#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iv4 s ILE 1403N 0.00 1.28 -0.00 0.55 2.07 -1.26 -0.82 121.20 123.02 1iv4 s ILE 1403Ca 0.00 -1.53 -0.03 0.00 -1.41 0.00 0.00 60.65 57.68 1iv4 s ILE 1403Cb 0.00 -1.35 -0.00 0.00 0.13 0.00 0.00 42.46 41.24 1iv4 s ILE 1403CO 0.00 -0.30 0.05 -0.83 -1.91 0.00 0.00 174.94 171.95 1iv4 s GLY 1404N -2.11 0.08 -0.04 1.50 0.00 -0.62 -4.22 107.32 101.91 1iv4 s GLY 1404Ca 0.04 -0.18 0.02 0.00 0.00 0.00 0.00 44.72 44.60 1iv4 s GLY 1404CO 0.03 -0.25 -0.09 -0.47 0.00 0.00 0.00 173.10 172.32 1iv4 s TYR 1405N -0.88 1.03 0.04 1.90 5.04 -1.26 -0.41 117.35 122.82 1iv4 s TYR 1405Ca -0.10 -0.31 -0.04 0.00 -2.44 0.00 0.00 57.07 54.18 1iv4 s TYR 1405Cb -0.06 -0.78 -0.02 0.00 0.35 0.00 0.00 41.96 41.45 1iv4 s TYR 1405CO 0.00 -0.17 0.06 0.20 -1.34 0.00 0.00 175.55 174.30 1iv4 s GLY 1406N 0.53 0.23 0.07 8.97 0.00 -0.18 -4.34 107.32 112.61 1iv4 s GLY 1406Ca -0.09 -0.68 0.02 0.00 0.00 0.00 0.00 44.72 43.97 1iv4 s GLY 1406CO 0.01 -0.81 -0.08 -0.54 0.00 0.00 0.00 173.10 171.69 1iv4 s GLU 1407N -2.78 0.69 0.14 2.90 2.02 -1.26 -0.68 118.70 119.72 1iv4 s GLU 1407Ca -0.03 -1.03 -0.13 0.00 0.02 0.00 0.00 54.97 53.79 1iv4 s GLU 1407Cb -0.00 -0.30 0.02 0.00 0.10 0.00 0.00 34.13 33.94 1iv4 s GLU 1407CO -0.05 0.03 0.36 0.34 0.02 0.00 0.00 175.26 175.95 1iv4 s ASP 1408N -2.25 -0.10 0.09 -0.19 2.15 -0.50 -4.49 116.67 111.38 1iv4 s ASP 1408Ca 0.00 -0.54 -0.19 0.00 0.43 0.00 0.00 52.55 52.25 1iv4 s ASP 1408Cb -0.03 0.46 0.04 0.00 -0.30 0.00 0.00 42.92 43.09 1iv4 s ASP 1408CO -0.02 -0.88 0.45 -0.94 -0.17 0.00 0.00 175.17 173.62 1iv4 s SER 1409N -2.87 -0.33 -0.08 -0.34 1.04 -1.26 -0.85 113.70 109.00 1iv4 s SER 1409Ca 0.08 -0.08 -0.08 0.00 0.48 0.00 0.00 55.95 56.35 1iv4 s SER 1409Cb 0.02 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.64 1iv4 s SER 1409CO -0.07 -0.78 0.22 -1.00 0.98 0.00 0.00 173.24 172.59 1iv4 s HIS 1410N -3.12 -0.25 0.41 5.02 3.76 -0.69 -5.00 115.29 115.42 1iv4 s HIS 1410Ca -0.01 0.61 -0.26 0.00 -0.15 0.00 0.00 55.06 55.24 1iv4 s HIS 1410Cb 0.00 0.08 -0.09 0.00 1.11 0.00 0.00 32.58 33.68 1iv4 s HIS 1410CO -0.07 -0.12 1.37 0.50 -0.85 0.00 0.00 174.74 175.56 1iv4 s ARG 1411N 0.17 3.95 -0.11 1.40 3.52 -1.26 -1.24 118.95 125.39 1iv4 s ARG 1411Ca -0.00 2.30 -0.03 0.00 -0.13 0.00 0.00 55.73 57.86 1iv4 s ARG 1411Cb -0.02 -2.79 -0.03 0.00 -1.56 0.00 0.00 34.95 30.54 1iv4 s ARG 1411CO -0.00 -0.56 0.03 -0.51 -0.81 0.00 0.00 175.30 173.45 1iv4 s LEU 1412N -2.40 3.71 0.03 -0.88 1.43 0.38 -1.53 118.68 119.42 1iv4 s LEU 1412Ca 0.57 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 1iv4 s LEU 1412Cb -0.41 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 1iv4 s LEU 1412CO 0.54 0.35 -0.08 -1.61 0.23 0.00 0.00 176.35 175.77 1iv4 s GLU 1413N -0.69 0.55 0.36 1.70 8.01 -0.01 -4.85 118.70 123.77 1iv4 s GLU 1413Ca 0.11 -0.65 -0.28 0.00 0.01 0.00 0.00 54.97 54.16 1iv4 s GLU 1413Cb -0.12 -0.39 -0.12 0.00 -4.31 0.00 0.00 34.13 29.20 1iv4 s GLU 1413CO 0.02 0.08 1.37 0.39 0.01 0.00 0.00 175.26 177.14 1iv4 n GLU 1414N 1.78 2.35 -0.84 1.61 4.71 -1.26 -1.27 120.64 127.73 1iv4 n GLU 1414Ca -0.20 0.83 0.00 0.00 -0.01 0.00 0.00 57.16 57.77 1iv4 n GLU 1414Cb 0.55 -2.47 0.00 0.00 -1.01 0.00 0.00 31.44 28.51 1iv4 n GLU 1414CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1iv4 n GLY 1415N 0.63 0.65 3.78 0.62 0.00 -0.75 -4.88 105.19 105.24 1iv4 n GLY 1415Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1iv4 n GLY 1415CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iv4 s ARG 1416N -0.16 2.86 0.44 1.61 0.52 -1.17 -4.98 118.95 118.07 1iv4 s ARG 1416Ca 0.00 -0.78 -0.21 0.00 -0.52 0.00 0.00 55.73 54.22 1iv4 s ARG 1416Cb 0.00 -2.67 -0.11 0.00 0.52 0.00 0.00 34.95 32.69 1iv4 s ARG 1416CO 0.00 0.53 0.96 -1.25 0.02 0.00 0.00 175.30 175.56 1iv4 s PRO 1417N -2.69 4.17 -0.24 3.54 0.04 -1.26 -2.68 135.00 135.88 1iv4 s PRO 1417Ca 0.30 1.13 -0.06 0.00 0.04 0.00 0.00 61.00 62.41 1iv4 s PRO 1417Cb -0.11 -2.17 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 1iv4 s PRO 1417CO 0.22 -0.09 0.04 -1.17 0.04 0.00 0.00 177.00 176.05 1iv4 s LEU 1418N -3.27 3.30 -0.17 -3.56 2.96 -1.26 -2.78 118.68 113.90 1iv4 s LEU 1418Ca 0.62 -0.25 -0.03 0.00 -0.22 0.00 0.00 54.13 54.25 1iv4 s LEU 1418Cb -0.10 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1iv4 s LEU 1418CO 0.15 -0.03 -0.06 -0.31 -1.32 0.00 0.00 176.35 174.77 1iv4 s TYR 1419N 1.58 2.94 -0.03 5.38 2.02 -1.26 -0.62 117.35 127.35 1iv4 s TYR 1419Ca 0.06 -0.65 0.01 0.00 -0.37 0.00 0.00 57.07 56.12 1iv4 s TYR 1419Cb -0.15 -1.99 0.02 0.00 -0.40 0.00 0.00 41.96 39.45 1iv4 s TYR 1419CO 0.02 -0.29 -0.02 -0.51 -1.57 0.00 0.00 175.55 173.18 1iv4 s LEU 1420N 0.81 1.40 -1.53 -1.29 1.43 -0.20 -4.07 118.68 115.22 1iv4 s LEU 1420Ca -0.02 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1iv4 s LEU 1420Cb -0.15 -0.29 0.00 0.00 0.03 0.00 0.00 46.19 45.78 1iv4 s LEU 1420CO 0.01 -0.05 0.00 0.00 0.23 0.00 0.00 176.35 176.54 1iv4 n GLY 1422N -0.90 0.77 3.57 0.00 0.00 -1.26 -4.51 105.19 102.86 1iv4 n GLY 1422Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 1iv4 n GLY 1422CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iv4 