#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k5m s LEU 1602N 0.00 4.25 0.14 0.99 2.96 -1.26 -4.98 118.68 120.78 1k5m s LEU 1602Ca 0.00 1.94 -0.30 0.00 -0.22 0.00 0.00 54.13 55.55 1k5m s LEU 1602Cb 0.00 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 43.08 1k5m s LEU 1602CO 0.00 -0.83 1.28 -2.16 -1.32 0.00 0.00 176.35 173.32 1k5m s PRO 1603N 3.68 4.40 0.13 0.98 0.04 -1.26 -5.02 135.00 137.96 1k5m s PRO 1603Ca 0.63 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.63 1k5m s PRO 1603Cb -0.27 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 30.97 1k5m s PRO 1603CO 0.21 -0.26 0.01 0.95 0.04 0.00 0.00 177.00 177.95 1k5m s THR 1604N 0.55 0.39 -0.18 1.26 -4.23 -1.26 -5.14 115.64 107.03 1k5m s THR 1604Ca 0.58 -1.93 -0.04 0.00 -1.18 0.00 0.00 61.69 59.13 1k5m s THR 1604Cb -0.34 -1.97 0.09 0.00 1.34 0.00 0.00 72.50 71.61 1k5m s THR 1604CO 0.34 -0.57 0.22 -0.89 -0.54 0.00 0.00 174.62 173.17 1k5m s THR 1605N -3.84 -0.33 0.11 3.99 2.01 -1.26 -5.13 115.64 111.19 1k5m s THR 1605Ca 0.21 -0.02 -0.31 0.00 0.31 0.00 0.00 61.69 61.88 1k5m s THR 1605Cb 0.07 -0.61 -0.07 0.00 0.01 0.00 0.00 72.50 71.90 1k5m s THR 1605CO 0.00 -0.13 1.26 0.42 -0.69 0.00 0.00 174.62 175.48 1k5m s THR 1606N 2.34 3.69 0.58 -0.82 -4.23 -1.26 -5.02 115.64 110.91 1k5m s THR 1606Ca 0.06 1.26 -0.07 0.00 -1.18 0.00 0.00 61.69 61.76 1k5m s THR 1606Cb -0.15 -3.81 -0.01 0.00 1.34 0.00 0.00 72.50 69.88 1k5m s THR 1606CO -0.11 0.13 0.90 -0.76 -0.54 0.00 0.00 174.62 174.24 1k5m s LEU 1607N 0.73 3.30 0.41 4.79 1.43 -1.26 -4.98 118.68 123.10 1k5m s LEU 1607Ca 0.59 0.86 -0.26 0.00 -1.03 0.00 0.00 54.13 54.29 1k5m s LEU 1607Cb -0.33 -3.74 -0.10 0.00 0.03 0.00 0.00 46.19 42.06 1k5m s LEU 1607CO 0.32 -0.95 1.40 -2.65 0.23 0.00 0.00 176.35 174.69 1k5m n PRO 1608N -2.56 2.30 -0.23 1.29 -0.02 -1.26 -1.87 135.00 132.65 1k5m n PRO 1608Ca 0.04 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1k5m n PRO 1608Cb 0.57 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1k5m n PRO 1608CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k5m n GLY 1609N 0.61 0.76 3.73 -1.23 0.00 -1.26 -5.03 105.19 102.77 1k5m n GLY 1609Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1k5m n GLY 1609CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1k5m s SER 1610N -2.90 6.41 0.00 1.61 0.15 -0.78 -2.11 113.70 116.09 1k5m s SER 1610Ca 0.00 2.86 0.00 0.00 0.70 0.00 0.00 55.95 59.51 1k5m s SER 1610Cb 0.00 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1k5m s SER 1610CO 0.00 -0.92 