#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jzy n GLY 1541N 0.00 0.29 2.98 3.28 0.00 -1.21 0.07 105.19 110.60 3jzy n GLY 1541Ca 0.00 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 44.93 3jzy n GLY 1541CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3jzy s ARG 1542N -2.00 0.67 -0.19 1.61 6.06 0.05 -0.64 118.95 124.50 3jzy s ARG 1542Ca 0.15 -0.25 0.01 0.00 -2.50 0.00 0.00 55.73 53.15 3jzy s ARG 1542Cb -0.00 -0.65 0.03 0.00 0.06 0.00 0.00 34.95 34.39 3jzy s ARG 1542CO -0.01 0.13 -0.19 -1.17 -2.50 0.00 0.00 175.30 171.56 3jzy s LEU 1543N -0.00 2.27 -0.04 -0.88 2.96 0.43 -0.71 118.68 122.71 3jzy s LEU 1543Ca 0.00 -0.73 -0.18 0.00 -0.22 0.00 0.00 54.13 53.00 3jzy s LEU 1543Cb -0.05 -1.47 -0.05 0.00 0.50 0.00 0.00 46.19 45.12 3jzy s LEU 1543CO -0.00 -0.03 0.52 -0.04 -1.32 0.00 0.00 176.35 175.48 3jzy s MET 1544N 1.28 4.24 -0.14 1.98 -1.94 0.34 -0.35 119.30 124.71 3jzy s MET 1544Ca 0.03 0.57 0.02 0.00 -1.71 0.00 0.00 55.69 54.60 3jzy s MET 1544Cb -0.14 -3.34 0.02 0.00 2.01 0.00 0.00 34.83 33.37 3jzy s MET 1544CO -0.12 0.38 -0.18 0.08 -0.01 0.00 0.00 175.02 175.17 3jzy s VAL 1545N -0.14 1.79 -0.40 -6.03 1.01 -0.22 -0.81 120.40 115.60 3jzy s VAL 1545Ca 0.28 -0.80 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 3jzy s VAL 1545Cb -0.17 -1.62 0.09 0.00 0.00 0.00 0.00 36.38 34.68 3jzy s VAL 1545CO 0.14 0.50 0.21 -1.00 0.00 0.00 0.00 175.10 174.95 3jzy s HIS 1546N 1.07 3.42 -0.57 5.22 3.76 -0.03 -1.08 115.29 127.07 3jzy s HIS 1546Ca -0.03 -1.89 -0.20 0.00 -0.15 0.00 0.00 55.06 52.79 3jzy s HIS 1546Cb -0.14 -2.98 0.07 0.00 1.11 0.00 0.00 32.58 30.64 3jzy s HIS 1546CO -0.05 -0.90 0.77 0.08 -0.85 0.00 0.00 174.74 173.79 3jzy s VAL 1547N 1.31 4.67 -0.12 -0.90 1.01 0.82 -1.22 120.40 125.97 3jzy s VAL 1547Ca 0.04 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.43 3jzy s VAL 1547Cb -0.23 -4.47 -0.06 0.00 0.00 0.00 0.00 36.38 31.62 3jzy s VAL 1547CO -0.01 -1.09 0.13 0.40 0.00 0.00 0.00 175.10 174.54 3jzy h ILE 1548N 5.93 0.39 -2.54 2.22 2.04 -1.35 -1.20 117.51 122.99 3jzy h ILE 1548Ca -0.28 -1.32 0.14 0.00 1.00 0.00 0.00 64.86 64.40 3jzy h ILE 1548Cb 1.08 0.76 -0.06 0.00 -0.74 0.00 0.00 36.82 37.86 3jzy h ILE 1548CO 1.07 0.13 0.43 -1.83 0.00 0.00 0.00 178.15 177.95 3jzy s GLU 1549N -1.82 1.40 0.11 2.37 -1.05 -1.18 -1.38 118.70 117.16 3jzy s GLU 1549Ca -0.07 -0.81 0.05 0.00 -0.15 0.00 0.00 54.97 53.99 3jzy s GLU 1549Cb 0.00 0.46 -0.04 0.00 -0.44 0.00 0.00 34.13 34.11 3jzy s GLU 1549CO 0.19 -0.65 -0.12 0.00 0.95 0.00 0.00 175.26 175.64 3jzy s ALA 1550N -3.20 1.30 0.06 -0.84 0.00 -0.27 -0.51 121.76 118.30 3jzy s ALA 1550Ca 0.13 -1.26 0.04 0.00 0.00 0.00 0.00 51.96 50.87 3jzy s ALA 1550Cb -0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 3jzy s ALA 1550CO 0.04 0.01 -0.11 0.95 0.00 0.00 0.00 175.76 176.65 3jzy s THR 1551N -2.42 0.87 -1.38 0.00 -4.23 -0.03 -2.94 115.64 105.51 3jzy s THR 1551Ca 0.08 -1.23 -0.09 0.00 -1.18 0.00 0.00 61.69 59.26 3jzy s THR 1551Cb -0.03 -0.90 0.02 0.00 1.34 0.00 0.00 72.50 72.93 3jzy s THR 1551CO 0.01 -0.31 1.14 -0.62 -0.54 0.00 0.00 174.62 174.31 3jzy n GLU 1552N 1.31 -7.52 -1.62 3.99 1.02 -0.99 -1.47 120.64 115.35 3jzy n GLU 1552Ca -0.22 0.79 -0.33 0.00 -0.02 0.00 0.00 57.16 57.39 3jzy n GLU 1552Cb 0.54 -5.82 0.06 0.00 -0.02 0.00 0.00 31.44 26.21 3jzy n GLU 1552CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3jzy s LEU 1553N -7.26 3.31 0.30 -4.62 1.43 -0.67 -2.15 118.68 109.02 3jzy s LEU 1553Ca 0.57 1.99 -0.29 0.00 -1.03 0.00 0.00 54.13 55.37 3jzy s LEU 1553Cb -0.26 -4.55 -0.11 0.00 0.03 0.00 0.00 46.19 41.31 3jzy s LEU 1553CO 0.75 -1.78 1.50 -0.75 0.23 0.00 0.00 176.35 176.30 3jzy s LYS 1554N -4.24 4.18 0.14 1.70 2.20 -1.26 -4.87 119.74 117.58 3jzy s LYS 1554Ca 0.66 2.46 -0.27 0.00 -0.36 0.00 0.00 55.97 58.46 3jzy s LYS 1554Cb -0.20 -3.04 -0.07 0.00 -1.51 0.00 0.00 37.83 33.01 3jzy s LYS 1554CO 0.45 -0.50 0.85 0.00 -0.36 0.00 0.00 175.35 175.79 3jzy s ALA 1555N -0.38 3.36 0.00 3.13 0.00 -1.26 -4.72 121.76 121.88 3jzy s ALA 1555Ca 0.58 0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.99 3jzy s ALA 1555Cb -0.45 