.02 1.56 0.09 0.00 0.00 178.44 180.32 3gf9 h GLN 1201N 0.11 0.24 -1.06 1.13 1.08 -0.91 -2.80 115.11 112.90 3gf9 h GLN 1201Ca 0.06 -0.09 0.29 0.00 -1.45 0.00 0.00 58.65 57.46 3gf9 h GLN 1201Cb 0.25 -0.02 -0.12 0.00 -0.05 0.00 0.00 27.48 27.55 3gf9 h GLN 1201CO -0.00 0.51 0.66 1.25 -0.95 0.00 0.00 178.83 180.30 3gf9 h LEU 1202N -0.06 0.50 0.06 1.46 6.46 -0.51 -0.20 115.31 123.02 3gf9 h LEU 1202Ca 0.03 0.12 -0.00 0.00 -0.12 0.00 0.00 57.88 57.91 3gf9 h LEU 1202Cb 0.42 0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.40 3gf9 h LEU 1202CO 0.01 0.02 -0.03 0.58 -0.62 0.00 0.00 178.44 178.40 3gf9 h VAL 1203N 0.40 1.13 -0.99 1.05 2.07 -1.26 0.25 116.25 118.89 3gf9 h VAL 1203Ca 0.66 -0.65 0.11 0.00 0.82 0.00 0.00 66.70 67.63 3gf9 h VAL 1203Cb 1.59 1.56 -0.08 0.00 -1.52 0.00 0.00 31.29 32.84 3gf9 h VAL 1203CO -0.41 0.16 0.63 0.58 0.02 0.00 0.00 177.57 178.55 3gf9 h VAL 1204N -0.37 0.96 0.00 2.57 2.07 -1.17 0.23 116.25 120.53 3gf9 h VAL 1204Ca -0.01 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.16 3gf9 h VAL 1204Cb 0.33 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 3gf9 h VAL 1204CO 0.01 0.19 0.00 -0.62 0.02 0.00 0.00 177.57 177.17 3gf9 n GLU 1205N -4.58 0.00 -0.32 1.57 -0.58 -0.21 -2.14 120.64 114.39 3gf9 n GLU 1205Ca 0.18 0.09 0.10 0.00 -0.42 0.00 0.00 57.16 57.11 3gf9 n GLU 1205Cb 0.32 -0.90 0.32 0.00 -0.57 0.00 0.00 31.44 30.61 3gf9 n GLU 1205CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3gf9 h VAL 1206N 0.00 0.85 0.00 2.62 2.07 -0.60 -3.39 116.25 117.80 3gf9 h VAL 1206Ca 0.00 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 3gf9 h VAL 1206Cb 0.00 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.72 3gf9 h VAL 1206CO 0.00 0.15 -0.81 0.49 0.02 0.00 0.00 177.57 177.42 3gf9 n PHE 1207N -4.60 0.00 -0.06 1.57 3.01 0.66 -4.63 117.46 113.41 3gf9 n PHE 1207Ca 0.19 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.53 3gf9 n PHE 1207Cb 0.44 -0.27 -0.06 0.00 -0.01 0.00 0.00 39.48 39.58 3gf9 n PHE 1207CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 3gf9 h GLN 1208N -0.41 0.36 -0.28 -1.08 4.15 -1.16 -0.06 115.11 116.63 3gf9 h GLN 1208Ca -0.10 -0.15 0.02 0.00 0.77 0.00 0.00 58.65 59.20 3gf9 h GLN 1208Cb 0.69 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.33 3gf9 h GLN 1208CO -0.06 0.65 0.13 0.87 -1.93 0.00 0.00 178.83 178.49 3gf9 h LYS 1209N 0.06 0.27 -0.26 1.69 1.57 -1.63 -1.81 116.57 116.46 3gf9 h LYS 1209Ca 0.04 -0.02 -0.14 0.00 -1.87 0.00 0.00 60.65 58.67 3gf9 h LYS 1209Cb 0.52 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 3gf9 h LYS 1209CO 0.02 0.18 -0.40 0.00 -0.57 0.00 0.00 179.45 178.68 3gf9 h ARG 1210N 0.27 0.63 -0.39 3.15 3.08 -1.74 -2.50 114.38 116.88 3gf9 h ARG 1210Ca 0.12 -0.32 -0.09 0.00 0.07 0.00 0.00 59.98 59.76 3gf9 h ARG 1210Cb 0.05 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3gf9 h ARG 1210CO -0.09 0.92 -0.12 0.52 -1.07 0.00 0.00 179.97 180.13 3gf9 h MET 1211N 0.51 0.69 0.20 0.04 2.86 -0.91 0.15 114.93 118.47 3gf9 h MET 1211Ca 0.04 -0.22 0.01 0.00 -2.06 0.00 0.00 59.70 57.47 3gf9 h MET 1211Cb 0.92 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.49 3gf9 h MET 1211CO 0.08 0.79 -0.24 0.00 1.06 0.00 0.00 176.91 178.60 3gf9 h ALA 1212N 1.24 -0.47 -0.07 6.32 0.00 -1.18 -2.82 119.26 122.28 3gf9 h ALA 1212Ca 0.11 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3gf9 h ALA 1212Cb 0.57 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3gf9 h ALA 1212CO 0.04 -0.80 -0.38 0.93 0.00 0.00 0.00 179.25 179.04 3gf9 h GLU 1213N -0.49 0.14 -0.87 0.00 5.08 -1.32 -3.34 114.58 113.78 3gf9 h GLU 1213Ca 0.01 -0.06 0.22 0.00 -1.00 0.00 0.00 59.36 58.53 3gf9 h GLU 1213Cb 0.48 -0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.59 3gf9 h GLU 1213CO -0.09 0.50 0.26 0.66 -1.00 0.00 0.00 179.01 179.35 3gf9 h SER 1214N 0.12 0.07 0.00 1.42 4.64 -0.42 -3.45 113.55 115.93 3gf9 h SER 1214Ca 0.01 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 3gf9 h SER 1214Cb 0.73 0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 3gf9 h SER 1214CO 0.05 -0.11 0.00 0.61 -0.87 0.00 0.00 176.83 176.51 3gf9 n GLY 1215N -1.37 0.22 0.12 -0.77 0.00 -1.25 -4.93 105.19 97.21 3gf9 n GLY 1215Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 3gf9 n GLY 1215CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3gf9 h PHE 1216N 0.00 0.00 -4.39 1.61 -1.00 -1.87 -3.45 116.94 107.83 3gf9 h PHE 1216Ca 0.00 0.00 -0.70 0.00 2.81 0.00 0.00 57.97 60.08 3gf9 h PHE 1216Cb 0.00 0.00 -0.30 0.00 3.61 0.00 0.00 35.95 39.26 3gf9 h PHE 1216CO 0.00 0.70 -0.88 -0.51 -1.61 0.00 0.00 178.31 176.01 3gf9 s LEU 1217N -7.35 2.12 0.82 1.54 1.43 -1.26 -5.13 118.68 110.85 3gf9 s LEU 1217Ca -0.01 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.52 3gf9 s LEU 1217Cb 0.12 -1.37 0.10 0.00 0.03 0.00 0.00 46.19 45.07 3gf9 s LEU 1217CO 0.77 0.30 1.17 0.42 0.23 0.00 0.00 176.35 179.24 3gf9 s THR 1218N -0.49 2.06 0.21 5.49 -4.23 -1.26 -4.86 115.64 112.55 3gf9 s THR 1218Ca 0.06 -0.08 -0.11 0.00 -1.18 0.00 0.00 61.69 60.39 3gf9 s THR 1218Cb -0.11 -2.99 0.15 0.00 1.34 0.00 0.00 72.50 70.89 3gf9 s THR 1218CO 0.00 0.00 1.88 -0.33 -0.54 0.00 0.00 174.62 175.63 3gf9 h GLU 1219N -1.06 0.97 -0.64 3.99 5.08 -1.99 -1.67 114.58 119.25 3gf9 h GLU 1219Ca -0.45 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 57.82 3gf9 h GLU 1219Cb 1.31 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 3gf9 h GLU 1219CO 0.58 0.64 0.29 0.78 -1.00 0.00 0.00 179.01 180.31 3gf9 h GLY 1220N 1.00 1.00 1.19 -3.84 0.00 -1.99 -1.20 103.07 99.23 3gf9 h