#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ia9 s TYR 1552N 0.00 1.55 -0.79 2.98 5.04 -1.26 -4.94 117.35 119.92 1ia9 s TYR 1552Ca 0.00 0.58 0.02 0.00 -2.44 0.00 0.00 57.07 55.23 1ia9 s TYR 1552Cb 0.00 -4.05 0.21 0.00 0.35 0.00 0.00 41.96 38.47 1ia9 s TYR 1552CO 0.00 -3.44 0.68 0.98 -1.34 0.00 0.00 175.55 172.44 1ia9 n TYR 1553N 10.80 3.67 -0.47 4.97 9.36 -1.26 -5.10 117.16 139.14 1ia9 n TYR 1553Ca 0.26 -4.16 -0.27 0.00 3.32 0.00 0.00 57.90 57.04 1ia9 n TYR 1553Cb 0.46 -0.85 0.22 0.00 -0.63 0.00 0.00 39.34 38.54 1ia9 n TYR 1553CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 1ia9 n SER 1554N 1.92 -2.92 0.11 2.98 3.41 -1.26 -4.77 113.62 113.09 1ia9 n SER 1554Ca 0.22 -0.41 -0.17 0.00 -0.26 0.00 0.00 58.87 58.25 1ia9 n SER 1554Cb 0.36 -0.98 -0.13 0.00 -0.26 0.00 0.00 64.21 63.20 1ia9 n SER 1554CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ia9 h ALA 1555N -2.80 0.09 -0.62 7.33 0.00 -1.98 -2.09 119.26 119.18 1ia9 h ALA 1555Ca -0.45 -0.87 -0.06 0.00 0.00 0.00 0.00 54.91 53.53 1ia9 h ALA 1555Cb 1.20 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 1ia9 h ALA 1555CO 0.31 0.93 0.16 0.28 0.00 0.00 0.00 179.25 180.93 1ia9 h VAL 1556N 0.09 1.25 -0.24 0.00 2.07 -1.98 0.61 116.25 118.06 1ia9 h VAL 1556Ca -0.14 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.42 1ia9 h VAL 1556Cb 1.96 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1ia9 h VAL 1556CO 0.21 0.34 -0.03 -0.33 0.02 0.00 0.00 177.57 177.78 1ia9 h GLU 1557N 0.91 0.45 -0.47 1.57 5.08 -1.92 -1.16 114.58 119.05 1ia9 h GLU 1557Ca 0.20 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1ia9 h GLU 1557Cb 0.35 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1ia9 h GLU 1557CO 0.00 0.66 0.09 -0.09 -1.00 0.00 0.00 179.01 178.67 1ia9 h ARG 1558N 0.21 0.77 -0.39 2.33 2.43 -1.14 -2.53 114.38 116.07 1ia9 h ARG 1558Ca 0.06 -0.20 0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1ia9 h ARG 1558Cb 0.48 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1ia9 h ARG 1558CO 0.02 0.78 0.25 -0.91 -1.51 0.00 0.00 179.97 178.60 1ia9 h ASN 1559N 0.65 0.42 0.92 -3.80 -0.26 0.33 -0.32 115.58 113.53 1ia9 h ASN 1559Ca 0.14 -0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.87 1ia9 h ASN 1559Cb 0.37 -0.10 -0.00 0.00 -1.06 0.00 0.00 38.32 37.53 1ia9 h ASN 1559CO 0.01 0.31 -0.01 0.78 -1.06 0.00 0.00 177.43 177.45 1ia9 h ASN 1560N 0.51 0.00 0.00 5.81 2.35 -1.13 -0.25 115.58 122.87 1ia9 h ASN 1560Ca 0.15 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1ia9 h ASN 1560Cb -0.04 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.33 1ia9 h ASN 1560CO -0.04 0.01 -0.02 -0.07 -1.65 0.00 0.00 177.43 175.66 1ia9 h LEU 1561N 0.00 0.00 -1.47 1.61 3.38 -0.98 -3.33 115.31 114.52 1ia9 h LEU 1561Ca -0.00 -0.83 -0.04 0.00 0.09 0.00 0.00 57.88 57.10 1ia9 h LEU 1561Cb 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1ia9 h LEU 1561CO 0.00 0.93 -0.06 0.24 0.09 0.00 0.00 178.44 179.64 1ia9 h MET 1562N -1.00 0.27 -0.55 1.13 2.86 -0.96 -1.87 114.93 114.80 1ia9 h MET 1562Ca -0.01 -0.05 0.09 0.00 -2.06 0.00 0.00 59.70 57.68 1ia9 h MET 1562Cb 0.85 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.43 1ia9 h MET 1562CO -0.00 0.35 0.37 -0.09 1.06 0.00 0.00 176.91 178.59 1ia9 h ARG 1563N 0.26 0.35 0.00 1.72 2.43 -1.16 -0.62 114.38 117.36 1ia9 h ARG 1563Ca 0.06 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1ia9 h ARG 1563Cb 0.28 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1ia9 h ARG 1563CO 0.01 0.23 0.00 -0.07 -1.51 0.00 0.00 179.97 178.64 1ia9 h LEU 1564N 0.36 0.00 0.00 3.80 3.38 -1.44 -2.53 115.31 118.89 1ia9 h LEU 1564Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1ia9 h LEU 1564Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1ia9 h LEU 1564CO -0.06 0.00 -0.30 -1.54 0.09 0.00 0.00 178.44 176.63 1ia9 n SER 1565N -2.37 0.53 -4.85 -0.43 3.41 -0.24 -4.90 113.62 104.77 1ia9 n SER 1565Ca 0.02 0.24 -0.27 0.00 -0.26 0.00 0.00 58.87 58.60 1ia9 n SER 1565Cb 0.25 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 1ia9 n SER 1565CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ia9 s GLN 1566N -3.08 2.25 0.04 4.33 -2.07 -0.95 -5.08 119.66 115.10 1ia9 s GLN 1566Ca 0.10 -2.06 -0.30 0.00 -1.82 0.00 0.00 55.36 51.28 1ia9 s GLN 1566Cb 0.15 -1.97 -0.06 0.00 -1.09 0.00 0.00 33.01 30.04 1ia9 s GLN 1566CO 0.64 -0.48 1.40 -1.12 -1.32 0.00 0.00 175.29 174.41 1ia9 s SER 1567N -4.14 6.84 -0.11 12.60 0.01 -1.26 -5.01 113.70 122.64 1ia9 s SER 1567Ca 0.29 2.18 0.00 0.00 1.31 0.00 0.00 55.95 59.74 1ia9 s SER 1567Cb -0.01 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.63 1ia9 s SER 1567CO 0.18 -0.70 -0.11 -0.63 0.41 0.00 0.00 173.24 172.39 1ia9 s ILE 1568N 1.99 3.25 0.26 1.44 1.01 -1.26 -5.08 121.20 122.82 1ia9 s ILE 1568Ca 0.64 -0.61 -0.31 0.00 0.00 0.00 0.00 60.65 60.37 1ia9 s ILE 1568Cb -0.33 -2.35 -0.13 0.00 0.01 0.00 0.00 42.46 39.66 1ia9 s ILE 1568CO 0.28 0.55 1.42 -0.81 0.00 0.00 0.00 174.94 176.38 1ia9 n PRO 1569N 3.06 2.16 -3.82 2.79 -0.04 -1.26 -5.00 135.00 132.89 1ia9 n PRO 1569Ca -0.18 0.77 -0.21 0.00 -0.04 0.00 0.00 63.50 63.84 1ia9 n PRO 1569Cb 0.53 -2.43 -0.17 0.00 -0.04 0.00 0.00 33.50 31.38 1ia9 n PRO 1569CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1ia9 s PHE 1570N -0.20 0.56 -0.35 0.54 5.36 -1.26 -5.10 117.98 117.53 1ia9 s PHE 1570Ca 0.66 -0.10 0.02 0.00 -0.96 0.00 0.00 56.93 56.55 1ia9 s PHE 1570Cb -0.61 -0.70 0.11 0.00 -0.34 0.00 0.00 43.02 41.48 1ia9 s PHE 1570CO 0.51 -0.27 0.10 0.08 -1.46 0.00 0.00 175.22 174.18 1ia9 s VAL 1571N 1.75 1.80 -0.09 3.12 1.01 -1.26 -5.09 120.40 121.65 1ia9 s VAL 1571Ca 0.01 -2.15 -0.30 0.00 0.00 0.00 0.00 61.98 59.55 1ia9 s VAL 1571Cb -0.13 -2.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.88 1ia9 s VAL 1571CO -0.04 -0.66 1.59 -2.16 0.00 0.00 0.00 175.10 173.83 1ia9 s PRO 1572N 0.98 4.15 -0.16 2.72 0.04 -1.26 -4.98 135.00 136.50 1ia9 s PRO 1572Ca 0.12 2.06 -0.02 0.00 0.04 0.00 0.00 61.00 63.20 1ia9 s PRO 1572Cb -0.19 -3.96 -0.01 0.00 0.04 0.00 0.00 34.50 30.37 1ia9 s PRO 1572CO -0.12 -0.87 -0.10 0.08 0.04 0.00 0.00 177.00 176.03 1ia9 s VAL 1573N 4.07 3.24 0.68 -0.36 1.01 -1.26 -5.10 120.40 122.69 1ia9 s VAL 1573Ca 0.70 -0.58 -0.17 0.00 0.00 0.00 0.00 61.98 61.94 1ia9 s VAL 1573Cb -0.31 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 1ia9 s VAL 1573CO 0.27 0.50 0.97 -2.65 0.00 0.00 0.00 175.10 174.19 1ia9 n PRO 1574N 3.84 0.67 -1.00 2.72 -0.02 -1.26 -4.92 135.00 135.03 1ia9 n PRO 1574Ca -0.18 0.28 -0.33 0.00 -2.02 0.00 0.00 63.50 61.24 1ia9 n PRO 1574Cb 0.52 -2.21 0.12 0.00 -0.02 0.00 0.00 33.50 31.92 1ia9 n PRO 1574CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ia9 n PRO 1575N -1.52 0.00 -3.47 0.52 -0.02 -1.26 -4.99 135.00 124.26 1ia9 n PRO 1575Ca 0.13 0.07 -0.34 0.00 -2.02 0.00 0.00 63.50 61.34 1ia9 n PRO 1575Cb 0.49 -2.21 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 1ia9 n PRO 1575CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1ia9 s ARG 1576N -3.88 3.84 4.20 -0.52 0.52 -1.26 -4.95 118.95 116.90 1ia9 s ARG 1576Ca 0.68 0.29 0.00 0.00 -0.52 0.00 0.00 55.73 56.18 1ia9 s ARG 1576Cb -0.27 -2.88 0.00 0.00 0.52 0.00 0.00 34.95 32.32 1ia9 s ARG 1576CO 0.56 0.47 0.00 0.41 0.02 0.00 0.00 175.30 176.76 1ia9 n GLY 1577N 0.56 0.98 3.36 -3.53 0.00 -1.26 -4.91 105.19 100.38 1ia9 n GLY 1577Ca -0.05 -0.75 -0.15 0.00 0.00 0.00 0.00 46.02 45.08 1ia9 n GLY 1577CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ia9 s GLU 1578N 0.00 0.76 0.10 1.61 0.41 -0.57 -5.02 118.70 115.99 1ia9 s GLU 1578Ca 0.00 0.14 -0.18 0.00 -0.41 0.00 0.00 54.97 54.52 1ia9 s GLU 1578Cb 0.00 0.35 -0.07 0.00 -1.78 0.00 0.00 34.13 32.63 1ia9 s GLU 1578CO 0.00 -0.20 0.58 -1.25 -0.49 0.00 0.00 175.26 173.90 1ia9 s PRO 1579N -0.93 4.16 0.17 0.39 0.04 -1.26 -1.83 135.00 135.74 1ia9 s PRO 1579Ca -0.10 0.70 0.02 0.00 0.04 0.00 0.00 61.00 61.67 1ia9 s PRO 1579Cb -0.03 -3.14 -0.05 0.00 0.04 0.00 0.00 34.50 31.32 1ia9 s PRO 1579CO 0.05 0.58 -0.02 0.14 0.04 0.00 0.00 177.00 177.79 1ia9 s VAL 1580N -1.23 0.78 -0.18 -0.36 -7.23 -0.13 -4.56 120.40 107.48 1ia9 s VAL 1580Ca 0.32 -1.99 -0.03 0.00 -1.81 0.00 0.00 61.98 58.47 1ia9 s VAL 1580Cb -0.18 -2.06 -0.02 0.00 0.56 0.00 0.00 36.38 34.68 1ia9 s VAL 1580CO 0.19 -0.54 -0.04 -0.89 -0.31 0.00 0.00 175.10 173.51 1ia9 s THR 1581N -3.59 3.63 -0.11 5.32 2.01 0.68 -1.41 115.64 122.16 1ia9 s THR 1581Ca 0.22 -0.43 -0.02 0.00 0.31 0.00 0.00 61.69 61.77 1ia9 s THR 1581Cb 0.05 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.93 1ia9 s THR 1581CO 0.03 0.46 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.69 1ia9 s VAL 1582N 0.82 3.91 0.01 3.82 1.01 0.85 0.01 120.40 130.83 1ia9 s VAL 1582Ca -0.01 -0.38 0.08 0.00 0.00 0.00 0.00 61.98 61.67 1ia9 s VAL 1582Cb -0.15 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.55 1ia9 s VAL 1582CO 0.02 0.55 -0.24 -0.31 0.00 0.00 0.00 175.10 175.12 1ia9 s TYR 1583N -0.24 2.11 0.05 5.22 2.02 0.76 -1.45 117.35 125.81 1ia9 s TYR 1583Ca 0.04 -0.40 0.07 0.00 -0.37 0.00 0.00 57.07 56.41 1ia9 s TYR 1583Cb -0.13 -1.31 -0.03 0.00 -0.40 0.00 0.00 41.96 40.09 1ia9 s TYR 1583CO 0.02 0.03 -0.15 0.50 -1.57 0.00 0.00 175.55 174.38 1ia9 s ARG 1584N -0.85 2.14 -0.66 -0.62 3.52 -1.26 -0.91 118.95 120.30 1ia9 s ARG 1584Ca 0.09 -0.96 -0.20 0.00 -0.13 0.00 0.00 55.73 54.54 1ia9 s ARG 1584Cb -0.09 -2.25 0.10 0.00 -1.56 0.00 0.00 34.95 31.14 1ia9 s ARG 1584CO 0.00 0.54 0.85 -1.17 -0.81 0.00 0.00 175.30 174.71 1ia9 s LEU 1585N -1.60 5.07 0.77 -0.88 2.96 -1.26 -0.42 118.68 123.31 1ia9 s LEU 1585Ca 0.16 -1.41 -0.11 0.00 -0.22 0.00 0.00 54.13 52.55 1ia9 s LEU 1585Cb -0.11 -2.35 0.05 0.00 0.50 0.00 0.00 46.19 44.29 1ia9 s LEU 1585CO 0.07 -1.20 1.09 -1.61 -1.32 0.00 0.00 176.35 173.38 1ia9 s GLU 1586N 3.05 2.31 -0.03 1.98 2.02 0.16 -4.81 118.70 123.38 1ia9 s GLU 1586Ca 0.18 0.70 0.03 0.00 0.02 0.00 0.00 54.97 55.90 1ia9 s GLU 1586Cb -0.19 -1.94 0.00 0.00 0.10 0.00 0.00 34.13 32.10 1ia9 s GLU 1586CO 0.05 -1.48 -0.11 -1.21 0.02 0.00 0.00 175.26 172.53 1ia9 s GLU 1587N -5.14 1.17 0.48 1.61 0.41 -1.26 -1.40 118.70 114.57 1ia9 s GLU 1587Ca 0.60 -0.37 0.27 0.00 -0.41 0.00 0.00 54.97 55.06 1ia9 s GLU 1587Cb -0.14 -1.06 0.99 0.00 -1.78 0.00 0.00 34.13 32.14 1ia9 s GLU 1587CO 0.54 0.14 1.85 0.66 -0.49 0.00 0.00 175.26 177.96 1ia9 h SER 1588N 6.39 0.00 -1.54 -0.19 4.64 -1.65 -3.37 113.55 117.83 1ia9 h SER 1588Ca -0.33 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.52 1ia9 h SER 1588Cb 1.17 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.94 1ia9 h SER 1588CO 0.48 0.12 -0.93 -0.24 -0.87 0.00 0.00 176.83 175.39 1ia9 n SER 1589N -3.23 -0.72 -0.24 4.97 2.88 -1.26 -4.93 113.62 111.09 1ia9 n SER 1589Ca 0.01 -2.81 0.01 0.00 -1.33 0.00 0.00 58.87 54.75 1ia9 n SER 1589Cb 0.40 0.02 0.09 0.00 -0.75 0.00 0.00 64.21 63.97 1ia9 n SER 1589CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1ia9 h PRO 1590N 4.19 0.02 0.00 -1.46 0.11 -1.95 0.81 132.00 133.72 1ia9 h PRO 1590Ca 0.04 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1ia9 h PRO 1590Cb 0.93 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ia9 h PRO 1590CO 0.41 0.01 0.00 -1.13 -0.21 0.00 0.00 178.00 177.08 1ia9 n SER 1591N -5.43 0.06 -2.99 -2.05 3.41 -1.26 -2.58 113.62 102.78 1ia9 n SER 1591Ca 0.10 0.52 -0.15 0.00 -0.26 0.00 0.00 58.87 59.08 1ia9 n SER 1591Cb 0.38 -0.53 -0.01 0.00 -0.26 0.00 0.00 64.21 63.79 1ia9 n SER 1591CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1ia9 n ILE 1592N -1.57 0.33 -0.39 -1.33 5.41 0.21 -4.99 119.36 117.03 1ia9 n ILE 1592Ca 0.02 -4.07 0.32 0.00 1.00 0.00 0.00 62.75 60.03 1ia9 n ILE 1592Cb 0.13 0.03 0.63 0.00 -0.71 0.00 0.00 39.64 39.72 1ia9 n ILE 1592CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1ia9 h LEU 1593N 2.99 0.25 -0.05 1.39 5.85 -1.11 0.25 115.31 124.88 1ia9 h LEU 1593Ca 0.03 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1ia9 h LEU 1593Cb 1.03 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.11 1ia9 h LEU 1593CO 0.51 -0.03 0.00 -0.46 -0.34 0.00 0.00 178.44 178.12 1ia9 n ASN 1594N -4.51 0.27 -0.50 1.25 2.04 -1.26 -2.74 115.26 109.81 1ia9 n ASN 1594Ca 0.31 0.53 0.06 0.00 -0.44 0.00 0.00 54.58 55.04 1ia9 n ASN 1594Cb 1.23 -0.60 0.19 0.00 -2.53 0.00 0.00 39.78 38.07 1ia9 n ASN 1594CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1ia9 n ASN 1595N -1.76 2.08 -4.64 0.53 4.13 0.06 -5.02 115.26 110.63 1ia9 n ASN 1595Ca 0.06 -3.60 -0.30 0.00 1.68 0.00 0.00 54.58 52.42 1ia9 n ASN 1595Cb 0.33 -0.51 -0.09 0.00 -1.54 0.00 0.00 39.78 37.98 1ia9 n ASN 1595CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1ia9 s SER 1596N -3.00 4.76 -0.17 6.41 0.15 -1.10 -4.83 113.70 115.92 1ia9 s SER 1596Ca 0.37 -0.27 -0.12 0.00 0.70 0.00 0.00 55.95 56.63 1ia9 s SER 1596Cb 0.34 -1.04 -0.05 0.00 -1.71 0.00 0.00 66.02 63.56 1ia9 s SER 1596CO -0.03 0.17 0.21 -0.32 1.20 0.00 0.00 173.24 174.48 1ia9 s MET 1597N -2.29 4.16 -0.04 5.44 1.75 -1.26 -4.86 119.30 122.21 1ia9 s MET 1597Ca 0.24 -0.05 -0.18 0.00 -1.25 0.00 0.00 55.69 54.44 1ia9 s MET 1597Cb -0.11 -3.40 -0.05 0.00 2.84 0.00 0.00 34.83 34.10 1ia9 s MET 1597CO 0.16 0.32 0.51 -1.12 -0.65 0.00 0.00 175.02 174.24 1ia9 s SER 1598N 0.27 6.84 -0.13 1.11 0.01 -1.26 -1.66 113.70 118.89 1ia9 s SER 1598Ca 0.13 1.00 -0.14 0.00 1.31 0.00 0.00 55.95 58.25 1ia9 s SER 1598Cb -0.12 -2.31 0.04 0.00 0.21 0.00 0.00 66.02 63.83 1ia9 s SER 1598CO 0.01 0.13 0.39 -0.94 0.41 0.00 0.00 173.24 173.24 1ia9 s SER 1599N -0.17 -0.39 0.34 2.44 1.04 -0.50 -4.98 113.70 111.49 1ia9 s SER 1599Ca 0.27 0.71 -0.28 0.00 0.48 0.00 0.00 55.95 57.14 1ia9 s SER 1599Cb -0.17 0.74 -0.10 0.00 0.10 0.00 0.00 66.02 66.60 1ia9 s SER 1599CO 0.14 -0.18 1.23 0.26 0.98 0.00 0.00 173.24 175.67 1ia9 s TRP 1600N 0.02 3.14 0.71 5.02 0.52 -1.26 -0.67 118.94 126.43 1ia9 s TRP 1600Ca -0.02 1.51 -0.11 0.00 0.02 0.00 0.00 56.10 57.51 1ia9 s TRP 1600Cb -0.03 -3.53 0.02 0.00 -1.15 0.00 0.00 33.47 28.78 1ia9 s TRP 1600CO 0.01 -1.48 1.07 -1.54 0.02 0.00 0.00 176.95 175.03 1ia9 s SER 1601N -0.74 5.19 -0.17 2.95 1.04 0.44 -4.85 113.70 117.56 1ia9 s SER 1601Ca 0.51 1.64 -0.03 0.00 0.48 0.00 0.00 55.95 58.54 1ia9 s SER 1601Cb -0.36 -2.48 -0.09 0.00 0.10 0.00 0.00 66.02 63.19 1ia9 s SER 1601CO 0.47 -1.57 -0.18 0.00 0.98 0.00 0.00 173.24 172.94 1ia9 n GLN 1602N -3.21 0.39 -2.46 4.02 0.00 -1.26 -4.77 117.38 110.08 1ia9 n GLN 1602Ca 0.08 0.12 -0.42 0.00 0.00 0.00 0.00 57.00 56.78 1ia9 n GLN 1602Cb 0.54 -1.23 -0.02 0.00 0.00 0.00 0.00 30.24 29.53 1ia9 n GLN 1602CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1ia9 s LEU 1603N -6.40 3.51 0.06 2.61 2.96 -1.26 -5.00 118.68 115.16 1ia9 s LEU 1603Ca -0.23 0.43 -0.30 0.00 -0.22 0.00 0.00 54.13 53.81 1ia9 s LEU 1603Cb 0.07 -3.31 -0.05 0.00 0.50 0.00 0.00 46.19 43.40 1ia9 s LEU 1603CO 0.34 -1.50 1.04 -0.83 -1.32 0.00 0.00 176.35 174.08 1ia9 s GLY 1604N 3.59 2.82 -0.01 7.98 0.00 -1.26 -4.90 107.32 115.54 1ia9 s GLY 1604Ca 0.52 0.65 0.00 0.00 0.00 0.00 0.00 44.72 45.89 1ia9 s GLY 1604CO 0.29 1.70 0.03 1.08 0.00 0.00 0.00 173.10 176.20 1ia9 s LEU 1605N 0.58 3.67 0.45 0.66 1.43 -0.53 -4.81 118.68 120.13 1ia9 s LEU 1605Ca 0.52 0.07 -0.21 0.00 -1.03 0.00 0.00 54.13 53.47 1ia9 s LEU 1605Cb -0.24 -2.10 -0.10 0.00 0.03 0.00 0.00 46.19 43.78 1ia9 s LEU 1605CO 0.30 0.29 0.99 0.00 0.23 0.00 0.00 176.35 178.15 1ia9 s ALA 1607N -2.05 -0.18 -0.22 0.00 0.00 -0.50 -0.46 121.76 118.34 1ia9 s ALA 1607Ca 0.64 -0.03 -0.05 0.00 0.00 0.00 0.00 51.96 52.51 1ia9 s ALA 1607Cb -0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 1ia9 s ALA 1607CO 0.17 -0.11 0.01 0.21 0.00 0.00 0.00 175.76 176.04 1ia9 s LYS 1608N -0.67 3.58 0.16 0.00 2.47 0.15 -0.96 119.74 124.46 1ia9 s LYS 1608Ca -0.08 -0.53 0.11 0.00 -1.56 0.00 0.00 55.97 53.91 1ia9 s LYS 1608Cb -0.05 -3.14 -0.04 0.00 -1.46 0.00 0.00 37.83 33.15 1ia9 s LYS 1608CO 0.00 -0.09 -0.24 0.96 0.16 0.00 0.00 175.35 176.14 1ia9 s ILE 1609N 1.28 2.20 -0.06 5.43 -4.36 -0.76 -1.24 121.20 123.69 1ia9 s ILE 1609Ca 0.04 -1.88 0.02 0.00 -0.26 0.00 0.00 60.65 58.57 1ia9 s ILE 1609Cb -0.15 -1.99 0.02 0.00 1.25 0.00 0.00 42.46 41.59 1ia9 s ILE 1609CO 0.01 -0.06 -0.11 -1.61 0.24 0.00 0.00 174.94 173.41 1ia9 s GLU 1610N -2.40 1.54 0.27 0.37 2.02 0.54 -1.52 118.70 119.52 1ia9 s GLU 1610Ca 0.16 -0.35 -0.29 0.00 0.02 0.00 0.00 54.97 54.51 1ia9 s GLU 1610Cb -0.09 -1.31 -0.09 0.00 0.10 0.00 0.00 34.13 32.74 1ia9 s GLU 1610CO 0.08 -0.00 1.23 -0.06 0.02 0.00 0.00 175.26 176.52 1ia9 s PHE 1611N 0.74 3.31 0.01 1.61 0.08 -1.26 -0.35 117.98 122.12 1ia9 s PHE 1611Ca -0.13 1.47 -0.03 0.00 0.12 0.00 0.00 56.93 58.36 1ia9 s PHE 1611Cb -0.15 -3.50 -0.01 0.00 -0.57 0.00 0.00 43.02 38.78 1ia9 s PHE 1611CO 0.03 -1.35 -0.06 1.28 -0.10 0.00 0.00 175.22 175.02 1ia9 n LEU 1612N 1.49 0.82 -3.83 -0.37 4.77 -0.68 -4.89 117.00 114.31 1ia9 n LEU 1612Ca 0.01 0.12 -0.05 0.00 -0.03 0.00 0.00 56.01 56.06 1ia9 n LEU 1612Cb 0.43 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1ia9 n LEU 1612CO 0.57 -0.32 0.70 -0.94 -1.33 0.00 0.00 177.39 176.07 1ia9 s SER 1613N -5.72 -0.07 0.95 -1.43 1.04 -1.11 -5.01 113.70 102.35 1ia9 s SER 1613Ca -0.05 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1ia9 s SER 1613Cb 0.01 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1ia9 s SER 1613CO 0.07 -1.15 0.00 0.29 0.98 0.00 0.00 173.24 173.43 1ia9 n LYS 1614N -0.58 0.00 -3.64 4.02 5.02 -1.26 -0.85 118.16 120.86 1ia9 n LYS 1614Ca -0.05 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.20 1ia9 n LYS 1614Cb 0.60 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.54 1ia9 n LYS 1614CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1ia9 s MET 1617N 0.00 0.15 0.04 1.97 -1.94 0.65 -4.72 119.30 115.44 1ia9 s MET 1617Ca 0.00 0.16 0.03 0.00 -1.71 0.00 0.00 55.69 54.17 1ia9 s MET 1617Cb 0.00 0.07 -0.02 0.00 2.01 0.00 0.00 34.83 36.89 1ia9 s MET 1617CO 0.00 -0.02 -0.10 0.20 -0.01 0.00 0.00 175.02 175.09 1ia9 s GLY 1618N -0.02 0.58 0.00 -0.03 0.00 -1.26 0.14 107.32 106.72 1ia9 s GLY 1618Ca 0.07 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.08 1ia9 s GLY 1618CO -0.13 -0.71 0.00 0.61 0.00 0.00 0.00 173.10 172.87 1ia9 n GLY 1619N 1.86 3.87 0.02 0.20 0.00 -1.19 -5.04 105.19 104.93 1ia9 n GLY 1619Ca -0.19 -0.45 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 1ia9 n GLY 1619CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ia9 h GLY 1620N 0.00 0.00 -1.58 -0.02 0.00 -2.04 -3.43 103.07 95.99 1ia9 h GLY 1620Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ia9 h GLY 1620CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 1ia9 n LEU 1621N -3.00 3.02 -4.05 3.11 4.32 -1.26 -5.01 117.00 114.13 1ia9 n LEU 1621Ca -0.02 -1.80 -0.09 0.00 -0.02 0.00 0.00 56.01 54.09 1ia9 n LEU 1621Cb 0.06 -0.24 -0.11 0.00 -1.62 0.00 0.00 43.42 41.51 1ia9 n LEU 1621CO 0.02 0.72 -0.37 -0.60 -1.22 0.00 0.00 177.39 175.95 1ia9 s ARG 1622N -1.05 0.50 -0.10 3.23 3.52 -1.26 -1.85 118.95 121.94 1ia9 s ARG 1622Ca 0.28 -0.93 -0.03 0.00 -0.13 0.00 0.00 55.73 54.92 1ia9 s ARG 1622Cb 0.15 0.07 -0.03 0.00 -1.56 0.00 0.00 34.95 33.58 1ia9 s ARG 1622CO 0.20 -0.06 0.01 1.03 -0.81 0.00 0.00 175.30 175.67 1ia9 s ARG 1623N -2.64 3.14 0.01 5.12 0.52 -0.78 -3.14 118.95 121.18 1ia9 s ARG 1623Ca -0.04 -0.40 0.04 0.00 -0.52 0.00 0.00 55.73 54.81 1ia9 s ARG 1623Cb -0.02 -2.85 -0.01 0.00 0.52 0.00 0.00 34.95 32.59 1ia9 s ARG 1623CO -0.05 0.63 -0.12 0.00 0.02 0.00 0.00 175.30 175.78 1ia9 s ALA 1624N -0.67 1.01 -0.01 2.13 0.00 0.37 -2.05 121.76 122.56 1ia9 s ALA 1624Ca 0.11 -0.60 0.03 0.00 0.00 0.00 0.00 51.96 51.49 1ia9 s ALA 1624Cb -0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.78 1ia9 s ALA 1624CO 0.02 0.22 -0.10 0.08 0.00 0.00 0.00 175.76 175.99 1ia9 s VAL 1625N -0.48 0.77 -0.02 0.00 1.01 -0.56 0.24 120.40 121.36 1ia9 s VAL 1625Ca 0.03 -0.42 -0.18 0.00 0.00 0.00 0.00 61.98 61.41 1ia9 s VAL 1625Cb -0.06 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.62 1ia9 s VAL 1625CO 0.00 0.22 0.50 -0.75 0.00 0.00 0.00 175.10 175.07 1ia9 s LYS 1626N -0.23 4.18 0.13 2.72 2.20 -0.03 -0.81 119.74 127.90 1ia9 s LYS 1626Ca 0.04 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 56.20 1ia9 s LYS 1626Cb -0.04 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 1ia9 s LYS 1626CO -0.00 0.46 0.01 0.14 -0.36 0.00 0.00 175.35 175.60 1ia9 s VAL 1627N -0.40 0.41 -0.14 4.02 -7.23 0.30 -1.68 120.40 115.67 1ia9 s VAL 1627Ca 0.27 -1.93 -0.03 0.00 -1.81 0.00 0.00 61.98 58.48 1ia9 s VAL 1627Cb -0.17 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.78 1ia9 s VAL 1627CO 0.14 -0.58 -0.05 -0.22 -0.31 0.00 0.00 175.10 174.09 1ia9 s LEU 1628N -3.08 3.22 -0.36 1.32 2.96 0.53 -0.83 118.68 122.43 1ia9 s LEU 1628Ca 0.20 -0.13 -0.15 0.00 -0.22 0.00 0.00 54.13 53.84 1ia9 s LEU 1628Cb 0.07 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 44.99 1ia9 s LEU 1628CO 0.00 0.19 0.36 0.00 -1.32 0.00 0.00 176.35 175.59 1ia9 n THR 1630N 5.26 0.58 -3.61 0.00 -2.24 -0.37 0.11 114.28 114.00 1ia9 n THR 1630Ca -0.09 -0.52 -0.05 0.00 -2.27 0.00 0.00 64.05 61.12 1ia9 n THR 1630Cb 0.49 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.38 1ia9 n THR 1630CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1ia9 s TRP 1631N -3.35 -0.15 -0.09 4.78 -0.00 -1.24 -4.47 118.94 114.42 1ia9 s TRP 1631Ca -0.00 0.19 -0.30 0.00 -0.00 0.00 0.00 56.10 55.99 1ia9 s TRP 1631Cb 0.10 0.49 0.08 0.00 -0.00 0.00 0.00 33.47 34.14 1ia9 s TRP 1631CO 0.79 -0.18 0.72 -1.54 -0.00 0.00 0.00 176.95 176.74 1ia9 s SER 1632N -1.55 -0.64 0.24 5.86 1.04 -1.26 0.32 113.70 117.71 1ia9 s SER 1632Ca 0.07 0.78 -0.31 0.00 0.48 0.00 0.00 55.95 56.97 1ia9 s SER 1632Cb -0.01 0.64 -0.11 0.00 0.10 0.00 0.00 66.02 66.64 1ia9 s SER 1632CO -0.04 -0.53 1.64 -1.61 0.98 0.00 0.00 173.24 173.68 1ia9 s GLU 1633N -0.96 4.14 -0.71 4.02 2.02 0.39 -2.36 118.70 125.23 1ia9 s GLU 1633Ca -0.08 2.56 0.00 0.00 0.02 0.00 0.00 54.97 57.47 1ia9 s GLU 1633Cb -0.01 -3.06 0.00 0.00 0.10 0.00 0.00 34.13 31.16 1ia9 s GLU 1633CO 0.08 -0.68 0.00 0.72 0.02 0.00 0.00 175.26 175.40 1ia9 n HIS 1634N 3.18 -1.34 -3.89 1.61 8.25 -1.26 -1.45 115.22 120.32 1ia9 n HIS 1634Ca 0.12 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.32 1ia9 n HIS 1634Cb 0.37 -2.05 0.01 0.00 1.12 0.00 0.00 29.99 29.44 1ia9 n HIS 1634CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1ia9 n ASP 1635N -1.16 -2.17 0.21 0.41 8.00 -1.00 -4.84 116.55 116.01 1ia9 n ASP 1635Ca -0.09 -0.88 0.05 0.00 0.71 0.00 0.00 54.79 54.58 1ia9 n ASP 1635Cb 0.48 -3.58 0.49 0.00 -0.02 0.00 0.00 41.12 38.49 1ia9 n ASP 1635CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1ia9 h ILE 1636N -1.88 1.14 -3.32 0.53 2.10 -1.47 -3.41 117.51 111.20 1ia9 h ILE 1636Ca -0.61 -0.64 -0.55 0.00 1.08 0.00 0.00 64.86 64.14 1ia9 h ILE 1636Cb 1.37 1.32 -0.18 0.00 -1.09 0.00 0.00 36.82 38.24 1ia9 h ILE 1636CO 0.64 0.19 -0.79 -0.76 -1.08 0.00 0.00 178.15 176.34 1ia9 s LEU 1637N -8.66 2.43 -0.24 2.19 1.43 -1.26 -5.11 118.68 109.45 1ia9 s LEU 1637Ca -0.04 -0.85 -0.23 0.00 -1.03 0.00 0.00 54.13 51.98 1ia9 s LEU 1637Cb 0.16 -0.90 -0.01 0.00 0.03 0.00 0.00 46.19 45.47 1ia9 s LEU 1637CO 0.70 0.00 0.77 -0.54 0.23 0.00 0.00 176.35 177.51 1ia9 s LYS 1638N -2.70 4.17 0.42 1.70 3.01 -1.26 -4.62 119.74 120.45 1ia9 s LYS 1638Ca 0.16 0.82 -0.26 0.00 -1.01 0.00 0.00 55.97 55.69 1ia9 s LYS 1638Cb -0.06 -3.64 -0.08 0.00 -1.01 0.00 0.00 37.83 33.03 1ia9 s LYS 1638CO 0.07 -0.47 1.30 -1.54 0.51 0.00 0.00 175.35 175.22 1ia9 s SER 1639N 1.36 6.24 -0.14 2.83 1.04 -1.26 -2.26 113.70 121.51 1ia9 s SER 1639Ca 0.32 2.64 0.00 0.00 0.48 0.00 0.00 55.95 59.39 1ia9 s SER 1639Cb -0.15 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.33 1ia9 s SER 1639CO 0.08 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 174.01 1ia9 n GLY 1640N 0.65 0.50 3.61 7.32 0.00 0.30 -4.98 105.19 112.59 1ia9 n GLY 1640Ca 0.04 -0.30 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 1ia9 n GLY 1640CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ia9 s HIS 1641N -1.92 2.75 -0.01 1.61 4.02 -0.96 -4.95 115.29 115.83 1ia9 s HIS 1641Ca 0.00 -0.16 -0.14 0.00 1.02 0.00 0.00 55.06 55.77 1ia9 s HIS 1641Cb 0.00 -1.38 -0.06 0.00 -1.02 0.00 0.00 32.58 30.13 1ia9 s HIS 1641CO 0.00 0.48 0.40 -0.51 1.02 0.00 0.00 174.74 176.13 1ia9 s LEU 1642N -2.63 4.46 0.18 0.89 1.43 -1.26 -1.61 118.68 120.14 1ia9 s LEU 1642Ca 0.25 0.93 0.03 0.00 -1.03 0.00 0.00 54.13 54.31 1ia9 s LEU 1642Cb -0.10 -2.57 -0.05 0.00 0.03 0.00 0.00 46.19 43.51 1ia9 s LEU 1642CO 0.16 0.32 -0.02 -0.31 0.23 0.00 0.00 176.35 176.72 1ia9 s TYR 1643N -1.00 1.31 -0.11 0.29 1.51 -0.01 -1.00 117.35 118.33 1ia9 s TYR 1643Ca 0.23 -0.94 0.03 0.00 -1.01 0.00 0.00 57.07 55.38 1ia9 s TYR 1643Cb -0.16 -0.74 0.00 0.00 -0.11 0.00 0.00 41.96 40.95 1ia9 s TYR 1643CO 0.13 -0.11 -0.23 0.42 -1.11 0.00 0.00 175.55 174.65 1ia9 s ILE 1644N -3.53 2.01 -0.15 2.71 -1.09 0.08 -0.54 121.20 120.69 1ia9 s ILE 1644Ca 0.23 -0.98 -0.03 0.00 -2.23 0.00 0.00 60.65 57.65 1ia9 s ILE 1644Cb 0.05 -1.76 -0.03 0.00 -1.58 0.00 0.00 42.46 39.15 1ia9 s ILE 1644CO 0.04 0.55 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.62 1ia9 s ILE 1645N 0.53 3.76 -0.02 2.92 1.01 0.01 -2.32 121.20 127.08 1ia9 s ILE 1645Ca -0.15 -0.41 0.07 0.00 0.00 0.00 0.00 60.65 60.17 1ia9 s ILE 1645Cb -0.17 -2.64 -0.02 0.00 0.01 0.00 0.00 42.46 39.64 1ia9 s ILE 1645CO 0.05 0.50 -0.24 -0.54 0.00 0.00 0.00 174.94 174.71 1ia9 s LYS 1646N 0.34 1.98 0.04 2.79 1.02 -0.12 -1.50 119.74 124.29 1ia9 s LYS 1646Ca -0.05 -0.85 0.04 0.00 0.02 0.00 0.00 55.97 55.13 1ia9 s LYS 1646Cb -0.14 -1.88 -0.02 0.00 -0.52 0.00 0.00 37.83 35.27 1ia9 s LYS 1646CO 0.03 0.49 -0.11 -1.54 -0.92 0.00 0.00 175.35 173.30 1ia9 s SER 1647N -0.50 1.28 0.57 2.83 1.04 -0.87 -1.62 113.70 116.44 1ia9 s SER 1647Ca 0.07 -0.44 -0.18 0.00 0.48 0.00 0.00 55.95 55.89 1ia9 s SER 1647Cb -0.10 -0.06 -0.04 0.00 0.10 0.00 0.00 66.02 65.92 1ia9 s SER 1647CO -0.00 -0.04 1.09 -0.36 0.98 0.00 0.00 173.24 174.92 1ia9 s PHE 1648N -0.91 2.78 0.71 5.02 0.08 -1.26 -1.86 117.98 122.53 1ia9 s PHE 1648Ca -0.02 1.54 -0.11 0.00 0.12 0.00 0.00 56.93 58.47 1ia9 s PHE 1648Cb -0.08 -3.16 0.01 0.00 -0.57 0.00 0.00 43.02 39.22 1ia9 s PHE 1648CO 0.01 -1.39 1.07 -0.51 -0.10 0.00 0.00 175.22 174.30 1ia9 s LEU 1649N -4.17 2.97 0.12 -0.37 1.02 -0.77 -4.84 118.68 112.63 1ia9 s LEU 1649Ca 0.68 1.39 -0.28 0.00 0.02 0.00 0.00 54.13 55.94 1ia9 s LEU 1649Cb -0.20 -4.22 -0.07 0.00 0.02 0.00 0.00 46.19 41.72 1ia9 s LEU 1649CO 0.32 -1.42 1.62 1.55 0.02 0.00 0.00 176.35 178.44 1ia9 h PRO 1650N -0.70 -0.48 -0.78 1.29 0.13 -1.96 -2.71 132.00 126.78 1ia9 h PRO 1650Ca -0.45 0.03 0.14 0.00 -0.87 0.00 0.00 66.00 64.86 1ia9 h PRO 1650Cb 1.23 0.11 -0.09 0.00 0.13 0.00 0.00 31.00 32.37 1ia9 h PRO 1650CO 0.60 -0.32 0.35 1.49 -0.23 0.00 0.00 178.00 179.89 1ia9 h GLU 1651N -0.50 0.49 -0.71 0.86 4.57 -1.97 -0.52 114.58 116.80 1ia9 h GLU 1651Ca 0.04 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 1ia9 h GLU 1651Cb 0.55 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 1ia9 h GLU 1651CO -0.20 0.32 0.26 0.28 -1.18 0.00 0.00 179.01 178.49 1ia9 h VAL 1652N 0.50 1.25 -0.03 0.32 2.07 -1.86 0.14 116.25 118.65 1ia9 h VAL 1652Ca 0.43 -0.81 -0.14 0.00 0.82 0.00 0.00 66.70 67.00 1ia9 h VAL 1652Cb 0.64 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1ia9 h VAL 1652CO -0.39 0.32 -0.62 0.40 0.02 0.00 0.00 177.57 177.30 1ia9 h ILE 1653N 1.04 1.43 0.00 4.57 2.04 -1.06 -2.68 117.51 122.85 1ia9 h ILE 1653Ca 0.24 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 64.00 1ia9 h ILE 1653Cb 0.24 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 1ia9 h ILE 1653CO -0.02 0.61 0.00 -1.13 0.00 0.00 0.00 178.15 177.61 1ia9 h ASN 1654N 0.07 0.00 1.01 1.72 -0.73 -0.42 -1.38 115.58 115.85 1ia9 h ASN 1654Ca -0.01 0.00 -0.18 0.00 1.87 0.00 0.00 56.30 57.98 1ia9 h ASN 1654Cb 1.12 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.68 1ia9 h ASN 1654CO 0.09 0.00 -1.04 0.74 -0.37 0.00 0.00 177.43 176.85 1ia9 h THR 1655N 0.00 1.11 -0.19 -3.57 2.02 -0.41 -3.32 112.91 108.55 1ia9 h THR 1655Ca 0.00 -2.70 0.00 0.00 0.77 0.00 0.00 66.41 64.48 1ia9 h THR 1655Cb 0.84 