#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lqi n GLY 1566N 0.00 -1.15 0.00 0.46 0.00 -1.26 0.07 105.19 103.31 3lqi n GLY 1566Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 3lqi n GLY 1566CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3lqi n ASN 1567N 0.05 0.00 -4.28 1.61 4.05 -1.03 -4.94 115.26 110.72 3lqi n ASN 1567Ca 0.00 -0.25 -0.25 0.00 0.45 0.00 0.00 54.58 54.52 3lqi n ASN 1567Cb 0.00 0.00 -0.13 0.00 1.23 0.00 0.00 39.78 40.88 3lqi n ASN 1567CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 3lqi s PHE 1568N -4.41 1.86 0.14 1.20 0.08 -1.26 -1.43 117.98 114.16 3lqi s PHE 1568Ca 0.00 -0.39 -0.31 0.00 0.12 0.00 0.00 56.93 56.34 3lqi s PHE 1568Cb 0.00 -1.07 -0.10 0.00 -0.57 0.00 0.00 43.02 41.28 3lqi s PHE 1568CO 0.00 0.15 1.62 0.00 -0.10 0.00 0.00 175.22 176.89 3lqi h PRO 1570N 7.33 0.00 0.00 0.00 0.13 -1.92 -0.35 132.00 137.19 3lqi h PRO 1570Ca -0.43 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.45 3lqi h PRO 1570Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 3lqi h PRO 1570CO 0.92 0.00 -1.70 1.28 -0.23 0.00 0.00 178.00 178.27 3lqi n LEU 1571N -2.49 1.92 0.01 1.56 4.32 -1.26 -4.67 117.00 116.39 3lqi n LEU 1571Ca -0.02 0.39 0.11 0.00 -0.02 0.00 0.00 56.01 56.47 3lqi n LEU 1571Cb 0.06 -0.83 -0.00 0.00 -1.62 0.00 0.00 43.42 41.02 3lqi n LEU 1571CO 0.13 0.20 0.02 0.00 -1.22 0.00 0.00 177.39 176.52 3lqi n ASP 1573N -1.69 -4.49 -4.78 0.00 2.03 -0.14 -4.98 116.55 102.50 3lqi n ASP 1573Ca 0.03 0.30 -0.37 0.00 0.52 0.00 0.00 54.79 55.27 3lqi n ASP 1573Cb 0.38 -3.11 -0.06 0.00 -0.72 0.00 0.00 41.12 37.61 3lqi n ASP 1573CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3lqi s LYS 1574N -3.10 4.60 0.60 -0.67 1.02 -1.26 -4.65 119.74 116.28 3lqi s LYS 1574Ca 0.00 1.35 -0.10 0.00 0.02 0.00 0.00 55.97 57.23 3lqi s LYS 1574Cb 0.00 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.44 3lqi s LYS 1574CO 0.00 0.29 1.00 0.00 -0.92 0.00 0.00 175.35 175.72 3lqi s TYR 1576N -3.11 -0.22 -0.09 0.00 1.13 -0.51 -4.91 117.35 109.64 3lqi s TYR 1576Ca 0.54 0.18 -0.09 0.00 -1.41 0.00 0.00 57.07 56.29 3lqi s TYR 1576Cb -0.11 0.17 -0.04 0.00 -1.10 0.00 0.00 41.96 40.88 3lqi s TYR 1576CO 0.52 -0.53 0.22 -0.51 -2.51 0.00 0.00 175.55 172.74 3lqi s ASP 1577N -1.93 6.51 0.58 -0.18 1.01 -1.26 -2.46 116.67 118.93 3lqi s ASP 1577Ca -0.06 0.61 0.27 0.00 0.71 0.00 0.00 52.55 54.08 3lqi s ASP 1577Cb -0.01 -2.12 1.70 0.00 1.01 0.00 0.00 42.92 43.49 3lqi s ASP 1577CO -0.02 0.38 2.21 0.44 0.21 0.00 0.00 175.17 178.40 3lqi h ASP 1578N 4.94 0.00 -0.60 0.27 3.32 -0.73 -2.24 116.42 121.38 3lqi h ASP 1578Ca -0.54 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.51 3lqi h ASP 1578Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3lqi h ASP 1578CO 0.59 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.21 3lqi n ASP 1579N -3.97 3.88 -4.49 6.45 5.68 -1.26 -4.88 116.55 117.96 3lqi n ASP 1579Ca -0.02 -2.14 -0.43 0.00 -0.50 0.00 0.00 54.79 51.70 3lqi n ASP 1579Cb 0.13 -0.45 -0.09 0.00 -1.14 0.00 0.00 41.12 39.57 3lqi n ASP 1579CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3lqi s ASP 1580N -1.02 6.19 -0.21 -1.12 2.15 -0.84 -4.91 116.67 116.91 3lqi s ASP 1580Ca 0.43 -0.66 0.15 0.00 0.43 0.00 0.00 52.55 52.90 3lqi s ASP 1580Cb 0.24 -2.22 0.65 0.00 -0.30 0.00 0.00 42.92 41.29 3lqi s ASP 1580CO 0.26 -0.56 1.56 -1.22 -0.17 0.00 0.00 175.17 175.05 3lqi n TYR 1581N 5.56 1.44 -2.29 -5.34 4.01 -1.26 -4.59 117.16 114.70 3lqi n TYR 1581Ca -0.08 -0.86 -0.39 0.00 -0.16 0.00 0.00 57.90 56.42 3lqi n TYR 1581Cb 0.47 -0.41 0.03 0.00 -0.31 0.00 0.00 39.34 39.12 3lqi n TYR 1581CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3lqi n GLU 1582N -0.10 3.86 -3.94 -0.72 -0.58 -1.26 -4.93 120.64 112.97 3lqi n GLU 1582Ca 0.25 -4.10 -0.09 0.00 -0.42 0.00 0.00 57.16 52.81 3lqi n GLU 1582Cb 1.04 -2.34 -0.05 0.00 -0.57 0.00 0.00 31.44 29.52 3lqi n GLU 1582CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3lqi s SER 1583N -1.46 -0.13 -0.46 1.62 1.04 -1.26 -5.12 113.70 107.93 3lqi s SER 1583Ca 0.47 -0.82 -0.01 0.00 0.48 0.00 0.00 55.95 56.06 3lqi s SER 1583Cb 0.33 0.59 0.12 0.00 0.10 0.00 0.00 66.02 67.17 3lqi s SER 1583CO -0.28 -1.14 0.24 -0.54 0.98 0.00 0.00 173.24 172.51 3lqi s LYS 1584N -3.98 2.06 0.09 4.02 1.02 -1.26 -5.05 119.74 116.63 3lqi s LYS 1584Ca 0.19 -2.07 -0.06 0.00 0.02 0.00 0.00 55.97 54.05 3lqi s LYS 1584Cb -0.01 -3.55 -0.02 0.00 -0.52 0.00 0.00 37.83 33.73 3lqi s LYS 1584CO 0.07 -1.08 0.12 -1.64 -0.92 0.00 0.00 175.35 171.89 3lqi s MET 1585N 0.70 0.80 0.03 1.68 -1.94 -1.26 -1.16 119.30 118.15 3lqi s MET 1585Ca 0.11 -1.09 0.08 0.00 -1.71 0.00 0.00 55.69 53.09 3lqi s MET 1585Cb -0.22 0.30 -0.03 0.00 2.01 0.00 0.00 34.83 36.89 3lqi s MET 1585CO -0.04 -0.23 -0.25 -1.64 -0.01 0.00 0.00 175.02 172.85 3lqi s MET 1586N -3.90 1.74 -0.23 2.03 -1.94 0.01 -4.90 119.30 112.11 3lqi s MET 1586Ca 0.08 -1.01 -0.08 0.00 -1.71 0.00 0.00 55.69 52.96 3lqi s MET 1586Cb 0.06 -1.85 -0.04 0.00 2.01 0.00 0.00 34.83 35.01 3lqi s MET 1586CO -0.09 0.48 0.10 -1.14 -0.01 0.00 0.00 175.02 174.36 3lqi s GLN 1587N -1.07 3.84 0.13 2.03 0.74 -1.26 -0.60 119.66 123.47 3lqi s GLN 1587Ca 0.10 -0.39 -0.31 0.00 0.05 0.00 0.00 55.36 54.81 3lqi s GLN 1587Cb -0.10 -3.36 -0.09 0.00 1.10 0.00 0.00 33.01 30.56 3lqi s GLN 1587CO 0.01 -0.02 1.59 0.00 -0.55 0.00 0.00 175.29 176.32 3lqi n GLY 1589N 3.82 -1.22 0.13 0.00 0.00 -0.74 -1.34 105.19 105.85 3lqi n GLY 1589Ca 0.14 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 3lqi n GLY 1589CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3lqi n LYS 1590N -2.07 0.63 0.00 1.61 5.02 -1.26 -4.64 118.16 117.44 3lqi n LYS 1590Ca 0.02 0.24 0.08 0.00 -2.02 0.00 0.00 58.31 56.63 3lqi n LYS 1590Cb 0.22 -1.54 -0.00 0.00 -0.02 0.00 0.00 35.03 33.68 3lqi n LYS 1590CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3lqi n ASP 1592N -0.15 -2.23 -4.81 0.00 8.00 -0.45 -5.00 116.55 111.91 3lqi n ASP 1592Ca 0.07 