GLY 1220Ca 0.27 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 3gf9 h GLY 1220CO -0.06 0.49 0.21 0.83 0.00 0.00 0.00 176.54 178.01 3gf9 h GLU 1221N 0.89 1.02 -0.99 4.80 5.08 -1.84 -1.26 114.58 122.27 3gf9 h GLU 1221Ca 0.22 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3gf9 h GLU 1221Cb 0.15 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 3gf9 h GLU 1221CO -0.02 0.87 0.66 0.52 -1.00 0.00 0.00 179.01 180.03 3gf9 h MET 1222N 0.98 1.30 -0.37 2.33 2.86 -0.89 -2.44 114.93 118.70 3gf9 h MET 1222Ca 0.22 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 57.69 3gf9 h MET 1222Cb 0.27 -0.29 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3gf9 h MET 1222CO -0.01 0.86 -0.13 0.00 1.06 0.00 0.00 176.91 178.69 3gf9 h ALA 1223N 1.36 1.08 -0.57 6.32 0.00 -0.44 -1.23 119.26 125.79 3gf9 h ALA 1223Ca 0.36 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3gf9 h ALA 1223Cb -0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3gf9 h ALA 1223CO -0.08 0.56 0.06 -0.07 0.00 0.00 0.00 179.25 179.72 3gf9 h LEU 1224N 0.60 0.90 0.15 0.00 3.38 -0.94 0.22 115.31 119.61 3gf9 h LEU 1224Ca 0.10 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3gf9 h LEU 1224Cb 0.57 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3gf9 h LEU 1224CO 0.04 0.92 -0.07 0.40 0.09 0.00 0.00 178.44 179.82 3gf9 h ILE 1225N 0.88 0.00 0.00 1.22 2.04 -1.17 -3.14 117.51 117.33 3gf9 h ILE 1225Ca 0.17 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.41 3gf9 h ILE 1225Cb 0.43 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3gf9 h ILE 1225CO 0.01 0.00 -0.31 0.49 0.00 0.00 0.00 178.15 178.35 3gf9 n PHE 1226N -4.25 0.14 0.00 1.37 3.01 -0.49 -4.82 117.46 112.43 3gf9 n PHE 1226Ca -0.02 0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.48 3gf9 n PHE 1226Cb 0.08 -0.44 0.00 0.00 -0.01 0.00 0.00 39.48 39.10 3gf9 n PHE 1226CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3gf9 n VAL 1227N -1.64 0.00 -1.36 -4.37 0.31 0.06 -0.75 118.33 110.59 3gf9 n VAL 1227Ca 0.06 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.06 3gf9 n VAL 1227Cb 0.36 0.00 0.09 0.00 -0.91 0.00 0.00 33.84 33.38 3gf9 n VAL 1227CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3gf9 n ASN 1228N 1.47 7.04 -0.33 4.52 6.94 -1.26 -4.74 115.26 128.89 3gf9 n ASN 1228Ca 0.00 -3.77 0.13 0.00 -0.02 0.00 0.00 54.58 50.92 3gf9 n ASN 1228Cb 0.00 -0.93 0.27 0.00 -2.36 0.00 0.00 39.78 36.76 3gf9 n ASN 1228CO 0.00 0.00 0.00 -0.25 -1.03 0.00 0.00 177.26 175.98 3gf9 h TRP 1229N 1.88 -0.05 -0.14 -2.53 2.91 -1.34 0.20 115.95 116.86 3gf9 h TRP 1229Ca 0.60 0.07 -0.03 0.00 1.13 0.00 0.00 58.89 60.66 3gf9 h TRP 1229Cb 1.11 0.18 -0.01 0.00 -0.51 0.00 0.00 29.16 29.92 3gf9 h TRP 1229CO 1.42 -0.40 -0.04 0.87 -1.03 0.00 0.00 178.44 179.26 3gf9 h LYS 1230N 0.03 0.21 -0.28 2.65 1.79 -1.85 -0.96 116.57 118.15 3gf9 h LYS 1230Ca 0.57 -0.03 -0.15 0.00 -2.18 0.00 0.00 60.65 58.86 3gf9 h LYS 1230Cb 1.15 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.76 3gf9 h LYS 1230CO -0.89 0.26 -0.43 0.93 -1.08 0.00 0.00 179.45 178.24 3gf9 h GLU 1231N 0.20 0.70 -0.52 3.15 5.08 -1.00 -2.12 114.58 120.07 3gf9 h GLU 1231Ca 0.05 -0.38 0.02 0.00 -1.00 0.00 0.00 59.36 58.05 3gf9 h GLU 1231Cb 0.21 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 3gf9 h GLU 1231CO 0.01 0.99 0.31 -0.07 -1.00 0.00 0.00 179.01 179.25 3gf9 h LEU 1232N 0.56 0.51 -0.30 1.33 3.38 -1.01 0.18 115.31 119.96 3gf9 h LEU 1232Ca 0.04 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.03 3gf9 h LEU 1232Cb 0.98 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 3gf9 h LEU 1232CO 0.09 0.36 0.16 0.40 0.09 0.00 0.00 178.44 179.53 3gf9 h ILE 1233N 0.62 1.00 0.27 1.22 2.04 -1.26 -2.16 117.51 119.24 3gf9 h ILE 1233Ca 0.21 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.95 3gf9 h ILE 1233Cb 0.02 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 3gf9 h ILE 1233CO -0.09 0.06 -0.14 0.24 0.00 0.00 0.00 178.15 178.22 3gf9 h MET 1234N 0.33 -0.36 -0.15 2.37 2.86 -0.65 0.21 114.93 119.53 3gf9 h MET 1234Ca 0.12 0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.83 3gf9 h MET 1234Cb 0.03 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 3gf9 h MET 1234CO -0.08 -0.24 0.11 0.66 1.06 0.00 0.00 176.91 178.42 3gf9 h SER 1235N -0.38 0.00 0.44 1.22 4.64 -0.51 -1.56 113.55 117.40 3gf9 h SER 1235Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3gf9 h SER 1235Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3gf9 h SER 1235CO 0.05 0.00 -1.23 0.59 -0.87 0.00 0.00 176.83 175.38 3gf9 n ASN 1236N -4.45 0.55 -0.29 4.97 4.13 -0.83 -3.73 115.26 115.61 3gf9 n ASN 1236Ca 0.01 -0.09 -0.03 0.00 1.68 0.00 0.00 54.58 56.15 3gf9 n ASN 1236Cb 0.24 0.98 0.09 0.00 -1.54 0.00 0.00 39.78 39.55 3gf9 n ASN 1236CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 3gf9 h THR 1237N 0.00 1.16 -0.66 3.41 2.02 0.47 -0.59 112.91 118.71 3gf9 h THR 1237Ca 0.00 -0.35 -0.09 0.00 0.77 0.00 0.00 66.41 66.74 3gf9 h THR 1237Cb 0.83 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 3gf9 h THR 1237CO 0.00 0.19 0.08 0.11 0.37 0.00 0.00 175.52 176.27 3gf9 h LYS 1238N 1.02 1.11 -0.27 6.66 6.56 -1.64 -2.38 116.57 127.63 3gf9 h LYS 1238Ca 0.31 -0.31 -0.07 0.00 -1.06 0.00 0.00 60.65 59.51 3gf9 h LYS 1238Cb -0.05 -0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 31.48 3gf9 h LYS 1238CO -0.09 1.03 -0.12 1.25 -2.06 0.00 0.00 179.45 179.46 3gf9 h LEU 1239N 1.03 0.58 -0.42 2.94 5.85 -1.55 -0.85 115.31 122.90 3gf9 h LEU 1239Ca 0.20 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 