0.00 0.61 1.20 0.00 0.00 173.24 174.13 1k5m n GLY 1611N 3.25 0.67 3.89 9.45 0.00 -1.26 -5.02 105.19 116.16 1k5m n GLY 1611Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1k5m n GLY 1611CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1k5m s GLN 1612N -0.10 3.56 -0.48 1.61 -2.07 -0.90 -5.04 119.66 116.23 1k5m s GLN 1612Ca 0.00 0.51 0.01 0.00 -1.82 0.00 0.00 55.36 54.06 1k5m s GLN 1612Cb 0.00 -2.20 0.13 0.00 -1.09 0.00 0.00 33.01 29.85 1k5m s GLN 1612CO 0.00 -0.43 0.25 0.12 -1.32 0.00 0.00 175.29 173.91 1k5m s PHE 1613N -3.00 3.47 -0.48 9.60 5.36 -1.26 -5.06 117.98 126.60 1k5m s PHE 1613Ca 0.52 -2.84 -0.20 0.00 -0.96 0.00 0.00 56.93 53.45 1k5m s PHE 1613Cb -0.11 -3.04 0.04 0.00 -0.34 0.00 0.00 43.02 39.58 1k5m s PHE 1613CO 0.50 -0.87 0.65 -1.17 -1.46 0.00 0.00 175.22 172.87 1k5m s LEU 1614N 0.36 4.73 0.00 6.12 2.96 -1.26 -4.92 118.68 126.67 1k5m s LEU 1614Ca 0.14 -0.66 0.00 0.00 -0.22 0.00 0.00 54.13 53.38 1k5m s LEU 1614Cb -0.22 -2.57 0.00 0.00 0.50 0.00 0.00 46.19 43.90 1k5m s LEU 1614CO -0.04 -0.87 0.83 0.35 -1.32 0.00 0.00 176.35 175.31 1k5m n THR 1615N 5.74 1.39 0.63 3.68 -2.24 -1.26 -0.55 114.28 121.66 1k5m n THR 1615Ca -0.04 0.44 0.07 0.00 -2.27 0.00 0.00 64.05 62.25 1k5m n THR 1615Cb 0.46 -1.44 -0.00 0.00 -2.10 0.00 0.00 70.33 67.25 1k5m n THR 1615CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1k5m n THR 1616N -1.33 0.00 -2.11 4.28 -1.04 -1.26 -5.00 114.28 107.82 1k5m n THR 1616Ca 0.00 -0.35 -0.35 0.00 -2.04 0.00 0.00 64.05 61.30 1k5m n THR 1616Cb 0.09 1.17 0.02 0.00 -1.82 0.00 0.00 70.33 69.79 1k5m n THR 1616CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1k5m s ASP 1617N -1.73 5.42 -0.53 8.00 -1.08 0.29 -5.02 116.67 122.02 1k5m s ASP 1617Ca 0.12 2.27 0.04 0.00 -0.52 0.00 0.00 52.55 54.45 1k5m s ASP 1617Cb 0.11 -2.59 0.15 0.00 -1.46 0.00 0.00 42.92 39.14 1k5m s ASP 1617CO 0.36 -1.43 0.35 -0.62 0.52 0.00 0.00 175.17 174.34 1k5m s ASP 1618N -1.73 3.66 0.42 -0.34 2.15 -1.26 -5.06 116.67 114.50 1k5m s ASP 1618Ca 0.75 -3.16 0.04 0.00 0.43 0.00 0.00 52.55 50.60 1k5m s ASP 1618Cb -0.27 -1.17 -0.05 0.00 -0.30 0.00 0.00 42.92 41.13 1k5m s ASP 1618CO 0.31 -0.18 0.04 -0.13 -0.17 0.00 0.00 175.17 175.04 1k5m s ARG 1619N -0.37 1.94 0.42 4.34 1.81 -1.26 -5.15 118.95 120.68 1k5m s ARG 1619Ca 0.23 -2.16 -0.06 0.00 -1.72 0.00 0.00 55.73 52.03 1k5m s ARG 1619Cb -0.12 -1.22 -0.04 0.00 -0.45 0.00 0.00 34.95 33.11 1k5m s ARG 1619CO -0.09 -0.25 0.71 -0.65 -0.68 0.00 0.00 175.30 174.34 1k5m s GLN 1620N -3.80 3.60 0.02 