s LEU 1423N 0.00 3.03 0.00 0.99 1.43 -0.50 -5.06 118.68 118.58 1iv4 s LEU 1423Ca 0.00 -0.26 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 1iv4 s LEU 1423Cb 0.00 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1iv4 s LEU 1423CO 0.00 0.25 1.21 -0.22 0.23 0.00 0.00 176.35 177.82 1iv4 s LEU 1424N -1.62 4.33 -0.31 1.79 0.20 -1.26 -1.03 118.68 120.77 1iv4 s LEU 1424Ca 0.18 1.92 -0.07 0.00 0.69 0.00 0.00 54.13 56.85 1iv4 s LEU 1424Cb -0.11 -3.57 0.02 0.00 -0.43 0.00 0.00 46.19 42.10 1iv4 s LEU 1424CO 0.09 -0.53 0.10 -0.63 -0.29 0.00 0.00 176.35 175.08 1iv4 s ILE 1425N 1.67 3.97 0.06 6.68 -1.09 0.21 -4.96 121.20 127.73 1iv4 s ILE 1425Ca 0.58 -0.82 -0.36 0.00 -2.23 0.00 0.00 60.65 57.82 1iv4 s ILE 1425Cb -0.27 -3.11 -0.15 0.00 -1.58 0.00 0.00 42.46 37.35 1iv4 s ILE 1425CO 0.26 -0.01 1.53 -2.65 -1.23 0.00 0.00 174.94 172.84 1iv4 n PRO 1426N 4.86 1.67 -3.54 2.79 -0.02 -1.26 -4.21 135.00 135.29 1iv4 n PRO 1426Ca -0.14 0.61 -0.15 0.00 -2.02 0.00 0.00 63.50 61.80 1iv4 n PRO 1426Cb 0.47 -2.33 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 1iv4 n PRO 1426CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1iv4 s SER 1427N 1.33 -0.56 0.37 2.55 0.15 -1.26 -4.87 113.70 111.41 1iv4 s SER 1427Ca 0.84 0.62 0.26 0.00 0.70 0.00 0.00 55.95 58.37 1iv4 s SER 1427Cb -0.82 0.47 0.73 0.00 -1.71 0.00 0.00 66.02 64.69 1iv4 s SER 1427CO 0.45 -0.51 1.73 1.55 1.20 0.00 0.00 173.24 177.67 1iv4 h PRO 1428N 2.89 0.00 -5.05 5.44 0.13 -1.91 -3.46 132.00 130.04 1iv4 h PRO 1428Ca -0.24 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.56 1iv4 h PRO 1428Cb 1.15 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.10 1iv4 h PRO 1428CO 0.35 0.00 -0.73 0.14 -0.23 0.00 0.00 178.00 177.53 1iv4 s VAL 1429N -3.27 1.04 0.23 1.56 -7.23 -1.26 -1.81 120.40 109.66 1iv4 s VAL 1429Ca 0.07 -1.72 -0.17 0.00 -1.81 0.00 0.00 61.98 58.35 1iv4 s VAL 1429Cb 0.08 -1.46 0.02 0.00 0.56 0.00 0.00 36.38 35.58 1iv4 s VAL 1429CO 0.60 -0.57 0.56 -0.83 -0.31 0.00 0.00 175.10 174.55 1iv4 s GLY 1430N -2.56 0.09 0.28 2.32 0.00 -0.39 -4.24 107.32 102.82 1iv4 s GLY 1430Ca 0.08 -0.44 -0.29 0.00 0.00 0.00 0.00 44.72 44.07 1iv4 s GLY 1430CO 0.01 -0.32 1.26 0.00 0.00 0.00 0.00 173.10 174.04 1iv4 s ALA 1431N -3.93 3.48 -0.65 3.20 0.00 -1.12 -0.83 121.76 121.92 1iv4 s ALA 1431Ca 0.14 1.13 -0.21 0.00 0.00 0.00 0.00 51.96 53.01 1iv4 s ALA 1431Cb -0.02 -3.44 0.09 0.00 0.00 0.00 0.00 23.12 19.74 1iv4 s ALA 1431CO 0.03 -0.49 0.88 -1.17 0.00 0.00 0.00 175.76 175.01 1iv4 s LEU 1432N -1.19 4.79 0.27 0.00 2.96 -0.58 -4.78 118.68 120.15 1iv4 s LEU 1432Ca 0.50 -1.21 -0.21 0.00 -0.22 0.00 0.00 54.13 52.99 1iv4 s LEU 1432Cb -0.37 -2.37 0.02 0.00 0.50 0.00 0.00 46.19 43.97 1iv4 s LEU 1432CO 0.46 -1.31 0.71 0.00 -1.32 0.00 0.00 176.35 174.89 1iv4 s ALA 1433N 3.49 -1.24 -0.10 5.97 0.00 -1.26 -4.66 121.76 123.96 1iv4 s ALA 1433Ca 0.19 -0.26 0.23 0.00 0.00 0.00 0.00 51.96 52.12 1iv4 s ALA 1433Cb -0.19 0.85 0.64 0.00 0.00 0.00 0.00 23.12 24.42 1iv4 s ALA 1433CO 0.08 -1.02 1.71 0.45 0.00 0.00 0.00 175.76 176.97 1iv4 h HIS 1434N 2.00 0.00 -2.53 0.00 3.86 -2.04 -3.46 115.15 112.99 1iv4 h HIS 1434Ca -0.20 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.01 1iv4 h HIS 1434Cb 1.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.72 1iv4 h HIS 1434CO 0.42 0.18 0.00 -1.13 0.86 0.00 0.00 177.93 178.26 1iv4 n SER 1435N -3.22 0.00 -0.40 2.45 3.41 -1.26 -4.79 113.62 109.81 1iv4 n SER 1435Ca 0.02 -0.78 0.13 0.00 -0.26 0.00 0.00 58.87 57.98 1iv4 n SER 1435Cb 0.51 0.00 0.54 0.00 -0.26 0.00 0.00 64.21 65.00 1iv4 n SER 1435CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1iv4 n ASP 1436N -2.34 1.24 -2.12 4.04 3.85 -1.26 -4.92 116.55 115.05 1iv4 n ASP 1436Ca 0.00 -1.48 -0.20 0.00 -0.71 0.00 0.00 54.79 52.40 1iv4 n ASP 1436Cb 0.00 -0.03 -0.03 0.00 -1.35 0.00 0.00 41.12 39.71 1iv4 n ASP 1436CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1iv4 n GLY 1437N 1.11 0.09 3.55 6.12 0.00 -1.26 -4.33 105.19 110.48 1iv4 n GLY 1437Ca 0.19 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1iv4 n GLY 1437CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iv4 s ASP 1438N -2.25 5.90 0.31 1.61 -1.08 -1.26 -4.80 116.67 115.09 1iv4 s ASP 1438Ca 0.00 -0.48 0.06 0.00 -0.52 0.00 0.00 52.55 51.61 1iv4 s ASP 1438Cb 0.00 -2.55 0.50 0.00 -1.46 0.00 0.00 42.92 39.40 1iv4 s ASP 1438CO 0.00 -2.01 1.74 0.00 0.52 0.00 0.00 175.17 175.43 1iv4 h ALA 1439N 11.33 1.17 -0.16 3.66 0.00 -1.92 -1.74 119.26 131.61 1iv4 h ALA 1439Ca -0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1iv4 h ALA 1439Cb 1.