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.23 3lqi n ASP 1592Cb 0.33 -1.70 -0.05 0.00 -0.02 0.00 0.00 41.12 39.69 3lqi n ASP 1592CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3lqi s ARG 1593N -0.79 3.99 -0.11 -1.24 1.81 -1.26 -4.67 118.95 116.69 3lqi s ARG 1593Ca 0.00 1.18 -0.08 0.00 -1.72 0.00 0.00 55.73 55.11 3lqi s ARG 1593Cb 0.00 -2.14 -0.04 0.00 -0.45 0.00 0.00 34.95 32.32 3lqi s ARG 1593CO 0.00 -0.24 0.16 -1.58 -0.68 0.00 0.00 175.30 172.96 3lqi s TRP 1594N -2.20 3.61 -0.06 -0.53 0.52 -1.26 -0.80 118.94 118.22 3lqi s TRP 1594Ca 0.63 0.57 0.03 0.00 0.02 0.00 0.00 56.10 57.36 3lqi s TRP 1594Cb -0.12 -1.98 0.00 0.00 -1.15 0.00 0.00 33.47 30.23 3lqi s TRP 1594CO 0.19 0.72 -0.16 0.08 0.02 0.00 0.00 176.95 177.80 3lqi s VAL 1595N -0.99 1.36 0.48 4.03 1.01 0.23 -4.24 120.40 122.28 3lqi s VAL 1595Ca 0.16 -0.65 -0.24 0.00 0.00 0.00 0.00 61.98 61.25 3lqi s VAL 1595Cb -0.12 -1.20 -0.07 0.00 0.00 0.00 0.00 36.38 34.99 3lqi s VAL 1595CO 0.05 0.40 1.34 -1.00 0.00 0.00 0.00 175.10 175.88 3lqi s HIS 1596N 0.30 2.53 0.25 5.22 3.76 -1.26 -0.81 115.29 125.27 3lqi s HIS 1596Ca -0.09 1.37 -0.05 0.00 -0.15 0.00 0.00 55.06 56.14 3lqi s HIS 1596Cb -0.14 -3.75 0.33 0.00 1.11 0.00 0.00 32.58 30.14 3lqi s HIS 1596CO 0.03 -2.54 1.87 1.03 -0.85 0.00 0.00 174.74 174.28 3lqi h SER 1597N 2.03 0.92 0.15 1.40 0.87 -1.49 -0.62 113.55 116.81 3lqi h SER 1597Ca -0.50 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.04 3lqi h SER 1597Cb 1.27 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 63.04 3lqi h SER 1597CO 0.60 0.60 -0.14 0.07 -0.53 0.00 0.00 176.83 177.43 3lqi h LYS 1598N 1.06 0.00 0.00 2.24 2.10 -1.82 -1.72 116.57 118.42 3lqi h LYS 1598Ca 0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 3lqi h LYS 1598Cb 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 3lqi h LYS 1598CO -0.16 0.14 0.00 0.00 -2.00 0.00 0.00 179.45 177.43 3lqi n GLU 1600N -1.29 2.83 -3.09 0.00 -0.58 -0.86 -4.97 120.64 112.68 3lqi n GLU 1600Ca 0.11 -2.00 -0.23 0.00 -0.42 0.00 0.00 57.16 54.62 3lqi n GLU 1600Cb 0.19 -1.27 0.03 0.00 -0.57 0.00 0.00 31.44 29.83 3lqi n GLU 1600CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3lqi n ASN 1601N -0.02 -5.75 -4.75 1.62 3.02 -0.63 -4.97 115.26 103.77 3lqi n ASN 1601Ca 0.09 -0.31 -0.36 0.00 -0.03 0.00 0.00 54.58 53.97 3lqi n ASN 1601Cb 0.44 -4.66 -0.07 0.00 -0.61 0.00 0.00 39.78 34.88 3lqi n ASN 1601CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3lqi s LEU 1602N -6.67 4.27 0.97 3.41 1.43 -0.71 -5.02 118.68 116.36 3lqi s LEU 1602Ca 0.32 0.52 -0.13 0.00 -1.03 0.00 0.00 54.13 53.82 3lqi s LEU 1602Cb -0.15 -2.35 0.17 0.00 0.03 0.00 0.00 46.19 43.89 3lqi s LEU 1602CO 0.40 0.14 1.14 -0.94 0.23 0.00 0.00 176.35 177.32 3lqi s SER 1603N 0.23 2.99 0.29 2.29 1.04 -1.26 -4.35 113.70 114.93 3lqi s SER 1603Ca 0.16 0.93 -0.00 0.00 0.48 0.00 0.00 55.95 57.52 3lqi s SER 1603Cb -0.13 -1.46 0.42 0.00 0.10 0.00 0.00 66.02 64.95 3lqi s SER 1603CO 0.04 -2.87 1.82 0.44 0.98 0.00 0.00 173.24 173.65 3lqi h ASP 1604N -1.72 0.72 -0.23 7.02 3.32 -1.98 -1.68 116.42 121.87 3lqi h ASP 1604Ca -0.51 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 56.40 3lqi h ASP 1604Cb 1.32 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 3lqi h ASP 1604CO 0.57 0.74 0.14 -0.33 -1.72 0.00 0.00 179.24 178.63 3lqi h GLU 1605N 0.73 0.31 -0.34 3.56 5.08 -2.00 -1.71 114.58 120.21 3lqi h GLU 1605Ca 0.16 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.42 3lqi h GLU 1605Cb 0.33 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 3lqi h GLU 1605CO 0.01 0.25 -0.06 0.52 -1.00 0.00 0.00 179.01 178.73 3lqi h MET 1606N 0.28 0.57 -0.62 2.33 2.86 -1.85 -1.43 114.93 117.06 3lqi h MET 1606Ca 0.08 -0.15 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 3lqi h MET 1606Cb 0.02 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.59 3lqi h MET 1606CO -0.02 0.64 0.22 -0.92 1.06 0.00 0.00 176.91 177.90 3lqi h TYR 1607N 0.53 0.97 -0.30 -0.22 3.20 -1.05 0.15 116.97 120.25 3lqi h TYR 1607Ca 0.10 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 3lqi h TYR 1607Cb 0.44 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 3lqi h TYR 1607CO 0.02 0.78 0.10 0.93 -1.64 0.00 0.00 178.16 178.35 3lqi h GLU 1608N 0.87 0.46 -0.62 1.82 4.39 -0.91 -1.35 114.58 119.25 3lqi h GLU 1608Ca 0.20 -0.09 -0.06 0.00 0.34 0.00 0.00 59.36 59.75 3lqi h GLU 1608Cb 0.24 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 3lqi h GLU 1608CO -0.01 0.50 0.14 0.82 -1.16 0.00 0.00 179.01 179.30 3lqi h ILE 1609N 0.33 1.25 -0.70 3.13 2.04 -1.05 -2.43 117.51 120.08 3lqi h ILE 1609Ca 0.10 -0.91 -0.04 0.00 1.00 0.00 0.00 64.86 65.01 3lqi h ILE 1609Cb 0.23 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3lqi h ILE 1609CO -0.00 0.34 0.28 0.25 0.00 0.00 0.00 178.15 179.02 3lqi h LEU 1610N 0.93 0.96 -2.84 1.44 5.85 -0.52 -1.40 115.31 119.72 3lqi h LEU 1610Ca 0.20 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 3lqi h LEU 1610Cb 0.35 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 3lqi h LEU 1610CO 0.00 0.87 -0.00 0.28 -0.34 0.00 0.00 178.44 179.25 3lqi h SER 1611N 1.00 0.00 -0.24 1.25 0.02 -0.76 -2.22 113.55 112.60 3lqi h SER 1611Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3lqi h SER 1611Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 3lqi h SER 1611CO -0.02 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.26 3lqi n ASN 1612N -3.23 3.17 -4.78 3.07 3.02 -0.54 -4.98 115.26 110.98 3lqi n ASN 1612Ca -0.03 -1.95 -0.31 0.00 -0.03 0.00 0.00 54.58 52.26 3lqi n ASN 1612Cb 0.08 -0.14 0.08 0.00 -0.61 0.00 0.00 39.78 39.19 3lqi n ASN 1612CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3lqi s LEU 1613N -1.59 2.92 0.63 3.41 1.43 -0.84 -4.98 118.68 119.66 3lqi s LEU 1613Ca 0.32 1.66 -0.18 0.00 -1.03 0.00 0.00 54.13 54.90 3lqi s LEU 1613Cb 0.20 -4.37 -0.02 0.00 0.03 0.00 0.00 46.19 42.03 3lqi s LEU 1613CO 0.29 -1.91 1.26 -2.16 0.23 0.00 0.00 176.35 174.06 