3.54 -0.21 -1.26 -5.11 119.66 116.44 1k5m s GLN 1620Ca 0.25 0.16 -0.14 0.00 0.02 0.00 0.00 55.36 55.65 1k5m s GLN 1620Cb 0.06 -2.46 0.02 0.00 1.00 0.00 0.00 33.01 31.63 1k5m s GLN 1620CO 0.13 -0.05 0.29 -1.54 -2.12 0.00 0.00 175.29 172.00 1k5m s SER 1621N -3.73 -0.13 0.41 5.90 1.04 -1.26 -5.15 113.70 110.78 1k5m s SER 1621Ca 0.47 -0.11 -0.26 0.00 0.48 0.00 0.00 55.95 56.52 1k5m s SER 1621Cb -0.10 0.33 -0.09 0.00 0.10 0.00 0.00 66.02 66.26 1k5m s SER 1621CO 0.38 -0.55 1.35 -2.16 0.98 0.00 0.00 173.24 173.24 1k5m s PRO 1622N -2.13 3.92 0.05 4.02 0.04 -1.26 -4.98 135.00 134.66 1k5m s PRO 1622Ca -0.08 2.25 -0.28 0.00 0.04 0.00 0.00 61.00 62.94 1k5m s PRO 1622Cb -0.02 -2.76 -0.05 0.00 0.04 0.00 0.00 34.50 31.71 1k5m s PRO 1622CO -0.01 -0.57 0.88 0.45 0.04 0.00 0.00 177.00 177.80 1k5m s SER 1623N -0.63 7.34 0.29 6.66 0.15 -1.26 -4.94 113.70 121.31 1k5m s SER 1623Ca 0.57 1.60 0.25 0.00 0.70 0.00 0.00 55.95 59.08 1k5m s SER 1623Cb -0.40 -2.53 0.74 0.00 -1.71 0.00 0.00 66.02 62.12 1k5m s SER 1623CO 0.52 -0.09 1.74 0.00 1.20 0.00 0.00 173.24 176.61 1k5m h ALA 1624N 5.97 1.00 -2.87 5.45 0.00 -2.07 -3.38 119.26 123.37 1k5m h ALA 1624Ca -0.43 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.87 1k5m h ALA 1624Cb 1.21 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.59 1k5m h ALA 1624CO 0.73 0.00 -0.67 1.28 0.00 0.00 0.00 179.25 180.59 1k5m n LEU 1625N -2.50 2.30 -4.77 0.00 4.77 -1.26 -5.10 117.00 110.43 1k5m n LEU 1625Ca 0.05 -5.04 -0.40 0.00 -0.03 0.00 0.00 56.01 50.59 1k5m n LEU 1625Cb 0.43 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 41.04 1k5m n LEU 1625CO 0.30 1.80 0.93 -2.16 -1.33 0.00 0.00 177.39 176.93 1k5m s PRO 1626N -1.21 4.16 0.00 3.23 0.04 -1.26 -3.04 135.00 136.92 1k5m s PRO 1626Ca 0.28 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.40 1k5m s PRO 1626Cb -0.01 -2.87 0.00 0.00 0.04 0.00 0.00 34.50 31.66 1k5m s PRO 1626CO -0.17 -0.31 0.00 0.09 0.04 0.00 0.00 177.00 176.65 1k5m n ASN 1627N 0.41 -1.57 -4.75 6.66 5.03 -1.26 -4.98 115.26 114.80 1k5m n ASN 1627Ca 0.02 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 55.06 1k5m n ASN 1627Cb 0.44 -1.26 -0.02 0.00 -1.02 0.00 0.00 39.78 37.92 1k5m n ASN 1627CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1k5m s TYR 1628N -2.36 3.08 -0.37 3.10 5.04 -1.17 -5.00 117.35 119.67 1k5m s TYR 1628Ca 0.00 1.17 -0.05 0.00 -2.44 0.00 0.00 57.07 55.75 1k5m s TYR 1628Cb 0.00 -3.73 0.07 0.00 0.35 0.00 0.00 41.96 38.65 1k5m s TYR 1628CO 0.00 -2.27 0.15 -1.21 -1.34 