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1iv4 h ALA 1439CO 1.29 0.54 -0.03 0.00 0.00 0.00 0.00 179.25 181.05 1iv4 h ALA 1440N 1.40 0.21 -0.36 0.00 0.00 -1.88 -0.95 119.26 117.70 1iv4 h ALA 1440Ca 0.03 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1iv4 h ALA 1440Cb 0.70 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1iv4 h ALA 1440CO 0.05 -0.04 -0.19 0.52 0.00 0.00 0.00 179.25 179.59 1iv4 h MET 1441N 0.01 0.67 -0.29 0.00 2.86 -1.88 -1.62 114.93 114.68 1iv4 h MET 1441Ca 0.04 -0.24 -0.04 0.00 -2.06 0.00 0.00 59.70 57.40 1iv4 h MET 1441Cb 0.44 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1iv4 h MET 1441CO 0.01 0.81 0.03 0.45 1.06 0.00 0.00 176.91 179.28 1iv4 h HIS 1442N 0.59 0.53 -0.53 -0.22 3.86 -1.31 0.26 115.15 118.32 1iv4 h HIS 1442Ca 0.09 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1iv4 h HIS 1442Cb 0.65 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.95 1iv4 h HIS 1442CO 0.03 0.60 0.29 0.00 0.86 0.00 0.00 177.93 179.71 1iv4 h ALA 1443N 0.86 0.69 -0.74 2.45 0.00 -1.07 -0.68 119.26 120.77 1iv4 h ALA 1443Ca 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1iv4 h ALA 1443Cb 0.37 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1iv4 h ALA 1443CO 0.01 0.21 0.41 -0.07 0.00 0.00 0.00 179.25 179.80 1iv4 h LEU 1444N 0.72 0.92 -0.02 0.00 3.38 -1.17 -0.89 115.31 118.24 1iv4 h LEU 1444Ca 0.19 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1iv4 h LEU 1444Cb 0.05 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1iv4 h LEU 1444CO -0.03 0.74 0.00 0.74 0.09 0.00 0.00 178.44 179.98 1iv4 h THR 1445N 1.04 1.20 -1.00 0.22 2.02 -0.53 -1.39 112.91 114.47 1iv4 h THR 1445Ca 0.26 -0.60 0.06 0.00 0.77 0.00 0.00 66.41 66.90 1iv4 h THR 1445Cb 0.03 1.57 -0.06 0.00 -1.74 0.00 0.00 68.15 67.94 1iv4 h THR 1445CO -0.04 0.16 0.65 0.44 0.37 0.00 0.00 175.52 177.10 1iv4 h ASP 1446N -0.21 1.06 -0.64 4.18 3.32 -1.04 -0.37 116.42 122.73 1iv4 h ASP 1446Ca 0.01 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 1iv4 h ASP 1446Cb 0.25 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1iv4 h ASP 1446CO 0.00 0.69 0.11 0.00 -1.72 0.00 0.00 179.24 178.32 1iv4 h ALA 1447N 1.44 0.96 -0.26 3.45 0.00 -0.91 0.20 119.26 124.14 1iv4 h ALA 1447Ca 0.42 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1iv4 h ALA 1447Cb 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1iv4 h ALA 1447CO -0.16 0.65 0.03 -0.07 0.00 0.00 0.00 179.25 179.71 1iv4 h LEU 1448N 1.00 0.42 -0.26 0.00 3.38 -0.52 -2.07 115.31 117.26 1iv4 h LEU 1448Ca 0.20 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1iv4 h LEU 1448Cb 0.42 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1iv4 h LEU 1448CO 0.01 0.59 0.16 -0.07 0.09 0.00 0.00 178.44 179.22 1iv4 h LEU 1449N 0.24 0.27 -1.12 1.67 3.38 -0.89 -2.65 115.31 116.22 1iv4 h LEU 1449Ca 0.08 -0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.22 1iv4 h LEU 1449Cb 0.35 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 40.94 1iv4 h LEU 1449CO 0.01 0.20 0.61 -1.28 0.09 0.00 0.00 178.44 178.07 1iv4 h SER 1450N 0.33 0.74 0.25 -0.43 0.87 -0.44 -0.78 113.55 114.09 1iv4 h SER 1450Ca 0.10 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1iv4 h SER 1450Cb -0.02 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1iv4 h SER 1450CO -0.03 0.30 0.00 0.00 -0.53 0.00 0.00 176.83 176.57 1iv4 h ALA 1451N 1.62 1.00 0.00 6.23 0.00 -0.99 -1.55 119.26 125.57 1iv4 h ALA 1451Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1iv4 h ALA 1451Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1iv4 h ALA 1451CO -0.31 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.60 1iv4 n TYR 1452N -2.65 0.00 -2.30 0.00 4.02 -0.56 -4.74 117.16 110.93 1iv4 n TYR 1452Ca -0.01 -0.32 -0.09 0.00 -0.01 0.00 0.00 57.90 57.47 1iv4 n TYR 1452Cb 0.11 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.40 1iv4 n TYR 1452CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1iv4 n GLY 1453N -0.32 0.05 0.03 2.72 0.00 -0.58 -4.91 105.19 102.17 1iv4 n GLY 1453Ca 0.00 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.67 1iv4 n GLY 1453CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iv4 n LEU 1454N -1.48 0.58 0.00 0.99 4.77 -0.41 -5.00 117.00 116.44 1iv4 n LEU 1454Ca -0.09 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1iv4 n LEU 1454Cb 0.57 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1iv4 n LEU 1454CO 0.15 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 1iv4 n GLY 1455N 1.48 0.25 3.40 -0.72 0.00 -1.26 -4.93 105.19 103.41 1iv4 n GLY 1455Ca 0.06 -1.99 -0.15 0.00 0.00 0.00 0.00 46.02 43.94 1iv4 n GLY 1455CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1iv4 s ASP 1456N -4.00 0.98 0.39 1.61 1.47 -1.26 -4.11 116.67 111.74 1iv4 s ASP 1456Ca 0.00 -1.52 0.13 0.00 1.18 0.00 0.00 52.55 52.34 1iv4 s ASP 1456Cb 0.00 0.59 0.78 0.00 -0.34 0.00 0.00 42.92 43.95 1iv4 s ASP 1456CO 0.00 -1.16 1.86 0.16 0.68 0.00 0.00 175.17 176.71 1iv4 h ILE 1457N 2.19 1.24 -0.01 2.11 3.07 -1.92 -1.21 117.51 122.97 1iv4 h ILE 1457Ca -0.28 -1.13 -0.12 0.00 1.55 0.00 0.00 64.86 64.88 1iv4 h ILE 1457Cb 1.24 1.60 -0.02 0.00 -0.27 0.00 0.00 36.82 39.38 1iv4 h ILE 1457CO 0.40 0.32 -0.54 1.23 -1.05 0.00 0.00 178.15 178.51 1iv4 h GLY 1458N 0.99 0.04 0.45 0.16 0.00 -1.97 0.26 103.07 103.00 1iv4 h GLY 1458Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 1iv4 h GLY 1458CO 0.04 0.04 -0.04 -2.00 0.00 0.00 0.00 176.54 174.58 1iv4 h LEU 1459N 0.03 -0.11 0.00 3.11 5.85 -1.74 -3.33 115.31 119.13 1iv4 h LEU 1459Ca -0.00 -0.44 -0.23 0.00 0.84 0.00 0.00 57.88 58.05 1iv4 h LEU 1459Cb 0.96 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.98 1iv4 h LEU 1459CO 0.07 0.42 -1.36 -0.07 -0.34 0.00 0.00 178.44 177.16 1iv4 h LEU 1460N -0.68 0.00 -5.43 2.25 3.38 -1.21 -3.39 115.31 110.23 1iv4 h LEU 1460Ca -0.01 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.44 1iv4 h LEU 1460Cb 0.54 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.88 1iv4 h LEU 1460CO 0.02 0.87 -0.93 0.49 0.09 0.00 0.00 178.44 178.98 1iv4 n PHE 1461N -3.11 2.18 -1.68 1.13 3.72 0.92 -5.07 117.46 115.55 1iv4 n PHE 1461Ca -0.09 -3.68 -0.30 0.00 -0.05 0.00 0.00 57.45 53.33 1iv4 n PHE 1461Cb 0.95 -0.40 0.07 0.00 -0.94 0.00 0.00 39.48 39.16 1iv4 n PHE 1461CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1iv4 s PRO 1462N -3.05 2.54 0.48 -1.08 0.04 -1.25 -4.78 135.00 127.90 1iv4 s PRO 1462Ca 0.43 0.63 0.31 0.00 0.04 0.00 0.00 61.00 62.41 1iv4 s PRO 1462Cb 0.34 -1.97 1.21 0.00 0.04 0.00 0.00 34.50 34.12 1iv4 s PRO 1462CO -0.10 -1.30 1.91 -0.44 0.04 0.00 0.00 177.00 177.11 1iv4 h ASP 1463N -0.85 0.00 1.01 6.66 3.32 -1.93 -2.84 116.42 121.79 1iv4 h ASP 1463Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1iv4 h ASP 1463Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1iv4 h ASP 1463CO 0.61 0.00 0.00 0.71 -1.72 0.00 0.00 179.24 178.84 1iv4 h THR 1464N 0.00 0.00 -3.58 0.35 1.35 -1.99 -3.41 112.91 105.62 1iv4 h THR 1464Ca 0.00 -0.48 -0.66 0.00 -0.55 0.00 0.00 66.41 64.72 1iv4 h THR 1464Cb 0.53 1.44 -0.16 0.00 -1.73 0.00 0.00 68.15 68.23 1iv4 h THR 1464CO 0.00 0.00 0.02 -0.62 -0.25 0.00 0.00 175.52 174.67 1iv4 s ASP 1465N -5.45 6.31 0.48 5.36 -1.08 -1.07 -4.95 116.67 116.27 1iv4 s ASP 1465Ca 0.02 -0.24 0.26 0.00 -0.52 0.00 0.00 52.55 52.07 1iv4 s ASP 1465Cb 0.09 -2.29 1.44 0.00 -1.46 0.00 0.00 42.92 40.70 1iv4 s ASP 1465CO 0.52 -0.63 1.79 1.55 0.52 0.00 0.00 175.17 178.92 1iv4 h PRO 1466N 8.68 0.00 0.00 4.34 0.13 -1.88 0.75 132.00 144.01 1iv4 h PRO 1466Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1iv4 h PRO 1466Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1iv4 h PRO 1466CO 0.83 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 178.58 1iv4 h ARG 1467N 0.00 0.00 0.00 0.86 3.08 -1.93 -3.34 114.38 113.06 1iv4 h ARG 1467Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1iv4 h ARG 1467Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1iv4 h ARG 1467CO 0.00 0.00 -1.36 0.91 -1.07 0.00 0.00 179.97 178.45 1iv4 n TRP 1468N -2.48 0.00 -1.64 3.04 5.03 0.17 -4.89 117.44 116.68 1iv4 n TRP 1468Ca 0.05 0.00 -0.48 0.00 3.03 0.00 0.00 57.50 60.10 1iv4 n TRP 1468Cb 0.46 -0.22 -0.05 0.00 -1.03 0.00 0.00 31.31 30.47 1iv4 n TRP 1468CO 0.00 0.00 0.00 -2.13 -0.03 0.00 0.00 177.69 175.53 1iv4 n ARG 1469N -1.93 1.95 -0.79 -0.99 0.63 -0.71 -1.43 116.66 113.39 1iv4 n ARG 1469Ca -0.05 0.68 0.00 0.00 -0.92 0.00 0.00 57.85 57.56 1iv4 n ARG 1469Cb 0.38 -2.67 0.00 0.00 0.45 0.00 0.00 32.46 30.63 1iv4 n ARG 1469CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1iv4 n GLY 1470N 4.90 0.60 3.90 5.14 0.00 -1.26 -5.00 105.19 113.47 1iv4 n GLY 1470Ca 0.27 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 1iv4 n GLY 1470CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iv4 s GLU 1471N -0.26 3.63 0.50 1.61 0.41 -0.52 -5.03 118.70 119.04 1iv4 s GLU 1471Ca 0.00 0.11 -0.23 0.00 -0.41 0.00 0.00 54.97 54.44 1iv4 s GLU 1471Cb 0.00 -2.53 -0.06 0.00 -1.78 0.00 0.00 34.13 29.75 1iv4 s GLU 1471CO 0.00 0.06 1.33 1.03 -0.49 0.00 0.00 175.26 177.19 1iv4 s ARG 1472N -3.96 3.44 0.55 1.61 0.52 -1.26 -4.74 118.95 115.10 1iv4 s ARG 1472Ca 0.46 2.18 0.23 0.00 -0.52 0.00 0.00 55.73 58.07 1iv4 s ARG 1472Cb -0.10 -2.41 1.45 0.00 0.52 0.00 0.00 34.95 34.40 1iv4 s ARG 1472CO 0.34 -0.93 2.11 0.77 0.02 0.00 0.00 175.30 177.61 1iv4 h SER 1473N 1.86 0.00 0.03 0.23 0.02 -1.96 0.17 113.55 113.90 1iv4 h SER 1473Ca -0.50 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 1iv4 h SER 1473Cb 1.28 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 1iv4 h SER 1473CO 0.59 0.00 -0.04 -0.08 -1.14 0.00 0.00 176.83 176.16 1iv4 h GLU 1474N 0.00 0.03 -0.91 3.45 4.81 -1.96 -0.84 114.58 119.16 1iv4 h GLU 1474Ca 0.09 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1iv4 h GLU 1474Cb 0.40 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 1iv4 h GLU 1474CO -0.00 0.08 0.59 0.28 -0.73 0.00 0.00 179.01 179.23 1iv4 h VAL 1475N 0.03 1.24 -0.30 0.32 2.07 -1.32 -0.82 116.25 117.48 1iv4 h VAL 1475Ca 0.01 -0.46 -0.18 0.00 0.82 0.00 0.00 66.70 66.88 1iv4 h VAL 1475Cb 0.10 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 1iv4 h VAL 1475CO 0.01 0.24 -0.53 -0.26 0.02 0.00 0.00 177.57 177.04 1iv4 h PHE 1476N 1.24 1.11 -0.56 1.57 0.04 -1.26 -1.91 116.94 117.17 1iv4 h PHE 1476Ca 0.33 -0.39 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1iv4 h PHE 1476Cb -0.12 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 37.79 1iv4 h PHE 1476CO -0.00 1.23 0.37 1.25 -0.60 0.00 0.00 178.31 180.55 1iv4 h LEU 1477N 0.68 0.65 -1.22 1.54 5.85 -1.23 -0.27 115.31 121.31 1iv4 h LEU 1477Ca 0.02 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 1iv4 h LEU 1477Cb 1.14 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1iv4 h LEU 1477CO 0.12 0.48 -0.15 0.03 -0.34 0.00 0.00 178.44 178.58 1iv4 h ARG 1478N 0.76 0.36 -0.15 1.25 2.47 -0.96 -0.20 114.38 117.91 1iv4 h ARG 1478Ca 0.21 -0.10 -0.17 0.00 -1.26 0.00 0.00 59.98 58.66 1iv4 h ARG 1478Cb -0.08 -0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.19 1iv4 h ARG 1478CO -0.04 0.50 -0.63 1.49 0.56 0.00 0.00 179.97 181.85 1iv4 h GLU 1479N 0.33 0.55 -0.87 0.04 4.57 -0.87 0.11 114.58 118.45 1iv4 h GLU 1479Ca 0.06 -0.38 -0.02 0.00 -1.18 0.00 0.00 59.36 57.84 1iv4 h GLU 1479Cb 0.46 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.07 1iv4 h GLU 1479CO 0.03 1.00 0.48 0.00 -1.18 0.00 0.00 179.01 179.34 1iv4 h ALA 1480N 0.91 1.11 -0.41 2.92 0.00 -0.54 -1.08 119.26 122.17 1iv4 h ALA 1480Ca -0.01 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.83 1iv4 h ALA 1480Cb 1.19 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1iv4 h ALA 1480CO 0.12 0.61 0.13 0.52 0.00 0.00 0.00 179.25 180.63 1iv4 h MET 1481N 1.21 0.27 -0.51 0.00 2.86 -0.70 -1.98 114.93 116.08 1iv4 h MET 1481Ca 0.31 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.97 1iv4 h MET 1481Cb 0.02 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.58 1iv4 h MET 1481CO -0.05 0.18 0.28 -0.09 1.06 0.00 0.00 176.91 178.29 1iv4 h ARG 1482N 0.28 0.53 -0.43 1.72 2.43 -0.36 -0.75 114.38 117.80 1iv4 h ARG 1482Ca 0.19 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 1iv4 h ARG 1482Cb 0.20 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1iv4 h ARG 1482CO -0.22 0.35 -0.10 -0.07 -1.51 0.00 0.00 179.97 178.42 1iv4 h LEU 1483N 0.54 0.83 -0.22 3.80 3.38 -0.85 -1.59 115.31 121.20 1iv4 h LEU 1483Ca 0.21 -0.36 -0.22 0.00 0.09 0.00 0.00 57.88 57.61 1iv4 h LEU 1483Cb 0.08 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1iv4 h LEU 1483CO -0.13 1.00 -0.90 -0.37 0.09 0.00 0.00 178.44 178.13 1iv4 h VAL 1484N 0.65 1.41 -0.38 1.22 -1.51 -1.23 -2.86 116.25 113.56 1iv4 h VAL 1484Ca 0.11 -2.44 -0.04 0.00 -1.23 0.00 0.00 66.70 63.10 1iv4 h VAL 1484Cb 0.63 2.39 -0.02 0.00 -2.13 0.00 0.00 31.29 32.16 1iv4 h VAL 1484CO 0.04 0.72 0.06 -0.33 -1.23 0.00 0.00 177.57 176.84 1iv4 h GLU 1485N 0.22 0.57 0.00 5.19 5.08 -1.03 -1.04 114.58 123.57 1iv4 h GLU 1485Ca -0.07 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1iv4 h GLU 1485Cb 1.53 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.69 1iv4 h GLU 1485CO 0.15 0.55 0.00 0.00 -1.00 0.00 0.00 179.01 178.72 1iv4 h ALA 1486N 1.51 1.00 -0.64 3.43 0.00 -1.07 -1.21 119.26 122.29 1iv4 h ALA 1486Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1iv4 h ALA 1486Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1iv4 h ALA 1486CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.79 1iv4 n ARG 1487N -2.97 2.55 -0.21 0.00 1.74 -0.49 -4.92 116.66 112.36 1iv4 n ARG 1487Ca -0.00 -2.41 0.00 0.00 -0.77 0.00 0.00 57.85 54.67 1iv4 n ARG 1487Cb 0.24 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1iv4 n ARG 1487CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iv4 n GLY 1488N 1.57 0.62 3.76 -0.13 0.00 -0.45 -5.05 105.19 105.50 1iv4 n GLY 1488Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 1iv4 n GLY 1488CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iv4 s ALA 1489N -2.41 3.16 -0.36 4.61 0.00 -0.64 -4.97 121.76 121.15 1iv4 s ALA 1489Ca 0.00 1.32 0.04 0.00 0.00 0.00 0.00 51.96 53.31 1iv4 s ALA 1489Cb 0.00 -3.53 0.10 0.00 0.00 0.00 0.00 23.12 19.69 1iv4 s ALA 1489CO 0.00 -1.04 0.08 0.15 0.00 0.00 0.00 175.76 174.94 1iv4 s LYS 1490N -2.47 1.47 0.22 0.00 1.02 -1.26 -4.37 119.74 114.35 1iv4 s LYS 1490Ca 0.61 -1.89 -0.31 0.00 0.02 0.00 0.00 55.97 54.40 1iv4 s LYS 1490Cb -0.40 -3.12 -0.11 0.00 -0.52 0.00 0.00 37.83 33.69 1iv4 s LYS 1490CO 0.50 -0.96 1.55 -1.17 -0.92 0.00 0.00 175.35 174.35 1iv4 s LEU 1491N 0.83 4.37 -0.09 3.17 2.96 -1.26 -0.01 118.68 128.65 1iv4 s LEU 1491Ca 0.12 2.73 0.01 0.00 -0.22 0.00 0.00 54.13 56.76 1iv4 s LEU 1491Cb -0.20 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 42.82 1iv4 s LEU 1491CO -0.08 -0.82 -0.08 -0.11 -1.32 0.00 0.00 176.35 173.94 1iv4 n LEU 1492N 3.13 2.92 -3.57 -0.68 7.94 0.34 -4.86 117.00 122.22 1iv4 n LEU 1492Ca 0.11 -0.05 -0.16 0.00 -1.11 0.00 0.00 56.01 54.80 1iv4 n LEU 1492Cb 0.38 -0.30 -0.06 0.00 0.53 0.00 0.00 43.42 43.97 1iv4 n LEU 1492CO 0.62 0.64 0.33 -1.58 -1.11 0.00 0.00 177.39 176.29 1iv4 s GLN 1493N -2.18 0.99 -0.03 1.96 0.74 -0.94 -4.87 119.66 115.33 1iv4 s GLN 1493Ca -0.12 0.06 0.01 0.00 0.05 0.00 0.00 55.36 55.37 1iv4 s GLN 1493Cb 0.03 0.46 0.01 0.00 1.10 0.00 0.00 33.01 34.62 1iv4 s GLN 1493CO 0.21 -0.32 -0.05 0.00 -0.55 0.00 0.00 175.29 174.58 1iv4 s ALA 1494N -1.52 0.64 -0.12 1.58 0.00 -0.75 -1.46 121.76 120.13 1iv4 s ALA 1494Ca -0.10 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.75 1iv4 s ALA 1494Cb -0.01 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.79 1iv4 s ALA 1494CO 0.06 0.04 -0.11 0.45 0.00 0.00 0.00 175.76 176.20 1iv4 s SER 1495N 0.62 2.32 0.07 0.00 0.15 -0.13 -0.59 113.70 116.14 1iv4 s SER 1495Ca -0.08 -0.37 -0.07 0.00 0.70 0.00 0.00 55.95 56.13 1iv4 s SER 1495Cb -0.11 -0.97 -0.01 0.00 -1.71 0.00 0.00 66.02 63.21 1iv4 s SER 1495CO 0.00 -0.07 0.14 -1.48 1.20 0.00 0.00 173.24 173.03 1iv4 s LEU 1496N 1.44 1.66 -0.09 3.45 2.34 