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 19.57 3jzy s ALA 1555CO 0.51 0.14 0.00 0.00 0.00 0.00 0.00 175.76 176.40 3jzy s LYS 1557N -1.53 3.19 0.63 0.00 1.02 -0.34 -5.01 119.74 117.70 3jzy s LYS 1557Ca 0.00 -0.84 0.37 0.00 0.02 0.00 0.00 55.97 55.52 3jzy s LYS 1557Cb 0.00 -2.76 2.12 0.00 -0.52 0.00 0.00 37.83 36.67 3jzy s LYS 1557CO 0.00 0.44 2.30 -1.35 -0.92 0.00 0.00 175.35 175.83 3jzy h PRO 1558N 1.63 0.00 -0.09 -1.68 0.11 -1.98 -1.22 132.00 128.76 3jzy h PRO 1558Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3jzy h PRO 1558Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3jzy h PRO 1558CO 0.63 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.69 3jzy n ASN 1559N -3.44 0.87 0.00 -2.05 6.94 -1.26 -4.89 115.26 111.43 3jzy n ASN 1559Ca -0.03 -1.61 0.00 0.00 -0.02 0.00 0.00 54.58 52.92 3jzy n ASN 1559Cb 0.10 -0.06 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 3jzy n ASN 1559CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3jzy n GLY 1560N 0.95 0.64 2.16 4.83 0.00 -0.46 -5.04 105.19 108.27 3jzy n GLY 1560Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 3jzy n GLY 1560CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3jzy n LYS 1561N -2.70 1.04 -4.23 1.61 4.76 -1.26 -4.70 118.16 112.69 3jzy n LYS 1561Ca 0.00 -1.97 -0.14 0.00 -2.87 0.00 0.00 58.31 53.33 3jzy n LYS 1561Cb 0.00 0.23 -0.09 0.00 -1.84 0.00 0.00 35.03 33.33 3jzy n LYS 1561CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3jzy s SER 1562N -2.82 0.64 -0.52 4.39 0.01 -1.22 -1.20 113.70 112.97 3jzy s SER 1562Ca 0.17 -1.49 0.04 0.00 1.31 0.00 0.00 55.95 55.97 3jzy s SER 1562Cb -0.01 0.42 0.14 0.00 0.21 0.00 0.00 66.02 66.78 3jzy s SER 1562CO 0.11 -0.90 0.29 0.20 0.41 0.00 0.00 173.24 173.35 3jzy s ASN 1563N -3.23 4.09 0.23 2.44 0.01 -1.26 -0.74 114.94 116.48 3jzy s ASN 1563Ca 0.39 -3.01 -0.12 0.00 -0.71 0.00 0.00 52.86 49.41 3jzy s ASN 1563Cb 0.06 -1.41 -0.08 0.00 0.41 0.00 0.00 41.25 40.23 3jzy s ASN 1563CO 0.16 -0.22 0.60 -2.84 -1.51 0.00 0.00 177.10 173.29 3jzy s PRO 1564N -0.25 3.91 0.13 -0.60 0.02 -1.09 -0.65 135.00 136.48 3jzy s PRO 1564Ca 0.19 0.43 0.01 0.00 0.02 0.00 0.00 61.00 61.65 3jzy s PRO 1564Cb -0.22 -2.68 -0.04 0.00 0.02 0.00 0.00 34.50 31.59 3jzy s PRO 1564CO -0.03 0.32 -0.01 1.52 -0.33 0.00 0.00 177.00 178.48 3jzy s TYR 1565N -1.76 0.97 -0.05 6.54 1.13 -0.20 -1.55 117.35 122.43 3jzy s TYR 1565Ca 0.46 -1.05 0.04 0.00 -1.41 0.00 0.00 57.07 55.12 3jzy s TYR 1565Cb -0.12 -0.56 -0.00 0.00 -1.10 0.00 0.00 41.96 40.17 3jzy s TYR 1565CO 0.20 -0.29 -0.18 0.00 -2.51 0.00 0.00 175.55 172.77 3jzy s GLU 1567N 0.13 3.52 -0.18 0.00 2.12 0.61 -0.77 118.70 124.14 3jzy s GLU 1567Ca -0.07 -0.31 0.01 0.00 0.36 0.00 0.00 54.97 54.96 3jzy s GLU 1567Cb -0.13 -3.07 0.02 0.00 0.26 0.00 0.00 34.13 31.22 3jzy s GLU 1567CO 0.03 0.54 -0.18 0.42 -0.54 0.00 0.00 175.26 175.52 3jzy s ILE 1568N -0.38 1.98 0.04 -3.70 1.09 0.34 -0.95 121.20 119.62 3jzy s ILE 1568Ca 0.09 -0.94 0.01 0.00 -1.10 0.00 0.00 60.65 58.71 3jzy s ILE 1568Cb -0.12 -1.83 -0.03 0.00 -1.06 0.00 0.00 42.46 39.43 3jzy s ILE 1568CO 0.02 0.48 -0.05 -0.94 -0.10 0.00 0.00 174.94 174.35 3jzy s SER 1569N 1.31 0.57 -0.28 3.58 1.04 -0.16 -0.90 113.70 118.85 3jzy s SER 1569Ca 0.04 -0.68 0.01 0.00 0.48 0.00 0.00 55.95 55.80 3jzy s SER 1569Cb -0.13 0.10 0.17 0.00 0.10 0.00 0.00 66.02 66.26 3jzy s SER 1569CO -0.12 -0.36 0.50 -0.32 0.98 0.00 0.00 173.24 173.92 3jzy s MET 1570N -2.30 0.48 4.06 4.02 0.00 -0.23 -0.53 119.30 124.80 3jzy s MET 1570Ca -0.06 0.57 0.00 0.00 0.00 0.00 0.00 55.69 56.20 3jzy s MET 1570Cb -0.04 0.03 0.00 0.00 0.00 0.00 0.00 34.83 34.82 3jzy s MET 1570CO -0.03 -0.83 0.00 0.41 0.00 0.00 0.00 175.02 174.57 3jzy n GLY 1571N 5.39 3.10 0.01 2.11 0.00 -1.26 -1.66 105.19 112.88 3jzy n GLY 1571Ca 0.00 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.08 3jzy n GLY 1571CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3jzy n SER 1572N 3.09 0.07 -4.75 1.61 3.41 -1.26 -4.75 113.62 111.03 3jzy n SER 1572Ca 0.00 0.51 -0.38 0.00 -0.26 0.00 0.00 58.87 58.74 3jzy n SER 1572Cb 0.00 -0.53 -0.06 0.00 -0.26 0.00 0.00 64.21 63.36 3jzy n SER 