0.00 0.00 175.55 170.88 1k5m s GLU 1629N -0.67 2.42 0.61 4.97 2.02 -1.26 -5.09 118.70 121.69 1k5m s GLU 1629Ca 0.56 -1.44 -0.18 0.00 0.02 0.00 0.00 54.97 53.93 1k5m s GLU 1629Cb -0.40 -3.52 -0.03 0.00 0.10 0.00 0.00 34.13 30.28 1k5m s GLU 1629CO 0.45 -0.84 1.21 -1.25 0.02 0.00 0.00 175.26 174.85 1k5m s PRO 1630N 1.31 2.88 0.31 0.39 0.04 -1.26 -4.95 135.00 133.71 1k5m s PRO 1630Ca 0.01 1.82 -0.29 0.00 0.04 0.00 0.00 61.00 62.59 1k5m s PRO 1630Cb -0.21 -1.92 -0.12 0.00 0.04 0.00 0.00 34.50 32.29 1k5m s PRO 1630CO -0.00 -1.28 1.36 2.41 0.04 0.00 0.00 177.00 179.52 1k5m n THR 1631N -1.72 1.64 -1.90 1.26 -1.04 -1.26 -4.93 114.28 106.32 1k5m n THR 1631Ca 0.14 -0.41 -0.36 0.00 -2.04 0.00 0.00 64.05 61.38 1k5m n THR 1631Cb 0.50 -1.60 0.05 0.00 -1.82 0.00 0.00 70.33 67.45 1k5m n THR 1631CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1k5m s PRO 1632N -1.39 2.81 0.24 -2.82 0.04 -1.26 -4.98 135.00 127.64 1k5m s PRO 1632Ca 0.59 1.83 -0.30 0.00 0.04 0.00 0.00 61.00 63.16 1k5m s PRO 1632Cb -0.58 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 31.96 1k5m s PRO 1632CO 0.58 -1.33 1.00 1.03 0.04 0.00 0.00 177.00 178.32 1k5m s ARG 1633N -3.44 4.76 0.32 4.56 0.52 -1.26 -5.07 118.95 119.34 1k5m s ARG 1633Ca 0.77 1.60 0.10 0.00 -0.52 0.00 0.00 55.73 57.68 1k5m s ARG 1633Cb -0.31 -3.26 -0.06 0.00 0.52 0.00 0.00 34.95 31.85 1k5m s ARG 1633CO 0.36 0.38 -0.06 0.96 0.02 0.00 0.00 175.30 176.95 1k5m s ILE 1634N -1.06 2.56 -0.16 1.52 -4.36 -1.26 -5.09 121.20 113.36 1k5m s ILE 1634Ca 0.43 -2.12 -0.29 0.00 -0.26 0.00 0.00 60.65 58.41 1k5m s ILE 1634Cb -0.28 -2.66 -0.02 0.00 1.25 0.00 0.00 42.46 40.75 1k5m s ILE 1634CO 0.35 -0.26 1.28 -2.28 0.24 0.00 0.00 174.94 174.28 1k5m s HIS 1635N -2.52 2.80 -0.11 1.37 5.65 -1.26 -5.01 115.29 116.21 1k5m s HIS 1635Ca 0.33 0.96 0.03 0.00 0.25 0.00 0.00 55.06 56.63 1k5m s HIS 1635Cb -0.01 -3.53 -0.00 0.00 -1.18 0.00 0.00 32.58 27.86 1k5m s HIS 1635CO 0.18 -1.81 -0.22 0.42 -0.65 0.00 0.00 174.74 172.66 1k5m s ILE 1636N 3.55 2.26 0.80 0.89 1.01 -1.26 -5.13 121.20 123.32 1k5m s ILE 1636Ca 0.56 -0.94 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 1k5m s ILE 1636Cb -0.22 -1.88 0.07 0.00 0.01 0.00 0.00 42.46 40.44 1k5m s ILE 1636CO 0.15 0.55 1.11 -2.84 0.00 0.00 0.00 174.94 173.91 1k5m s PRO 1637N 0.38 2.00 -0.33 2.79 0.02 -1.26 -4.37 135.00 134.23 1k5m s PRO 1637Ca -0.17 1.28 -0.02 0.00 0.02 0.00 0.00 61.00 62.12 1k5m s PRO 1637Cb -0.17 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1k5m s PRO 1637CO 