0.98 -0.57 118.68 127.91 1iv4 s LEU 1496Ca 0.02 -0.68 0.04 0.00 0.06 0.00 0.00 54.13 53.57 1iv4 s LEU 1496Cb -0.13 0.82 0.00 0.00 -0.56 0.00 0.00 46.19 46.32 1iv4 s LEU 1496CO -0.07 -0.66 -0.21 -0.69 -1.06 0.00 0.00 176.35 173.66 1iv4 s VAL 1497N -3.60 1.84 -0.21 1.48 1.01 -0.27 -1.81 120.40 118.84 1iv4 s VAL 1497Ca 0.03 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 61.05 1iv4 s VAL 1497Cb 0.04 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1iv4 s VAL 1497CO -0.09 0.51 0.05 -0.76 0.00 0.00 0.00 175.10 174.81 1iv4 s LEU 1498N 0.37 3.57 -0.23 3.92 1.43 -0.40 -1.68 118.68 125.67 1iv4 s LEU 1498Ca -0.17 -0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 52.83 1iv4 s LEU 1498Cb -0.17 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.13 1iv4 s LEU 1498CO 0.07 0.08 -0.05 -0.89 0.23 0.00 0.00 176.35 175.79 1iv4 s THR 1499N 0.93 3.19 -0.25 5.49 2.01 0.43 -1.29 115.64 126.15 1iv4 s THR 1499Ca 0.03 -0.65 -0.26 0.00 0.31 0.00 0.00 61.69 61.12 1iv4 s THR 1499Cb -0.14 -2.48 0.12 0.00 0.01 0.00 0.00 72.50 70.01 1iv4 s THR 1499CO 0.03 0.37 1.03 -1.48 -0.69 0.00 0.00 174.62 173.88 1iv4 s LEU 1500N 1.43 -0.42 0.10 4.42 2.34 0.07 -0.63 118.68 126.00 1iv4 s LEU 1500Ca 0.05 0.73 -0.12 0.00 0.06 0.00 0.00 54.13 54.85 1iv4 s LEU 1500Cb -0.15 1.86 -0.16 0.00 -0.56 0.00 0.00 46.19 47.19 1iv4 s LEU 1500CO -0.04 -0.20 1.28 0.44 -1.06 0.00 0.00 176.35 176.77 1iv4 h ASP 1501N 3.74 0.88 -5.04 1.48 3.32 -1.82 -3.36 116.42 115.61 1iv4 h ASP 1501Ca -0.26 -0.62 -0.10 0.00 0.02 0.00 0.00 57.03 56.07 1iv4 h ASP 1501Cb 1.17 -0.26 -0.18 0.00 0.22 0.00 0.00 39.33 40.28 1iv4 h ASP 1501CO 0.16 1.42 -0.27 0.00 -1.72 0.00 0.00 179.24 178.83 1iv4 s ARG 1502N -3.58 0.77 0.88 3.56 1.70 -1.26 -4.71 118.95 116.31 1iv4 s ARG 1502Ca -0.09 -0.44 -0.12 0.00 -0.47 0.00 0.00 55.73 54.60 1iv4 s ARG 1502Cb 0.08 0.33 0.16 0.00 -0.57 0.00 0.00 34.95 34.96 1iv4 s ARG 1502CO 0.90 -0.24 1.23 -1.25 -1.08 0.00 0.00 175.30 174.86 1iv4 s PRO 1503N -2.26 1.11 0.19 3.89 0.04 -1.26 -4.94 135.00 131.78 1iv4 s PRO 1503Ca -0.07 -0.43 -0.30 0.00 0.04 0.00 0.00 61.00 60.23 1iv4 s PRO 1503Cb -0.02 -1.96 -0.09 0.00 0.04 0.00 0.00 34.50 32.47 1iv4 s PRO 1503CO -0.02 -2.06 1.35 0.15 0.04 0.00 0.00 177.00 176.47 1iv4 s LYS 1504N -5.68 4.36 0.01 4.56 -0.14 -1.26 -4.93 119.74 116.66 1iv4 s LYS 1504Ca 0.70 2.10 0.22 0.00 -1.36 0.00 0.00 55.97 57.63 1iv4 s LYS 1504Cb -0.06 -3.19 -0.20 0.00 -1.68 0.00 0.00 37.83 32.70 1iv4 s LYS 1504CO 0.50 -0.32 0.76 1.28 -0.76 0.00 0.00 175.35 176.82 1iv4 n LEU 1505N 2.84 0.48 -0.27 3.17 4.77 -1.26 -4.45 117.00 122.28 1iv4 n LEU 1505Ca 0.07 -0.15 0.04 0.00 -0.03 0.00 0.00 56.01 55.95 1iv4 n LEU 1505Cb 0.42 -0.03 0.13 0.00 -2.33 0.00 0.00 43.42 41.62 1iv4 n LEU 1505CO 0.58 0.08 0.76 1.23 -1.33 0.00 0.00 177.39 178.71 1iv4 h GLY 1506N 4.44 0.72 2.00 -0.72 0.00 -2.00 0.36 103.07 107.87 1iv4 h GLY 1506Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1iv4 h GLY 1506CO 0.00 -0.31 0.00 -1.05 0.00 0.00 0.00 176.54 175.18 1iv4 n PRO 1507N -5.45 0.13 -0.00 4.80 -0.02 -1.26 -2.02 135.00 131.19 1iv4 n PRO 1507Ca 0.13 0.54 0.09 0.00 -2.02 0.00 0.00 63.50 62.24 1iv4 n PRO 1507Cb 0.45 -1.87 0.07 0.00 -0.02 0.00 0.00 33.50 32.14 1iv4 n PRO 1507CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1iv4 n HIS 1508N -2.14 0.00 -0.16 6.00 8.25 0.12 -4.73 115.22 122.57 1iv4 n HIS 1508Ca -0.00 -0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.43 1iv4 n HIS 1508Cb 0.09 -0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.27 1iv4 n HIS 1508CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1iv4 h ARG 1509N 3.46 0.18 -0.34 -0.41 2.43 -0.67 -0.25 114.38 118.78 1iv4 h ARG 1509Ca 0.00 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1iv4 h ARG 1509Cb 0.74 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 1iv4 h ARG 1509CO 0.00 0.12 0.20 -0.22 -1.51 0.00 0.00 179.97 178.56 1iv4 h LYS 1510N 0.19 0.40 -0.26 0.20 3.11 -1.85 -1.47 116.57 116.89 1iv4 h LYS 1510Ca 0.25 -0.02 -0.11 0.00 -2.81 0.00 0.00 60.65 57.96 1iv4 h LYS 1510Cb 0.35 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.48 1iv4 h LYS 1510CO -0.36 0.26 -0.28 0.00 -2.81 0.00 0.00 179.45 176.26 1iv4 h ALA 1511N 1.15 1.03 -0.29 5.00 0.00 -1.75 0.04 119.26 124.44 1iv4 h ALA 1511Ca 0.13 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1iv4 h ALA 1511Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1iv4 h ALA 1511CO -0.06 0.59 -0.16 -0.07 0.00 0.00 0.00 179.25 179.55 1iv4 h LEU 1512N 0.45 0.63 -0.86 0.00 3.38 -0.60 -0.50 115.31 117.81 1iv4 h LEU 1512Ca 0.06 -0.42 -0.07 0.00 0.09 0.00 0.00 57.88 57.54 1iv4 h LEU 1512Cb 0.73 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1iv4 h LEU 1512CO 0.06 0.91 0.04 0.58 0.09 0.00 0.00 178.44 180.12 1iv4 h VAL 1513N 0.36 1.25 -0.62 1.22 2.07 -1.22 -1.46 116.25 117.84 1iv4 h VAL 1513Ca 0.06 -1.00 -0.04 0.00 0.82 0.00 0.00 66.70 66.55 1iv4 h VAL 1513Cb 0.68 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1iv4 h VAL 1513CO 0.05 0.36 0.24 0.44 0.02 0.00 0.00 177.57 178.67 1iv4 h ASP 1514N 0.83 0.83 -0.02 0.57 3.32 -0.73 -0.09 116.42 121.13 1iv4 h ASP 1514Ca 0.16 