3lqi s PRO 1614N -4.98 2.69 0.59 1.29 0.04 -1.26 -4.89 135.00 128.47 3lqi s PRO 1614Ca 0.60 1.97 0.28 0.00 0.04 0.00 0.00 61.00 63.90 3lqi s PRO 1614Cb -0.16 -1.87 1.71 0.00 0.04 0.00 0.00 34.50 34.22 3lqi s PRO 1614CO 0.56 -1.47 2.17 0.93 0.04 0.00 0.00 177.00 179.23 3lqi h GLU 1615N 0.64 0.00 0.00 4.56 5.08 -1.98 -0.79 114.58 122.09 3lqi h GLU 1615Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 3lqi h GLU 1615Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3lqi h GLU 1615CO 0.54 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.42 3lqi n SER 1616N -3.87 0.37 -4.32 1.42 3.41 -1.26 -4.30 113.62 105.08 3lqi n SER 1616Ca -0.01 0.59 -0.46 0.00 -0.26 0.00 0.00 58.87 58.73 3lqi n SER 1616Cb 0.21 -0.67 -0.05 0.00 -0.26 0.00 0.00 64.21 63.44 3lqi n SER 1616CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3lqi s VAL 1617N -3.16 5.20 0.31 -3.33 1.01 -0.30 -5.05 120.40 115.07 3lqi s VAL 1617Ca 0.06 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.39 3lqi s VAL 1617Cb 0.10 -4.36 -0.09 0.00 0.00 0.00 0.00 36.38 32.04 3lqi s VAL 1617CO 0.36 -0.89 0.73 0.00 0.00 0.00 0.00 175.10 175.29 3lqi s ALA 1618N 1.63 3.34 0.21 5.51 0.00 -1.26 -4.86 121.76 126.33 3lqi s ALA 1618Ca 0.04 0.04 -0.23 0.00 0.00 0.00 0.00 51.96 51.81 3lqi s ALA 1618Cb -0.29 -2.76 -0.08 0.00 0.00 0.00 0.00 23.12 19.99 3lqi s ALA 1618CO 0.03 0.34 0.78 -0.47 0.00 0.00 0.00 175.76 176.44 3lqi s TYR 1619N -1.94 3.77 -0.04 0.00 5.04 -1.26 -4.35 117.35 118.56 3lqi s TYR 1619Ca 0.53 1.55 0.01 0.00 -2.44 0.00 0.00 57.07 56.72 3lqi s TYR 1619Cb -0.11 -2.73 0.02 0.00 0.35 0.00 0.00 41.96 39.50 3lqi s TYR 1619CO 0.18 0.40 -0.03 0.95 -1.34 0.00 0.00 175.55 175.70 3lqi s THR 1620N -1.38 0.44 1.01 4.34 -4.23 -1.26 -1.80 115.64 112.76 3lqi s THR 1620Ca 0.41 -0.08 -0.14 0.00 -1.18 0.00 0.00 61.69 60.70 3lqi s THR 1620Cb -0.20 -0.47 0.20 0.00 1.34 0.00 0.00 72.50 73.37 3lqi s THR 1620CO 0.24 0.19 1.12 0.00 -0.54 0.00 0.00 174.62 175.63 3lqi h VAL 1622N -1.91 0.96 -0.03 0.00 -1.51 -1.99 -1.56 116.25 110.21 3lqi h VAL 1622Ca -0.52 -0.16 -0.17 0.00 -1.23 0.00 0.00 66.70 64.62 3lqi h VAL 1622Cb 1.32 0.46 -0.01 0.00 -2.13 0.00 0.00 31.29 30.94 3lqi h VAL 1622CO 0.54 0.08 -0.74 0.78 -1.23 0.00 0.00 177.57 177.01 3lqi h ASN 1623N 0.46 0.27 -0.00 4.19 -0.26 -1.99 -3.29 115.58 114.96 3lqi h ASN 1623Ca 0.24 -0.19 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 3lqi h ASN 1623Cb 0.34 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.52 3lqi h ASN 1623CO -0.06 0.92 -0.22 0.00 -1.06 0.00 0.00 177.43 177.00 3lqi s THR 1625N -2.24 4.65 -0.08 0.00 2.01 -0.63 -4.88 115.64 114.47 3lqi s THR 1625Ca 0.25 1.48 0.14 0.00 0.31 0.00 0.00 61.69 63.86 3lqi s THR 1625Cb 0.19 -4.29 -0.23 0.00 0.01 0.00 0.00 72.50 68.18 3lqi s THR 1625CO 0.43 -0.37 0.54 -0.62 -0.69 0.00 0.00 174.62 173.92 3lqi n GLU 1626N 6.54 0.64 -4.42 4.92 -0.58 -1.26 -4.85 120.64 121.63 3lqi n GLU 1626Ca 0.08 0.23 -0.33 0.00 -0.42 0.00 0.00 57.16 56.72 3lqi n GLU 1626Cb 0.47 -1.74 -0.15 0.00 -0.57 0.00 0.00 31.44 29.46 3lqi n GLU 1626CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3lqi s ARG 1627N -2.59 3.22 -0.10 3.49 0.52 -1.26 -5.11 118.95 117.12 3lqi s ARG 1627Ca -0.06 -0.74 -0.02 0.00 -0.52 0.00 0.00 55.73 54.40 3lqi s ARG 1627Cb 0.08 -2.67 -0.03 0.00 0.52 0.00 0.00 34.95 32.85 3lqi s ARG 1627CO 0.83 -0.02 -0.02 -1.01 0.02 0.00 0.00 175.30 175.09 3lqi s HIS 1628N 0.92 3.08 0.46 -0.53 3.76 -1.26 -3.08 115.29 118.64 3lqi s HIS 1628Ca -0.03 0.04 -0.23 0.00 -0.15 0.00 0.00 55.06 54.69 3lqi s HIS 1628Cb -0.15 -1.82 -0.07 0.00 1.11 0.00 0.00 32.58 31.64 3lqi s HIS 1628CO -0.02 0.31 1.17 -2.14 -0.85 0.00 0.00 174.74 173.21 3lqi s PRO 1629N -0.52 3.74 0.58 8.40 0.02 -1.26 -5.11 135.00 140.85 3lqi s PRO 1629Ca 0.09 1.78 -0.20 0.00 0.02 0.00 0.00 61.00 62.68 3lqi s PRO 1629Cb -0.12 -2.39 -0.05 0.00 0.02 0.00 0.00 34.50 31.96 3lqi s PRO 1629CO 0.02 -0.57 1.14 0.00 -0.33 0.00 0.00 177.00 177.26 3lqi n ALA 1630N -0.52 0.75 -0.33 -1.55 0.00 -1.18 -4.82 120.51 112.87 3lqi n ALA 1630Ca 0.07 0.06 0.09 0.00 0.00 0.00 0.00 53.44 53.67 3lqi n ALA 1630Cb 0.48 -2.22 0.29 0.00 0.00 0.00 0.00 19.45 18.01 3lqi n ALA 1630CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3lqi h GLU 1631N 0.86 0.85 -0.01 0.00 4.81 -1.91 -1.21 114.58 117.96 3lqi h GLU 1631Ca -0.49 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 58.62 3lqi h GLU 1631Cb 1.34 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 3lqi h GLU 1631CO 0.53 0.56 -0.33 0.11 -0.73 0.00 0.00 179.01 179.16 3lqi h TRP 1632N 0.87 0.01 -0.32 0.92 5.08 -1.90 -1.47 115.95 119.15 3lqi h TRP 1632Ca 0.49 -0.00 -0.15 0.00 1.08 0.00 0.00 58.89 60.31 3lqi h TRP 1632Cb 0.60 -0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.75 3lqi h TRP 1632CO -0.00 0.34 -0.40 0.00 -1.28 0.00 0.00 178.44 177.10 3lqi h ARG 1633N 0.01 0.77 -0.19 0.12 3.08 -1.57 -0.73 114.38 115.87 3lqi h ARG 1633Ca -0.00 -0.40 -0.05 0.00 0.07 0.00 0.00 59.98 59.60 3lqi h ARG 1633Cb 0.58 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 3lqi h ARG 1633CO 0.04 1.03 -0.08 -0.07 -1.07 0.00 0.00 179.97 179.82 3lqi h LEU 1634N 0.63 0.41 -0.93 3.04 3.38 -1.18 -1.98 115.31 118.68 3lqi h LEU 1634Ca 0.05 -0.40 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 3lqi h LEU 1634Cb 0.95 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 3lqi h LEU 1634CO 0.09 0.72 0.42 0.00 0.09 0.00 0.00 178.44 179.75 3lqi h ALA 1635N 0.70 1.17 -0.26 1.53 0.00 -1.23 -1.80 119.26 119.37 3lqi h ALA 1635Ca 0.04 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3lqi h ALA 1635Cb 0.56 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3lqi h ALA 1635CO 0.03 0.64 -0.00 1.25 0.00 0.00 0.00 179.25 181.17 3lqi h LEU 1636N 1.18 0.46 -0.34 0.00 5.85 -1.08 -0.03 115.31 121.34 3lqi h LEU 1636Ca 0.29 -0.31 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 3lqi h LEU 1636Cb 0.09 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 