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 69.76 1ia9 h THR 1655CO 0.00 0.63 0.00 0.79 0.37 0.00 0.00 175.52 177.31 1ia9 n TRP 1656N -3.18 0.24 -0.15 3.16 7.02 -1.07 -4.54 117.44 118.92 1ia9 n TRP 1656Ca -0.04 -0.19 0.14 0.00 -1.02 0.00 0.00 57.50 56.39 1ia9 n TRP 1656Cb 0.88 -0.01 0.50 0.00 -2.42 0.00 0.00 31.31 30.26 1ia9 n TRP 1656CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1ia9 h SER 1657N 2.85 0.40 0.19 -0.99 4.64 -1.35 0.25 113.55 119.54 1ia9 h SER 1657Ca 0.00 0.02 -0.28 0.00 -0.47 0.00 0.00 61.79 61.06 1ia9 h SER 1657Cb 0.69 -0.06 0.02 0.00 -0.31 0.00 0.00 62.40 62.74 1ia9 h SER 1657CO 0.00 0.22 -1.31 0.77 -0.87 0.00 0.00 176.83 175.64 1ia9 h SER 1658N 0.43 0.62 -0.85 4.97 4.64 -1.83 -3.34 113.55 118.19 1ia9 h SER 1658Ca 0.35 -0.92 -0.02 0.00 -0.47 0.00 0.00 61.79 60.73 1ia9 h SER 1658Cb 0.77 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.61 1ia9 h SER 1658CO -0.11 1.61 0.47 0.40 -0.87 0.00 0.00 176.83 178.33 1ia9 h ILE 1659N -0.10 1.25 -3.60 0.95 1.08 -1.63 -3.36 117.51 112.10 1ia9 h ILE 1659Ca -0.24 -0.61 -0.66 0.00 -0.39 0.00 0.00 64.86 62.96 1ia9 h ILE 1659Cb 1.93 0.10 -0.39 0.00 -3.07 0.00 0.00 36.82 35.38 1ia9 h ILE 1659CO 0.19 0.28 -0.67 -0.31 -0.69 0.00 0.00 178.15 176.94 1ia9 s TYR 1660N -5.86 3.62 0.00 1.37 2.02 0.82 -5.02 117.35 114.30 1ia9 s TYR 1660Ca -0.13 -2.96 0.00 0.00 -0.37 0.00 0.00 57.07 53.62 1ia9 s TYR 1660Cb 0.16 -2.96 0.00 0.00 -0.40 0.00 0.00 41.96 38.76 1ia9 s TYR 1660CO 0.82 -0.91 0.77 0.36 -1.57 0.00 0.00 175.55 175.02 1ia9 n LYS 1661N 4.05 0.00 -3.85 -0.62 0.00 -1.26 -4.30 118.16 112.18 1ia9 n LYS 1661Ca 0.04 0.73 -0.22 0.00 -0.00 0.00 0.00 58.31 58.85 1ia9 n LYS 1661Cb 0.40 -1.27 -0.05 0.00 -0.00 0.00 0.00 35.03 34.11 1ia9 n LYS 1661CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1ia9 s GLU 1662N -2.09 2.51 -1.46 -1.58 2.56 -1.26 -4.67 118.70 112.72 1ia9 s GLU 1662Ca 0.00 -1.50 -0.01 0.00 0.00 0.00 0.00 54.97 53.46 1ia9 s GLU 1662Cb 0.00 -2.31 0.01 0.00 2.00 0.00 0.00 34.13 33.83 1ia9 s GLU 1662CO 0.00 -0.01 0.34 -0.25 -0.56 0.00 0.00 175.26 174.77 1ia9 n ASP 1663N -1.35 -0.14 0.16 -1.70 8.00 -1.26 -4.87 116.55 115.38 1ia9 n ASP 1663Ca -0.00 -1.07 -0.14 0.00 0.71 0.00 0.00 54.79 54.29 1ia9 n ASP 1663Cb 0.61 -2.69 -0.07 0.00 -0.02 0.00 0.00 41.12 38.96 1ia9 n ASP 1663CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1ia9 h THR 1664N -1.80 0.56 -0.75 -3.53 2.02 -1.83 -1.82 112.91 105.75 1ia9 h THR 1664Ca -0.64 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.56 1ia9 h THR 1664Cb 1.38 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.31 1ia9 h THR 1664CO 0.65 0.00 0.49 0.58 0.37 0.00 0.00 175.52 177.61 1ia9 h VAL 1665N -0.45 1.15 -0.22 3.16 2.07 -1.94 -0.37 116.25 119.65 1ia9 h VAL 1665Ca -0.00 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.23 1ia9 h VAL 1665Cb 0.41 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1ia9 h VAL 1665CO -0.04 0.18 -0.06 0.25 0.02 0.00 0.00 177.57 177.92 1ia9 h LEU 1666N 0.97 -0.21 -0.82 2.57 5.85 -1.87 0.57 115.31 122.38 1ia9 h LEU 1666Ca 0.29 0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.98 1ia9 h LEU 1666Cb -0.05 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1ia9 h LEU 1666CO -0.08 -0.07 -0.10 0.45 -0.34 0.00 0.00 178.44 178.29 1ia9 h HIS 1667N -0.00 0.85 -0.72 1.25 3.86 -0.90 0.12 115.15 119.61 1ia9 h HIS 1667Ca 0.11 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 1ia9 h HIS 1667Cb 0.16 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.38 1ia9 h HIS 1667CO -0.23 0.84 0.46 -0.07 0.86 0.00 0.00 177.93 179.78 1ia9 h LEU 1668N 0.71 0.84 -0.22 2.43 3.38 -0.48 0.12 115.31 122.09 1ia9 h LEU 1668Ca 0.12 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1ia9 h LEU 1668Cb 0.58 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1ia9 h LEU 1668CO 0.04 0.63 -0.00 0.00 0.09 0.00 0.00 178.44 179.20 1ia9 h LEU 1670N 0.16 0.37 -0.58 0.00 3.38 -0.59 -0.91 115.31 117.15 1ia9 h LEU 1670Ca 0.06 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 1ia9 h LEU 1670Cb 0.41 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1ia9 h LEU 1670CO 0.01 0.26 -0.21 0.03 0.09 0.00 0.00 178.44 178.62 1ia9 h ARG 1671N 0.51 0.92 -0.40 1.13 2.47 -0.91 -1.37 114.38 116.73 1ia9 h ARG 1671Ca 0.24 -0.38 -0.02 0.00 -1.26 0.00 0.00 59.98 58.56 1ia9 h ARG 1671Cb 0.15 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.42 1ia9 h ARG 1671CO -0.17 1.03 0.19 1.49 0.56 0.00 0.00 179.97 183.07 1ia9 h GLU 1672N 0.80 0.59 -0.58 0.04 4.57 -0.75 0.49 114.58 119.73 1ia9 h GLU 1672Ca 0.11 -0.09 -0.09 0.00 -1.18 0.00 0.00 59.36 58.11 1ia9 h GLU 1672Cb 0.76 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.22 1ia9 h GLU 1672CO 0.06 0.52 0.01 0.82 -1.18 0.00 0.00 179.01 179.24 1ia9 h ILE 1673N 0.51 1.26 -0.61 2.32 2.04 -1.09 -2.61 117.51 119.34 1ia9 h ILE 1673Ca 0.14 -1.11 -0.08 0.00 1.00 0.00 0.00 64.86 64.80 1ia9 h ILE 1673Cb 0.14 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1ia9 h ILE 1673CO -0.02 0.40 0.06 1.56 0.00 0.00 0.00 178.15 180.16 1ia9 h GLN 1674N 0.92 1.02 -0.38 2.37 4.20 -0.94 -2.14 115.11 120.15 1ia9 h GLN 1674Ca 0.17 -0.28 0.02 0.00 0.06 0.00 0.00 58.65 58.61 1ia9 h GLN 1674Cb 0.53 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 1ia9 h GLN 1674CO 0.03 0.96 0.22 0.37 -0.67 0.00 0.00 178.83 179.74 1ia9 h GLN 1675N 0.95 0.44 -0.30 1.46 4.15 -0.66 -1.22 115.11 119.93 1ia9 h GLN 1675Ca 0.18 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.51 1ia9 h GLN 1675Cb 0.47 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.04 1ia9 h GLN 1675CO 0.02 0.29 -0.09 0.37 -1.93 0.00 0.00 178.83 177.49 1ia9 h GLN 1676N 0.45 0.49 -0.39 1.69 4.15 -1.31 -2.10 115.11 118.09 1ia9 h GLN 1676Ca 0.15 -0.13 -0.08 0.00 0.77 0.00 0.00 58.65 59.36 1ia9 h GLN 1676Cb 0.00 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 1ia9 h GLN 1676CO -0.07 0.59 -0.08 -0.09 -1.93 0.00 0.00 178.83 177.25 1ia9 h ARG 1677N 0.46 0.67 -0.16 1.69 9.65 -0.78 -0.94 114.38 124.97 1ia9 h ARG 1677Ca 0.09 -0.20 -0.00 0.00 -1.10 0.00 0.00 59.98 58.77 1ia9 h ARG 1677Cb 0.44 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 1ia9 h ARG 1677CO 0.02 0.75 0.10 0.00 2.80 0.00 0.00 179.97 183.64 1ia9 h ALA 1678N 1.29 0.20 -1.01 2.80 0.00 -0.57 0.12 119.26 122.10 1ia9 h ALA 1678Ca 0.11 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ia9 h ALA 1678Cb 0.51 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1ia9 h ALA 1678CO 0.03 -0.29 0.67 0.00 0.00 0.00 0.00 179.25 179.65 1ia9 h ALA 1679N 1.03 1.30 -0.54 0.00 0.00 -1.16 -1.57 119.26 118.32 1ia9 h ALA 1679Ca 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ia9 h ALA 1679Cb 0.01 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 1ia9 h ALA 1679CO -0.01 0.62 0.31 0.37 0.00 0.00 0.00 179.25 180.54 1ia9 h GLN 1680N 1.33 0.74 -0.33 0.00 4.15 -0.64 0.19 115.11 120.55 1ia9 h GLN 1680Ca 0.38 -0.08 -0.03 0.00 0.77 0.00 0.00 58.65 59.69 1ia9 h GLN 1680Cb -0.09 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.43 1ia9 h GLN 1680CO -0.10 0.56 0.08 0.87 -1.93 0.00 0.00 178.83 178.31 1ia9 h LYS 1681N 0.72 0.49 -0.18 1.69 1.57 -0.36 0.35 116.57 120.85 1ia9 h LYS 1681Ca 0.19 -0.08 -0.16 0.00 -1.87 0.00 0.00 60.65 58.74 1ia9 h LYS 1681Cb 0.03 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1ia9 h LYS 1681CO -0.03 0.45 -0.50 -0.07 -0.57 0.00 0.00 179.45 178.73 1ia9 h LEU 1682N 0.48 0.75 -1.25 2.94 3.38 -0.33 -2.26 115.31 119.02 1ia9 h LEU 1682Ca 0.11 -0.58 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 1ia9 h LEU 1682Cb 0.19 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1ia9 h LEU 1682CO -0.00 1.20 0.12 0.71 0.09 0.00 0.00 178.44 180.56 1ia9 h THR 1683N 0.33 1.19 -0.29 0.22 1.35 -0.21 -0.58 112.91 114.92 1ia9 h THR 1683Ca -0.01 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 1ia9 h THR 1683Cb 1.12 0.73 -0.01 0.00 -1.73 0.00 0.00 68.15 68.25 1ia9 h THR 1683CO 0.11 0.24 0.18 0.15 -0.25 0.00 0.00 175.52 175.95 1ia9 h PHE 1684N 0.63 0.37 -0.51 4.73 3.04 -0.81 -0.79 116.94 123.60 1ia9 h PHE 1684Ca 0.15 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.08 1ia9 h PHE 1684Cb 0.21 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.58 1ia9 h PHE 1684CO 0.01 0.26 0.24 0.00 -2.02 0.00 0.00 178.31 176.80 1ia9 h ALA 1685N 1.08 0.66 -0.31 2.41 0.00 -0.95 -2.47 119.26 119.68 1ia9 h ALA 1685Ca 0.10 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1ia9 h ALA 1685Cb -0.01 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 1ia9 h ALA 1685CO -0.02 0.22 -0.09 0.35 0.00 0.00 0.00 179.25 179.71 1ia9 h PHE 1686N 0.68 -0.19 0.00 0.00 3.57 -0.69 -0.06 116.94 120.24 1ia9 h PHE 1686Ca 0.17 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1ia9 h PHE 1686Cb 0.12 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.99 1ia9 h PHE 1686CO -0.01 -0.15 -0.12 -0.91 -2.23 0.00 0.00 178.31 174.90 1ia9 h ASN 1687N -0.02 0.00 0.07 0.41 2.35 -0.99 0.96 115.58 118.37 1ia9 h ASN 1687Ca 0.15 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.66 1ia9 h ASN 1687Cb 0.24 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.64 1ia9 h ASN 1687CO -0.33 0.12 -0.98 1.56 -1.65 0.00 0.00 177.43 176.15 1ia9 h GLN 1688N 0.00 0.54 0.00 0.81 1.08 -0.61 -3.38 115.11 113.55 1ia9 h GLN 1688Ca -0.00 -0.68 -0.29 0.00 -1.45 0.00 0.00 58.65 56.23 1ia9 h GLN 1688Cb 0.35 0.22 -0.05 0.00 -0.05 0.00 0.00 27.48 27.94 1ia9 h GLN 1688CO 0.02 1.28 -1.77 -1.33 -0.95 0.00 0.00 178.83 176.08 1ia9 n MET 1689N -3.96 0.64 -1.14 1.46 0.00 -0.26 -4.99 117.12 108.86 1ia9 n MET 1689Ca -0.12 0.26 -0.35 0.00 0.00 0.00 0.00 57.70 57.48 1ia9 n MET 1689Cb 0.86 -1.76 0.08 0.00 0.00 0.00 0.00 33.22 32.40 1ia9 n MET 1689CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1ia9 n LYS 1690N -3.00 0.15 -1.95 0.03 2.85 0.31 -4.93 118.16 111.62 1ia9 n LYS 1690Ca -0.18 0.10 -0.34 0.00 -1.05 0.00 0.00 58.31 56.83 1ia9 n LYS 1690Cb 1.05 -1.85 0.03 0.00 -0.65 0.00 0.00 35.03 33.62 1ia9 n LYS 1690CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 1ia9 s PRO 1691N -3.01 2.98 0.23 -1.58 0.02 -1.26 -4.90 135.00 127.49 1ia9 s PRO 1691Ca 0.63 1.53 0.22 0.00 0.02 0.00 0.00 61.00 63.40 1ia9 s PRO 1691Cb -0.31 -1.96 0.94 0.00 0.02 0.00 0.00 34.50 33.18 1ia9 s PRO 1691CO 0.60 -1.13 1.66 0.36 -0.33 0.00 0.00 177.00 178.16 1ia9 n LYS 1692N -1.95 0.16 0.02 5.54 0.00 -1.26 -1.77 118.16 118.90 1ia9 n LYS 1692Ca 0.11 0.43 0.10 0.00 -0.00 0.00 0.00 58.31 58.96 1ia9 n LYS 1692Cb 0.51 -1.83 0.44 0.00 -0.00 0.00 0.00 35.03 34.16 1ia9 n LYS 1692CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1ia9 n SER 1693N -2.13 0.11 -4.42 -5.58 3.41 -1.26 -4.39 113.62 99.35 1ia9 n SER 1693Ca 0.02 0.52 -0.44 0.00 -0.26 0.00 0.00 58.87 58.71 1ia9 n SER 1693Cb 0.19 -0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 63.52 1ia9 n SER 1693CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1ia9 s ILE 1694N -3.03 5.18 0.00 -1.33 1.01 -0.73 -5.00 121.20 117.29 1ia9 s ILE 1694Ca 0.09 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 59.92 1ia9 s ILE 1694Cb 0.13 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1ia9 s ILE 1694CO 0.39 -0.53 0.61 -0.81 0.00 0.00 0.00 174.94 174.60 1ia9 n PRO 1695N 5.37 0.00 -0.75 2.79 -0.04 -1.26 -4.90 135.00 136.20 1ia9 n PRO 1695Ca -0.11 0.14 -0.34 0.00 -0.04 0.00 0.00 63.50 63.15 1ia9 n PRO 1695Cb 0.45 -1.12 0.14 0.00 -0.04 0.00 0.00 33.50 32.93 1ia9 n PRO 1695CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ia9 n TYR 1696N -0.92 -1.50 -3.40 0.54 4.01 -1.26 -5.04 117.16 109.59 1ia9 n TYR 1696Ca 0.00 0.25 -0.16 0.00 -0.16 0.00 0.00 57.90 57.83 1ia9 n TYR 1696Cb 0.00 -1.54 -0.10 0.00 -0.31 0.00 0.00 39.34 37.40 1ia9 n TYR 1696CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1ia9 s SER 1697N -1.66 1.34 0.60 7.72 0.01 -1.26 -5.06 113.70 115.39 1ia9 s SER 1697Ca 0.52 -0.53 -0.19 0.00 1.31 0.00 0.00 55.95 57.06 1ia9 s SER 1697Cb -0.08 0.62 -0.04 0.00 0.21 0.00 0.00 66.02 66.73 1ia9 s SER 1697CO 0.67 -0.37 1.10 -2.65 0.41 0.00 0.00 173.24 172.40 1ia9 n PRO 1698N 5.32 1.05 -3.71 12.44 -0.02 -1.26 -4.85 135.00 143.98 1ia9 n PRO 1698Ca -0.02 0.41 -0.12 0.00 -2.02 0.00 0.00 63.50 61.74 1ia9 n PRO 1698Cb 0.48 -2.31 -0.10 0.00 -0.02 0.00 0.00 33.50 31.55 1ia9 n PRO 1698CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1ia9 s ARG 1699N -2.92 0.51 -0.13 -0.52 3.52 -0.06 -4.81 118.95 114.53 1ia9 s ARG 1699Ca 0.77 0.70 -0.08 0.00 -0.13 0.00 0.00 55.73 56.99 1ia9 s ARG 1699Cb -0.41 0.18 -0.04 0.00 -1.56 0.00 0.00 34.95 33.12 1ia9 s ARG 1699CO 0.46 -0.09 0.15 -0.06 -0.81 0.00 0.00 175.30 174.95 1ia9 s PHE 1700N 0.61 3.56 0.48 5.12 0.40 -1.26 0.23 117.98 127.11 1ia9 s PHE 1700Ca -0.03 0.50 -0.23 0.00 -0.60 0.00 0.00 56.93 56.57 1ia9 s PHE 1700Cb -0.05 -2.01 -0.07 0.00 0.51 0.00 0.00 43.02 41.40 1ia9 s PHE 1700CO -0.04 0.62 1.23 -0.51 0.70 0.00 0.00 175.22 177.22 1ia9 s LEU 1701N -0.68 3.99 0.31 -0.37 1.43 -0.59 -4.90 118.68 117.87 1ia9 s LEU 1701Ca 0.14 2.46 -0.28 0.00 -1.03 0.00 0.00 54.13 55.42 1ia9 s LEU 1701Cb -0.12 -4.22 -0.09 0.00 0.03 0.00 0.00 46.19 41.79 1ia9 s LEU 1701CO 0.03 -1.08 1.01 -0.70 0.23 0.00 0.00 176.35 175.84 1ia9 s GLU 1702N -2.70 4.59 -0.06 1.70 2.12 -1.26 -4.91 118.70 118.17 1ia9 s GLU 1702Ca 0.65 1.54 0.05 0.00 0.36 0.00 0.00 54.97 57.57 1ia9 s GLU 1702Cb -0.33 -2.98 -0.01 0.00 0.26 0.00 0.00 34.13 31.07 1ia9 s GLU 1702CO 0.39 0.24 -0.23 0.08 -0.54 0.00 0.00 175.26 175.20 1ia9 s VAL 1703N -1.39 2.21 0.21 3.70 1.01 -1.26 -4.47 120.40 120.41 1ia9 s VAL 1703Ca 0.48 -1.01 0.08 0.00 0.00 0.00 0.00 61.98 61.53 1ia9 s VAL 1703Cb -0.25 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 1ia9 s VAL 1703CO 0.31 0.57 -0.01 -0.36 0.00 0.00 0.00 175.10 175.61 1ia9 s PHE 1704N -0.18 2.77 -0.02 5.22 0.40 0.51 -4.68 117.98 122.01 1ia9 s PHE 1704Ca -0.03 -0.18 -0.17 0.00 -0.60 0.00 0.00 56.93 55.96 1ia9 s PHE 1704Cb -0.14 -1.31 -0.05 0.00 0.51 0.00 0.00 43.02 42.03 1ia9 s PHE 1704CO 0.04 0.55 0.47 -1.17 0.70 0.00 0.00 175.22 175.80 1ia9 s LEU 1705N -3.19 4.43 0.02 -0.37 2.96 -0.09 -0.81 118.68 121.63 1ia9 s LEU 1705Ca 0.28 0.99 0.04 0.00 -0.22 0.00 0.00 54.13 55.22 1ia9 s LEU 1705Cb -0.08 -2.69 -0.02 0.00 0.50 0.00 0.00 46.19 43.90 1ia9 s LEU 1705CO 0.19 0.22 -0.12 -0.22 -1.32 0.00 0.00 176.35 175.09 1ia9 s LEU 1706N -0.58 2.10 -0.08 -0.68 0.20 0.16 -0.17 118.68 119.63 1ia9 s LEU 1706Ca 0.26 -0.33 0.03 0.00 0.69 0.00 0.00 54.13 54.77 1ia9 s LEU 1706Cb -0.17 -0.55 0.01 0.00 -0.43 0.00 0.00 46.19 45.04 1ia9 s LEU 1706CO 0.14 0.07 -0.17 -0.47 -0.29 0.00 0.00 176.35 175.63 1ia9 s TYR 1707N -0.58 1.91 -0.12 5.38 5.04 0.10 -0.44 117.35 128.64 1ia9 s TYR 1707Ca 0.02 -0.76 0.02 0.00 -2.44 0.00 0.00 57.07 53.91 1ia9 s TYR 1707Cb -0.06 -1.34 0.01 0.00 0.35 0.00 0.00 41.96 40.93 1ia9 s TYR 1707CO 0.00 -0.34 -0.17 0.00 -1.34 0.00 0.00 175.55 173.70 1ia9 h HIS 1709N 7.42 0.32 -0.69 0.00 2.76 -1.87 0.32 115.15 123.40 1ia9 h HIS 1709Ca -0.32 -0.23 0.15 0.00 -2.20 0.00 0.00 60.37 57.77 1ia9 h HIS 1709Cb 1.18 -0.01 -0.11 0.00 1.55 0.00 0.00 27.41 30.02 1ia9 h HIS 1709CO 0.47 1.20 0.10 0.77 -1.30 0.00 0.00 177.93 179.18 1ia9 h SER 1710N 0.05 -0.12 0.43 3.26 0.02 -1.95 -0.74 113.55 114.50 1ia9 h SER 1710Ca -0.13 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1ia9 h SER 1710Cb 1.92 0.23 0.00 0.00 0.14 0.00 0.00 62.40 64.70 1ia9 h SER 1710CO 0.17 -0.08 -1.32 0.00 -1.14 0.00 0.00 176.83 174.46 1ia9 n ALA 1711N -2.73 3.04 -3.30 3.77 0.00 -1.23 -5.01 120.51 115.04 1ia9 n ALA 1711Ca 0.12 -0.40 -0.16 0.00 0.00 0.00 0.00 53.44 53.00 1ia9 n ALA 1711Cb 0.42 -0.93 0.08 0.00 0.00 0.00 0.00 19.45 19.02 1ia9 n ALA 1711CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ia9 n GLY 1712N 1.29 -0.50 3.59 0.00 0.00 0.11 -5.02 105.19 104.66 1ia9 n GLY 1712Ca -0.00 0.19 -0.08 0.00 0.00 0.00 0.00 46.02 46.12 1ia9 n GLY 1712CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ia9 s GLN 1713N -5.04 1.20 0.16 1.61 2.00 -0.86 -5.02 119.66 113.70 1ia9 s GLN 1713Ca 0.11 -0.54 -0.06 0.00 -2.00 0.00 0.00 55.36 52.87 1ia9 s GLN 1713Cb -0.01 0.49 -0.06 0.00 0.80 0.00 0.00 33.01 34.22 1ia9 s GLN 1713CO 0.69 -0.54 0.41 -1.58 -0.50 0.00 0.00 175.29 173.78 1ia9 s TRP 1714N -3.48 3.47 0.23 1.67 0.52 -1.26 -2.30 118.94 117.80 1ia9 s TRP 1714Ca 0.06 0.63 -0.06 0.00 0.02 0.00 0.00 56.10 56.75 1ia9 s TRP 1714Cb -0.02 -2.06 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 1ia9 s TRP 1714CO -0.05 0.41 0.30 -0.06 0.02 0.00 0.00 176.95 177.57 1ia9 s PHE 1715N -1.67 0.83 0.01 -1.98 0.40 0.41 -4.86 117.98 111.12 1ia9 s PHE 1715Ca 0.42 -1.10 0.05 0.00 -0.60 0.00 0.00 56.93 55.69 1ia9 s PHE 1715Cb -0.12 -0.22 -0.03 0.00 0.51 0.00 0.00 43.02 43.16 1ia9 s PHE 1715CO 0.24 -0.83 -0.12 0.00 0.70 0.00 0.00 175.22 175.21 1ia9 s ALA 1716N -4.02 2.80 0.01 5.36 0.00 -0.64 -0.66 121.76 124.61 1ia9 s ALA 1716Ca 0.31 -1.08 0.02 0.00 0.00 0.00 0.00 51.96 51.21 1ia9 s ALA 1716Cb 0.03 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 1ia9 s ALA 1716CO 0.12 0.59 -0.05 0.54 0.00 0.00 0.00 175.76 176.95 1ia9 s VAL 1717N -0.93 0.40 0.13 0.00 0.11 0.01 -0.94 120.40 119.18 1ia9 s VAL 1717Ca 0.15 -0.52 -0.15 0.00 -2.93 0.00 0.00 61.98 58.53 1ia9 s VAL 1717Cb -0.11 -0.40 0.03 0.00 -1.53 0.00 0.00 36.38 34.37 1ia9 s VAL 1717CO 0.06 -0.09 0.39 -1.83 -3.33 0.00 0.00 175.10 170.29 1ia9 s GLU 1718N -0.66 1.06 0.43 1.54 -1.05 -0.98 -0.36 118.70 118.67 1ia9 s GLU 1718Ca -0.03 -0.74 -0.26 0.00 -0.15 0.00 0.00 54.97 53.79 1ia9 s GLU 1718Cb -0.05 0.46 -0.09 0.00 -0.44 0.00 0.00 34.13 34.01 1ia9 s GLU 1718CO -0.00 -0.41 1.46 -1.21 0.95 0.00 0.00 175.26 176.05 1ia9 s GLU 1719N -3.81 3.82 -0.06 -4.83 2.02 -1.26 -0.74 118.70 113.83 1ia9 s GLU 1719Ca 0.03 2.49 -0.27 0.00 0.02 0.00 0.00 54.97 57.25 1ia9 s GLU 1719Cb 0.02 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.46 1ia9 s GLU 1719CO -0.11 -0.74 0.86 0.00 0.02 0.00 0.00 175.26 175.29 1ia9 s MET 1721N 1.22 3.78 -0.10 0.00 1.00 -1.26 -4.88 119.30 119.06 1ia9 s MET 1721Ca 0.44 0.21 -0.02 0.00 0.00 0.00 0.00 55.69 56.32 1ia9 s MET 1721Cb -0.19 -2.87 -0.03 0.00 0.00 0.00 0.00 34.83 31.74 1ia9 s MET 1721CO 0.21 0.47 -0.04 -0.08 0.00 0.00 0.00 175.02 175.59 1ia9 s THR 1722N -1.56 3.95 -2.85 2.05 -1.32 -1.26 -5.03 115.64 109.63 1ia9 s THR 1722Ca 0.39 -0.37 0.00 0.00 -1.21 0.00 0.00 61.69 60.50 1ia9 s THR 1722Cb -0.13 -2.67 0.00 0.00 -1.51 0.00 0.00 72.50 68.19 1ia9 s THR 1722CO 0.20 0.56 0.00 0.61 -2.21 0.00 0.00 174.62 173.78 1ia9 n GLY 1723N 2.67 0.91 3.66 6.08 0.00 -1.26 -5.01 105.19 112.25 1ia9 n GLY 1723Ca -0.18 -2.11 -0.43 0.00 0.00 0.00 0.00 46.02 43.30 1ia9 n GLY 1723CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ia9 s GLU 1724N -1.02 4.24 -0.20 1.61 -6.30 -1.26 -4.99 118.70 110.77 