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1iv4 h ASP 1514Cb 0.44 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 1iv4 h ASP 1514CO 0.02 0.75 -0.00 -1.28 -1.72 0.00 0.00 179.24 177.01 1iv4 h SER 1515N 0.89 0.04 -0.88 6.45 0.87 -0.71 -0.87 113.55 119.33 1iv4 h SER 1515Ca 0.21 -0.33 0.02 0.00 -1.23 0.00 0.00 61.79 60.46 1iv4 h SER 1515Cb 0.19 -0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 62.09 1iv4 h SER 1515CO -0.02 0.36 0.58 -0.07 -0.53 0.00 0.00 176.83 177.15 1iv4 h LEU 1516N -0.29 0.98 -0.16 2.23 3.38 -1.03 0.17 115.31 120.58 1iv4 h LEU 1516Ca 0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1iv4 h LEU 1516Cb 0.34 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1iv4 h LEU 1516CO 0.00 0.69 0.10 -1.28 0.09 0.00 0.00 178.44 178.03 1iv4 h SER 1517N 1.14 0.16 -0.35 -0.43 0.87 -0.87 -0.89 113.55 113.18 1iv4 h SER 1517Ca 0.34 -0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.82 1iv4 h SER 1517Cb -0.05 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 1iv4 h SER 1517CO -0.09 0.12 -0.08 -0.09 -0.53 0.00 0.00 176.83 176.16 1iv4 h ARG 1518N 0.20 0.67 -0.33 2.24 2.43 -0.79 0.13 114.38 118.94 1iv4 h ARG 1518Ca 0.06 -0.25 -0.04 0.00 -0.81 0.00 0.00 59.98 58.93 1iv4 h ARG 1518Cb -0.02 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1iv4 h ARG 1518CO -0.02 0.83 0.04 -0.07 -1.51 0.00 0.00 179.97 179.24 1iv4 h LEU 1519N 0.47 0.53 -0.46 3.80 4.07 -0.90 -3.15 115.31 119.66 1iv4 h LEU 1519Ca 0.09 -0.27 0.00 0.00 0.08 0.00 0.00 57.88 57.78 1iv4 h LEU 1519Cb 0.58 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.17 1iv4 h LEU 1519CO 0.03 0.67 -0.16 0.23 -1.08 0.00 0.00 178.44 178.13 1iv4 n MET 1520N -4.58 0.92 -3.72 1.13 2.81 -0.35 -4.96 117.12 108.37 1iv4 n MET 1520Ca -0.02 -0.46 -0.24 0.00 -1.81 0.00 0.00 57.70 55.16 1iv4 n MET 1520Cb 0.23 -1.49 0.05 0.00 -0.71 0.00 0.00 33.22 31.30 1iv4 n MET 1520CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1iv4 n ARG 1521N -0.64 -5.97 -4.54 0.03 1.74 -0.02 -5.02 116.66 102.25 1iv4 n ARG 1521Ca 0.14 0.68 -0.30 0.00 -0.77 0.00 0.00 57.85 57.60 1iv4 n ARG 1521Cb 0.32 -5.52 -0.12 0.00 -1.02 0.00 0.00 32.46 26.12 1iv4 n ARG 1521CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1iv4 s LEU 1522N -6.97 2.62 0.71 0.55 1.43 -0.90 -5.05 118.68 111.06 1iv4 s LEU 1522Ca 0.35 -0.48 -0.15 0.00 -1.03 0.00 0.00 54.13 52.81 1iv4 s LEU 1522Cb -0.17 -1.51 0.03 0.00 0.03 0.00 0.00 46.19 44.57 1iv4 s LEU 1522CO 0.79 0.23 1.21 -2.16 0.23 0.00 0.00 176.35 176.65 1iv4 s PRO 1523N -1.68 2.27 0.60 1.29 0.04 -1.26 -4.59 135.00 131.67 1iv4 s PRO 1523Ca 0.16 1.76 0.37 0.00 0.04 0.00 0.00 61.00 63.33 1iv4 s PRO 1523Cb -0.10 -1.85 1.91 0.00 0.04 0.00 0.00 34.50 34.50 1iv4 s PRO 1523CO 0.07 -1.74 2.20 1.96 0.04 0.00 0.00 177.00 179.53 1iv4 h GLN 1524N -0.13 0.00 0.00 4.56 4.20 -1.93 0.32 115.11 122.13 1iv4 h GLN 1524Ca -0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1iv4 h GLN 1524Cb 1.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.08 1iv4 h GLN 1524CO 0.51 0.03 0.00 -0.40 -0.67 0.00 0.00 178.83 178.29 1iv4 n ASP 1525N -3.25 0.00 -0.89 1.46 5.68 -1.26 -2.37 116.55 115.91 1iv4 n ASP 1525Ca -0.02 0.32 0.07 0.00 -0.50 0.00 0.00 54.79 54.66 1iv4 n ASP 1525Cb 0.17 -0.42 0.22 0.00 -1.14 0.00 0.00 41.12 39.94 1iv4 n ASP 1525CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1iv4 n ARG 1526N -1.42 2.96 -3.75 0.11 5.12 0.10 -4.81 116.66 114.97 1iv4 n ARG 1526Ca 0.07 -2.35 -0.38 0.00 -1.93 0.00 0.00 57.85 53.26 1iv4 n ARG 1526Cb 0.22 -1.46 -0.12 0.00 -1.16 0.00 0.00 32.46 29.93 1iv4 n ARG 1526CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1iv4 s ILE 1527N -1.33 3.91 -0.39 0.55 -1.09 -1.00 -1.81 121.20 120.04 1iv4 s ILE 1527Ca 0.33 -0.90 -0.02 0.00 -2.23 0.00 0.00 60.65 57.83 1iv4 s ILE 1527Cb 0.19 -3.11 0.10 0.00 -1.58 0.00 0.00 42.46 38.06 1iv4 s ILE 1527CO 0.19 -0.05 0.16 -0.83 -1.23 0.00 0.00 174.94 173.18 1iv4 s GLY 1528N 1.46 1.95 -0.16 6.18 0.00 0.25 -4.98 107.32 112.01 1iv4 s GLY 1528Ca 0.01 -2.42 0.00 0.00 0.00 0.00 0.00 44.72 42.31 1iv4 s GLY 1528CO 0.03 0.97 -0.16 -2.27 0.00 0.00 0.00 173.10 171.67 1iv4 s LEU 1529N 1.15 2.39 0.10 0.66 2.96 -1.26 -0.01 118.68 124.66 1iv4 s LEU 1529Ca 0.06 -0.52 0.06 0.00 -0.22 0.00 0.00 54.13 53.52 1iv4 s LEU 1529Cb -0.22 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 1iv4 s LEU 1529CO -0.04 0.06 -0.17 0.42 -1.32 0.00 0.00 176.35 175.31 1iv4 s THR 1530N 0.95 1.39 0.02 3.68 -4.23 -0.75 -5.01 115.64 111.69 1iv4 s THR 1530Ca -0.03 -1.49 0.08 0.00 -1.18 0.00 0.00 61.69 59.08 1iv4 s THR 1530Cb -0.15 -1.36 -0.03 0.00 1.34 0.00 0.00 72.50 72.31 1iv4 s THR 1530CO -0.03 -0.21 -0.25 -0.36 -0.54 0.00 0.00 174.62 173.24 1iv4 s PHE 1531N -1.42 2.36 0.02 3.99 0.08 -1.26 -1.27 117.98 120.48 1iv4 s PHE 1531Ca 0.04 -0.40 -0.05 0.00 0.12 0.00 0.00 56.93 56.64 1iv4 s PHE 1531Cb -0.09 -1.45 -0.01 0.00 -0.57 0.00 0.00 43.02 40.91 1iv4 s PHE 1531CO 0.03 0.08 0.08 0.15 -0.10 0.00 0.00 175.22 175.46 1iv4 s LYS 1532N -1.01 0.50 0.74 0.44 -0.14 -0.41 -4.97 119.74 114.89 1iv4 s LYS 1532Ca 0.11 -0.63 -0.07 0.00 -1.36 0.00 0.00 55.97 54.02 1iv4 s LYS 1532Cb -0.10 0.20 