3lqi h LEU 1636CO -0.04 0.65 0.20 -0.08 -0.34 0.00 0.00 178.44 178.84 3lqi h GLU 1637N 0.24 0.46 -0.47 1.25 4.22 -1.19 -1.91 114.58 117.19 3lqi h GLU 1637Ca 0.07 -0.04 -0.12 0.00 0.08 0.00 0.00 59.36 59.35 3lqi h GLU 1637Cb 0.42 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3lqi h GLU 1637CO 0.01 0.35 -0.18 0.87 -2.18 0.00 0.00 179.01 177.88 3lqi h LYS 1638N 0.44 0.95 -0.94 1.92 1.57 -1.29 -2.93 116.57 116.29 3lqi h LYS 1638Ca 0.12 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 3lqi h LYS 1638Cb 0.01 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.24 3lqi h LYS 1638CO -0.02 1.06 0.59 1.49 -0.57 0.00 0.00 179.45 182.00 3lqi h GLU 1639N 0.79 1.25 0.08 3.15 4.57 -0.83 0.05 114.58 123.65 3lqi h GLU 1639Ca 0.11 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3lqi h GLU 1639Cb 0.75 -0.27 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 3lqi h GLU 1639CO 0.06 0.85 -0.04 1.25 -1.18 0.00 0.00 179.01 179.95 3lqi h LEU 1640N 1.28 -0.10 -0.63 1.64 5.85 -1.27 -0.25 115.31 121.84 3lqi h LEU 1640Ca 0.34 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 3lqi h LEU 1640Cb -0.10 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 3lqi h LEU 1640CO -0.07 0.06 0.29 1.56 -0.34 0.00 0.00 178.44 179.94 3lqi h GLN 1641N -0.25 0.91 -0.39 1.25 1.08 -1.33 -1.40 115.11 114.98 3lqi h GLN 1641Ca -0.01 -0.14 -0.00 0.00 -1.45 0.00 0.00 58.65 57.05 3lqi h GLN 1641Cb 0.21 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 3lqi h GLN 1641CO 0.02 0.74 0.24 0.82 -0.95 0.00 0.00 178.83 179.70 3lqi h ILE 1642N 0.86 1.12 -0.44 2.54 2.04 -0.90 0.81 117.51 123.54 3lqi h ILE 1642Ca 0.21 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 3lqi h ILE 1642Cb 0.14 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3lqi h ILE 1642CO -0.02 0.12 0.25 0.28 0.00 0.00 0.00 178.15 178.78 3lqi h SER 1643N 0.51 0.54 0.43 1.72 0.02 -0.81 0.36 113.55 116.33 3lqi h SER 1643Ca 0.14 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 3lqi h SER 1643Cb -0.02 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.39 3lqi h SER 1643CO -0.03 0.46 -0.21 -0.07 -1.14 0.00 0.00 176.83 175.85 3lqi h LEU 1644N 0.58 -0.49 -1.40 5.07 3.38 -1.03 -2.80 115.31 118.61 3lqi h LEU 1644Ca 0.16 -0.05 0.15 0.00 0.09 0.00 0.00 57.88 58.22 3lqi h LEU 1644Cb 0.03 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 3lqi h LEU 1644CO -0.03 -0.25 0.55 0.11 0.09 0.00 0.00 178.44 178.91 3lqi h LYS 1645N -0.71 0.56 -0.05 1.13 1.57 -0.74 -1.26 116.57 117.06 3lqi h LYS 1645Ca -0.06 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.72 3lqi h LYS 1645Cb 0.51 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.65 3lqi h LYS 1645CO 0.10 0.37 -0.21 0.37 -0.57 0.00 0.00 179.45 179.51 3lqi h GLN 1646N 0.58 -0.30 -0.63 3.15 4.15 -0.66 0.83 115.11 122.23 3lqi h GLN 1646Ca 0.42 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.85 3lqi h GLN 1646Cb 0.79 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.51 3lqi h GLN 1646CO -0.17 -0.20 0.34 0.28 -1.93 0.00 0.00 178.83 177.15 3lqi h VAL 1647N -0.31 1.20 -0.57 2.39 2.07 -1.09 -2.41 116.25 117.53 3lqi h VAL 1647Ca 0.08 -0.51 -0.08 0.00 0.82 0.00 0.00 66.70 67.00 3lqi h VAL 1647Cb 0.42 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3lqi h VAL 1647CO -0.23 0.22 0.05 0.25 0.02 0.00 0.00 177.57 177.88 3lqi h LEU 1648N 0.86 0.92 -0.42 2.57 5.85 -0.80 -2.48 115.31 121.81 3lqi h LEU 1648Ca 0.22 -0.22 -0.18 0.00 0.84 0.00 0.00 57.88 58.54 3lqi h LEU 1648Cb 0.05 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.83 3lqi h LEU 1648CO -0.04 0.95 -0.63 0.71 -0.34 0.00 0.00 178.44 179.09 3lqi h THR 1649N 0.89 1.33 -0.23 1.05 1.35 -0.76 -0.97 112.91 115.56 3lqi h THR 1649Ca 0.17 -1.91 -0.01 0.00 -0.55 0.00 0.00 66.41 64.11 3lqi h THR 1649Cb 0.46 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.75 3lqi h THR 1649CO 0.02 0.59 0.09 0.00 -0.25 0.00 0.00 175.52 175.97 3lqi h ALA 1650N 0.88 1.73 0.21 6.62 0.00 -1.24 0.34 119.26 127.80 3lqi h ALA 1650Ca -0.01 -0.07 -0.30 0.00 0.00 0.00 0.00 54.91 54.53 3lqi h ALA 1650Cb 1.20 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.93 3lqi h ALA 1650CO 0.12 0.22 -1.30 -0.07 0.00 0.00 0.00 179.25 178.22 3lqi h LEU 1651N 0.32 0.78 -1.23 0.00 3.38 -1.25 -2.58 115.31 114.72 3lqi h LEU 1651Ca 0.08 -0.91 -0.06 0.00 0.09 0.00 0.00 57.88 57.08 3lqi h LEU 1651Cb 0.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3lqi h LEU 1651CO -0.01 1.63 -0.13 -0.07 0.09 0.00 0.00 178.44 179.95 3lqi h LEU 1652N 0.05 0.35 -0.11 1.67 4.07 -0.65 -2.50 115.31 118.19 3lqi h LEU 1652Ca -0.22 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.65 3lqi h LEU 1652Cb 2.02 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 43.67 3lqi h LEU 1652CO 0.25 0.52 -0.32 0.59 -1.08 0.00 0.00 178.44 178.39 3lqi n ASN 1653N -4.23 0.50 -4.64 -0.43 5.03 0.11 -4.73 115.26 106.88 3lqi n ASN 1653Ca -0.00 -0.28 -0.43 0.00 0.87 0.00 0.00 54.58 54.74 3lqi n ASN 1653Cb 0.30 0.06 -0.02 0.00 -1.02 0.00 0.00 39.78 39.10 3lqi n ASN 1653CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3lqi s SER 1654N -2.84 6.96 0.12 6.41 0.15 -0.94 -4.95 113.70 118.61 3lqi s SER 1654Ca 0.16 1.14 -0.30 0.00 0.70 0.00 0.00 55.95 57.65 3lqi s SER 1654Cb 0.18 -2.52 -0.08 0.00 -1.71 0.00 0.00 66.02 61.89 3lqi s SER 1654CO 0.61 -0.76 1.60 0.03 1.20 0.00 0.00 173.24 175.92 3lqi h ARG 1655N 7.84 -0.56 0.16 5.44 3.08 -1.86 0.14 114.38 128.60 3lqi h ARG 1655Ca -0.20 0.04 0.01 0.00 0.07 0.00 0.00 59.98 59.89 3lqi h ARG 1655Cb 1.06 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.22 3lqi h ARG 1655CO 0.99 -0.38 -0.19 1.15 -1.07 0.00 0.00 179.97 180.48 3lqi h THR 1656N -0.59 0.58 -0.47 2.04 2.02 -1.94 0.17 112.91 114.73 3lqi h THR 1656Ca 0.04 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.13 3lqi h THR 1656Cb 0.64 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 3lqi h THR 1656CO -0.25 0.00 -0.04 0.71 0.37 0.00 0.00 175.52 176.31 