1ia9 s GLU 1724Ca 0.00 1.39 -0.24 0.00 -2.50 0.00 0.00 54.97 53.62 1ia9 s GLU 1724Cb 0.00 -3.67 -0.01 0.00 0.00 0.00 0.00 34.13 30.45 1ia9 s GLU 1724CO 0.00 -0.67 0.78 0.12 0.02 0.00 0.00 175.26 175.51 1ia9 s PHE 1725N 3.30 3.37 0.04 5.30 2.19 -1.26 -4.48 117.98 126.44 1ia9 s PHE 1725Ca 0.46 1.14 0.00 0.00 0.33 0.00 0.00 56.93 58.86 1ia9 s PHE 1725Cb -0.16 -2.97 -0.03 0.00 -1.31 0.00 0.00 43.02 38.55 1ia9 s PHE 1725CO 0.08 -0.27 -0.04 1.03 1.83 0.00 0.00 175.22 177.84 1ia9 s ARG 1726N 2.30 0.50 -0.19 10.12 0.52 -0.32 -4.95 118.95 126.94 1ia9 s ARG 1726Ca 0.35 -0.89 -0.09 0.00 -0.52 0.00 0.00 55.73 54.57 1ia9 s ARG 1726Cb -0.16 0.01 -0.05 0.00 0.52 0.00 0.00 34.95 35.28 1ia9 s ARG 1726CO 0.10 -0.04 0.11 0.21 0.02 0.00 0.00 175.30 175.71 1ia9 s LYS 1727N -2.43 4.07 -0.13 3.54 2.20 -1.26 -1.20 119.74 124.53 1ia9 s LYS 1727Ca -0.05 -0.24 0.04 0.00 -0.36 0.00 0.00 55.97 55.36 1ia9 s LYS 1727Cb -0.03 -3.35 -0.24 0.00 -1.51 0.00 0.00 37.83 32.70 1ia9 s LYS 1727CO -0.04 0.34 0.32 0.66 -0.36 0.00 0.00 175.35 176.28 1ia9 n TYR 1728N 3.37 0.81 -3.94 4.03 4.01 0.32 -4.81 117.16 120.95 1ia9 n TYR 1728Ca -0.16 0.22 -0.09 0.00 -0.16 0.00 0.00 57.90 57.70 1ia9 n TYR 1728Cb 0.52 -1.12 -0.05 0.00 -0.31 0.00 0.00 39.34 38.38 1ia9 n TYR 1728CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1ia9 s ASN 1729N -6.45 -0.13 0.18 7.72 2.20 -1.21 -1.62 114.94 115.62 1ia9 s ASN 1729Ca -0.17 -0.82 0.02 0.00 -0.94 0.00 0.00 52.86 50.95 1ia9 s ASN 1729Cb 0.07 0.60 -0.01 0.00 -2.00 0.00 0.00 41.25 39.91 1ia9 s ASN 1729CO 0.77 -1.14 0.07 -0.46 -2.94 0.00 0.00 177.10 173.39 1ia9 n ASN 1730N -0.38 0.95 0.29 3.54 6.94 -0.88 -3.19 115.26 122.54 1ia9 n ASN 1730Ca -0.03 -1.97 0.18 0.00 -0.02 0.00 0.00 54.58 52.74 1ia9 n ASN 1730Cb 0.62 0.49 0.82 0.00 -2.36 0.00 0.00 39.78 39.34 1ia9 n ASN 1730CO 0.00 0.00 0.00 0.78 -1.03 0.00 0.00 177.26 177.01 1ia9 h ASN 1731N 0.74 0.00 -0.19 0.53 2.35 -1.91 -2.69 115.58 114.42 1ia9 h ASN 1731Ca -0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 1ia9 h ASN 1731Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1ia9 h ASN 1731CO 0.22 0.01 0.00 -3.20 -1.65 0.00 0.00 177.43 172.81 1ia9 n ASN 1732N -3.11 2.55 0.00 5.81 5.15 -1.26 -4.60 115.26 119.80 1ia9 n ASN 1732Ca -0.00 -1.84 0.00 0.00 -0.60 0.00 0.00 54.58 52.14 1ia9 n ASN 1732Cb 0.25 -0.11 0.00 0.00 -0.53 0.00 0.00 39.78 39.39 1ia9 n ASN 1732CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ia9 n GLY 1733N 1.32 0.65 3.77 8.20 0.00 -1.01 -4.46 105.19 113.64 1ia9 n GLY 1733Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1ia9 n GLY 1733CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ia9 s ASP 1734N -2.97 5.95 0.06 1.61 1.01 -1.26 -4.56 116.67 116.51 1ia9 s ASP 1734Ca 0.00 2.36 0.03 0.00 0.71 0.00 0.00 52.55 55.65 1ia9 s ASP 1734Cb 0.00 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.30 1ia9 s ASP 1734CO 0.00 -1.07 -0.09 -1.61 0.21 0.00 0.00 175.17 172.61 1ia9 s GLU 1735N -2.82 0.67 0.84 8.23 2.02 -1.26 -2.07 118.70 124.30 1ia9 s GLU 1735Ca 0.66 -0.93 -0.12 0.00 0.02 0.00 0.00 54.97 54.60 1ia9 s GLU 1735Cb -0.30 -0.41 0.10 0.00 0.10 0.00 0.00 34.13 33.62 1ia9 s GLU 1735CO 0.35 0.07 1.18 0.96 0.02 0.00 0.00 175.26 177.84 1ia9 s ILE 1736N -1.83 2.00 -0.28 -1.63 -4.36 -0.64 -5.00 121.20 109.46 1ia9 s ILE 1736Ca -0.03 0.00 -0.15 0.00 -0.26 0.00 0.00 60.65 60.21 1ia9 s ILE 1736Cb -0.07 -2.95 -0.03 0.00 1.25 0.00 0.00 42.46 40.65 1ia9 s ILE 1736CO 0.00 0.00 0.37 -0.63 0.24 0.00 0.00 174.94 174.92 1ia9 s ILE 1737N -3.54 5.17 0.03 8.37 1.01 -1.26 -5.02 121.20 125.96 1ia9 s ILE 1737Ca 0.63 0.52 -0.31 0.00 0.00 0.00 0.00 60.65 61.48 1ia9 s ILE 1737Cb -0.11 -3.71 -0.10 0.00 0.01 0.00 0.00 42.46 38.54 1ia9 s ILE 1737CO 0.50 0.13 1.92 -0.81 0.00 0.00 0.00 174.94 176.67 1ia9 n PRO 1738N 5.35 2.68 -0.13 2.79 -0.04 -1.26 -4.88 135.00 139.51 1ia9 n PRO 1738Ca -0.08 0.98 0.09 0.00 -0.04 0.00 0.00 63.50 64.45 1ia9 n PRO 1738Cb 0.51 -2.90 0.15 0.00 -0.04 0.00 0.00 33.50 31.22 1ia9 n PRO 1738CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1ia9 n THR 1739N 5.24 0.47 -3.57 0.52 -2.24 -1.26 -4.95 114.28 108.48 1ia9 n THR 1739Ca 0.20 -0.73 -0.09 0.00 -2.27 0.00 0.00 64.05 61.16 1ia9 n THR 1739Cb 0.37 0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 69.55 1ia9 n THR 1739CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ia9 s ASN 1740N -1.25 -0.39 0.26 3.42 2.20 -1.26 -5.06 114.94 112.86 1ia9 s ASN 1740Ca 0.28 -0.16 -0.02 0.00 -0.94 0.00 0.00 52.86 52.02 1ia9 s ASN 1740Cb 0.17 0.53 0.55 0.00 -2.00 0.00 0.00 41.25 40.50 1ia9 s ASN 1740CO 0.23 -0.91 1.71 0.74 -2.94 0.00 0.00 177.10 175.93 1ia9 h THR 1741N 2.00 0.56 -0.37 0.54 2.02 -2.00 -2.40 112.91 113.26 1ia9 h THR 1741Ca -0.26 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 1ia9 h THR 1741Cb 1.27 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1ia9 h THR 1741CO 0.31 0.07 0.21 0.25 0.37 0.00 0.00 175.52 176.74 1ia9 h LEU 1742N 0.39 0.46 -1.32 2.58 5.85 -1.99 -1.35 115.31 119.93 1ia9 h LEU 1742Ca 0.46 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 59.06 1ia9 h LEU 1742Cb 0.78 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1ia9 h LEU 1742CO -0.47 0.40 -0.13 -0.33 -0.34 0.00 0.00 178.44 177.56 1ia9 h GLU 1743N 0.48 0.29 -0.09 1.25 5.08 -1.87 -1.21 114.58 118.52 1ia9 h GLU 1743Ca 0.13 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1ia9 h GLU 1743Cb 0.03 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 1ia9 h GLU 1743CO -0.02 0.44 0.02 0.93 -1.00 0.00 0.00 179.01 179.37 1ia9 h GLU 1744N 0.28 0.14 -1.00 2.33 5.08 -1.02 -1.26 114.58 119.13 1ia9 h GLU 1744Ca 0.06 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1ia9 h GLU 1744Cb 0.41 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.59 1ia9 h GLU 1744CO 0.02 0.35 0.66 0.82 -1.00 0.00 0.00 179.01 179.86 1ia9 h ILE 1745N -0.08 1.20 -0.22 3.13 2.04 -0.90 0.22 117.51 122.91 1ia9 h ILE 1745Ca 0.03 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1ia9 h ILE 1745Cb 0.27 -0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 1ia9 h ILE 1745CO 0.00 0.24 0.11 0.24 0.00 0.00 0.00 178.15 178.74 1ia9 h MET 1746N 1.30 0.31 -0.46 2.37 2.86 -1.03 -0.41 114.93 119.86 1ia9 h MET 1746Ca 0.39 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.91 1ia9 h MET 1746Cb -0.05 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 1ia9 h MET 1746CO -0.11 0.31 -0.01 -0.07 1.06 0.00 0.00 176.91 178.09 1ia9 h LEU 1747N 0.23 0.73 -1.22 1.22 3.38 -0.55 -2.20 115.31 116.90 1ia9 h LEU 1747Ca 0.07 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 1ia9 h LEU 1747Cb 0.10 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1ia9 h LEU 1747CO -0.01 0.81 -0.24 0.00 0.09 0.00 0.00 178.44 179.08 1ia9 h ALA 1748N 1.28 1.35 -0.46 1.53 0.00 -0.28 -3.16 119.26 119.52 1ia9 h ALA 1748Ca 0.14 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ia9 h ALA 1748Cb 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1ia9 h ALA 1748CO 0.02 0.45 0.30 0.35 0.00 0.00 0.00 179.25 180.37 1ia9 h PHE 1749N 0.21 0.58 -0.94 0.00 3.57 -0.41 0.27 116.94 120.21 1ia9 h PHE 1749Ca 0.03 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.58 1ia9 h PHE 1749Cb 0.55 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.04 1ia9 h PHE 1749CO 0.01 0.37 0.61 0.77 -2.23 0.00 0.00 178.31 177.85 1ia9 h SER 1750N 0.62 1.02 -0.44 0.41 0.02 -1.52 -0.33 113.55 113.33 1ia9 h SER 1750Ca 0.17 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.03 1ia9 h SER 1750Cb -0.06 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 1ia9 h SER 1750CO -0.04 0.70 -0.03 -0.74 -1.14 0.00 0.00 176.83 175.59 1ia9 h HIS 1751N 1.19 0.88 -0.68 3.45 -0.00 -1.49 -2.98 115.15 115.52 1ia9 h HIS 1751Ca 0.38 -0.16 0.01 0.00 -0.00 0.00 0.00 60.37 60.60 1ia9 h HIS 1751Cb 0.01 -0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 27.16 1ia9 h HIS 1751CO -0.01 0.87 0.45 2.35 -0.00 0.00 0.00 177.93 181.58 1ia9 h TRP 1752N 0.64 0.85 -0.73 5.26 7.01 -0.17 -2.50 115.95 126.30 1ia9 h TRP 1752Ca 0.12 0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.20 1ia9 h TRP 1752Cb 0.53 -0.28 -0.06 0.00 -2.10 0.00 0.00 29.16 27.25 1ia9 h TRP 1752CO 0.04 0.53 0.43 1.79 -2.79 0.00 0.00 178.44 178.43 1ia9 h THR 1753N 0.91 0.99 -0.06 2.65 1.35 -0.93 0.21 112.91 118.03 1ia9 h THR 1753Ca 0.25 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1ia9 h THR 1753Cb -0.09 0.14 -0.00 0.00 -1.73 0.00 0.00 68.15 66.47 1ia9 h THR 1753CO -0.06 0.14 0.04 0.22 -0.25 0.00 0.00 175.52 175.61 1ia9 h TYR 1754N 0.78 0.08 -0.26 4.73 3.20 -1.38 -1.60 116.97 122.52 1ia9 h TYR 1754Ca 0.32 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.13 1ia9 h TYR 1754Cb 0.18 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 1ia9 h TYR 1754CO -0.06 0.05 -0.11 0.93 -1.64 0.00 0.00 178.16 177.33 1ia9 h GLU 1755N 0.08 0.53 -0.71 1.82 4.39 -1.08 0.49 114.58 120.11 1ia9 h GLU 1755Ca 0.02 -0.23 0.02 0.00 0.34 0.00 0.00 59.36 59.52 1ia9 h GLU 1755Cb -0.01 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.59 1ia9 h GLU 1755CO -0.00 0.78 0.47 -0.92 -1.16 0.00 0.00 179.01 178.17 1ia9 h TYR 1756N 0.26 0.85 -0.39 4.33 3.20 -0.54 -1.47 116.97 123.21 1ia9 h TYR 1756Ca 0.06 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.95 1ia9 h TYR 1756Cb 0.61 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1ia9 h TYR 1756CO 0.06 0.51 