1572CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3jzy s GLN 1573N -3.02 4.29 0.02 4.33 -0.21 -0.67 -5.07 119.66 119.33 3jzy s GLN 1573Ca 0.09 0.59 -0.18 0.00 0.02 0.00 0.00 55.36 55.88 3jzy s GLN 1573Cb 0.12 -3.37 0.03 0.00 1.00 0.00 0.00 33.01 30.79 3jzy s GLN 1573CO 0.35 0.30 0.40 -1.54 -2.12 0.00 0.00 175.29 172.67 3jzy s SER 1574N 0.10 -0.27 0.09 5.90 1.04 -1.26 -1.06 113.70 118.24 3jzy s SER 1574Ca 0.29 0.05 0.03 0.00 0.48 0.00 0.00 55.95 56.80 3jzy s SER 1574Cb -0.17 0.40 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 3jzy s SER 1574CO 0.14 -0.61 -0.10 -0.31 0.98 0.00 0.00 173.24 173.35 3jzy s TYR 1575N -2.13 1.02 -0.02 5.02 2.02 -0.08 -5.00 117.35 118.17 3jzy s TYR 1575Ca -0.07 -0.66 0.03 0.00 -0.37 0.00 0.00 57.07 56.00 3jzy s TYR 1575Cb -0.02 -0.56 -0.00 0.00 -0.40 0.00 0.00 41.96 40.98 3jzy s TYR 1575CO -0.00 -0.02 -0.11 0.95 -1.57 0.00 0.00 175.55 174.80 3jzy s THR 1576N -2.40 0.91 0.90 -0.71 -4.23 -1.26 -0.50 115.64 108.34 3jzy s THR 1576Ca 0.04 -0.45 -0.12 0.00 -1.18 0.00 0.00 61.69 59.99 3jzy s THR 1576Cb -0.03 -0.80 0.13 0.00 1.34 0.00 0.00 72.50 73.14 3jzy s THR 1576CO -0.00 0.27 1.11 0.42 -0.54 0.00 0.00 174.62 175.88 3jzy s THR 1577N 0.07 2.40 0.85 3.99 -4.23 0.05 -5.00 115.64 113.77 3jzy s THR 1577Ca -0.02 0.13 -0.11 0.00 -1.18 0.00 0.00 61.69 60.51 3jzy s THR 1577Cb -0.08 -2.79 0.10 0.00 1.34 0.00 0.00 72.50 71.07 3jzy s THR 1577CO 0.01 -0.17 1.09 0.00 -0.54 0.00 0.00 174.62 175.01 3jzy s ARG 1578N -5.14 1.65 -0.09 3.99 1.70 -1.26 -4.57 118.95 115.24 3jzy s ARG 1578Ca 0.63 1.00 -0.19 0.00 -0.47 0.00 0.00 55.73 56.70 3jzy s ARG 1578Cb -0.16 -1.84 -0.04 0.00 -0.57 0.00 0.00 34.95 32.34 3jzy s ARG 1578CO 0.55 -2.01 0.52 0.99 -1.08 0.00 0.00 175.30 174.26 3jzy s THR 1579N -2.91 5.11 -0.22 4.99 2.01 -1.26 -4.47 115.64 118.91 3jzy s THR 1579Ca 0.63 1.06 -0.12 0.00 0.31 0.00 0.00 61.69 63.57 3jzy s THR 1579Cb -0.18 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.43 3jzy s THR 1579CO 0.57 0.35 0.20 -0.63 -0.69 0.00 0.00 174.62 174.42 3jzy s ILE 1580N 0.41 5.34 0.15 1.82 -1.09 -0.60 -4.95 121.20 122.29 3jzy s ILE 1580Ca 0.28 0.30 -0.30 0.00 -2.23 0.00 0.00 60.65 58.70 3jzy s ILE 1580Cb -0.16 -3.54 -0.07 0.00 -1.58 0.00 0.00 42.46 37.10 3jzy s ILE 1580CO 0.13 0.36 1.17 -1.10 -1.23 0.00 0.00 174.94 174.26 3jzy s GLN 1581N 0.85 4.51 -0.92 2.79 -1.52 -1.26 -2.66 119.66 121.46 3jzy s GLN 1581Ca 0.10 1.80 -0.02 0.00 -1.95 0.00 0.00 55.36 55.30 3jzy s GLN 1581Cb -0.13 -3.28 -0.02 0.00 -0.22 0.00 0.00 33.01 29.36 3jzy s GLN 1581CO 0.03 -0.08 0.78 -3.47 -0.25 0.00 0.00 175.29 172.30 3jzy n ASP 1582N 2.79 -3.49 -3.69 5.90 4.64 -0.75 -4.97 116.55 116.98 3jzy n ASP 1582Ca 0.05 -0.53 -0.14 0.00 -1.38 0.00 0.00 54.79 52.79 3jzy n ASP 1582Cb 0.45 -4.24 -0.08 0.00 -1.04 0.00 0.00 41.12 36.21 3jzy n ASP 1582CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 3jzy s THR 1583N -3.30 0.03 -2.81 5.18 -1.32 0.08 -4.83 115.64 108.67 3jzy s THR 1583Ca 0.14 -0.25 0.23 0.00 -1.21 0.00 0.00 61.69 60.61 3jzy s THR 1583Cb -0.02 -0.71 0.21 0.00 -1.51 0.00 0.00 72.50 70.47 3jzy s THR 1583CO 0.59 -0.14 1.24 0.18 -2.21 0.00 0.00 174.62 174.29 3jzy n LEU 1584N 1.55 2.97 -3.10 9.08 4.77 -1.26 -3.43 117.00 127.58 3jzy n LEU 1584Ca -0.19 -1.06 -0.21 0.00 -0.03 0.00 0.00 56.01 54.52 3jzy n LEU 1584Cb 0.56 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 3jzy n LEU 1584CO 0.20 0.52 -0.11 0.59 -1.33 0.00 0.00 177.39 177.26 3jzy n ASN 1585N 1.31 1.98 -4.76 -1.43 3.02 -1.26 -1.67 115.26 112.44 3jzy n ASN 1585Ca 0.14 -3.22 -0.41 0.00 -0.03 0.00 0.00 54.58 51.07 3jzy n ASN 1585Cb 0.58 -0.60 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 3jzy n ASN 1585CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3jzy s PRO 1586N -2.76 4.48 -0.35 3.52 0.04 -1.15 -4.77 135.00 134.01 3jzy s PRO 1586Ca 0.43 2.03 -0.03 0.00 0.04 0.00 0.00 61.00 63.47 3jzy s PRO 1586Cb 0.33 -3.13 0.07 0.00 0.04 0.00 0.00 34.50 31.81 3jzy s PRO 1586CO -0.10 -0.02 0.09 0.15 0.04 0.00 0.00 177.00 177.17 3jzy s LYS 1587N -1.52 2.26 -0.13 4.56 1.02 -1.26 -1.11 119.74 123.56 3jzy s LYS 1587Ca 0.47 -1.49 -0.01 0.00 0.02 0.00 0.00 55.97 54.97 3jzy