3lqi h THR 1657N -0.39 1.27 -0.23 3.16 1.35 -1.83 -2.06 112.91 114.18 3lqi h THR 1657Ca 0.01 -1.12 0.04 0.00 -0.55 0.00 0.00 66.41 64.78 3lqi h THR 1657Cb 0.38 1.05 -0.03 0.00 -1.73 0.00 0.00 68.15 67.82 3lqi h THR 1657CO -0.07 0.39 0.00 -1.28 -0.25 0.00 0.00 175.52 174.32 3lqi h SER 1658N 0.70 -0.08 -0.32 5.36 0.87 -0.60 0.67 113.55 120.16 3lqi h SER 1658Ca 0.13 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.77 3lqi h SER 1658Cb 0.56 0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.56 3lqi h SER 1658CO 0.03 -0.01 -0.31 0.45 -0.53 0.00 0.00 176.83 176.46 3lqi h HIS 1659N 0.08 -0.96 0.00 2.24 3.86 -0.37 -0.91 115.15 119.10 3lqi h HIS 1659Ca 0.11 0.05 -0.12 0.00 -1.16 0.00 0.00 60.37 59.25 3lqi h HIS 1659Cb 0.13 0.46 -0.02 0.00 1.06 0.00 0.00 27.41 29.04 3lqi h HIS 1659CO -0.18 -0.25 -0.57 -0.07 0.86 0.00 0.00 177.93 177.72 3lqi h LEU 1660N -0.15 0.00 0.00 2.43 3.38 -1.08 -3.41 115.31 116.48 3lqi h LEU 1660Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3lqi h LEU 1660Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3lqi h LEU 1660CO -0.38 0.57 -0.94 0.18 0.09 0.00 0.00 178.44 177.96 3lqi n LEU 1661N -3.75 0.00 0.11 1.67 4.77 0.23 -4.82 117.00 115.21 3lqi n LEU 1661Ca -0.01 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 3lqi n LEU 1661Cb 0.60 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.63 3lqi n LEU 1661CO 0.41 0.00 0.76 -0.09 -1.33 0.00 0.00 177.39 177.14 3lqi h ARG 1662N 0.00 -0.32 -5.19 3.23 2.43 -1.24 -1.50 114.38 111.79 3lqi h ARG 1662Ca 0.00 0.02 -0.66 0.00 -0.81 0.00 0.00 59.98 58.53 3lqi h ARG 1662Cb 0.13 0.07 -0.29 0.00 -0.42 0.00 0.00 29.97 29.46 3lqi h ARG 1662CO 0.00 -0.22 -0.79 0.71 -1.51 0.00 0.00 179.97 178.17 3lqi s TYR 1663N -6.12 2.81 -0.02 2.20 2.02 -1.26 -1.83 117.35 115.15 3lqi s TYR 1663Ca -0.15 -0.97 -0.04 0.00 -0.37 0.00 0.00 57.07 55.54 3lqi s TYR 1663Cb 0.07 -1.91 -0.04 0.00 -0.40 0.00 0.00 41.96 39.68 3lqi s TYR 1663CO 0.65 -0.44 0.18 0.50 -1.57 0.00 0.00 175.55 174.87 3lqi s ARG 1664N 0.83 3.45 0.00 -0.62 3.00 -1.26 -4.95 118.95 119.40 3lqi s ARG 1664Ca -0.04 -0.27 0.00 0.00 -1.00 0.00 0.00 55.73 54.42 3lqi s ARG 1664Cb -0.15 -3.11 0.00 0.00 0.00 0.00 0.00 34.95 31.69 3lqi s ARG 1664CO 0.00 0.69 0.00 1.04 0.00 0.00 0.00 175.30 177.03 3lqi n GLN 1665N 1.12 0.00 -0.06 5.12 6.02 -1.26 -5.09 117.38 123.23 3lqi n GLN 1665Ca -0.12 0.00 0.16 0.00 -0.01 0.00 0.00 57.00 57.03 3lqi n GLN 1665Cb 0.53 0.00 0.25 0.00 1.02 0.00 0.00 30.24 32.04 3lqi n GLN 1665CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3lqi n GLN 1704N 0.00 0.01 -1.67 -1.09 0.00 -1.26 -5.23 117.38 108.14 3lqi n GLN 1704Ca 0.00 0.79 -0.45 0.00 0.00 0.00 0.00 57.00 57.34 3lqi n GLN 1704Cb 0.00 -2.01 -0.04 0.00 0.00 0.00 0.00 30.24 28.19 3lqi n GLN 1704CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 3lqi n PRO 1705N -2.64 2.54 0.13 2.61 -0.02 -1.26 -4.84 135.00 131.52 3lqi n PRO 1705Ca 0.14 0.93 0.09 0.00 -2.02 0.00 0.00 63.50 62.64 3lqi n PRO 1705Cb 1.11 -2.83 0.04 0.00 -0.02 0.00 0.00 33.50 31.79 3lqi n PRO 1705CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3lqi h LEU 1706N 9.62 0.00 -8.21 2.45 4.07 -1.95 -3.47 115.31 117.82 3lqi h LEU 1706Ca -0.49 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.40 3lqi h LEU 1706Cb 1.25 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.93 3lqi h LEU 1706CO 0.94 0.14 0.00 1.51 -1.08 0.00 0.00 178.44 179.95 3lqi s ASP 1707N -5.76 0.10 0.63 -0.43 1.47 -1.26 -4.84 116.67 106.57 3lqi s ASP 1707Ca 0.02 -1.02 0.35 0.00 1.18 0.00 0.00 52.55 53.07 3lqi s ASP 1707Cb 0.08 0.68 1.98 0.00 -0.34 0.00 0.00 42.92 45.31 3lqi s ASP 1707CO 0.76 -1.31 2.23 -0.07 0.68 0.00 0.00 175.17 177.45 3lqi h LEU 1708N 2.13 0.00 -0.53 2.11 3.38 -1.22 0.17 115.31 121.36 3lqi h LEU 1708Ca -0.26 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.54 3lqi h LEU 1708Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 3lqi h LEU 1708CO 0.35 0.00 -0.63 -0.08 0.09 0.00 0.00 178.44 178.17 3lqi h GLU 1709N 0.00 0.40 -0.16 1.13 4.57 -1.60 -1.19 114.58 117.74 3lqi h GLU 1709Ca 0.02 -0.28 -0.14 0.00 -1.18 0.00 0.00 59.36 57.78 3lqi h GLU 1709Cb 0.19 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 3lqi h GLU 1709CO -0.00 0.90 -0.51 0.78 -1.18 0.00 0.00 179.01 178.99 3lqi h GLY 1710N 1.27 0.47 1.06 1.92 0.00 -0.94 -2.03 103.07 104.82 3lqi h GLY 1710Ca -0.01 -0.53 -0.04 0.00 0.00 0.00 0.00 47.33 46.75 3lqi h GLY 1710CO 0.11 0.47 0.32 -2.08 0.00 0.00 0.00 176.54 175.36 3lqi h VAL 1711N 0.34 1.26 -0.24 4.60 2.07 -0.91 -2.21 116.25 121.15 3lqi h VAL 1711Ca 0.01 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.68 3lqi h VAL 1711Cb 1.02 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 3lqi h VAL 1711CO 0.09 0.34 0.03 0.11 0.02 0.00 0.00 177.57 178.16 3lqi h LYS 1712N 1.16 0.40 -0.94 1.57 1.57 -0.93 0.11 116.57 119.51 3lqi h LYS 1712Ca 0.27 -0.11 0.07 0.00 -1.87 0.00 0.00 60.65 59.00 3lqi h LYS 1712Cb 0.21 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.41 3lqi h LYS 1712CO -0.02 0.54 0.61 0.07 -0.57 0.00 0.00 179.45 180.08 3lqi h ARG 1713N 0.20 1.05 -0.18 3.15 0.11 -1.19 0.67 114.38 118.19 3lqi h ARG 1713Ca 0.07 -0.06 -0.04 0.00 0.10 0.00 0.00 59.98 60.05 3lqi h ARG 1713Cb 0.34 -0.24 -0.01 0.00 1.11 0.00 0.00 29.97 31.18 3lqi h ARG 1713CO 0.01 0.69 -0.04 -0.22 0.10 0.00 0.00 179.97 180.51 3lqi h LYS 1714N 1.08 0.34 0.04 0.08 3.64 -1.13 -1.75 116.57 118.87 3lqi h LYS 1714Ca 0.41 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.67 3lqi h LYS 1714Cb 0.20 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 3lqi h LYS 1714CO -0.16 0.60 -0.11 1.98 -2.27 0.00 0.00 179.45 179.49 3lqi h MET 1715N 0.06 -0.20 -0.40 1.90 4.05 0.50 -2.16 114.93 118.67 3lqi h MET 1715Ca 0.05 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.46 3lqi h MET 1715Cb 0.47 0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.30 3lqi h MET 1715CO 0.02 -0.13 0.17 -0.44 0.23 0.00 0.00 