0.00 0.25 -1.64 0.00 0.00 178.16 177.34 1ia9 n THR 1757N -4.45 1.62 -3.71 1.81 -2.24 -0.61 -4.91 114.28 101.80 1ia9 n THR 1757Ca 0.08 -0.87 -0.27 0.00 -2.27 0.00 0.00 64.05 60.73 1ia9 n THR 1757Cb 0.09 -0.26 0.05 0.00 -2.10 0.00 0.00 70.33 68.12 1ia9 n THR 1757CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ia9 n ARG 1758N 0.48 -6.48 -0.97 -0.78 1.74 -0.55 -1.61 116.66 108.48 1ia9 n ARG 1758Ca 0.18 0.71 0.00 0.00 -0.77 0.00 0.00 57.85 57.97 1ia9 n ARG 1758Cb 0.80 -5.67 0.00 0.00 -1.02 0.00 0.00 32.46 26.57 1ia9 n ARG 1758CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ia9 n GLY 1759N -1.81 0.52 0.09 -0.13 0.00 0.17 -4.91 105.19 99.12 1ia9 n GLY 1759Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 1ia9 n GLY 1759CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ia9 h GLU 1760N 1.29 0.11 -4.98 1.61 4.81 -1.48 -3.41 114.58 112.52 1ia9 h GLU 1760Ca 0.00 -0.19 -0.33 0.00 -0.13 0.00 0.00 59.36 58.71 1ia9 h GLU 1760Cb 0.14 0.07 -0.18 0.00 0.63 0.00 0.00 28.75 29.41 1ia9 h GLU 1760CO 0.00 0.94 -0.74 -0.51 -0.73 0.00 0.00 179.01 177.97 1ia9 s LEU 1761N -6.69 2.39 -0.09 1.64 1.43 -1.26 -1.93 118.68 114.17 1ia9 s LEU 1761Ca -0.05 -0.78 -0.05 0.00 -1.03 0.00 0.00 54.13 52.22 1ia9 s LEU 1761Cb 0.08 -0.32 0.04 0.00 0.03 0.00 0.00 46.19 46.03 1ia9 s LEU 1761CO 0.84 -0.24 0.22 -0.22 0.23 0.00 0.00 176.35 177.17 1ia9 s LEU 1762N -2.34 0.52 -0.29 1.79 2.96 -0.20 -3.11 118.68 118.01 1ia9 s LEU 1762Ca 0.04 0.46 -0.10 0.00 -0.22 0.00 0.00 54.13 54.31 1ia9 s LEU 1762Cb -0.04 0.62 -0.03 0.00 0.50 0.00 0.00 46.19 47.25 1ia9 s LEU 1762CO 0.00 -0.16 0.15 -0.69 -1.32 0.00 0.00 176.35 174.33 1ia9 s VAL 1763N 1.21 4.77 0.41 1.68 1.01 -1.26 0.10 120.40 128.32 1ia9 s VAL 1763Ca -0.09 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1ia9 s VAL 1763Cb -0.11 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1ia9 s VAL 1763CO -0.08 0.18 0.03 0.18 0.00 0.00 0.00 175.10 175.42 1ia9 n LEU 1764N 5.00 0.00 -3.21 3.92 4.77 0.15 -4.58 117.00 123.05 1ia9 n LEU 1764Ca -0.14 -2.55 -0.18 0.00 -0.03 0.00 0.00 56.01 53.11 1ia9 n LEU 1764Cb 0.51 0.25 0.08 0.00 -2.33 0.00 0.00 43.42 41.93 1ia9 n LEU 1764CO 0.33 -0.38 0.16 0.47 -1.33 0.00 0.00 177.39 176.64 1ia9 n ASP 1765N -1.31 -3.83 -4.70 -1.43 9.92 -1.23 -1.25 116.55 112.72 1ia9 n ASP 1765Ca -0.16 -0.52 -0.42 0.00 -0.53 0.00 0.00 54.79 53.16 1ia9 n ASP 1765Cb 0.52 -4.59 -0.03 0.00 -0.64 0.00 0.00 41.12 36.38 1ia9 n ASP 1765CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1ia9 s LEU 1766N -6.23 4.34 -0.01 0.64 1.43 -1.19 -4.22 118.68 113.43 1ia9 s LEU 1766Ca 0.24 1.95 -0.29 0.00 -1.03 0.00 0.00 54.13 55.00 1ia9 s LEU 1766Cb -0.11 -3.57 0.08 0.00 0.03 0.00 0.00 46.19 42.62 1ia9 s LEU 1766CO 0.65 -0.52 0.72 0.00 0.23 0.00 0.00 176.35 177.43 1ia9 s GLN 1767N 1.55 1.03 0.00 1.70 -2.07 -1.26 -0.52 119.66 120.09 1ia9 s GLN 1767Ca 0.58 0.03 0.00 0.00 -1.82 0.00 0.00 55.36 54.15 1ia9 s GLN 1767Cb -0.28 0.48 0.00 0.00 -1.09 0.00 0.00 33.01 32.12 1ia9 s GLN 1767CO 0.26 -0.37 0.00 0.41 -1.32 0.00 0.00 175.29 174.28 1ia9 n GLY 1768N 0.49 -0.22 2.99 2.60 0.00 -0.34 -1.60 105.19 109.11 1ia9 n GLY 1768Ca -0.16 -0.89 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 1ia9 n GLY 1768CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ia9 s VAL 1769N -4.00 1.38 0.00 1.61 1.01 -0.57 -1.17 120.40 118.66 1ia9 s VAL 1769Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1ia9 s VAL 1769Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 35.07 1ia9 s VAL 1769CO 0.00 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1ia9 n GLY 1770N 4.67 3.27 0.46 4.51 0.00 -1.26 -1.67 105.19 115.16 1ia9 n GLY 1770Ca -0.16 -0.21 0.14 0.00 0.00 0.00 0.00 46.02 45.78 1ia9 n GLY 1770CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1ia9 n GLU 1771N 13.90 1.63 -3.28 1.61 0.28 -1.26 -4.82 120.64 128.70 1ia9 n GLU 1771Ca 0.00 -0.92 -0.40 0.00 -0.16 0.00 0.00 57.16 55.68 1ia9 n GLU 1771Cb 0.00 -1.47 -0.08 0.00 1.43 0.00 0.00 31.44 31.32 1ia9 n GLU 1771CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1ia9 s ASN 1772N -1.93 6.38 0.28 -1.84 0.01 -0.67 -0.88 114.94 116.29 1ia9 s ASN 1772Ca 0.38 0.46 0.10 0.00 -0.71 0.00 0.00 52.86 53.09 1ia9 s ASN 1772Cb 0.20 -2.26 -0.05 0.00 0.41 0.00 0.00 41.25 39.56 1ia9 s ASN 1772CO 0.32 -0.25 -0.06 -0.76 -1.51 0.00 0.00 177.10 174.84 1ia9 s LEU 1773N 2.22 2.98 0.24 0.60 1.43 0.13 -1.52 118.68 124.77 1ia9 s LEU 1773Ca 0.19 -0.81 -0.21 0.00 -1.03 0.00 0.00 54.13 52.28 1ia9 s LEU 1773Cb -0.16 -1.48 0.03 0.00 0.03 0.00 0.00 46.19 44.62 1ia9 s LEU 1773CO 0.09 -0.02 0.66 0.28 0.23 0.00 0.00 176.35 177.60 1ia9 s THR 1774N -2.41 0.00 -1.35 5.49 -1.32 -0.63 -1.54 115.64 113.89 1ia9 s THR 1774Ca 0.31 -0.72 -0.08 0.00 -1.21 0.00 0.00 61.69 59.99 1ia9 s THR 1774Cb -0.05 -1.70 0.01 0.00 -1.51 0.00 0.00 72.50 69.25 1ia9 s THR 1774CO 0.18 -0.01 1.18 0.47 -2.21 0.00 0.00 174.62 174.23 1ia9 n ASP 1775N -0.42 -6.09 -4.88 8.08 8.00 -1.26 -4.29 116.55 115.69 1ia9 n ASP 1775Ca -0.08 -0.55 -0.29 0.00 0.71 0.00 0.00 54.79 54.58 1ia9 n ASP 1775Cb 0.61 -5.04 0.09 0.00 -0.02 0.00 0.00 41.12 36.76 1ia9 n ASP 1775CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1ia9 s PRO 1776N -6.25 1.99 -0.20 -0.24 0.04 -1.26 -4.85 135.00 124.23 1ia9 s PRO 1776Ca 0.55 0.20 0.01 0.00 0.04 0.00 0.00 61.00 61.81 1ia9 s PRO 1776Cb -0.24 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.38 1ia9 s PRO 1776CO 0.73 -1.60 -0.17 -1.12 0.04 0.00 0.00 177.00 174.88 1ia9 s SER 1777N -4.45 3.43 -0.31 6.66 0.01 -0.38 -4.85 113.70 113.82 1ia9 s SER 1777Ca 0.62 -0.83 -0.11 0.00 1.31 0.00 0.00 55.95 56.94 1ia9 s SER 1777Cb -0.12 -1.48 -0.03 0.00 0.21 0.00 0.00 66.02 64.61 1ia9 s SER 1777CO 0.50 -0.05 0.20 -0.69 0.41 0.00 0.00 173.24 173.61 1ia9 s VAL 1778N 1.26 5.13 -0.17 3.43 1.01 -1.26 -0.67 120.40 129.13 1ia9 s VAL 1778Ca 0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 1ia9 s VAL 1778Cb -0.15 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 1ia9 s VAL 1778CO -0.11 0.13 0.00 -0.63 0.00 0.00 0.00 175.10 174.50 1ia9 s ILE 1779N 1.71 4.25 -0.97 2.22 1.01 0.11 -2.06 121.20 127.47 1ia9 s ILE 1779Ca 0.06 -0.23 -0.21 0.00 0.00 0.00 0.00 60.65 60.27 1ia9 s ILE 1779Cb -0.17 -2.89 0.08 0.00 0.01 0.00 0.00 42.46 39.50 1ia9 s ILE 1779CO 0.10 0.48 1.31 -0.54 0.00 0.00 0.00 174.94 176.29 1ia9 s LYS 1780N 0.39 3.58 0.14 2.79 1.02 0.14 -1.04 119.74 126.76 1ia9 s LYS 1780Ca -0.01 -1.34 0.07 0.00 0.02 0.00 0.00 55.97 54.71 1ia9 s LYS 1780Cb -0.13 -5.14 0.38 0.00 -0.52 0.00 0.00 37.83 32.41 1ia9 s LYS 1780CO 0.02 -2.03 1.10 0.00 -0.92 0.00 0.00 175.35 173.51 1ia9 n ALA 1781N 7.98 0.72 0.96 5.17 0.00 -0.81 -2.12 120.51 132.41 1ia9 n ALA 1781Ca 0.28 0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.89 1ia9 n ALA 1781Cb 0.50 -0.81 -0.11 0.00 0.00 0.00 0.00 19.45 19.03 1ia9 n ALA 1781CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ia9 n GLU 1782N -1.69 0.03 -2.29 0.00 1.02 -1.26 -4.95 120.64 111.49 1ia9 n GLU 1782Ca -0.00 -0.01 -0.39 0.00 -0.02 0.00 0.00 57.16 56.74 1ia9 n GLU 1782Cb 0.19 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.08 1ia9 n GLU 1782CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1ia9 s GLU 1783N -3.02 4.21 -0.28 3.49 2.56 -0.90 -4.93 118.70 119.84 1ia9 s GLU 1783Ca 0.07 1.91 0.12 0.00 0.00 0.00 0.00 54.97 57.07 1ia9 s GLU 1783Cb 0.16 -2.84 0.70 0.00 2.00 0.00 0.00 34.13 34.15 1ia9 s GLU 1783CO 0.86 -0.20 1.69 1.63 -0.56 0.00 0.00 175.26 178.69 1ia9 n LYS 1784N 0.41 3.65 -3.68 4.30 4.76 -1.26 -4.87 118.16 121.47 1ia9 n LYS 1784Ca 0.03 -3.07 -0.10 0.00 -2.87 0.00 0.00 58.31 52.30 1ia9 n LYS 1784Cb 0.45 -2.12 -0.11 0.00 -1.84 0.00 0.00 35.03 31.41 1ia9 n LYS 1784CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1ia9 s ARG 1785N -2.94 0.34 0.31 1.97 3.03 -1.26 -5.05 118.95 115.35 1ia9 s ARG 1785Ca 0.52 0.87 0.02 0.00 2.03 0.00 0.00 55.73 59.17 1ia9 s ARG 1785Cb 0.41 0.10 0.59 0.00 -1.03 0.00 0.00 34.95 35.02 1ia9 s ARG 1785CO 0.12 -0.20 1.89 0.77 -1.13 0.00 0.00 175.30 176.75 1ia9 h SER 1786N 7.58 0.86 -0.65 -2.89 0.02 -1.95 -1.64 113.55 114.89 1ia9 h SER 1786Ca -0.28 0.02 0.19 0.00 -0.84 0.00 0.00 61.79 60.88 1ia9 h SER 1786Cb 1.15 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.50 1ia9 h SER 1786CO 0.22 0.52 0.52 0.00 -1.14 0.00 0.00 176.83 176.96 1ia9 n ASP 1788N -4.10 1.75 -0.09 0.00 8.00 -0.67 -4.76 116.55 116.68 1ia9 n ASP 1788Ca 0.13 -3.43 -0.13 0.00 0.71 0.00 0.00 54.79 52.07 1ia9 n ASP 1788Cb 0.77 -0.47 -0.15 0.00 -0.02 0.00 0.00 41.12 41.26 1ia9 n ASP 1788CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 1ia9 n MET 1789N -1.02 0.68 -4.37 -1.24 1.56 0.17 -4.80 117.12 108.10 1ia9 n MET 1789Ca 0.16 0.09 -0.31 0.00 -0.27 0.00 0.00 57.70 57.37 1ia9 n MET 1789Cb 0.72 -1.57 -0.10 0.00 2.15 0.00 0.00 33.22 34.42 1ia9 n MET 1789CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 1ia9 s VAL 1790N -2.52 3.44 0.07 1.12 1.01 -1.25 0.23 120.40 122.50 1ia9 s VAL 1790Ca -0.17 -1.05 -0.35 0.00 0.00 0.00 0.00 61.98 60.42 1ia9 s VAL 1790Cb 0.07 -2.54 -0.20 0.00 0.00 0.00 0.00 36.38 33.71 1ia9 s VAL 1790CO 0.76 0.25 1.61 -0.26 0.00 0.00 0.00 175.10 177.46 1ia9 h PHE 1791N 4.08 -1.01 -5.01 5.22 -1.00 -1.80 -3.46 116.94 113.96 1ia9 h PHE 1791Ca -0.48 -0.02 -0.52 0.00 2.81 0.00 0.00 57.97 59.76 1ia9 h PHE 1791Cb 1.16 0.34 -0.09 0.00 3.61 0.00 0.00 