s LYS 1587Cb -0.36 -3.37 -0.24 0.00 -0.52 0.00 0.00 37.83 33.33 3jzy s LYS 1587CO 0.47 -0.81 0.33 0.91 -0.92 0.00 0.00 175.35 175.33 3jzy n TRP 1588N 4.63 0.98 -3.83 3.18 8.01 -0.48 -4.98 117.44 124.95 3jzy n TRP 1588Ca -0.08 0.24 -0.26 0.00 -1.31 0.00 0.00 57.50 56.08 3jzy n TRP 1588Cb 0.43 -1.14 0.01 0.00 -2.01 0.00 0.00 31.31 28.59 3jzy n TRP 1588CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 3jzy n ASN 1589N -3.33 -1.68 -4.63 -0.99 3.02 -0.53 -4.95 115.26 102.17 3jzy n ASN 1589Ca -0.31 -0.97 -0.35 0.00 -0.03 0.00 0.00 54.58 52.93 3jzy n ASN 1589Cb 1.05 -3.35 -0.10 0.00 -0.61 0.00 0.00 39.78 36.76 3jzy n ASN 1589CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3jzy s PHE 1590N -3.78 3.22 -0.05 3.10 2.19 -0.47 -4.95 117.98 117.24 3jzy s PHE 1590Ca 0.11 0.05 0.06 0.00 0.33 0.00 0.00 56.93 57.49 3jzy s PHE 1590Cb -0.04 -2.00 -0.01 0.00 -1.31 0.00 0.00 43.02 39.66 3jzy s PHE 1590CO 0.86 0.21 -0.25 -0.80 1.83 0.00 0.00 175.22 177.08 3jzy s ASN 1591N 0.06 3.02 0.15 6.13 0.01 -1.26 -0.13 114.94 122.92 3jzy s ASN 1591Ca 0.04 -0.50 -0.08 0.00 -0.71 0.00 0.00 52.86 51.62 3jzy s ASN 1591Cb -0.12 -0.74 -0.01 0.00 0.41 0.00 0.00 41.25 40.78 3jzy s ASN 1591CO 0.01 0.25 0.25 0.00 -1.51 0.00 0.00 177.10 176.11 3jzy s GLN 1593N -3.97 1.72 0.02 0.00 0.74 -1.26 -1.06 119.66 115.86 3jzy s GLN 1593Ca 0.17 -0.61 0.08 0.00 0.05 0.00 0.00 55.36 55.04 3jzy s GLN 1593Cb 0.04 -1.52 -0.03 0.00 1.10 0.00 0.00 33.01 32.60 3jzy s GLN 1593CO -0.01 0.27 -0.24 -0.06 -0.55 0.00 0.00 175.29 174.70 3jzy s PHE 1594N -0.05 2.40 0.02 1.67 0.40 0.52 -4.97 117.98 117.97 3jzy s PHE 1594Ca -0.02 -0.37 -0.26 0.00 -0.60 0.00 0.00 56.93 55.68 3jzy s PHE 1594Cb -0.11 -1.45 -0.05 0.00 0.51 0.00 0.00 43.02 41.93 3jzy s PHE 1594CO 0.02 0.11 0.81 0.12 0.70 0.00 0.00 175.22 176.98 3jzy s PHE 1595N -0.78 3.70 -0.23 0.36 5.99 -1.26 -0.43 117.98 125.33 3jzy s PHE 1595Ca 0.12 1.49 -0.09 0.00 0.00 0.00 0.00 56.93 58.45 3jzy s PHE 1595Cb -0.10 -2.89 -0.04 0.00 0.00 0.00 0.00 43.02 39.99 3jzy s PHE 1595CO 0.02 0.18 0.12 0.42 -0.00 0.00 0.00 175.22 175.95 3jzy s ILE 1596N 0.31 4.96 -0.21 3.12 -1.09 0.18 -4.93 121.20 123.56 3jzy s ILE 1596Ca 0.41 0.04 0.13 0.00 -2.23 0.00 0.00 60.65 59.00 3jzy s ILE 1596Cb -0.20 -3.30 -0.22 0.00 -1.58 0.00 0.00 42.46 37.16 3jzy s ILE 1596CO 0.23 0.36 -0.02 0.29 -1.23 0.00 0.00 174.94 174.58 3jzy n LYS 1597N 4.33 0.77 -3.44 2.79 5.02 -1.26 -2.30 118.16 124.08 3jzy n LYS 1597Ca -0.16 0.04 -0.18 0.00 -2.02 0.00 0.00 58.31 55.99 3jzy n LYS 1597Cb 0.52 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.92 3jzy n LYS 1597CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3jzy s ASP 1598N -5.68 1.70 0.29 4.39 -1.08 -1.26 -4.74 116.67 110.29 3jzy s ASP 1598Ca -0.17 -0.62 0.03 0.00 -0.52 0.00 0.00 52.55 51.28 3jzy s ASP 1598Cb 0.07 0.42 0.62 0.00 -1.46 0.00 0.00 42.92 42.57 3jzy s ASP 1598CO 0.73 -0.37 1.82 0.25 0.52 0.00 0.00 175.17 178.11 3jzy h LEU 1599N 8.29 0.88 -1.39 -1.34 6.46 -1.94 0.52 115.31 126.79 3jzy h LEU 1599Ca -0.15 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.67 3jzy h LEU 1599Cb 1.09 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.92 3jzy h LEU 1599CO 0.33 0.42 0.00 -1.22 -0.62 0.00 0.00 178.44 177.35 3jzy n TYR 1600N -4.66 0.09 -0.01 1.25 4.01 -1.26 -3.01 117.16 113.56 3jzy n TYR 1600Ca 0.20 -0.04 -0.01 0.00 -0.16 0.00 0.00 57.90 57.89 3jzy n TYR 1600Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.45 3jzy n TYR 1600CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3jzy n GLN 1601N 0.66 3.47 -2.23 -0.72 1.13 -0.77 -4.97 117.38 113.95 3jzy n GLN 1601Ca 0.17 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.82 3jzy n GLN 1601Cb 0.44 -1.03 -0.03 0.00 0.11 0.00 0.00 30.24 29.73 3jzy n GLN 1601CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3jzy s ASP 1602N -3.24 6.92 -0.07 1.08 -0.00 0.10 -4.95 116.67 116.51 3jzy s ASP 1602Ca -0.01 2.48 0.01 0.00 -0.00 0.00 0.00 52.55 55.04 3jzy s ASP 1602Cb 0.00 -2.63 0.02 0.00 -0.00 0.00 0.00 42.92 40.32 3jzy s ASP 1602CO 0.05 -0.46 -0.08 -0.69 -0.00 0.00 0.00 175.17 173.98 3jzy s VAL 1603N -0.56 0.92 -0.09 -1.27 1.01 -1.26 -0.86 120.40 118.28 3jzy s VAL 1603Ca 0.52 -0.31 -0.20 0.00 0.00 0.00 0.00 61.98 61.99 3jzy s VAL 1603Cb -0.37 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 3jzy s VAL 1603CO 0.44 0.32 0.55 -0.22 0.00 0.00 0.00 175.10 176.19 3jzy s LEU 1604N 1.07 4.30 -0.03 3.92 2.96 -0.24 -4.41 118.68 126.24 3jzy s LEU 1604Ca -0.08 0.95 0.07 0.00 -0.22 0.00 0.00 54.13 54.85 3jzy s LEU 1604Cb -0.14 -2.82 -0.02 0.00 0.50 0.00 0.00 46.19 43.71 3jzy s LEU 1604CO -0.01 -0.02 -0.25 0.00 -1.32 0.00 0.00 176.35 174.75 3jzy s LEU 1606N -0.52 2.11 -0.06 0.00 1.43 -0.04 -0.99 118.68 120.61 3jzy s LEU 1606Ca 0.07 -0.61 0.02 0.00 -1.03 0.00 0.00 54.13 52.58 3jzy s LEU 1606Cb -0.11 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 44.68 3jzy s LEU 1606CO 0.00 0.06 -0.12 -0.89 0.23 0.00 0.00 176.35 175.63 3jzy s THR 1607N 0.92 1.12 -0.01 5.49 2.01 -0.13 -0.72 115.64 124.32 3jzy s THR 1607Ca -0.05 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 61.50 3jzy s THR 1607Cb -0.15 -1.02 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 3jzy s THR 1607CO -0.04 0.35 0.01 -0.76 -0.69 0.00 0.00 174.62 173.49 3jzy s LEU 1608N 0.67 3.55 0.05 4.42 1.02 -0.08 -0.28 118.68 128.03 3jzy s LEU 1608Ca -0.14 0.02 0.01 0.00 0.02 0.00 0.00 54.13 54.03 3jzy s LEU 1608Cb -0.16 -2.02 -0.03 0.00 0.02 0.00 0.00 46.19 44.00 3jzy s LEU 1608CO 0.04 0.29 -0.05 -0.36 0.02 0.00 0.00 176.35 176.28 3jzy s PHE 1609N -1.08 0.55 -0.09 0.29 0.08 -0.17 -0.95 117.98 116.62 3jzy s PHE 1609Ca 0.19 -0.71 -0.11 0.00 0.12 0.00 0.00 56.93 56.43 3jzy s PHE 1609Cb -0.12 -0.36 -0.05 0.00 -0.57 0.00 0.00 43.02 41.93 3jzy s PHE 1609CO 0.10 -0.19 0.25 0.34 -0.10 0.00 0.00 175.22 175.62 3jzy s ASP 1610N -2.10 6.54 -0.34 1.36 -1.08 0.24 -1.04 116.67 120.25 3jzy s ASP 1610Ca -0.04 0.64 0.02 0.00 -0.52 0.00 0.00 52.55 52.65 3jzy s ASP 1610Cb -0.03 -2.15 0.09 0.00 -1.46 0.00 0.00 42.92 39.37 3jzy s ASP 1610CO -0.03 0.33 0.05 -0.60 0.52 0.00 0.00 175.17 175.44 3jzy s ARG 1611N -0.79 1.80 0.11 4.34 6.06 0.18 -2.87 118.95 127.77 3jzy s ARG 1611Ca 0.18 -1.73 0.01 0.00 -2.50 0.00 0.00 55.73 51.69 3jzy s ARG 1611Cb -0.14 -3.24 -0.00 0.00 0.06 0.00 0.00 34.95 31.64 3jzy s ARG 1611CO 0.07 -0.88 0.02 -3.47 -2.50 0.00 0.00 175.30 168.54 3jzy n ASP 1612N 4.38 1.62 0.23 -2.12 2.03 -1.26 -4.60 116.55 116.83 3jzy n ASP 1612Ca -0.02 -1.52 0.16 0.00 0.52 0.00 0.00 54.79 53.93 3jzy n ASP 1612Cb 0.42 0.17 0.75 0.00 -0.72 0.00 0.00 41.12 41.74 3jzy n ASP 1612CO 0.00 0.00 0.00 0.06 -1.92 0.00 0.00 177.20 175.34 3jzy h GLN 1613N 0.00 0.00 -6.15 -0.67 3.07 -1.99 -3.44 115.11 105.93 3jzy h GLN 1613Ca -0.09 0.00 -0.67 0.00 0.09 0.00 0.00 58.65 57.98 3jzy h GLN 1613Cb 0.29 0.00 -0.15 0.00 0.08 0.00 0.00 27.48 27.70 3jzy h GLN 1613CO 0.14 0.00 -0.66 -0.06 0.09 0.00 0.00 178.83 178.34 3jzy s PHE 1614N -3.67 3.03 0.25 0.06 0.08 -1.26 -5.12 117.98 111.36 3jzy s PHE 1614Ca -0.00 0.07 -0.19 0.00 0.12 0.00 0.00 56.93 56.93 3jzy s PHE 1614Cb 0.09 -1.68 -0.09 0.00 -0.57 0.00 0.00 43.02 40.77 3jzy s PHE 1614CO 0.41 0.43 0.74 -1.12 -0.10 0.00 0.00 175.22 175.58 3jzy s SER 1615N -1.29 7.01 0.58 1.36 0.01 -1.26 -4.32 113.70 115.79 3jzy s SER 1615Ca 0.17 1.42 -0.09 0.00 1.31 0.00 0.00 55.95 58.76 3jzy s SER 1615Cb -0.11 -2.42 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 3jzy s SER 1615CO 0.07 -0.03 0.95 -2.16 0.41 0.00 0.00 173.24 172.48 3jzy s PRO 1616N -2.21 3.58 0.01 12.44 0.04 -1.26 -5.09 135.00 142.51 3jzy s PRO 1616Ca 0.46 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 3jzy s PRO 1616Cb -0.15 -2.17 -0.08 0.00 0.04 0.00 0.00 34.50 32.14 3jzy s PRO 1616CO 0.20 -0.45 1.78 -0.51 0.04 0.00 0.00 177.00 178.06 3jzy s ASP 1617N -4.15 6.56 0.20 6.66 1.01 -1.26 -4.95 116.67 120.74 3jzy s ASP 1617Ca 0.53 2.47 -0.30 0.00 0.71 0.00 0.00 52.55 55.96 3jzy s ASP 1617Cb -0.11 -2.54 -0.09 0.00 1.01 0.00 0.00 42.92 41.20 3jzy s ASP 1617CO 0.51 -0.97 1.24 -1.81 0.21 0.00 0.00 175.17 174.35 3jzy s ASP 1618N 3.56 7.00 0.06 0.27 1.01 -1.14 -4.72 116.67 122.70 3jzy s ASP 1618Ca 0.80 2.33 -0.31 0.00 0.71 0.00 0.00 52.55 56.08 3jzy s ASP 1618Cb -0.39 -2.61 -0.07 0.00 1.01 0.00 0.00 42.92 40.87 