0.08 0.00 -1.68 0.00 0.00 37.83 36.33 1iv4 s LYS 1532CO 0.01 -0.12 1.05 0.95 -0.76 0.00 0.00 175.35 176.49 1iv4 s THR 1533N -2.04 2.22 -2.47 2.17 -4.23 -1.26 -0.75 115.64 109.27 1iv4 s THR 1533Ca -0.10 -0.26 0.24 0.00 -1.18 0.00 0.00 61.69 60.38 1iv4 s THR 1533Cb -0.05 -2.96 0.44 0.00 1.34 0.00 0.00 72.50 71.27 1iv4 s THR 1533CO -0.02 0.00 1.53 -1.54 -0.54 0.00 0.00 174.62 174.05 1iv4 n SER 1534N -3.02 2.14 -3.96 3.99 3.41 -1.26 -4.69 113.62 110.22 1iv4 n SER 1534Ca 0.09 -1.75 -0.31 0.00 -0.26 0.00 0.00 58.87 56.65 1iv4 n SER 1534Cb 0.60 -0.09 0.02 0.00 -0.26 0.00 0.00 64.21 64.48 1iv4 n SER 1534CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1iv4 n GLU 1535N 0.64 -5.13 0.00 4.33 -0.58 -1.26 -1.87 120.64 116.78 1iv4 n GLU 1535Ca 0.17 0.56 0.00 0.00 -0.42 0.00 0.00 57.16 57.47 1iv4 n GLU 1535Cb 0.43 -5.41 0.00 0.00 -0.57 0.00 0.00 31.44 25.88 1iv4 n GLU 1535CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1iv4 n GLY 1536N -1.65 2.68 0.23 0.62 0.00 -1.26 -4.91 105.19 100.89 1iv4 n GLY 1536Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 1iv4 n GLY 1536CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1iv4 h LEU 1537N 0.00 0.78 -5.91 0.99 5.85 -1.79 -3.38 115.31 111.84 1iv4 h LEU 1537Ca 0.00 -0.43 -0.51 0.00 0.84 0.00 0.00 57.88 57.79 1iv4 h LEU 1537Cb 0.00 -0.22 -0.37 0.00 0.37 0.00 0.00 40.66 40.43 1iv4 h LEU 1537CO 0.00 1.18 -1.08 0.00 -0.34 0.00 0.00 178.44 178.20 1iv4 n ALA 1538N -2.54 1.99 0.54 1.25 0.00 -1.26 -4.96 120.51 115.52 1iv4 n ALA 1538Ca -0.04 -3.23 0.12 0.00 0.00 0.00 0.00 53.44 50.29 1iv4 n ALA 1538Cb 0.63 -0.89 0.45 0.00 0.00 0.00 0.00 19.45 19.65 1iv4 n ALA 1538CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1iv4 n PRO 1539N 1.04 0.18 -0.80 0.00 -0.04 -1.26 -2.59 135.00 131.52 1iv4 n PRO 1539Ca 0.21 0.30 -0.01 0.00 -0.04 0.00 0.00 63.50 63.96 1iv4 n PRO 1539Cb 0.58 -1.77 0.19 0.00 -0.04 0.00 0.00 33.50 32.46 1iv4 n PRO 1539CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1iv4 n SER 1540N -2.09 2.32 -4.19 3.54 7.64 -1.26 -4.79 113.62 114.79 1iv4 n SER 1540Ca 0.04 -3.85 -0.15 0.00 1.01 0.00 0.00 58.87 55.92 1iv4 n SER 1540Cb 0.30 -0.57 -0.11 0.00 -1.01 0.00 0.00 64.21 62.82 1iv4 n SER 1540CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1iv4 s HIS 1541N -3.28 1.11 -0.11 1.43 3.76 -1.07 -0.47 115.29 116.65 1iv4 s HIS 1541Ca 0.42 -0.64 -0.03 0.00 -0.15 0.00 0.00 55.06 54.66 1iv4 s HIS 1541Cb 0.39 -0.60 -0.03 0.00 1.11 0.00 0.00 32.58 33.45 1iv4 s HIS 1541CO -0.04 0.02 -0.00 0.54 -0.85 0.00 0.00 174.74 174.41 1iv4 s VAL 1542N -2.41 4.25 0.08 -0.90 0.11 -0.37 -4.63 120.40 116.52 1iv4 s VAL 1542Ca 0.06 -0.26 0.07 0.00 -2.93 0.00 0.00 61.98 58.92 1iv4 s VAL 1542Cb -0.03 -2.81 -0.03 0.00 -1.53 0.00 0.00 36.38 31.98 1iv4 s VAL 1542CO 0.00 0.57 -0.19 -1.10 -3.33 0.00 0.00 175.10 171.05 1iv4 s GLN 1543N -0.48 1.13 -0.00 1.54 -0.21 0.20 -1.70 119.66 120.14 1iv4 s GLN 1543Ca 0.08 -1.03 0.01 0.00 0.02 0.00 0.00 55.36 54.44 1iv4 s GLN 1543Cb -0.12 -1.30 -0.00 0.00 1.00 0.00 0.00 33.01 32.59 1iv4 s GLN 1543CO 0.02 0.31 -0.02 0.00 -2.12 0.00 0.00 175.29 173.48 1iv4 s ALA 1544N -1.05 0.17 -0.02 6.09 0.00 -0.03 -0.43 121.76 126.49 1iv4 s ALA 1544Ca 0.05 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.91 1iv4 s ALA 1544Cb -0.09 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.00 1iv4 s ALA 1544CO 0.03 0.03 -0.02 1.03 0.00 0.00 0.00 175.76 176.83 1iv4 s ARG 1545N -0.11 0.33 0.01 0.00 0.52 -0.68 -1.41 118.95 117.61 1iv4 s ARG 1545Ca 0.00 -0.05 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 1iv4 s ARG 1545Cb -0.01 -0.39 -0.01 0.00 0.52 0.00 0.00 34.95 35.06 1iv4 s ARG 1545CO -0.00 -0.01 -0.02 0.00 0.02 0.00 0.00 175.30 175.29 1iv4 s ALA 1546N 0.40 0.10 -0.08 2.13 0.00 0.14 -1.11 121.76 123.34 1iv4 s ALA 1546Ca -0.04 -0.19 0.04 0.00 0.00 0.00 0.00 51.96 51.77 1iv4 s ALA 1546Cb -0.07 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1iv4 s ALA 1546CO -0.01 -0.02 -0.19 0.08 0.00 0.00 0.00 175.76 175.62 1iv4 s VAL 1547N -0.40 2.63 0.18 0.00 1.01 0.27 -1.01 120.40 123.08 1iv4 s VAL 1547Ca -0.04 -0.85 0.11 0.00 0.00 0.00 0.00 61.98 61.20 1iv4 s VAL 1547Cb -0.03 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 1iv4 s VAL 1547CO -0.00 0.56 -0.24 0.68 0.00 0.00 0.00 175.10 176.10 1iv4 s VAL 1548N -0.16 2.30 -0.06 2.92 -7.23 0.46 -0.96 120.40 117.67 1iv4 s VAL 1548Ca -0.02 -1.98 0.03 0.00 -1.81 0.00 0.00 61.98 58.19 1iv4 s VAL 1548Cb -0.14 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 34.73 1iv4 s VAL 1548CO 0.04 -0.10 -0.13 -0.22 -0.31 0.00 0.00 175.10 174.37 1iv4 s LEU 1549N -2.58 1.72 0.02 1.32 2.96 -0.53 -1.59 118.68 120.00 1iv4 s LEU 1549Ca 0.19 -0.30 0.05 0.00 -0.22 0.00 0.00 54.13 53.85 1iv4 s LEU 1549Cb -0.08 -0.84 -0.02 0.00 0.50 0.00 0.00 46.19 45.75 1iv4 s LEU 1549CO 0.09 0.06 -0.15 -0.76 -1.32 0.00 0.00 176.35 174.28 1iv4 s LEU 1550N 0.50 2.12 0.00 -0.68 1.02 -0.00 -0.50 118.68 121.13 1iv4 s LEU 1550Ca -0.12 -0.39 0.00 0.00 0.02 0.00 0.00 54.13 53.64 1iv4 s LEU 1550Cb -0.14 -0.68 0.00 0.00 0.02 0.00 0.00 46.19 45.39 1iv4 s LEU 1550CO 0.03 0.09 0.00 0.47 0.02 0.00 0.00 176.35 176.97