0.08 -1.85 0.29 0.41 -0.33 0.00 0.00 177.00 175.59 1k5m n GLY 1638N -0.81 0.48 3.74 0.52 0.00 -1.26 -5.02 105.19 102.84 1k5m n GLY 1638Ca 0.10 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 1k5m n GLY 1638CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1k5m s LYS 1639N -5.04 4.53 -0.13 1.61 2.20 -1.26 -5.03 119.74 116.62 1k5m s LYS 1639Ca 0.10 1.81 -0.01 0.00 -0.36 0.00 0.00 55.97 57.52 1k5m s LYS 1639Cb -0.05 -3.26 -0.02 0.00 -1.51 0.00 0.00 37.83 33.00 1k5m s LYS 1639CO 0.18 -0.02 -0.11 0.08 -0.36 0.00 0.00 175.35 175.12 1k5m s VAL 1640N -0.11 3.22 -0.14 4.02 1.01 -1.26 -5.01 120.40 122.13 1k5m s VAL 1640Ca 0.51 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 61.98 1k5m s VAL 1640Cb -0.31 -2.36 -0.15 0.00 0.00 0.00 0.00 36.38 33.56 1k5m s VAL 1640CO 0.36 0.52 -0.01 1.41 0.00 0.00 0.00 175.10 177.38 1k5m n HIS 1641N 3.47 0.00 -3.86 5.22 8.25 -1.26 -5.02 115.22 122.02 1k5m n HIS 1641Ca -0.18 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.16 1k5m n HIS 1641Cb 0.53 -0.64 -0.13 0.00 1.12 0.00 0.00 29.99 30.87 1k5m n HIS 1641CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1k5m s ASN 1642N -4.85 -0.05 0.59 0.41 3.84 -1.26 -5.02 114.94 108.60 1k5m s ASN 1642Ca -0.11 0.08 0.37 0.00 0.21 0.00 0.00 52.86 53.41 1k5m s ASN 1642Cb 0.04 0.15 1.76 0.00 -0.55 0.00 0.00 41.25 42.65 1k5m s ASN 1642CO 0.49 -0.07 2.14 -0.07 -2.79 0.00 0.00 177.10 176.80 1k5m h LEU 1643N 5.82 0.00 -1.09 3.21 3.38 -2.01 -1.76 115.31 122.86 1k5m h LEU 1643Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1k5m h LEU 1643Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1k5m h LEU 1643CO 0.46 0.02 0.00 -0.07 0.09 0.00 0.00 178.44 178.94 1k5m h LEU 1644N 0.00 0.00 -0.01 1.67 3.38 -1.98 -2.91 115.31 115.47 1k5m h LEU 1644Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1k5m h LEU 1644Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1k5m h LEU 1644CO 0.00 0.00 -0.07 -0.33 0.09 0.00 0.00 178.44 178.13 1k5m h GLU 1645N 0.00 0.06 0.00 1.13 5.08 -1.74 -3.35 114.58 115.76 1k5m h GLU 1645Ca 0.00 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1k5m h GLU 1645Cb 0.42 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1k5m h GLU 1645CO 0.00 0.75 -0.22 -0.84 -1.00 0.00 0.00 179.01 177.70 1k5m h ILE 1646N -0.60 0.48 0.00 3.13 3.07 -1.63 -2.90 117.51 119.07 1k5m h ILE 1646Ca -0.01 -1.19 0.00 0.00 1.55 0.00 0.00 64.86 65.22 1k5m h ILE 1646Cb 0.76 1.85 0.00 0.00 -0.27 0.00 0.00 36.82 39.16 1k5m h ILE 1646CO 0.01 0.21 0.00 2.30 -1.05 