3jzy s ASP 1618CO 0.35 -0.43 1.36 0.12 0.21 0.00 0.00 175.17 176.78 3jzy s PHE 1619N -0.11 3.12 -0.35 4.23 2.19 -1.26 -0.59 117.98 125.20 3jzy s PHE 1619Ca 0.54 0.95 0.08 0.00 0.33 0.00 0.00 56.93 58.83 3jzy s PHE 1619Cb -0.35 -3.63 0.19 0.00 -1.31 0.00 0.00 43.02 37.92 3jzy s PHE 1619CO 0.39 -2.23 1.15 1.28 1.83 0.00 0.00 175.22 177.63 3jzy n LEU 1620N 4.52 2.54 0.00 6.12 4.77 -0.13 -4.91 117.00 129.91 3jzy n LEU 1620Ca 0.12 -2.23 0.00 0.00 -0.03 0.00 0.00 56.01 53.87 3jzy n LEU 1620Cb 0.43 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 3jzy n LEU 1620CO 0.58 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 3jzy n GLY 1621N -0.27 2.80 3.34 -0.72 0.00 -1.24 -4.76 105.19 104.35 3jzy n GLY 1621Ca 0.08 -2.04 -0.10 0.00 0.00 0.00 0.00 46.02 43.97 3jzy n GLY 1621CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3jzy s ARG 1622N -2.57 1.11 0.00 1.61 1.70 -0.65 -0.90 118.95 119.25 3jzy s ARG 1622Ca 0.00 -0.98 -0.13 0.00 -0.47 0.00 0.00 55.73 54.15 3jzy s ARG 1622Cb 0.00 0.41 0.02 0.00 -0.57 0.00 0.00 34.95 34.81 3jzy s ARG 1622CO 0.00 -0.42 0.27 -0.08 -1.08 0.00 0.00 175.30 173.99 3jzy s THR 1623N -3.90 0.07 -0.03 4.99 -1.32 0.10 -0.25 115.64 115.29 3jzy s THR 1623Ca 0.10 -0.57 -0.00 0.00 -1.21 0.00 0.00 61.69 60.01 3jzy s THR 1623Cb 0.03 -0.64 0.03 0.00 -1.51 0.00 0.00 72.50 70.40 3jzy s THR 1623CO -0.05 -0.31 0.01 -1.83 -2.21 0.00 0.00 174.62 170.23 3jzy s GLU 1624N -1.58 0.25 -0.11 7.08 -1.05 -1.26 -0.86 118.70 121.16 3jzy s GLU 1624Ca -0.12 0.14 -0.00 0.00 -0.15 0.00 0.00 54.97 54.83 3jzy s GLU 1624Cb -0.05 -0.52 0.02 0.00 -0.44 0.00 0.00 34.13 33.15 3jzy s GLU 1624CO 0.02 -0.19 -0.09 -1.50 0.95 0.00 0.00 175.26 174.46 3jzy s ILE 1625N 1.31 1.11 0.35 1.83 2.07 0.51 -4.97 121.20 123.42 3jzy s ILE 1625Ca -0.06 -0.35 -0.29 0.00 -1.41 0.00 0.00 60.65 58.54 3jzy s ILE 1625Cb -0.13 -1.10 -0.11 0.00 0.13 0.00 0.00 42.46 41.25 3jzy s ILE 1625CO -0.02 0.38 1.48 -2.84 -1.91 0.00 0.00 174.94 172.02 3jzy s PRO 1626N 1.57 4.15 0.50 3.50 0.02 -1.26 -1.08 135.00 142.40 3jzy s PRO 1626Ca 0.03 2.52 0.16 0.00 0.02 0.00 0.00 61.00 63.73 3jzy s PRO 1626Cb -0.13 -3.00 1.22 0.00 0.02 0.00 0.00 34.50 32.62 3jzy s PRO 1626CO -0.07 -0.50 2.11 0.28 -0.33 0.00 0.00 177.00 178.49 3jzy h VAL 1627N 3.07 0.98 -0.92 3.83 2.07 -1.22 -0.97 116.25 123.08 3jzy h VAL 1627Ca -0.50 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.03 3jzy h VAL 1627Cb 1.23 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 3jzy h VAL 1627CO 0.67 0.02 0.61 0.00 0.02 0.00 0.00 177.57 178.88 3jzy h ALA 1628N 1.92 1.42 -0.17 1.67 0.00 -1.76 -0.53 119.26 121.80 3jzy h ALA 1628Ca 0.06 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 3jzy h ALA 1628Cb 0.14 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3jzy h ALA 1628CO -0.01 0.49 -0.62 0.87 0.00 0.00 0.00 179.25 179.98 3jzy h LYS 1629N 1.15 0.60 -0.74 0.00 1.57 -1.54 -2.46 116.57 115.15 3jzy h LYS 1629Ca 0.37 -0.42 0.07 0.00 -1.87 0.00 0.00 60.65 58.80 3jzy h LYS 1629Cb 0.03 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.34 3jzy h LYS 1629CO -0.12 1.04 0.43 0.82 -0.57 0.00 0.00 179.45 181.05 3jzy h ILE 1630N 0.45 0.98 -0.48 1.86 2.04 -0.91 0.24 117.51 121.68 3jzy h ILE 1630Ca -0.01 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.59 3jzy h ILE 1630Cb 1.19 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 3jzy h ILE 1630CO 0.12 0.14 0.30 -0.09 0.00 0.00 0.00 178.15 178.62 3jzy h ARG 1631N 0.78 0.64 0.04 2.37 2.43 -0.88 -0.41 114.38 119.34 3jzy h ARG 1631Ca 0.34 -0.05 -0.23 0.00 -0.81 0.00 0.00 59.98 59.23 3jzy h ARG 1631Cb 0.21 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3jzy h ARG 1631CO -0.19 0.44 -1.02 1.79 -1.51 0.00 0.00 179.97 179.49 3jzy h THR 1632N 0.64 1.48 -0.78 0.20 1.35 -1.08 -2.44 112.91 112.28 3jzy h THR 1632Ca 0.17 -2.74 -0.01 0.00 -0.55 0.00 0.00 66.41 63.28 3jzy h THR 1632Cb -0.04 2.62 -0.04 0.00 -1.73 0.00 0.00 68.15 68.96 3jzy h THR 1632CO -0.03 0.80 0.44 -0.33 -0.25 0.00 0.00 175.52 176.15 3jzy h GLU 1633N 0.13 1.08 -0.48 4.72 3.07 -0.87 -1.68 114.58 120.55 3jzy h GLU 1633Ca -0.08 -0.12 -0.10 0.00 -0.50 0.00 0.00 59.36 58.56 