3gf9 h LEU 1239Cb 0.48 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 3gf9 h LEU 1239CO 0.02 0.85 0.22 0.25 -0.34 0.00 0.00 178.44 179.44 3gf9 h LEU 1240N 0.31 0.53 -0.67 2.25 5.85 -1.04 -1.65 115.31 120.88 3gf9 h LEU 1240Ca 0.06 -0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 3gf9 h LEU 1240Cb 0.63 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3gf9 h LEU 1240CO 0.04 0.48 0.07 0.11 -0.34 0.00 0.00 178.44 178.80 3gf9 h LYS 1241N 0.54 1.10 0.00 1.25 1.57 -1.43 0.96 116.57 120.55 3gf9 h LYS 1241Ca 0.15 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3gf9 h LYS 1241Cb 0.08 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 3gf9 h LYS 1241CO -0.02 1.02 -0.00 0.00 -0.57 0.00 0.00 179.45 179.88 3gf9 h ALA 1242N 1.05 1.07 0.02 3.86 0.00 -0.78 -1.27 119.26 123.21 3gf9 h ALA 1242Ca 0.19 -0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.75 3gf9 h ALA 1242Cb 0.49 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 3gf9 h ALA 1242CO 0.02 0.01 -2.14 1.28 0.00 0.00 0.00 179.25 178.42 3gf9 n LEU 1243N -3.19 1.23 -0.11 0.00 4.77 -0.50 -3.65 117.00 115.55 3gf9 n LEU 1243Ca -0.03 0.13 -0.11 0.00 -0.03 0.00 0.00 56.01 55.98 3gf9 n LEU 1243Cb 0.10 -0.11 0.02 0.00 -2.33 0.00 0.00 43.42 41.10 3gf9 n LEU 1243CO 0.22 0.60 0.60 0.03 -1.33 0.00 0.00 177.39 177.51 3gf9 h ARG 1244N 0.01 0.88 -0.14 3.23 3.08 -0.55 -2.97 114.38 117.92 3gf9 h ARG 1244Ca -0.46 -0.43 -0.10 0.00 0.07 0.00 0.00 59.98 59.07 3gf9 h ARG 1244Cb 2.08 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 32.12 3gf9 h ARG 1244CO 0.03 1.07 -0.37 0.28 -1.07 0.00 0.00 179.97 179.92 3gf9 h VAL 1245N 0.73 1.29 0.00 2.04 2.07 -1.42 -1.40 116.25 119.57 3gf9 h VAL 1245Ca 0.07 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 66.16 3gf9 h VAL 1245Cb 0.90 1.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 3gf9 h VAL 1245CO 0.08 0.43 0.00 -1.14 0.02 0.00 0.00 177.57 176.96 3gf9 n ARG 1246N -4.06 0.09 -3.60 1.57 3.00 -1.21 -5.12 116.66 107.33 3gf9 n ARG 1246Ca -0.01 0.03 -0.37 0.00 -0.00 0.00 0.00 57.85 57.49 3gf9 n ARG 1246Cb 0.45 -1.50 -0.10 0.00 0.00 0.00 0.00 32.46 31.32 3gf9 n ARG 1246CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3gf9 s LYS 1247N -2.91 4.05 0.00 -0.14 3.01 -0.53 -4.98 119.74 118.24 3gf9 s LYS 1247Ca 0.16 -0.22 0.00 0.00 -1.01 0.00 0.00 55.97 54.90 3gf9 s LYS 1247Cb 0.18 -3.57 0.00 0.00 -1.01 0.00 0.00 37.83 33.43 3gf9 s LYS 1247CO 0.49 -0.02 0.00 1.55 0.51 0.00 0.00 175.35 177.88 3gf9 n VAL 1256N 4.50 0.00 0.89 3.17 3.14 -1.26 -5.10 118.33 123.67 3gf9 n VAL 1256Ca -0.14 0.00 0.09 0.00 -2.96 0.00 0.00 64.34 61.34 3gf9 n VAL 1256Cb 0.52 0.00 -0.11 0.00 -1.06 0.00 0.00 33.84 33.18 3gf9 n VAL 1256CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3gf9 n GLN 1257N 0.00 0.46 -3.67 1.45 3.00 -1.26 -4.94 117.38 112.43 3gf9 n GLN 1257Ca 0.00 -0.01 -0.19 0.00 -0.01 0.00 0.00 57.00 56.80 3gf9 n GLN 1257Cb 0.00 -1.44 -0.17 0.00 0.00 0.00 0.00 30.24 28.63 3gf9 n GLN 1257CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.06 175.42 3gf9 s MET 1258N -2.90 -0.03 0.00 -1.09 1.00 -1.26 -4.52 119.30 110.50 3gf9 s MET 1258Ca 0.07 0.45 0.00 0.00 0.00 0.00 0.00 55.69 56.21 3gf9 s MET 1258Cb 0.15 -0.41 0.00 0.00 0.00 0.00 0.00 34.83 34.57 3gf9 s MET 1258CO 0.82 -0.32 0.00 1.51 0.00 0.00 0.00 175.02 177.03 3gf9 n ILE 1259N 5.29 0.00 -0.39 2.53 3.06 -1.26 -4.89 119.36 123.70 3gf9 n ILE 1259Ca -0.04 0.00 0.32 0.00 -2.50 0.00 0.00 62.75 60.53 3gf9 n ILE 1259Cb 0.50 0.00 0.63 0.00 0.54 0.00 0.00 39.64 41.31 3gf9 n ILE 1259CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 3gf9 h GLY 1260N 0.00 0.89 0.50 4.50 0.00 -1.86 -0.92 103.07 106.19 3gf9 h GLY 1260Ca 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 3gf9 h GLY 1260CO 0.00 -0.18 -0.00 1.29 0.00 0.00 0.00 176.54 177.65 3gf9 h ASP 1261N 0.18 -0.00 -0.70 0.19 -0.00 -1.90 0.69 116.42 114.88 3gf9 h ASP 1261Ca 0.69 -0.50 0.15 0.00 -0.00 0.00 0.00 57.03 57.37 3gf9 h ASP 1261Cb 2.19 0.00 -0.12 0.00 -0.00 0.00 0.00 39.33 41.40 3gf9 h ASP 1261CO -0.25 0.50 0.01 0.40 -0.00 0.00 0.00 179.24 179.89 3gf9 h ILE 1262N -0.50 0.41 -0.13 4.15 2.04 -1.53 -1.85 117.51 120.09 3gf9 h ILE 1262Ca -0.00 -0.04 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 3gf9 h ILE 1262Cb 0.50 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3gf9 h ILE 1262CO 0.00 0.02 -0.29 -0.07 0.00 0.00 0.00 178.15 177.81 3gf9 h LEU 1263N 0.12 0.48 -1.38 1.44 3.38 -1.25 -1.27 115.31 116.83 3gf9 h LEU 1263Ca 0.38 -0.57 0.04 0.00 0.09 0.00 0.00 57.88 57.81 3gf9 h LEU 1263Cb 0.64 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 3gf9 h LEU 1263CO -0.60 0.96 0.45 0.00 0.09 0.00 0.00 178.44 179.34 3gf9 h ALA 1264N 0.53 1.63 0.19 1.53 0.00 -0.71 0.11 119.26 122.54 3gf9 h ALA 1264Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3gf9 h ALA 1264Cb 0.89 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3gf9 h ALA 1264CO 0.06 0.30 -0.09 0.00 0.00 0.00 0.00 179.25 179.52 3gf9 h ALA 1265N 1.60 -0.25 -0.62 0.00 0.00 -1.25 -3.30 119.26 115.44 3gf9 h ALA 1265Ca 0.28 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3gf9 h ALA 1265Cb 0.09 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3gf9 h ALA 1265CO -0.08 -0.29 0.28 0.93 0.00 0.00 0.00 179.25 180.09 3gf9 h GLU 1266N -0.95 0.91 0.00 0.00 4.39 -1.12 -2.25 114.58 115.56 3gf9 h GLU 1266Ca -0.03 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.53 3gf9 h GLU 1266Cb 0.46 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 3gf9 h GLU 1266CO 0.04 0.74 0.00 1.28 -1.16 