0.00 0.00 178.15 179.63 1k5m n ILE 1647N -3.31 0.06 0.96 0.16 -5.35 -1.11 -2.57 119.36 108.20 1k5m n ILE 1647Ca 0.01 0.02 0.13 0.00 -0.27 0.00 0.00 62.75 62.63 1k5m n ILE 1647Cb 0.47 -0.57 0.40 0.00 -1.74 0.00 0.00 39.64 38.20 1k5m n ILE 1647CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1k5m n GLN 1648N -1.13 0.03 -3.08 6.28 6.02 -1.10 -0.73 117.38 123.68 1k5m n GLN 1648Ca 0.17 0.01 -0.40 0.00 -0.01 0.00 0.00 57.00 56.78 1k5m n GLN 1648Cb 0.15 -1.52 -0.05 0.00 1.02 0.00 0.00 30.24 29.84 1k5m n GLN 1648CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1k5m s VAL 1649N -3.01 5.05 0.30 5.09 1.01 -1.06 -4.61 120.40 123.16 1k5m s VAL 1649Ca 0.12 1.35 -0.21 0.00 0.00 0.00 0.00 61.98 63.25 1k5m s VAL 1649Cb 0.18 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.46 1k5m s VAL 1649CO 0.63 0.22 0.82 1.51 0.00 0.00 0.00 175.10 178.27 1k5m s ASP 1650N 0.87 7.07 0.15 3.32 1.47 -1.26 -4.70 116.67 123.59 1k5m s ASP 1650Ca 0.35 1.55 0.06 0.00 1.18 0.00 0.00 52.55 55.68 1k5m s ASP 1650Cb -0.17 -2.47 -0.04 0.00 -0.34 0.00 0.00 42.92 39.90 1k5m s ASP 1650CO 0.15 -0.09 -0.13 0.42 0.68 0.00 0.00 175.17 176.21 1k5m s THR 1651N -1.72 1.38 0.34 2.11 -4.23 -1.02 -4.89 115.64 107.62 1k5m s THR 1651Ca 0.50 -1.97 -0.28 0.00 -1.18 0.00 0.00 61.69 58.75 1k5m s THR 1651Cb -0.15 -1.78 -0.10 0.00 1.34 0.00 0.00 72.50 71.81 1k5m s THR 1651CO 0.20 -0.58 1.30 -0.76 -0.54 0.00 0.00 174.62 174.24 1k5m s LEU 1652N -2.93 4.40 -0.18 4.79 1.43 -1.26 -1.85 118.68 123.08 1k5m s LEU 1652Ca 0.15 2.67 -0.12 0.00 -1.03 0.00 0.00 54.13 55.80 1k5m s LEU 1652Cb -0.01 -3.68 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 1k5m s LEU 1652CO 0.03 -0.56 0.20 -0.63 0.23 0.00 0.00 176.35 175.62 1k5m s ILE 1653N -1.16 5.37 -1.49 -0.59 1.01 -0.38 -4.80 121.20 119.15 1k5m s ILE 1653Ca 0.50 0.34 -0.11 0.00 0.00 0.00 0.00 60.65 61.38 1k5m s ILE 1653Cb -0.39 -3.54 -0.06 0.00 0.01 0.00 0.00 42.46 38.49 1k5m s ILE 1653CO 0.52 0.42 2.67 -0.81 0.00 0.00 0.00 174.94 177.74 1k5m n PRO 1654N 3.52 3.26 -0.05 2.79 -0.04 -1.25 -4.53 135.00 138.71 1k5m n PRO 1654Ca -0.14 -2.21 0.04 0.00 -0.04 0.00 0.00 63.50 61.14 1k5m n PRO 1654Cb 0.52 -2.89 0.40 0.00 -0.04 0.00 0.00 33.50 31.49 1k5m n PRO 1654CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1k5m h MET 1655N 5.48 0.61 -2.02 0.54 4.05 -1.78 -3.02 114.93 118.79 1k5m h MET 1655Ca 0.75 -0.04 -0.53 0.00 -0.28 0.00 0.00 59.70 59.60 1k5m h MET 1655Cb 0.37 -0.14 -0.18 0.00 -0.80 0.00 0.00 31.60 30.85 1k5m h MET 1655CO 1.79 0.41 