176.91 176.76 3lqi h ASP 1716N -0.21 0.50 0.00 1.39 3.32 0.32 -1.06 116.42 120.68 3lqi h ASP 1716Ca 0.03 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3lqi h ASP 1716Cb 0.23 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3lqi h ASP 1716CO -0.08 0.45 0.00 0.00 -1.72 0.00 0.00 179.24 177.89 3lqi n GLN 1717N -4.39 0.82 -1.98 3.56 6.02 -0.66 -4.87 117.38 115.88 3lqi n GLN 1717Ca 0.03 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.91 3lqi n GLN 1717Cb 0.13 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 29.90 3lqi n GLN 1717CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3lqi n GLY 1718N 0.62 0.26 0.81 1.08 0.00 -0.40 -4.93 105.19 102.63 3lqi n GLY 1718Ca 0.19 -0.44 0.10 0.00 0.00 0.00 0.00 46.02 45.87 3lqi n GLY 1718CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3lqi n ASN 1719N -0.06 2.40 -4.46 1.61 5.03 -0.84 -4.84 115.26 114.09 3lqi n ASN 1719Ca -0.13 -1.87 -0.36 0.00 0.87 0.00 0.00 54.58 53.09 3lqi n ASN 1719Cb 0.54 -0.21 -0.12 0.00 -1.02 0.00 0.00 39.78 38.97 3lqi n ASN 1719CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 3lqi s TYR 1720N -1.59 3.10 0.00 3.10 2.02 -1.26 -4.89 117.35 117.82 3lqi s TYR 1720Ca 0.34 -0.37 0.00 0.00 -0.37 0.00 0.00 57.07 56.67 3lqi s TYR 1720Cb 0.19 -2.23 0.00 0.00 -0.40 0.00 0.00 41.96 39.52 3lqi s TYR 1720CO 0.26 -0.31 0.00 2.41 -1.57 0.00 0.00 175.55 176.34 3lqi n THR 1721N 4.81 0.00 -3.22 -0.71 -1.04 -1.26 -4.94 114.28 107.91 3lqi n THR 1721Ca -0.16 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.46 3lqi n THR 1721Cb 0.51 -0.52 -0.06 0.00 -1.82 0.00 0.00 70.33 68.44 3lqi n THR 1721CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3lqi s SER 1722N -3.26 6.66 0.23 8.00 0.15 -1.26 -4.96 113.70 119.26 3lqi s SER 1722Ca 0.00 0.79 -0.05 0.00 0.70 0.00 0.00 55.95 57.39 3lqi s SER 1722Cb 0.00 -2.31 0.24 0.00 -1.71 0.00 0.00 66.02 62.24 3lqi s SER 1722CO 0.00 -0.15 1.75 0.58 1.20 0.00 0.00 173.24 176.62 3lqi h VAL 1723N 5.00 1.25 -0.55 4.45 2.07 -1.99 -1.07 116.25 125.41 3lqi h VAL 1723Ca -0.36 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 3lqi h VAL 1723Cb 1.16 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 3lqi h VAL 1723CO 0.75 0.36 0.30 0.25 0.02 0.00 0.00 177.57 179.25 3lqi h LEU 1724N 0.91 0.69 -0.38 2.57 5.85 -1.99 0.56 115.31 123.53 3lqi h LEU 1724Ca 0.18 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 3lqi h LEU 1724Cb 0.40 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 3lqi h LEU 1724CO 0.01 0.58 -0.14 -0.08 -0.34 0.00 0.00 178.44 178.48 3lqi h GLU 1725N 0.74 0.76 0.22 1.25 4.81 -1.90 0.51 114.58 120.97 3lqi h GLU 1725Ca 0.19 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 3lqi h GLU 1725Cb 0.05 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.40 3lqi h GLU 1725CO -0.03 0.92 -0.11 0.35 -0.73 0.00 0.00 179.01 179.41 3lqi h PHE 1726N 0.56 -0.29 -0.73 0.92 3.57 -1.00 -0.19 116.94 119.78 3lqi h PHE 1726Ca 0.09 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 3lqi h PHE 1726Cb 0.67 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.47 3lqi h PHE 1726CO 0.05 -0.18 0.25 0.66 -2.23 0.00 0.00 178.31 176.87 3lqi h SER 1727N -0.30 1.03 -0.74 0.41 4.64 -0.87 -2.55 113.55 115.17 3lqi h SER 1727Ca -0.03 -0.18 0.01 0.00 -0.47 0.00 0.00 61.79 61.12 3lqi h SER 1727Cb 0.24 -0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 62.02 3lqi h SER 1727CO 0.04 0.94 0.49 0.44 -0.87 0.00 0.00 176.83 177.88 3lqi h ASP 1728N 1.08 0.85 -0.95 4.97 3.32 -0.64 0.18 116.42 125.24 3lqi h ASP 1728Ca 0.24 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 3lqi h ASP 1728Cb 0.26 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.55 3lqi h ASP 1728CO -0.01 0.62 0.59 0.44 -1.72 0.00 0.00 179.24 179.16 3lqi h ASP 1729N 1.01 1.12 0.05 6.45 3.32 -0.64 -0.62 116.42 127.11 3lqi h ASP 1729Ca 0.27 -0.05 -0.26 0.00 0.02 0.00 0.00 57.03 57.01 3lqi h ASP 1729Cb -0.11 -0.28 0.02 0.00 0.22 0.00 0.00 39.33 39.17 3lqi h ASP 1729CO -0.06 0.84 -1.02 0.40 -1.72 0.00 0.00 179.24 177.69 3lqi h ILE 1730N 1.30 1.30 -0.91 0.35 2.04 -1.11 -2.94 117.51 117.54 3lqi h ILE 1730Ca 0.34 -2.27 -0.01 0.00 1.00 0.00 0.00 64.86 63.93 3lqi h ILE 1730Cb -0.09 2.37 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 3lqi h ILE 1730CO -0.07 0.70 0.53 0.58 0.00 0.00 0.00 178.15 179.89 3lqi h VAL 1731N 0.38 1.25 -0.52 1.67 2.07 -0.38 -0.70 116.25 120.02 3lqi h VAL 1731Ca -0.12 -0.57 0.03 0.00 0.82 0.00 0.00 66.70 66.86 3lqi h VAL 1731Cb 1.66 -0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 3lqi h VAL 1731CO 0.20 0.27 0.31 0.11 0.02 0.00 0.00 177.57 178.48 3lqi h LYS 1732N 1.26 0.60 -0.51 1.57 1.57 -1.11 0.17 116.57 120.13 3lqi h LYS 1732Ca 0.32 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 59.00 3lqi h LYS 1732Cb -0.03 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 3lqi h LYS 1732CO -0.06 0.40 0.05 0.82 -0.57 0.00 0.00 179.45 180.09 3lqi h ILE 1733N 0.62 1.26 -0.02 1.86 2.04 -1.24 -0.86 117.51 121.17 3lqi h ILE 1733Ca 0.21 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 3lqi h ILE 1733Cb 0.03 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 3lqi h ILE 1733CO -0.10 0.35 -0.01 0.40 0.00 0.00 0.00 178.15 178.80 3lqi h ILE 1734N 0.73 1.30 -0.07 -0.67 2.04 -0.81 -2.69 117.51 117.35 3lqi h ILE 1734Ca 0.15 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 3lqi h ILE 1734Cb 0.45 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 3lqi h ILE 1734CO 0.02 0.24 -0.10 -0.61 0.00 0.00 0.00 178.15 177.69 3lqi h GLN 1735N -0.34 0.10 -0.59 2.37 5.75 -0.66 -1.43 115.11 120.30 3lqi h GLN 1735Ca 0.00 -0.02 -0.09 0.00 -0.15 0.00 0.00 58.65 58.40 3lqi h GLN 1735Cb 0.39 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 3lqi h GLN 1735CO 0.00 0.21 0.01 0.00 -2.65 0.00 0.00 178.83 176.41 3lqi h ALA 1736N 1.80 0.80 -0.51 3.38 0.00 -1.07 -0.16 119.26 123.50 3lqi h ALA 1736Ca 0.02 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 3lqi