0.00 0.00 179.01 179.92 3gf9 n LEU 1267N -4.48 0.00 -0.77 1.33 4.77 0.36 -1.58 117.00 116.64 3gf9 n LEU 1267Ca 0.04 0.30 0.08 0.00 -0.03 0.00 0.00 56.01 56.40 3gf9 n LEU 1267Cb 0.14 -0.30 0.15 0.00 -2.33 0.00 0.00 43.42 41.08 3gf9 n LEU 1267CO 0.38 -0.23 0.60 -1.54 -1.33 0.00 0.00 177.39 175.28 3gf9 n SER 1268N -1.30 2.87 -2.10 -1.43 3.41 -0.84 -4.23 113.62 110.00 3gf9 n SER 1268Ca 0.03 -1.86 -0.25 0.00 -0.26 0.00 0.00 58.87 56.54 3gf9 n SER 1268Cb 0.06 -0.19 0.02 0.00 -0.26 0.00 0.00 64.21 63.83 3gf9 n SER 1268CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3gf9 n HIS 1269N 0.87 2.87 -1.17 7.33 8.25 -0.61 -4.80 115.22 127.95 3gf9 n HIS 1269Ca 0.13 -2.38 -0.01 0.00 -0.26 0.00 0.00 57.72 55.20 3gf9 n HIS 1269Cb 0.45 -0.31 0.25 0.00 1.12 0.00 0.00 29.99 31.49 3gf9 n HIS 1269CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3gf9 n MET 1270N -0.67 2.74 -0.27 -0.41 2.00 -1.26 -4.72 117.12 114.53 3gf9 n MET 1270Ca 0.43 -3.03 0.17 0.00 0.00 0.00 0.00 57.70 55.27 3gf9 n MET 1270Cb 0.91 -1.95 0.46 0.00 0.00 0.00 0.00 33.22 32.64 3gf9 n MET 1270CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 3gf9 h GLN 1271N 1.71 0.50 -1.09 0.03 1.08 -1.93 -0.92 115.11 114.48 3gf9 h GLN 1271Ca 0.18 -0.03 0.30 0.00 -1.45 0.00 0.00 58.65 57.65 3gf9 h GLN 1271Cb 1.84 -0.11 -0.09 0.00 -0.05 0.00 0.00 27.48 29.06 3gf9 h GLN 1271CO 0.47 0.33 0.72 0.00 -0.95 0.00 0.00 178.83 179.39 3gf9 h ALA 1272N 1.61 2.42 -0.19 3.87 0.00 -1.94 -0.20 119.26 124.84 3gf9 h ALA 1272Ca 0.49 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.30 3gf9 h ALA 1272Cb 1.06 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3gf9 h ALA 1272CO -0.22 -0.84 -0.49 1.88 0.00 0.00 0.00 179.25 179.58 3gf9 h TYR 1273N 0.30 0.63 -0.30 0.00 0.05 -1.56 -1.63 116.97 114.47 3gf9 h TYR 1273Ca 0.61 -0.21 0.02 0.00 0.05 0.00 0.00 58.73 59.20 3gf9 h TYR 1273Cb 1.74 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 39.33 3gf9 h TYR 1273CO -0.00 0.91 0.16 0.82 -1.05 0.00 0.00 178.16 178.99 3gf9 h ILE 1274N 0.41 1.01 -0.40 -2.88 5.03 -1.13 0.14 117.51 119.68 3gf9 h ILE 1274Ca 0.02 -0.11 -0.01 0.00 -0.12 0.00 0.00 64.86 64.64 3gf9 h ILE 1274Cb 1.01 0.65 -0.02 0.00 -3.03 0.00 0.00 36.82 35.43 3gf9 h ILE 1274CO 0.09 0.06 0.20 -0.09 -0.68 0.00 0.00 178.15 177.73 3gf9 h ARG 1275N 0.33 0.57 0.04 2.37 2.43 -1.45 -1.95 114.38 116.71 3gf9 h ARG 1275Ca 0.12 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3gf9 h ARG 1275Cb 0.02 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3gf9 h ARG 1275CO -0.07 0.48 -0.02 0.35 -1.51 0.00 0.00 179.97 179.20 3gf9 h PHE 1276N 0.51 -0.04 -0.35 2.20 3.57 -1.04 -3.03 116.94 118.75 3gf9 h PHE 1276Ca 0.14 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.56 3gf9 h PHE 1276Cb 0.09 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 3gf9 h PHE 1276CO -0.02 0.03 -0.11 0.00 -2.23 0.00 0.00 178.31 175.98 3gf9 n SER 1278N -4.19 0.66 -0.00 0.00 3.41 -0.74 -3.54 113.62 109.23 3gf9 n SER 1278Ca 0.01 0.61 0.02 0.00 -0.26 0.00 0.00 58.87 59.25 3gf9 n SER 1278Cb 0.34 -0.77 -0.02 0.00 -0.26 0.00 0.00 64.21 63.49 3gf9 n SER 1278CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gf9 h GLN 1280N 0.00 0.56 -0.36 0.00 -0.00 -1.30 -3.10 115.11 110.91 3gf9 h GLN 1280Ca 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.59 3gf9 h GLN 1280Cb 0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 27.48 27.44 3gf9 h GLN 1280CO 0.00 0.44 0.23 -0.07 0.00 0.00 0.00 178.83 179.42 3gf9 h LEU 1281N 0.53 0.41 -0.78 -2.39 3.38 -1.87 -0.08 115.31 114.51 3gf9 h LEU 1281Ca 0.14 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.12 3gf9 h LEU 1281Cb 0.03 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 3gf9 h LEU 1281CO -0.02 0.31 0.51 0.78 0.09 0.00 0.00 178.44 180.10 3gf9 h ASN 1282N 0.49 0.86 -0.88 -0.43 2.35 -1.88 0.25 115.58 116.33 3gf9 h ASN 1282Ca 0.13 -0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.89 3gf9 h ASN 1282Cb -0.04 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.08 3gf9 h ASN 1282CO -0.03 0.61 0.57 1.23 -1.65 0.00 0.00 177.43 178.17 3gf9 h GLY 1283N 1.01 1.27 1.07 2.83 0.00 -1.03 -1.09 103.07 107.14 3gf9 h GLY 1283Ca 0.30 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 47.07 3gf9 h GLY 1283CO -0.08 0.38 -0.17 0.00 0.00 0.00 0.00 176.54 176.67 3gf9 h ALA 1284N 1.36 0.64 -0.71 3.60 0.00 -0.41 -0.19 119.26 123.55 3gf9 h ALA 1284Ca 0.35 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3gf9 h ALA 1284Cb -0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3gf9 h ALA 1284CO -0.11 0.60 0.26 0.00 0.00 0.00 0.00 179.25 179.99 3gf9 h ALA 1285N 0.86 0.93 -0.05 0.00 0.00 -0.70 -1.75 119.26 118.55 3gf9 h ALA 1285Ca 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3gf9 h ALA 1285Cb 0.74 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3gf9 h ALA 1285CO 0.06 0.58 0.00 1.25 0.00 0.00 0.00 179.25 181.14 3gf9 h LEU 1286N 1.04 0.08 -1.62 0.00 5.85 -0.77 0.11 115.31 120.00 3gf9 h LEU 1286Ca 0.23 -0.30 0.13 0.00 0.84 0.00 0.00 57.88 58.78 3gf9 h LEU 1286Cb 0.25 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 3gf9 h LEU 1286CO -0.01 0.36 0.46 0.25 -0.34 0.00 0.00 178.44 179.16 3gf9 h LEU 1287N -0.20 0.36 0.33 2.25 5.85 -1.04 0.15 115.31 123.01 3gf9 h LEU 1287Ca 0.01 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 3gf9 h LEU 1287Cb 0.32 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.29 3gf9 h LEU 1287CO 0.00 0.20 -0.16 -0.61 -0.34 0.00 0.00 178.44 177.54 3gf9 h GLN 1288N 0.40 -0.42 -0.06 1.25 5.75 -0.55 -1.94 115.11 119.54 