35.95 40.98 1ia9 h PHE 1791CO 0.58 -0.62 -0.35 0.41 -1.61 0.00 0.00 178.31 176.72 1ia9 n GLY 1792N -1.55 3.48 3.66 -1.45 0.00 -1.26 -4.88 105.19 103.19 1ia9 n GLY 1792Ca -0.15 -2.33 -0.52 0.00 0.00 0.00 0.00 46.02 43.03 1ia9 n GLY 1792CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ia9 n PRO 1793N -1.14 1.69 -3.67 1.61 -0.02 -1.26 -4.93 135.00 127.28 1ia9 n PRO 1793Ca -0.13 0.60 -0.14 0.00 -2.02 0.00 0.00 63.50 61.81 1ia9 n PRO 1793Cb 0.51 -2.45 -0.08 0.00 -0.02 0.00 0.00 33.50 31.46 1ia9 n PRO 1793CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ia9 s ALA 1794N 4.44 -1.38 -0.77 3.55 0.00 -1.26 -5.01 121.76 121.32 1ia9 s ALA 1794Ca 0.97 1.40 -0.23 0.00 0.00 0.00 0.00 51.96 54.10 1ia9 s ALA 1794Cb -0.83 -0.66 0.06 0.00 0.00 0.00 0.00 23.12 21.69 1ia9 s ALA 1794CO 0.56 -0.28 1.15 -0.80 0.00 0.00 0.00 175.76 176.39 1ia9 s ASN 1795N -0.12 6.28 0.13 0.00 0.02 -1.26 -5.00 114.94 114.98 1ia9 s ASN 1795Ca -0.03 -1.05 0.11 0.00 -1.02 0.00 0.00 52.86 50.87 1ia9 s ASN 1795Cb -0.03 -2.48 -0.04 0.00 0.02 0.00 0.00 41.25 38.72 1ia9 s ASN 1795CO 0.03 -1.52 -0.26 -0.76 0.02 0.00 0.00 177.10 174.61 1ia9 s LEU 1796N 4.49 2.32 -0.12 0.60 1.02 -1.26 -4.80 118.68 120.93 1ia9 s LEU 1796Ca 0.31 -0.75 -0.02 0.00 0.02 0.00 0.00 54.13 53.69 1ia9 s LEU 1796Cb -0.10 -1.19 -0.03 0.00 0.02 0.00 0.00 46.19 44.89 1ia9 s LEU 1796CO 0.06 0.17 -0.04 -0.83 0.02 0.00 0.00 176.35 175.73 1ia9 s GLY 1797N -2.05 1.74 0.02 -3.19 0.00 -1.26 -4.97 107.32 97.61 1ia9 s GLY 1797Ca 0.13 -0.83 0.01 0.00 0.00 0.00 0.00 44.72 44.03 1ia9 s GLY 1797CO 0.06 -0.31 0.85 1.18 0.00 0.00 0.00 173.10 174.88 1ia9 n GLU 1798N 2.95 0.01 0.01 2.90 1.02 -1.26 0.76 120.64 127.03 1ia9 n GLU 1798Ca -0.18 0.33 0.12 0.00 -0.02 0.00 0.00 57.16 57.41 1ia9 n GLU 1798Cb 0.53 -1.72 0.24 0.00 -0.02 0.00 0.00 31.44 30.47 1ia9 n GLU 1798CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1ia9 n ASP 1799N -1.37 0.52 -0.28 1.62 5.68 -1.26 -4.57 116.55 116.89 1ia9 n ASP 1799Ca -0.00 -0.15 -0.07 0.00 -0.50 0.00 0.00 54.79 54.07 1ia9 n ASP 1799Cb 0.20 0.22 -0.07 0.00 -1.14 0.00 0.00 41.12 40.33 1ia9 n ASP 1799CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ia9 n ALA 1800N -1.58 -0.43 0.38 2.12 0.00 0.23 0.79 120.51 122.02 1ia9 n ALA 1800Ca 0.05 0.57 -0.18 0.00 0.00 0.00 0.00 53.44 53.88 1ia9 n ALA 1800Cb 0.36 -0.05 -0.09 0.00 0.00 0.00 0.00 19.45 19.67 1ia9 n ALA 1800CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1ia9 h ILE 1801N 0.00 0.15 -0.53 0.00 5.03 -1.82 0.14 117.51 120.48 1ia9 h ILE 1801Ca 0.11 0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.92 1ia9 h ILE 1801Cb 0.28 0.15 -0.06 0.00 -3.03 0.00 0.00 36.82 34.16 1ia9 h ILE 1801CO -0.64 0.00 0.21 0.50 -0.68 0.00 0.00 178.15 177.54 1ia9 h LYS 1802N -1.04 0.39 -0.38 2.37 3.64 -1.75 -1.17 116.57 118.64 1ia9 h LYS 1802Ca -0.09 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1ia9 h LYS 1802Cb 0.84 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 1ia9 h LYS 1802CO 0.09 0.26 0.24 -0.91 -2.27 0.00 0.00 179.45 176.86 1ia9 h ASN 1803N 0.40 0.43 -0.43 4.20 -0.26 0.55 -0.69 115.58 119.79 1ia9 h ASN 1803Ca 0.25 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.96 1ia9 h ASN 1803Cb 0.26 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.39 1ia9 h ASN 1803CO -0.24 0.32 0.24 0.15 -1.06 0.00 0.00 177.43 176.85 1ia9 h PHE 1804N 0.50 0.58 -0.51 1.19 3.57 -0.20 0.20 116.94 122.28 1ia9 h PHE 1804Ca 0.14 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 1ia9 h PHE 1804Cb -0.05 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.48 1ia9 h PHE 1804CO -0.05 0.44 0.16 0.00 -2.23 0.00 0.00 178.31 176.63 1ia9 h ARG 1805N 0.56 0.75 -0.07 1.11 3.08 -0.98 0.27 114.38 119.10 1ia9 h ARG 1805Ca 0.15 -0.13 -0.20 0.00 0.07 0.00 0.00 59.98 59.88 1ia9 h ARG 1805Cb 0.04 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 29.98 1ia9 h ARG 1805CO -0.03 0.65 -0.72 0.00 -1.07 0.00 0.00 179.97 178.80 1ia9 h ALA 1806N 1.44 0.19 0.10 0.04 0.00 -0.74 -3.39 119.26 116.90 1ia9 h ALA 1806Ca 0.17 -0.59 -0.33 0.00 0.00 0.00 0.00 54.91 54.16 1ia9 h ALA 1806Cb 0.21 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1ia9 h ALA 1806CO -0.01 0.53 -1.76 0.87 0.00 0.00 0.00 179.25 178.87 1ia9 h LYS 1807N 0.25 0.22 -6.32 0.00 1.57 -0.44 -3.48 116.57 108.37 1ia9 h LYS 1807Ca -0.07 -0.38 -0.62 0.00 -1.87 0.00 0.00 60.65 57.71 1ia9 h LYS 1807Cb 1.38 0.14 0.11 0.00 0.08 0.00 0.00 32.23 33.94 1ia9 h LYS 1807CO 0.15 1.05 -0.12 1.58 -0.57 0.00 0.00 179.45 181.53 1ia9 n HIS 1808N -3.39 0.56 -4.06 -1.35 -0.00 0.95 -4.96 115.22 102.96 1ia9 n HIS 1808Ca -0.23 0.77 -0.32 0.00 0.46 0.00 0.00 57.72 58.40 1ia9 n HIS 1808Cb 1.05 -2.14 -0.15 0.00 -0.12 0.00 0.00 29.99 28.63 1ia9 n HIS 1808CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1ia9 s HIS 1809N -1.08 3.04 0.50 1.57 2.46 -1.26 -5.00 115.29 115.51 1ia9 s HIS 1809Ca 0.61 -2.09 -0.23 0.00 0.47 0.00 0.00 55.06 53.82 1ia9 s HIS 1809Cb -0.76 -1.88 -0.06 0.00 -0.13 0.00 0.00 32.58 29.75 1ia9 s HIS 1809CO 0.59 -0.85 1.29 0.00 -2.47 0.00 0.00 174.74 173.30 1ia9 n ASN 1811N -0.69 1.54 0.04 0.00 0.23 -1.26 -4.98 115.26 110.14 1ia9 n ASN 1811Ca 0.08 -2.20 0.20 0.00 -0.53 0.00 0.00 54.58 52.13 1ia9 n ASN 1811Cb 0.46 0.47 0.72 0.00 -2.08 0.00 0.00 39.78 39.35 1ia9 n ASN 1811CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1ia9 h SER 1812N 0.84 0.00 -0.02 0.53 4.64 -1.96 -0.58 113.55 117.00 1ia9 h SER 1812Ca -0.19 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.97 1ia9 h SER 1812Cb 0.68 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.78 1ia9 h SER 1812CO 0.30 0.00 -0.62 0.00 -0.87 0.00 0.00 176.83 175.65 1ia9 h ARG 1815N 0.99 0.61 -0.62 0.00 3.08 -1.24 -1.92 114.38 115.29 1ia9 h ARG 1815Ca 0.44 -0.42 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1ia9 h ARG 1815Cb 0.33 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1ia9 h ARG 1815CO -0.22 1.03 0.37 0.87 -1.07 0.00 0.00 179.97 180.95 1ia9 h LYS 1816N 0.46 0.83 -0.01 0.04 1.57 0.32 -0.42 116.57 119.36 1ia9 h LYS 1816Ca -0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1ia9 h LYS 1816Cb 1.18 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1ia9 h LYS 1816CO 0.12 0.58 0.00 1.28 -0.57 0.00 0.00 179.45 180.86 1ia9 n LEU 1817N -4.41 0.34 -3.70 2.94 4.77 0.33 -4.88 117.00 112.38 1ia9 n LEU 1817Ca 0.06 -0.12 -0.27 0.00 -0.03 0.00 0.00 56.01 55.65 1ia9 n LEU 1817Cb 0.07 -0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1ia9 n LEU 1817CO 0.37 0.06 0.15 0.29 -1.33 0.00 0.00 177.39 176.93 1ia9 n LYS 1818N -0.71 -6.38 -2.84 3.23 5.02 -0.17 -4.95 118.16 111.36 1ia9 n LYS 1818Ca 0.21 0.71 -0.41 0.00 -2.02 0.00 0.00 58.31 56.81 1ia9 n LYS 1818Cb 0.16 -5.66 -0.05 0.00 -0.02 0.00 0.00 35.03 29.46 1ia9 n LYS 1818CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ia9 s LEU 1819N -7.23 4.47 0.78 -0.35 1.43 -0.75 -5.04 118.68 111.98 1ia9 s LEU 1819Ca 0.60 1.62 -0.11 0.00 -1.03 0.00 0.00 54.13 55.21 1ia9 s LEU 1819Cb -0.29 -3.42 0.06 0.00 0.03 0.00 0.00 46.19 42.57 1ia9 s LEU 1819CO 0.74 -0.04 1.08 -2.84 0.23 0.00 0.00 176.35 175.52 1ia9 s PRO 1820N 0.05 2.23 0.14 1.29 0.02 -1.26 -4.82 135.00 132.65 1ia9 s PRO 1820Ca 0.43 0.82 -0.31 0.00 0.02 0.00 0.00 61.00 61.96 1ia9 s PRO 1820Cb -0.22 -1.92 -0.09 0.00 0.02 0.00 0.00 34.50 32.29 1ia9 s PRO 1820CO 0.26 -1.56 1.44 0.34 -0.33 0.00 0.00 177.00 177.15 1ia9 s ASP 1821N -3.74 6.75 0.34 2.53 2.15 -1.26 -4.89 116.67 118.55 1ia9 s ASP 1821Ca 0.60 2.43 0.26 0.00 0.43 0.00 0.00 52.55 56.27 1ia9 s ASP 1821Cb -0.15 -2.59 1.11 0.00 -0.30 0.00 0.00 42.92 40.99 1ia9 s ASP 1821CO 0.55 -0.70 1.78 -0.07 -0.17 0.00 0.00 175.17 176.57 1ia9 h LEU 1822N 6.64 0.00 0.00 -1.34 3.38 -1.93 -2.76 115.31 119.30 1ia9 h LEU 1822Ca -0.43 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 1ia9 h LEU 1822Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ia9 h LEU 1822CO 0.87 0.00 -0.35 0.11 0.09 0.00 0.00 178.44 179.16 1ia9 h LYS 1823N 0.00 0.00 -6.52 1.13 1.57 -1.90 -3.47 116.57 107.38 1ia9 h LYS 1823Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 1ia9 h LYS 1823Cb 0.36 0.00 0.24 0.00 0.08 0.00 0.00 32.23 32.91 1ia9 h LYS 1823CO 0.00 0.05 -1.36 2.89 -0.57 0.00 0.00 179.45 180.46 1ia9 n ARG 1824N -2.99 -0.91 -2.74 3.15 1.85 -1.04 -4.92 116.66 109.06 1ia9 n ARG 1824Ca 0.02 -0.25 -0.41 0.00 -1.00 0.00 0.00 57.85 56.21 1ia9 n ARG 1824Cb 0.56 -1.54 -0.04 0.00 -1.05 0.00 0.00 32.46 30.39 1ia9 n ARG 1824CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 1ia9 s ASN 1825N -1.65 7.40 0.29 2.89 2.47 -1.26 -4.96 114.94 120.13 1ia9 s ASN 1825Ca 0.51 1.69 0.26 0.00 0.42 0.00 0.00 52.86 55.74 1ia9 s ASN 1825Cb -0.10 -2.57 0.91 0.00 -1.45 0.00 0.00 41.25 38.05 1ia9 s ASN 1825CO 0.68 -0.17 1.76 0.44 -3.72 0.00 0.00 177.10 176.09 1ia9 h ASP 1826N 6.29 0.00 -0.34 -4.21 3.32 -1.96 -3.15 116.42 116.37 1ia9 h ASP 1826Ca -0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1ia9 h ASP 1826Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1ia9 h ASP 1826CO 0.74 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 177.04 1ia9 n TYR 1827N -2.43 0.44 1.29 4.55 4.01 -1.26 -5.22 117.16 118.53 1ia9 n TYR 1827Ca 0.03 -0.30 0.13 0.00 -0.16 0.00 0.00 57.90 57.61 1ia9 n TYR 1827Cb 0.34 -0.01 0.35 0.00 -0.31 0.00 0.00 39.34 39.71 1ia9 n TYR 1827CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81