h ALA 1736Cb 0.25 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3lqi h ALA 1736CO 0.02 0.63 0.04 0.00 0.00 0.00 0.00 179.25 179.93 3lqi h ALA 1737N 0.98 0.68 -0.50 0.00 0.00 -1.02 -2.80 119.26 116.60 3lqi h ALA 1737Ca 0.17 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3lqi h ALA 1737Cb 0.54 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3lqi h ALA 1737CO 0.03 0.46 0.18 0.82 0.00 0.00 0.00 179.25 180.74 3lqi h ILE 1738N 0.75 1.22 0.00 0.00 2.04 -0.97 -2.47 117.51 118.08 3lqi h ILE 1738Ca 0.15 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 3lqi h ILE 1738Cb 0.47 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 3lqi h ILE 1738CO 0.02 0.26 -0.07 0.78 0.00 0.00 0.00 178.15 179.14 3lqi h ASN 1739N 0.68 0.00 -0.61 1.72 2.35 -0.94 -2.51 115.58 116.27 3lqi h ASN 1739Ca 0.17 0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 55.53 3lqi h ASN 1739Cb 0.23 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 38.36 3lqi h ASN 1739CO -0.01 0.07 -0.04 -1.54 -1.65 0.00 0.00 177.43 174.27 3lqi n SER 1740N -3.62 4.11 0.26 5.81 3.41 -0.96 -4.61 113.62 118.02 3lqi n SER 1740Ca -0.02 -3.77 0.15 0.00 -0.26 0.00 0.00 58.87 54.96 3lqi n SER 1740Cb 0.19 -0.64 0.66 0.00 -0.26 0.00 0.00 64.21 64.15 3lqi n SER 1740CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3lqi h ASP 1741N 1.47 0.00 -0.51 4.04 3.04 -1.13 -3.46 116.42 119.86 3lqi h ASP 1741Ca 0.36 0.00 -0.20 0.00 -3.24 0.00 0.00 57.03 53.95 3lqi h ASP 1741Cb 1.56 0.00 -0.07 0.00 -1.04 0.00 0.00 39.33 39.78 3lqi h ASP 1741CO 0.75 0.08 -0.18 0.61 -2.04 0.00 0.00 179.24 178.46 3lqi n GLY 1742N -0.08 1.07 3.10 7.15 0.00 -1.26 -2.34 105.19 112.83 3lqi n GLY 1742Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 3lqi n GLY 1742CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lqi n GLY 1743N -1.75 0.34 3.63 -0.02 0.00 -1.26 -4.93 105.19 101.19 3lqi n GLY 1743Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3lqi n GLY 1743CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3lqi s GLN 1744N -0.82 3.88 0.34 1.61 -0.21 -0.99 -4.94 119.66 118.53 3lqi s GLN 1744Ca 0.00 1.40 0.02 0.00 0.02 0.00 0.00 55.36 56.80 3lqi s GLN 1744Cb 0.00 -3.93 0.60 0.00 1.00 0.00 0.00 33.01 30.68 3lqi s GLN 1744CO 0.00 -1.17 1.99 -1.00 -2.12 0.00 0.00 175.29 172.99 3lqi h PRO 1745N 9.78 0.89 0.00 2.91 0.13 -1.91 -2.12 132.00 141.67 3lqi h PRO 1745Ca -0.29 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 64.70 3lqi h PRO 1745Cb 1.12 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 3lqi h PRO 1745CO 1.02 0.59 -0.45 1.49 -0.23 0.00 0.00 178.00 180.42 3lqi h GLU 1746N 0.91 0.00 -0.13 0.86 4.57 -1.97 -2.09 114.58 116.73 3lqi h GLU 1746Ca 0.26 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.37 3lqi h GLU 1746Cb -0.06 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.53 3lqi h GLU 1746CO -0.06 0.45 -0.19 0.82 -1.18 0.00 0.00 179.01 178.84 3lqi h ILE 1747N 0.00 1.36 -0.01 2.32 1.08 -1.82 -2.36 117.51 118.08 3lqi h ILE 1747Ca -0.00 -1.42 0.02 0.00 -0.39 0.00 0.00 64.86 63.07 3lqi h ILE 1747Cb 0.91 1.98 -0.02 0.00 -3.07 0.00 0.00 36.82 36.61 3lqi h ILE 1747CO 0.06 0.41 -0.08 0.11 -0.69 0.00 0.00 178.15 177.96 3lqi h LYS 1748N -0.03 -0.13 -0.68 2.37 1.57 -1.24 0.25 116.57 118.68 3lqi h LYS 1748Ca 0.01 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 3lqi h LYS 1748Cb 0.75 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 33.02 3lqi h LYS 1748CO 0.04 -0.09 0.32 -0.22 -0.57 0.00 0.00 179.45 178.94 3lqi h LYS 1749N -0.14 0.53 0.27 3.15 3.64 -1.42 0.15 116.57 122.76 3lqi h LYS 1749Ca 0.03 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3lqi h LYS 1749Cb 0.18 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3lqi h LYS 1749CO -0.09 0.35 -0.13 0.00 -2.27 0.00 0.00 179.45 177.31 3lqi h ALA 1750N 1.42 -0.36 -0.67 5.00 0.00 -0.81 -1.80 119.26 122.04 3lqi h ALA 1750Ca 0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3lqi h ALA 1750Cb 0.37 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3lqi h ALA 1750CO -0.27 -0.65 0.38 -0.91 0.00 0.00 0.00 179.25 177.79 3lqi h ASN 1751N -0.47 0.82 0.14 0.00 2.35 -0.08 -1.50 115.58 116.84 3lqi h ASN 1751Ca -0.04 -0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.58 3lqi h ASN 1751Cb 0.36 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3lqi h ASN 1751CO 0.06 0.65 -0.26 0.77 -1.65 0.00 0.00 177.43 177.00 3lqi h SER 1752N 0.93 0.20 -0.14 5.81 4.64 -0.59 -1.60 113.55 122.80 3lqi h SER 1752Ca 0.24 -0.06 -0.10 0.00 -0.47 0.00 0.00 61.79 61.40 3lqi h SER 1752Cb 0.01 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3lqi h SER 1752CO -0.04 0.47 -0.29 0.24 -0.87 0.00 0.00 176.83 176.33 3lqi h MET 1753N 0.18 0.44 0.00 4.77 2.86 -0.40 -2.39 114.93 120.40 3lqi h MET 1753Ca 0.03 -0.29 -0.04 0.00 -2.06 0.00 0.00 59.70 57.33 3lqi h MET 1753Cb 0.56 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 3lqi h MET 1753CO 0.04 0.90 -0.21 -0.39 1.06 0.00 0.00 176.91 178.31 3lqi h VAL 1754N 0.05 0.68 -0.18 -2.22 -1.51 -1.18 -0.94 116.25 110.95 3lqi h VAL 1754Ca 0.00 -0.91 -0.05 0.00 -1.23 0.00 0.00 66.70 64.51 3lqi h VAL 1754Cb 0.89 1.58 -0.00 0.00 -2.13 0.00 0.00 31.29 31.62 3lqi h VAL 1754CO 0.06 0.21 -0.08 0.50 -1.23 0.00 0.00 177.57 177.03 3lqi h LYS 1755N 0.00 0.37 -0.36 5.19 3.64 -1.18 -1.05 116.57 123.18 3lqi h LYS 1755Ca -0.00 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.11 3lqi h LYS 1755Cb 0.56 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 3lqi h LYS 1755CO 0.03 0.67 -0.23 0.77 -2.27 0.00 0.00 179.45 178.42 3lqi h SER 1756N 0.05 0.72 -0.41 4.20 0.02 -1.04 -1.89 113.55 115.20 3lqi h SER 1756Ca 0.04 -0.26 -0.03 0.00 -0.84 0.00 0.00 61.79 60.71 3lqi h SER 1756Cb 0.56 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 3lqi h SER 1756CO 0.03 0.93 0.16 0.15 -1.14 0.00 0.00 176.83 176.95 3lqi h PHE 1757N 0.62 0.63 -0.13 3.45 3.57 -1.13 -1.47 116.94 122.48 3lqi h PHE 1757Ca 0.09 