3gf9 h GLN 1288Ca 0.33 0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.88 3gf9 h GLN 1288Cb 0.73 0.10 -0.06 0.00 1.07 0.00 0.00 27.48 29.32 3gf9 h GLN 1288CO -0.10 -0.10 -0.54 1.96 -2.65 0.00 0.00 178.83 177.41 3gf9 h GLN 1289N -0.92 -0.61 -1.04 1.69 4.20 -0.38 0.28 115.11 118.33 3gf9 h GLN 1289Ca -0.04 0.04 0.32 0.00 0.06 0.00 0.00 58.65 59.03 3gf9 h GLN 1289Cb 0.52 0.14 -0.14 0.00 0.30 0.00 0.00 27.48 28.30 3gf9 h GLN 1289CO 0.07 -0.41 0.61 -0.22 -0.67 0.00 0.00 178.83 178.22 3gf9 h LYS 1290N -0.64 0.32 -0.02 1.46 1.63 -0.80 -0.91 116.57 117.61 3gf9 h LYS 1290Ca 0.02 -0.02 -0.11 0.00 -0.85 0.00 0.00 60.65 59.69 3gf9 h LYS 1290Cb 0.71 -0.07 0.01 0.00 -0.60 0.00 0.00 32.23 32.27 3gf9 h LYS 1290CO -0.39 0.21 -0.42 1.15 -3.45 0.00 0.00 179.45 176.54 3gf9 h THR 1291N 0.33 1.46 -0.86 1.00 2.02 -0.15 -3.01 112.91 113.71 3gf9 h THR 1291Ca 0.72 -1.94 0.15 0.00 0.77 0.00 0.00 66.41 66.11 3gf9 h THR 1291Cb 1.72 2.57 -0.07 0.00 -1.74 0.00 0.00 68.15 70.63 3gf9 h THR 1291CO -0.54 0.55 0.56 0.44 0.37 0.00 0.00 175.52 176.90 3gf9 h ASP 1292N -0.23 0.57 0.44 4.18 3.32 0.78 -3.03 116.42 122.45 3gf9 h ASP 1292Ca -0.05 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3gf9 h ASP 1292Cb 1.13 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.61 3gf9 h ASP 1292CO 0.08 0.29 -1.11 -1.84 -1.72 0.00 0.00 179.24 174.94 3gf9 n GLU 1293N -4.54 0.34 -3.74 3.56 0.28 -0.71 -4.80 120.64 111.03 3gf9 n GLU 1293Ca 0.17 -0.01 -0.30 0.00 -0.16 0.00 0.00 57.16 56.86 3gf9 n GLU 1293Cb 0.50 -1.61 -0.15 0.00 1.43 0.00 0.00 31.44 31.61 3gf9 n GLU 1293CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 3gf9 s ASP 1294N -4.09 4.01 0.32 -1.84 -1.08 -1.14 -4.99 116.67 107.86 3gf9 s ASP 1294Ca 0.02 -1.62 0.03 0.00 -0.52 0.00 0.00 52.55 50.46 3gf9 s ASP 1294Cb 0.14 -0.87 0.61 0.00 -1.46 0.00 0.00 42.92 41.33 3gf9 s ASP 1294CO 0.81 -0.41 1.93 0.74 0.52 0.00 0.00 175.17 178.76 3gf9 h THR 1295N 6.50 1.05 -0.31 1.71 2.02 -1.87 -0.98 112.91 121.02 3gf9 h THR 1295Ca -0.14 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 66.68 3gf9 h THR 1295Cb 1.02 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 3gf9 h THR 1295CO 0.47 0.17 0.01 0.44 0.37 0.00 0.00 175.52 176.98 3gf9 h ASP 1296N 0.93 0.52 -0.63 4.18 3.32 -1.94 -1.42 116.42 121.38 3gf9 h ASP 1296Ca 0.37 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3gf9 h ASP 1296Cb 0.23 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 3gf9 h ASP 1296CO -0.13 0.69 0.41 0.15 -1.72 0.00 0.00 179.24 178.64 3gf9 h PHE 1297N 0.33 0.80 -0.07 4.55 3.57 -1.77 -1.53 116.94 122.83 3gf9 h PHE 1297Ca 0.09 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 3gf9 h PHE 1297Cb 0.41 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 3gf9 h PHE 1297CO 0.03 0.51 0.03 -0.22 -2.23 0.00 0.00 178.31 176.43 3gf9 h LYS 1298N 0.85 0.10 -0.24 1.11 3.64 -0.96 -1.73 116.57 119.34 3gf9 h LYS 1298Ca 0.23 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.55 3gf9 h LYS 1298Cb -0.09 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 3gf9 h LYS 1298CO -0.05 0.19 -0.05 0.93 -2.27 0.00 0.00 179.45 178.20 3gf9 h GLU 1299N -0.02 0.36 -0.67 1.90 5.08 -1.17 -2.44 114.58 117.63 3gf9 h GLU 1299Ca 0.02 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 3gf9 h GLU 1299Cb 0.12 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3gf9 h GLU 1299CO -0.00 0.43 0.19 0.35 -1.00 0.00 0.00 179.01 178.98 3gf9 h PHE 1300N 0.35 1.09 -0.56 4.33 3.57 -0.80 -0.58 116.94 124.33 3gf9 h PHE 1300Ca 0.08 -0.12 -0.10 0.00 3.53 0.00 0.00 57.97 61.36 3gf9 h PHE 1300Cb 0.32 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 3gf9 h PHE 1300CO 0.01 0.89 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.88 3gf9 h LEU 1301N 0.98 1.00 -1.02 0.59 3.38 -0.90 -2.45 115.31 116.89 3gf9 h LEU 1301Ca 0.21 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 3gf9 h LEU 1301Cb 0.32 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3gf9 h LEU 1301CO -0.00 1.07 -0.47 0.11 0.09 0.00 0.00 178.44 179.24 3gf9 h LYS 1302N 0.90 0.00 0.13 1.13 1.57 -1.25 -2.45 116.57 116.59 3gf9 h LYS 1302Ca 0.16 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3gf9 h LYS 1302Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3gf9 h LYS 1302CO 0.03 0.47 -0.06 0.87 -0.57 0.00 0.00 179.45 180.19 3gf9 h LYS 1303N 0.00 -0.16 -0.74 3.15 1.79 -0.70 -2.67 116.57 117.23 3gf9 h LYS 1303Ca -0.00 0.01 0.15 0.00 -2.18 0.00 0.00 60.65 58.62 3gf9 h LYS 1303Cb 0.87 0.04 -0.10 0.00 -1.58 0.00 0.00 32.23 31.46 3gf9 h LYS 1303CO 0.06 -0.04 0.27 -0.07 -1.08 0.00 0.00 179.45 178.59 3gf9 h LEU 1304N -0.25 0.21 -1.63 2.94 3.38 -1.18 0.38 115.31 119.15 3gf9 h LEU 1304Ca -0.02 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3gf9 h LEU 1304Cb 0.20 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3gf9 h LEU 1304CO 0.03 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.62 3gf9 h ALA 1305N 1.56 1.00 0.00 1.53 0.00 -1.17 -1.71 119.26 120.47 3gf9 h ALA 1305Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3gf9 h ALA 1305Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3gf9 h ALA 1305CO -0.43 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 177.69 3gf9 n SER 1306N -2.51 0.44 -4.67 0.00 3.41 0.13 -3.67 113.62 106.75 3gf9 n SER 1306Ca -0.01 0.59 -0.46 0.00 -0.26 0.00 0.00 58.87 58.73 3gf9 n SER 1306Cb 0.11 -0.69 -0.04 0.00 -0.26 0.00 0.00 64.21 63.33 3gf9 n SER 1306CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3gf9 n ASP 1307N -1.96 2.99 0.24 4.04 -0.08 -0.65 -4.82 116.55 116.31 3gf9 