3jzy h GLU 1633Cb 1.68 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 29.36 3jzy h GLU 1633CO 0.16 0.79 -0.08 0.37 -1.40 0.00 0.00 179.01 178.85 3jzy h GLN 1634N 1.08 0.87 -0.51 2.33 4.15 -0.98 0.69 115.11 122.73 3jzy h GLN 1634Ca 0.28 -0.29 -0.08 0.00 0.77 0.00 0.00 58.65 59.33 3jzy h GLN 1634Cb 0.01 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 3jzy h GLN 1634CO -0.05 0.92 0.00 0.93 -1.93 0.00 0.00 178.83 178.70 3jzy h GLU 1635N 0.78 0.86 0.23 1.69 5.08 -1.35 -1.78 114.58 120.09 3jzy h GLU 1635Ca 0.13 -0.24 -0.34 0.00 -1.00 0.00 0.00 59.36 57.91 3jzy h GLU 1635Cb 0.59 -0.10 0.03 0.00 0.50 0.00 0.00 28.75 29.77 3jzy h GLU 1635CO 0.04 0.86 -1.55 0.77 -1.00 0.00 0.00 179.01 178.12 3jzy h SER 1636N 0.80 0.77 0.00 1.42 0.02 -0.80 -3.41 113.55 112.36 3jzy h SER 1636Ca 0.15 -0.90 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 3jzy h SER 1636Cb 0.47 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.76 3jzy h SER 1636CO 0.02 1.72 -0.32 0.29 -1.14 0.00 0.00 176.83 177.40 3jzy n LYS 1637N -3.68 4.76 0.00 3.45 5.02 0.19 -5.10 118.16 122.81 3jzy n LYS 1637Ca -0.19 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 3jzy n LYS 1637Cb 1.10 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 3jzy n LYS 1637CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3jzy n GLY 1638N 1.47 -1.50 3.63 0.72 0.00 -0.67 -4.60 105.19 104.24 3jzy n GLY 1638Ca 0.00 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.29 3jzy n GLY 1638CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3jzy s PRO 1639N 0.00 3.70 0.04 1.61 0.04 -1.26 -4.64 135.00 134.48 3jzy s PRO 1639Ca 0.00 1.90 0.03 0.00 0.04 0.00 0.00 61.00 62.97 3jzy s PRO 1639Cb 0.00 -4.14 -0.02 0.00 0.04 0.00 0.00 34.50 30.38 3jzy s PRO 1639CO 0.00 -1.43 -0.09 -1.64 0.04 0.00 0.00 177.00 173.88 3jzy s MET 1640N 5.04 0.61 -0.00 4.56 -1.94 -1.26 -5.11 119.30 121.20 3jzy s MET 1640Ca 0.81 -0.70 -0.29 0.00 -1.71 0.00 0.00 55.69 53.80 3jzy s MET 1640Cb -0.30 -0.48 -0.03 0.00 2.01 0.00 0.00 34.83 36.03 3jzy s MET 1640CO 0.33 0.11 0.95 0.99 -0.01 0.00 0.00 175.02 177.39 3jzy s THR 1641N -1.09 4.87 -0.11 2.05 2.01 -1.26 -4.44 115.64 117.67 3jzy s THR 1641Ca -0.05 2.00 -0.05 0.00 0.31 0.00 0.00 61.69 63.90 3jzy s THR 1641Cb -0.08 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 3jzy s THR 1641CO 0.01 0.18 0.08 -0.13 -0.69 0.00 0.00 174.62 174.06 3jzy s ARG 1642N 0.94 3.27 -0.22 4.92 3.00 0.63 -4.94 118.95 126.54 3jzy s ARG 1642Ca 0.50 -0.26 -0.08 0.00 0.00 0.00 0.00 55.73 55.89 3jzy s ARG 1642Cb -0.21 -3.02 -0.04 0.00 0.00 0.00 0.00 34.95 31.68 3jzy s ARG 1642CO 0.27 0.72 0.09 1.03 0.00 0.00 0.00 175.30 177.41 3jzy s ARG 1643N -0.90 3.85 -0.17 3.54 0.52 -1.26 -1.16 118.95 123.37 3jzy s ARG 1643Ca 0.14 -0.39 -0.01 0.00 -0.52 0.00 0.00 55.73 54.95 3jzy s ARG 1643Cb -0.12 -3.33 -0.00 0.00 0.52 0.00 0.00 34.95 32.01 3jzy s ARG 1643CO 0.03 0.02 -0.11 -0.51 0.02 0.00 0.00 175.30 174.75 3jzy s LEU 1644N 1.08 2.64 0.19 2.53 1.43 0.41 -4.96 118.68 122.00 3jzy s LEU 1644Ca 0.05 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.42 3jzy s LEU 1644Cb -0.14 -1.63 -0.09 0.00 0.03 0.00 0.00 46.19 44.37 3jzy s LEU 1644CO 0.04 0.06 1.31 -0.22 0.23 0.00 0.00 176.35 177.77 3jzy s LEU 1645N 0.98 4.41 0.06 1.79 0.20 -1.26 -0.98 118.68 123.87 3jzy s LEU 1645Ca -0.02 2.39 -0.30 0.00 0.69 0.00 0.00 54.13 56.89 3jzy s LEU 1645Cb -0.15 -3.61 -0.05 0.00 -0.43 0.00 0.00 46.19 41.96 3jzy s LEU 1645CO -0.01 -0.54 1.00 -0.76 -0.29 0.00 0.00 176.35 175.75 3jzy s LEU 1646N 0.03 4.42 0.33 -0.68 1.43 -0.63 -4.69 118.68 118.89 3jzy s LEU 1646Ca 0.57 1.77 0.03 0.00 -1.03 0.00 0.00 54.13 55.48 3jzy s LEU 1646Cb -0.36 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.26 3jzy s LEU 1646CO 0.37 -0.21 0.50 -1.00 0.23 0.00 0.00 176.35 176.24 3jzy s HIS 1647N 0.57 3.35 -1.62 0.29 3.76 0.65 -4.53 115.29 117.76 3jzy s HIS 1647Ca 0.51 0.09 0.00 0.00 -0.15 0.00 0.00 55.06 55.51 3jzy s HIS 1647Cb -0.23 -1.90 0.00 0.00 1.11 0.00 0.00 32.58 31.56 3jzy s HIS 1647CO 0.29 0.09 0.00 0.39 -0.85 0.00 0.00 174.74 174.67 3jzy n GLU 1648N -1.70 -1.57 -4.08 1.40 -0.58 -1.26 -1.64 120.64 