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 3lqi h PHE 1757Cb 0.72 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 3lqi h PHE 1757CO 0.03 0.56 0.07 0.35 -2.23 0.00 0.00 178.31 177.10 3lqi h PHE 1758N 0.52 0.19 -0.37 0.41 3.57 -1.05 -1.09 116.94 119.12 3lqi h PHE 1758Ca 0.14 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.64 3lqi h PHE 1758Cb 0.21 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3lqi h PHE 1758CO 0.00 0.22 0.25 0.82 -2.23 0.00 0.00 178.31 177.37 3lqi h ILE 1759N 0.10 1.07 0.01 1.41 2.04 -1.21 -0.78 117.51 120.15 3lqi h ILE 1759Ca 0.05 -0.16 -0.26 0.00 1.00 0.00 0.00 64.86 65.49 3lqi h ILE 1759Cb 0.10 0.57 0.02 0.00 -0.74 0.00 0.00 36.82 36.77 3lqi h ILE 1759CO -0.01 0.08 -1.03 -0.09 0.00 0.00 0.00 178.15 177.10 3lqi h ARG 1760N 0.46 0.62 -0.69 2.37 9.65 -0.98 -1.82 114.38 123.99 3lqi h ARG 1760Ca 0.14 -0.68 -0.04 0.00 -1.10 0.00 0.00 59.98 58.30 3lqi h ARG 1760Cb 0.01 0.20 -0.03 0.00 -1.39 0.00 0.00 29.97 28.76 3lqi h ARG 1760CO -0.03 1.28 0.27 1.96 2.80 0.00 0.00 179.97 186.25 3lqi h GLN 1761N 0.35 1.03 -0.32 0.20 1.08 -0.70 -1.94 115.11 114.81 3lqi h GLN 1761Ca -0.12 -0.19 -0.08 0.00 -1.45 0.00 0.00 58.65 56.81 3lqi h GLN 1761Cb 1.68 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 28.94 3lqi h GLN 1761CO 0.20 0.85 -0.13 0.52 -0.95 0.00 0.00 178.83 179.32 3lqi h MET 1762N 0.98 0.66 -0.16 1.46 2.86 -1.17 -2.19 114.93 117.38 3lqi h MET 1762Ca 0.23 -0.28 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 3lqi h MET 1762Cb 0.21 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 3lqi h MET 1762CO -0.02 0.86 -0.23 0.93 1.06 0.00 0.00 176.91 179.51 3lqi h GLU 1763N 0.43 0.27 -0.05 1.72 5.08 -1.21 0.47 114.58 121.29 3lqi h GLU 1763Ca 0.07 -0.09 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 3lqi h GLU 1763Cb 0.65 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.89 3lqi h GLU 1763CO 0.04 0.49 -0.65 -0.09 -1.00 0.00 0.00 179.01 177.81 3lqi h ARG 1764N 0.25 0.53 0.06 2.33 9.65 -1.30 -2.53 114.38 123.38 3lqi h ARG 1764Ca 0.04 -0.50 -0.24 0.00 -1.10 0.00 0.00 59.98 58.18 3lqi h ARG 1764Cb 0.55 0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 29.25 3lqi h ARG 1764CO 0.04 1.13 -1.08 0.28 2.80 0.00 0.00 179.97 183.14 3lqi h VAL 1765N 0.12 1.51 -2.24 0.20 2.07 -1.29 -3.39 116.25 113.22 3lqi h VAL 1765Ca -0.07 -2.91 -0.58 0.00 0.82 0.00 0.00 66.70 63.96 3lqi h VAL 1765Cb 1.32 2.74 -0.40 0.00 -1.52 0.00 0.00 31.29 33.43 3lqi h VAL 1765CO 0.13 0.85 -0.87 0.49 0.02 0.00 0.00 177.57 178.19 3lqi n PHE 1766N -3.57 1.19 -0.19 1.57 3.72 0.17 -4.97 117.46 115.38 3lqi n PHE 1766Ca -0.06 -3.79 0.13 0.00 -0.05 0.00 0.00 57.45 53.68 3lqi n PHE 1766Cb 0.93 -0.35 0.45 0.00 -0.94 0.00 0.00 39.48 39.58 3lqi n PHE 1766CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3lqi h PRO 1767N 4.47 0.52 0.00 -1.08 0.11 -1.62 -1.46 132.00 132.94 3lqi h PRO 1767Ca 0.15 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.23 3lqi h PRO 1767Cb 0.80 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.80 3lqi h PRO 1767CO 0.59 0.34 0.00 -2.67 -0.21 0.00 0.00 178.00 176.05 3lqi n TRP 1768N -4.50 0.09 -3.72 0.65 4.27 -1.26 -4.83 117.44 108.14 3lqi n TRP 1768Ca 0.14 0.03 -0.36 0.00 -3.89 0.00 0.00 57.50 53.41 3lqi n TRP 1768Cb 0.46 -0.55 -0.07 0.00 -1.36 0.00 0.00 31.31 29.80 3lqi n TRP 1768CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 3lqi s PHE 1769N -3.02 3.54 -1.09 -2.67 5.36 -0.55 -5.05 117.98 114.51 3lqi s PHE 1769Ca 0.11 0.56 -0.14 0.00 -0.96 0.00 0.00 56.93 56.49 3lqi s PHE 1769Cb 0.15 -2.13 0.18 0.00 -0.34 0.00 0.00 43.02 40.88 3lqi s PHE 1769CO 0.44 0.51 1.25 -1.12 -1.46 0.00 0.00 175.22 174.83 3lqi s SER 1770N -0.37 6.97 0.34 6.13 0.01 -1.26 -4.85 113.70 120.67 3lqi s SER 1770Ca 0.15 -2.82 0.05 0.00 1.31 0.00 0.00 55.95 54.64 3lqi s SER 1770Cb -0.13 -2.35 0.62 0.00 0.21 0.00 0.00 66.02 64.37 3lqi s SER 1770CO 0.04 -0.74 1.88 -0.37 0.41 0.00 0.00 173.24 174.46 3lqi h VAL 1771N 4.82 1.19 0.00 3.43 -1.51 -1.95 -2.50 116.25 119.74 3lqi h VAL 1771Ca 0.24 -0.76 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 3lqi h VAL 1771Cb 0.93 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.03 3lqi h VAL 1771CO 1.13 0.26 0.00 0.11 -1.23 0.00 0.00 177.57 177.84 3lqi h LYS 1772N 0.49 0.00 -0.01 5.19 1.57 -1.96 -2.52 116.57 119.32 3lqi h LYS 1772Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3lqi h LYS 1772Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3lqi h LYS 1772CO 0.01 0.00 -0.04 1.63 -0.57 0.00 0.00 179.45 180.48 3lqi n LYS 1773N -2.65 1.32 -1.62 3.15 4.76 -0.94 -4.94 118.16 117.23 3lqi n LYS 1773Ca 0.00 -0.62 -0.49 0.00 -2.87 0.00 0.00 58.31 54.34 3lqi n LYS 1773Cb 0.20 -1.49 -0.05 0.00 -1.84 0.00 0.00 35.03 31.86 3lqi n LYS 1773CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3lqi n SER 1774N -0.30 2.21 0.13 4.39 2.88 -0.95 -4.84 113.62 117.14 3lqi n SER 1774Ca 0.19 1.11 0.18 0.00 -1.33 0.00 0.00 58.87 59.02 3lqi n SER 1774Cb 0.29 -1.30 0.76 0.00 -0.75 0.00 0.00 64.21 63.21 3lqi n SER 1774CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3lqi h ARG 1775N 4.75 0.00 -0.01 -1.46 9.65 -1.92 -2.64 114.38 122.76 3lqi h ARG 1775Ca -0.46 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 3lqi h ARG 1775Cb 1.30 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.88 3lqi h ARG 1775CO 0.80 0.00 -0.04 1.19 2.80 0.00 0.00 179.97 184.72 3lqi n PHE 1776N -4.02 0.00 -2.69 2.20 3.72 -1.26 -4.82 117.46 110.58 3lqi n PHE 1776Ca 0.05 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.06 3lqi n PHE 1776Cb 0.44 -0.06 -0.06 0.00 -0.94 0.00 0.00 39.48 38.86 3lqi n PHE 1776CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3lqi s TRP 1777N -2.17 3.71 0.00 1.38 0.23 -1.00 -4.75 118.94 116.35 3lqi s TRP 1777Ca 0.38 1.80 0.00 0.00 -2.03 0.00 0.00 56.10 56.25 3lqi s TRP 1777Cb 0.21 -3.03 0.00 0.00 0.03 0.00 0.00 33.47 30.68 3lqi s TRP 1777CO 0.40 0.06 0.37 0.39 0.96 0.00 0.00 176.95 179.13