n ASP 1307Ca 0.03 1.10 0.16 0.00 -1.51 0.00 0.00 54.79 54.58 3gf9 n ASP 1307Cb 0.25 -1.42 0.73 0.00 2.34 0.00 0.00 41.12 43.01 3gf9 n ASP 1307CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3gf9 h PRO 1308N 5.45 0.00 0.00 -0.67 0.11 -1.91 -1.34 132.00 133.63 3gf9 h PRO 1308Ca -0.45 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.50 3gf9 h PRO 1308Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 3gf9 h PRO 1308CO 0.85 0.00 -0.77 0.00 -0.21 0.00 0.00 178.00 177.87 3gf9 h ARG 1309N 0.00 0.00 0.00 1.05 3.08 -1.91 -3.22 114.38 113.38 3gf9 h ARG 1309Ca 0.08 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.00 3gf9 h ARG 1309Cb 0.97 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 3gf9 h ARG 1309CO -0.00 0.77 -0.62 0.00 -1.07 0.00 0.00 179.97 179.05 3gf9 n LYS 1311N -3.49 -2.12 0.00 0.00 4.01 -1.22 -2.38 118.16 112.97 3gf9 n LYS 1311Ca 0.00 0.55 0.00 0.00 -0.51 0.00 0.00 58.31 58.35 3gf9 n LYS 1311Cb 0.69 -4.66 0.00 0.00 -0.51 0.00 0.00 35.03 30.55 3gf9 n LYS 1311CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3gf9 n GLY 1312N -1.13 2.77 3.71 0.72 0.00 -1.24 -5.02 105.19 105.00 3gf9 n GLY 1312Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 3gf9 n GLY 1312CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3gf9 s MET 1313N -0.08 4.29 0.73 1.61 -1.94 -1.00 -4.95 119.30 117.96 3gf9 s MET 1313Ca 0.00 2.12 -0.11 0.00 -1.71 0.00 0.00 55.69 55.99 3gf9 s MET 1313Cb 0.00 -3.31 0.03 0.00 2.01 0.00 0.00 34.83 33.56 3gf9 s MET 1313CO 0.00 -0.50 1.08 -1.25 -0.01 0.00 0.00 175.02 174.34 3gf9 s PRO 1314N 1.41 2.66 0.18 2.03 0.05 -1.26 -4.81 135.00 135.25 3gf9 s PRO 1314Ca 0.66 0.67 -0.13 0.00 0.05 0.00 0.00 61.00 62.25 3gf9 s PRO 1314Cb -0.37 -1.98 0.16 0.00 0.05 0.00 0.00 34.50 32.36 3gf9 s PRO 1314CO 0.30 -1.22 1.73 1.25 0.05 0.00 0.00 177.00 179.11 3gf9 h LEU 1315N -0.80 0.06 -1.72 -3.56 5.85 -1.95 -0.56 115.31 112.64 3gf9 h LEU 1315Ca -0.45 0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.46 3gf9 h LEU 1315Cb 1.24 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.34 3gf9 h LEU 1315CO 0.60 0.07 0.58 0.77 -0.34 0.00 0.00 178.44 180.12 3gf9 h SER 1316N 0.27 0.00 0.80 1.25 4.64 -1.99 0.15 113.55 118.66 3gf9 h SER 1316Ca 0.23 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.31 3gf9 h SER 1316Cb 0.28 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 3gf9 h SER 1316CO -0.28 0.00 -1.25 0.77 -0.87 0.00 0.00 176.83 175.20 3gf9 h SER 1317N 0.00 0.04 0.87 4.97 4.64 -1.45 -3.26 113.55 119.36 3gf9 h SER 1317Ca 0.19 -0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.31 3gf9 h SER 1317Cb 1.35 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.41 3gf9 h SER 1317CO -0.00 1.04 -0.70 -0.26 -0.87 0.00 0.00 176.83 176.04 3gf9 h PHE 1318N 0.01 0.00 0.00 4.77 -1.00 -0.75 -3.17 116.94 116.80 3gf9 h PHE 1318Ca -0.11 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.67 3gf9 h PHE 1318Cb 1.87 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.43 3gf9 h PHE 1318CO 0.01 0.70 0.00 1.28 -1.61 0.00 0.00 178.31 178.69 3gf9 n LEU 1319N -3.55 0.61 0.15 1.54 4.77 -0.60 -2.79 117.00 117.14 3gf9 n LEU 1319Ca -0.00 0.59 0.03 0.00 -0.03 0.00 0.00 56.01 56.60 3gf9 n LEU 1319Cb 0.72 -0.44 0.16 0.00 -2.33 0.00 0.00 43.42 41.53 3gf9 n LEU 1319CO 0.43 -0.30 0.54 -0.07 -1.33 0.00 0.00 177.39 176.65 3gf9 h LEU 1320N 0.00 0.00 -0.48 2.23 3.38 -1.59 -3.40 115.31 115.46 3gf9 h LEU 1320Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3gf9 h LEU 1320Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3gf9 h LEU 1320CO 0.00 0.49 0.04 0.11 0.09 0.00 0.00 178.44 179.17 3gf9 h LYS 1321N 0.00 0.82 -0.66 1.13 1.57 -1.64 -2.90 116.57 114.88 3gf9 h LYS 1321Ca -0.00 -0.24 0.13 0.00 -1.87 0.00 0.00 60.65 58.66 3gf9 h LYS 1321Cb 1.19 -0.09 -0.13 0.00 0.08 0.00 0.00 32.23 33.29 3gf9 h LYS 1321CO 0.06 0.85 -0.21 -1.35 -0.57 0.00 0.00 179.45 178.23 3gf9 h PRO 1322N 0.69 -0.04 -0.34 3.15 0.11 -1.78 0.22 132.00 134.01 3gf9 h PRO 1322Ca 0.14 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.12 3gf9 h PRO 1322Cb 0.45 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 3gf9 h PRO 1322CO 0.02 -0.02 -0.33 1.98 -0.21 0.00 0.00 178.00 179.43 3gf9 h MET 1323N -0.04 0.75 -0.63 1.05 1.85 -1.81 -2.61 114.93 113.48 3gf9 h MET 1323Ca 0.31 -0.35 0.00 0.00 -0.61 0.00 0.00 59.70 59.05 3gf9 h MET 1323Cb 0.51 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.50 3gf9 h MET 1323CO -0.70 0.97 0.40 1.96 -0.40 0.00 0.00 176.91 179.15 3gf9 h GLN 1324N 0.63 0.84 -0.02 0.39 4.20 -1.20 -2.30 115.11 117.65 3gf9 h GLN 1324Ca 0.07 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.73 3gf9 h GLN 1324Cb 0.86 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 3gf9 h GLN 1324CO 0.08 0.57 -0.08 -0.09 -0.67 0.00 0.00 178.83 178.63 3gf9 h ARG 1325N 0.85 -0.13 -0.84 1.46 9.65 -0.33 -1.75 114.38 123.29 3gf9 h ARG 1325Ca 0.23 0.01 0.16 0.00 -1.10 0.00 0.00 59.98 59.28 3gf9 h ARG 1325Cb -0.07 0.03 -0.10 0.00 -1.39 0.00 0.00 29.97 28.44 3gf9 h ARG 1325CO -0.05 -0.09 0.39 0.82 2.80 0.00 0.00 179.97 183.84 3gf9 h ILE 1326N -0.14 0.65 0.00 1.20 1.08 -1.34 0.38 117.51 119.34 3gf9 h ILE 1326Ca 0.04 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 3gf9 h ILE 1326Cb 0.19 0.08 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 3gf9 h ILE 1326CO -0.10 0.10 0.00 0.35 -0.69 0.00 0.00 178.15 177.81 3gf9 n THR 1327N -4.95 0.39 -0.03 -0.27 -2.24 -0.87 -3.32 114.28 102.99 3gf9 n THR 1327Ca 0.17 0.10 -0.13 0.00 -2.27 0.00 0.00 64.05 61.93 3gf9 n THR 1327Cb 0.48 -0.71 -0.14 0.00 -2.10 0.00 0.00 70.33 67.86 3gf9 n THR 1327CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3gf9 n ARG 1328N -1.43 0.67 -0.13 -0.78 0.63 0.13 -4.46 116.66 111.30 3gf9 n ARG 1328Ca 0.07 0.24 -0.05 0.00 -0.92 0.00 0.00 57.85 57.19 3gf9 n ARG 1328Cb 0.24 -1.72 0.01 0.00 0.45 0.00 0.00 32.46 31.44 3gf9 n ARG 1328CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 3gf9 h TYR 1329N 0.02 -0.61 -0.70 -0.14 -1.99 -1.39 0.67 116.97 112.83 3gf9 h TYR 1329Ca -0.38 0.05 0.09 0.00 2.00 0.00 0.00 58.73 60.49 3gf9 h TYR 1329Cb 2.05 0.34 -0.04 0.00 2.00 0.00 0.00 36.73 41.07 3gf9 h TYR 1329CO 0.02 -0.31 0.46 -1.35 -0.00 0.00 0.00 178.16 176.98 3gf9 h PRO 1330N -0.15 0.60 -0.19 4.88 0.11 -1.79 -0.32 132.00 135.15 3gf9 h PRO 1330Ca 0.20 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.24 3gf9 h PRO 1330Cb 0.47 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 3gf9 h PRO 1330CO -0.53 0.40 -0.04 -0.07 -0.21 0.00 0.00 178.00 177.55 3gf9 h LEU 1331N 0.62 0.36 -0.58 2.35 3.38 -1.15 -0.49 115.31 119.79 3gf9 h LEU 1331Ca 0.31 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 3gf9 h LEU 1331Cb 0.41 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3gf9 h LEU 1331CO -0.11 0.64 0.27 -0.07 0.09 0.00 0.00 178.44 179.27 3gf9 h LEU 1332N 0.08 0.77 -0.76 1.67 3.38 -0.32 -2.21 115.31 117.92 3gf9 h LEU 1332Ca 0.05 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 3gf9 h LEU 1332Cb 0.48 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3gf9 h LEU 1332CO 0.02 0.69 -0.18 0.40 0.09 0.00 0.00 178.44 179.46 3gf9 h ILE 1333N 0.79 1.27 -0.35 1.22 2.04 -1.08 -2.81 117.51 118.58 3gf9 h ILE 1333Ca 0.20 -1.26 0.03 0.00 1.00 0.00 0.00 64.86 64.83 3gf9 h ILE 1333Cb 0.14 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 3gf9 h ILE 1333CO -0.02 0.42 0.16 0.03 0.00 0.00 0.00 178.15 178.74 3gf9 h ARG 1334N 0.66 0.32 -0.07 2.37 2.47 -0.66 -1.00 114.38 118.47 3gf9 h ARG 1334Ca 0.10 -0.02 0.03 0.00 -1.26 0.00 0.00 59.98 58.83 3gf9 h ARG 1334Cb 0.67 -0.07 -0.04 0.00 -1.65 0.00 0.00 29.97 28.88 3gf9 h ARG 1334CO 0.05 0.21 -0.13 0.77 0.56 0.00 0.00 179.97 181.43 3gf9 h SER 1335N 0.33 -0.39 -0.79 7.04 0.02 -1.26 -1.27 113.55 117.22 3gf9 h SER 1335Ca 0.15 0.07 0.06 0.00 -0.84 0.00 0.00 61.79 61.23 3gf9 h SER 1335Cb 0.09 0.18 -0.06 0.00 0.14 0.00 0.00 62.40 62.75 3gf9 h SER 1335CO -0.13 -0.18 0.48 0.40 -1.14 0.00 0.00 176.83 176.26 3gf9 h ILE 1336N -0.18 1.02 -0.11 3.27 2.04 -1.25 -2.40 117.51 119.90 3gf9 h ILE 1336Ca 0.07 -0.30 -0.08 0.00 1.00 0.00 0.00 64.86 65.54 3gf9 h ILE 1336Cb 0.28 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 3gf9 h ILE 1336CO -0.18 0.16 -0.31 0.25 0.00 0.00 0.00 178.15 178.07 3gf9 h LEU 1337N 0.87 0.21 -1.70 1.44 5.85 -0.83 -1.36 115.31 119.78 3gf9 h LEU 1337Ca 0.35 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.00 3gf9 h LEU 1337Cb 0.17 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.15 3gf9 h LEU 1337CO -0.17 0.52 0.00 -0.33 -0.34 0.00 0.00 178.44 178.11 3gf9 h GLU 1338N 0.18 0.00 -0.02 1.25 3.07 -0.71 -2.31 114.58 116.04 3gf9 h GLU 1338Ca 0.03 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.88 3gf9 h GLU 1338Cb 0.65 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.55 3gf9 h GLU 1338CO 0.05 0.00 -0.32 0.09 -1.40 0.00 0.00 179.01 177.43 3gf9 n ASN 1339N -2.80 1.98 -3.69 1.42 3.02 -0.55 -4.80 115.26 109.84 3gf9 n ASN 1339Ca -0.00 -3.64 -0.30 0.00 -0.03 0.00 0.00 54.58 50.61 3gf9 n ASN 1339Cb 0.19 -0.50 -0.15 0.00 -0.61 0.00 0.00 39.78 38.71 3gf9 n ASN 1339CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3gf9 s THR 1340N -3.12 0.79 0.90 3.41 2.01 -0.87 -4.51 115.64 114.24 3gf9 s THR 1340Ca 0.37 -1.49 -0.12 0.00 0.31 0.00 0.00 61.69 60.76 3gf9 s THR 1340Cb 0.34 -1.59 0.13 0.00 0.01 0.00 0.00 72.50 71.39 3gf9 s THR 1340CO -0.03 -0.73 1.10 -2.84 -0.69 0.00 0.00 174.62 171.42 3gf9 s PRO 1341N 1.48 1.22 0.33 4.92 0.02 -1.26 -4.74 135.00 136.97 3gf9 s PRO 1341Ca 0.11 0.66 0.09 0.00 0.02 0.00 0.00 61.00 61.88 3gf9 s PRO 1341Cb -0.18 -1.82 0.82 0.00 0.02 0.00 0.00 34.50 33.34 3gf9 s PRO 1341CO -0.22 -2.22 1.78 1.05 -0.33 0.00 0.00 177.00 177.06 3gf9 h GLU 1342N -1.53 0.66 0.00 5.54 9.09 -1.99 -0.86 114.58 125.50 3gf9 h GLU 1342Ca -0.50 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 58.87 3gf9 h GLU 1342Cb 1.30 -0.15 0.00 0.00 -1.65 0.00 0.00 28.75 28.25 3gf9 h GLU 1342CO 0.57 0.44 0.00 -1.13 0.05 0.00 0.00 179.01 178.94 3gf9 n SER 1343N -4.73 0.19 -4.77 3.06 3.41 -1.26 -4.74 113.62 104.78 3gf9 n SER 1343Ca 0.23 0.53 -0.39 0.00 -0.26 0.00 0.00 58.87 58.99 3gf9 n SER 1343Cb 0.62 -0.58 -0.01 0.00 -0.26 0.00 0.00 64.21 63.98 3gf9 n SER 1343CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3gf9 s HIS 1344N -3.05 2.99 0.02 7.33 5.04 -0.33 -4.90 115.29 122.39 3gf9 s HIS 1344Ca 0.10 1.51 0.29 0.00 -1.54 0.00 0.00 55.06 55.43 3gf9 s HIS 1344Cb 0.14 -3.47 1.50 0.00 0.04 0.00 0.00 32.58 30.79 3gf9 s HIS 1344CO 0.44 -1.54 1.88 0.00 -2.34 0.00 0.00 174.74 173.18 3gf9 h ALA 1345N 2.63 1.00 -0.01 1.58 0.00 -1.88 -2.69 119.26 119.90 3gf9 h ALA 1345Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3gf9 h ALA 1345Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3gf9 h ALA 1345CO 0.62 0.00 -0.51 -3.47 0.00 0.00 0.00 179.25 175.90 3gf9 n ASP 1346N -2.53 1.12 0.00 0.00 2.03 -1.26 -4.65 116.55 111.26 3gf9 n ASP 1346Ca -0.01 -1.06 -0.10 0.00 0.52 0.00 0.00 54.79 54.14 3gf9 n ASP 1346Cb 0.09 0.74 -0.03 0.00 -0.72 0.00 0.00 41.12 41.19 3gf9 n ASP 1346CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 