111.21 3jzy n GLU 1648Ca -0.04 0.91 -0.10 0.00 -0.42 0.00 0.00 57.16 57.51 3jzy n GLU 1648Cb 0.57 -5.32 -0.11 0.00 -0.57 0.00 0.00 31.44 26.01 3jzy n GLU 1648CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3jzy s VAL 1649N -2.53 0.42 -0.25 2.62 0.11 -1.26 -4.76 120.40 114.74 3jzy s VAL 1649Ca 0.00 -1.47 0.25 0.00 -2.93 0.00 0.00 61.98 57.83 3jzy s VAL 1649Cb 0.00 -1.07 0.32 0.00 -1.53 0.00 0.00 36.38 34.10 3jzy s VAL 1649CO 0.00 -0.70 1.70 -0.65 -3.33 0.00 0.00 175.10 172.12 3jzy h PRO 1650N 3.75 0.00 -3.65 1.54 0.11 -1.92 -3.48 132.00 128.35 3jzy h PRO 1650Ca -0.34 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.69 3jzy h PRO 1650Cb 1.18 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.16 3jzy h PRO 1650CO 0.54 0.06 -0.23 -0.08 -0.21 0.00 0.00 178.00 178.08 3jzy s THR 1651N -3.32 0.09 0.00 -1.15 -1.32 -1.26 -5.13 115.64 103.55 3jzy s THR 1651Ca 0.05 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 59.52 3jzy s THR 1651Cb 0.06 -1.43 0.00 0.00 -1.51 0.00 0.00 72.50 69.62 3jzy s THR 1651CO 0.64 -0.41 0.00 0.61 -2.21 0.00 0.00 174.62 173.25 3jzy n GLY 1652N -0.18 3.74 3.08 6.08 0.00 -0.91 -4.35 105.19 112.65 3jzy n GLY 1652Ca -0.13 -1.44 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 3jzy n GLY 1652CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3jzy s GLU 1653N -5.05 0.48 -0.03 1.61 -1.05 -0.54 -1.61 118.70 112.50 3jzy s GLU 1653Ca 0.00 -0.61 0.07 0.00 -0.15 0.00 0.00 54.97 54.28 3jzy s GLU 1653Cb 0.00 0.19 -0.02 0.00 -0.44 0.00 0.00 34.13 33.86 3jzy s GLU 1653CO 0.00 -0.11 -0.24 0.54 0.95 0.00 0.00 175.26 176.40 3jzy s VAL 1654N -1.92 2.20 -0.22 1.83 0.11 -0.16 -0.85 120.40 121.39 3jzy s VAL 1654Ca -0.11 -1.04 -0.05 0.00 -2.93 0.00 0.00 61.98 57.85 3jzy s VAL 1654Cb -0.05 -1.78 -0.02 0.00 -1.53 0.00 0.00 36.38 33.00 3jzy s VAL 1654CO -0.02 0.58 -0.01 0.26 -3.33 0.00 0.00 175.10 172.58 3jzy s TRP 1655N -0.51 3.00 0.00 1.54 0.52 0.34 -0.44 118.94 123.39 3jzy s TRP 1655Ca 0.07 -0.73 -0.02 0.00 0.02 0.00 0.00 56.10 55.43 3jzy s TRP 1655Cb -0.11 -2.14 -0.01 0.00 -1.15 0.00 0.00 33.47 30.07 3jzy s TRP 1655CO 0.00 -0.45 0.03 0.08 0.02 0.00 0.00 176.95 176.63 3jzy s VAL 1656N 1.45 0.06 -0.11 4.03 1.01 -0.31 -1.05 120.40 125.49 3jzy s VAL 1656Ca 0.05 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.56 3jzy s VAL 1656Cb -0.15 -0.22 -0.00 0.00 0.00 0.00 0.00 36.38 36.01 3jzy s VAL 1656CO -0.01 -0.28 -0.22 -0.60 0.00 0.00 0.00 175.10 174.00 3jzy s ARG 1657N -0.85 3.12 -0.07 2.72 3.52 -0.36 -0.27 118.95 126.77 3jzy s ARG 1657Ca -0.09 -0.84 -0.03 0.00 -0.13 0.00 0.00 55.73 54.64 3jzy s ARG 1657Cb -0.06 -2.37 -0.04 0.00 -1.56 0.00 0.00 34.95 30.92 3jzy s ARG 1657CO -0.00 0.18 0.08 -0.06 -0.81 0.00 0.00 175.30 174.69 3jzy s PHE 1658N 0.36 3.36 -0.25 5.12 0.08 -1.26 -0.85 117.98 124.54 3jzy s PHE 1658Ca -0.17 0.31 -0.01 0.00 0.12 0.00 0.00 56.93 57.18 3jzy s PHE 1658Cb -0.18 -1.82 0.07 0.00 -0.57 0.00 0.00 43.02 40.53 3jzy s PHE 1658CO 0.08 0.59 0.04 0.34 -0.10 0.00 0.00 175.22 176.17 3jzy s ASP 1659N -1.26 3.55 -0.26 1.36 2.15 0.01 -4.83 116.67 117.38 3jzy s ASP 1659Ca 0.18 -1.21 -0.14 0.00 0.43 0.00 0.00 52.55 51.81 3jzy s ASP 1659Cb -0.12 -0.84 -0.04 0.00 -0.30 0.00 0.00 42.92 41.62 3jzy s ASP 1659CO 0.08 -0.33 0.33 -0.22 -0.17 0.00 0.00 175.17 174.86 3jzy s LEU 1660N 1.65 4.06 -0.32 -1.34 2.96 -1.26 -0.50 118.68 123.93 3jzy s LEU 1660Ca 0.02 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.20 3jzy s LEU 1660Cb -0.18 -2.37 0.08 0.00 0.50 0.00 0.00 46.19 44.22 3jzy s LEU 1660CO -0.13 -0.12 0.01 -1.10 -1.32 0.00 0.00 176.35 173.68 3jzy s GLN 1661N 1.81 2.06 -0.13 1.98 -0.21 0.12 -5.01 119.66 120.28 3jzy s GLN 1661Ca 0.14 -1.54 -0.13 0.00 0.02 0.00 0.00 55.36 53.85 3jzy s GLN 1661Cb -0.15 -3.16 -0.05 0.00 1.00 0.00 0.00 33.01 30.64 3jzy s GLN 1661CO 0.09 -0.76 0.29 -0.51 -2.12 0.00 0.00 175.29 172.29 3jzy s LEU 1662N 1.10 4.30 0.00 2.90 1.43 -1.26 -0.77 118.68 126.38 3jzy s LEU 1662Ca -0.00 0.58 0.30 0.00 -1.03 0.00 0.00 54.13 53.98 3jzy s LEU 1662Cb -0.20 -2.37 1.43 0.00 0.03 0.00 0.00 46.19 45.08 3jzy s LEU 1662CO -0.05 0.18 1.96 0.49 0.23 0.00 0.00 176.35 179.16