3gf9 h HIS 1347N 0.83 -0.71 -0.81 -0.67 2.76 -1.72 -2.32 115.15 112.52 3gf9 h HIS 1347Ca 0.00 0.03 0.14 0.00 -2.20 0.00 0.00 60.37 58.35 3gf9 h HIS 1347Cb 0.43 0.33 -0.09 0.00 1.55 0.00 0.00 27.41 29.63 3gf9 h HIS 1347CO 0.00 -0.35 0.38 0.77 -1.30 0.00 0.00 177.93 177.44 3gf9 h SER 1348N -0.33 0.43 -0.36 3.26 0.02 -1.82 -2.45 113.55 112.29 3gf9 h SER 1348Ca 0.10 0.10 -0.16 0.00 -0.84 0.00 0.00 61.79 60.99 3gf9 h SER 1348Cb 0.48 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.06 3gf9 h SER 1348CO -0.32 0.17 -0.42 0.28 -1.14 0.00 0.00 176.83 175.40 3gf9 h SER 1349N 0.55 0.99 -0.27 3.07 0.02 -1.74 -2.98 113.55 113.19 3gf9 h SER 1349Ca 0.44 -0.48 -0.05 0.00 -0.84 0.00 0.00 61.79 60.86 3gf9 h SER 1349Cb 0.64 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3gf9 h SER 1349CO -0.38 1.27 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.50 3gf9 h LEU 1350N 0.72 0.47 -0.84 5.07 3.38 -1.13 0.17 115.31 123.16 3gf9 h LEU 1350Ca 0.05 -0.32 0.18 0.00 0.09 0.00 0.00 57.88 57.87 3gf9 h LEU 1350Cb 1.02 -0.13 -0.11 0.00 0.09 0.00 0.00 40.66 41.53 3gf9 h LEU 1350CO 0.10 0.68 0.37 0.11 0.09 0.00 0.00 178.44 179.80 3gf9 h LYS 1351N 0.25 0.46 0.04 1.13 6.56 -1.46 0.22 116.57 123.77 3gf9 h LYS 1351Ca 0.07 -0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.63 3gf9 h LYS 1351Cb 0.45 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 3gf9 h LYS 1351CO 0.02 0.30 -0.02 1.25 -2.06 0.00 0.00 179.45 178.94 3gf9 h LEU 1352N 0.47 -0.04 -2.13 2.94 5.85 -1.28 -2.20 115.31 118.92 3gf9 h LEU 1352Ca 0.49 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 3gf9 h LEU 1352Cb 0.82 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.86 3gf9 h LEU 1352CO -0.45 0.27 -0.07 0.00 -0.34 0.00 0.00 178.44 177.85 3gf9 h ALA 1353N 0.58 1.40 0.07 1.25 0.00 0.42 -1.39 119.26 121.59 3gf9 h ALA 1353Ca -0.01 -0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 3gf9 h ALA 1353Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3gf9 h ALA 1353CO 0.01 0.09 -1.23 1.25 0.00 0.00 0.00 179.25 179.38 3gf9 h LEU 1354N 0.00 0.25 -0.86 0.00 5.85 -0.54 -1.60 115.31 118.41 3gf9 h LEU 1354Ca -0.00 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 3gf9 h LEU 1354Cb 0.20 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 3gf9 h LEU 1354CO 0.01 1.23 0.45 -0.33 -0.34 0.00 0.00 178.44 179.46 3gf9 h GLU 1355N 0.04 1.21 -0.05 1.25 5.08 -0.62 -1.74 114.58 119.76 3gf9 h GLU 1355Ca -0.11 -0.15 -0.22 0.00 -1.00 0.00 0.00 59.36 57.87 3gf9 h GLU 1355Cb 1.91 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 30.94 3gf9 h GLU 1355CO 0.16 0.90 -0.88 0.00 -1.00 0.00 0.00 179.01 178.19 3gf9 h ARG 1356N 1.20 0.55 -0.66 2.33 3.08 -1.42 -0.07 114.38 119.40 3gf9 h ARG 1356Ca 0.30 -0.52 -0.05 0.00 0.07 0.00 0.00 59.98 59.78 3gf9 h ARG 1356Cb 0.05 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 3gf9 h ARG 1356CO -0.05 1.15 0.23 0.00 -1.07 0.00 0.00 179.97 180.24 3gf9 h ALA 1357N 0.68 0.85 -0.17 0.04 0.00 -1.21 -0.77 119.26 118.68 3gf9 h ALA 1357Ca -0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3gf9 h ALA 1357Cb 1.51 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3gf9 h ALA 1357CO 0.16 0.50 0.03 0.93 0.00 0.00 0.00 179.25 180.88 3gf9 h GLU 1358N 0.94 0.28 -0.50 0.00 5.08 -1.26 -2.26 114.58 116.86 3gf9 h GLU 1358Ca 0.21 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.56 3gf9 h GLU 1358Cb 0.25 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 3gf9 h GLU 1358CO -0.01 0.44 0.33 1.49 -1.00 0.00 0.00 179.01 180.26 3gf9 h GLU 1359N 0.08 0.41 -0.06 2.33 4.57 -0.79 -1.28 114.58 119.84 3gf9 h GLU 1359Ca 0.05 -0.02 -0.15 0.00 -1.18 0.00 0.00 59.36 58.06 3gf9 h GLU 1359Cb 0.29 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 3gf9 h GLU 1359CO 0.00 0.27 -0.62 1.25 -1.18 0.00 0.00 179.01 178.74 3gf9 h LEU 1360N 0.43 0.27 -0.42 1.64 5.85 -0.85 -0.89 115.31 121.34 3gf9 h LEU 1360Ca 0.22 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 3gf9 h LEU 1360Cb 0.31 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 3gf9 h LEU 1360CO -0.06 0.82 0.16 0.00 -0.34 0.00 0.00 178.44 179.03 3gf9 h SER 1362N 0.54 -1.18 -0.73 0.00 0.87 -1.09 -2.20 113.55 109.77 3gf9 h SER 1362Ca 0.14 0.10 0.15 0.00 -1.23 0.00 0.00 61.79 60.95 3gf9 h SER 1362Cb 0.20 0.40 -0.10 0.00 -0.44 0.00 0.00 62.40 62.46 3gf9 h SER 1362CO -0.01 -0.53 0.22 1.56 -0.53 0.00 0.00 176.83 177.54 3gf9 h GLN 1363N -0.78 0.31 0.00 2.24 4.20 -1.11 0.12 115.11 120.09 3gf9 h GLN 1363Ca -0.04 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3gf9 h GLN 1363Cb 0.69 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.40 3gf9 h GLN 1363CO -0.09 0.21 0.00 0.28 -0.67 0.00 0.00 178.83 178.55 3gf9 h VAL 1364N 0.32 0.00 0.00 -0.54 2.07 -1.00 -2.67 116.25 114.44 3gf9 h VAL 1364Ca 0.41 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 3gf9 h VAL 1364Cb 0.67 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 3gf9 h VAL 1364CO -0.47 0.00 -1.91 -3.20 0.02 0.00 0.00 177.57 172.02 3gf9 n ASN 1365N -3.05 0.12 0.08 0.57 2.85 0.02 -4.10 115.26 111.74 3gf9 n ASN 1365Ca 0.00 0.05 0.10 0.00 -0.11 0.00 0.00 54.58 54.61 3gf9 n ASN 1365Cb 0.27 1.70 0.42 0.00 1.24 0.00 0.00 39.78 43.40 3gf9 n ASN 1365CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 3gf9 n GLU 1366N -2.36 0.11 0.00 1.20 0.28 0.20 -5.07 120.64 115.00 3gf9 n GLU 1366Ca -0.06 0.36 0.03 0.00 -0.16 0.00 0.00 57.16 57.33 3gf9 n GLU 1366Cb 0.62 -1.72 0.03 0.00 1.43 0.00 0.00 31.44 31.80 3gf9 n GLU 1366CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38