0.52 -1.71 0.23 0.00 0.00 176.91 178.14 1k5m n ASN 1656N -4.47 6.62 -3.59 1.39 5.15 0.21 -4.84 115.26 115.73 1k5m n ASN 1656Ca 0.05 -3.27 -0.41 0.00 -0.60 0.00 0.00 54.58 50.35 1k5m n ASN 1656Cb 0.08 -1.22 -0.01 0.00 -0.53 0.00 0.00 39.78 38.10 1k5m n ASN 1656CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1k5m n ASN 1657N 0.76 5.71 -0.03 1.20 6.94 -1.14 -4.31 115.26 124.39 1k5m n ASN 1657Ca 0.50 -2.77 0.03 0.00 -0.02 0.00 0.00 54.58 52.32 1k5m n ASN 1657Cb 0.51 -1.61 0.05 0.00 -2.36 0.00 0.00 39.78 36.37 1k5m n ASN 1657CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1k5m n THR 1658N 4.40 1.28 -3.84 5.53 -2.24 -1.26 -5.05 114.28 113.11 1k5m n THR 1658Ca 0.61 -1.40 -0.23 0.00 -2.27 0.00 0.00 64.05 60.75 1k5m n THR 1658Cb 0.33 0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 1k5m n THR 1658CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1k5m s HIS 1659N -1.60 3.47 -0.02 4.78 3.76 -1.26 -5.00 115.29 119.42 1k5m s HIS 1659Ca 0.10 0.11 0.25 0.00 -0.15 0.00 0.00 55.06 55.38 1k5m s HIS 1659Cb 0.09 -1.68 0.79 0.00 1.11 0.00 0.00 32.58 32.89 1k5m s HIS 1659CO 0.01 0.40 1.77 0.00 -0.85 0.00 0.00 174.74 176.07 1k5m h THR 1660N 1.26 0.37 -4.23 1.30 1.03 -2.00 -3.45 112.91 107.19 1k5m h THR 1660Ca -0.50 -1.12 -0.22 0.00 -0.01 0.00 0.00 66.41 64.56 1k5m h THR 1660Cb 1.22 1.85 -0.15 0.00 -1.07 0.00 0.00 68.15 69.99 1k5m h THR 1660CO 0.64 0.17 -0.65 -1.59 -0.01 0.00 0.00 175.52 174.08 1k5m s LYS 1661N -3.47 0.99 0.07 0.00 -2.85 -1.26 -5.13 119.74 108.09 1k5m s LYS 1661Ca 0.02 -1.48 -0.31 0.00 -1.00 0.00 0.00 55.97 53.21 1k5m s LYS 1661Cb 0.09 0.09 -0.07 0.00 -2.06 0.00 0.00 37.83 35.88 1k5m s LYS 1661CO 0.64 -0.23 1.35 -0.51 0.10 0.00 0.00 175.35 176.70 1k5m s ASP 1662N -3.09 6.89 0.20 0.03 1.01 -1.26 -4.98 116.67 115.47 1k5m s ASP 1662Ca 0.25 2.20 -0.12 0.00 0.71 0.00 0.00 52.55 55.58 1k5m s ASP 1662Cb 0.07 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.43 1k5m s ASP 1662CO 0.03 -0.63 0.41 -1.83 0.21 0.00 0.00 175.17 173.36 1k5m s GLU 1663N 1.42 1.34 0.47 8.23 -1.05 -1.26 -5.02 118.70 122.83 1k5m s GLU 1663Ca 0.63 -1.12 0.13 0.00 -0.15 0.00 0.00 54.97 54.46 1k5m s GLU 1663Cb -0.34 0.44 1.11 0.00 -0.44 0.00 0.00 34.13 34.90 1k5m s GLU 1663CO 0.29 -0.53 2.10 0.28 0.95 0.00 0.00 175.26 178.35 1k5m h VAL 1664N 2.36 1.02 0.00 1.83 2.07 -2.02 -2.02 116.25 119.49 1k5m h VAL 1664Ca -0.29 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1k5m h VAL 1664Cb 1.24 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1k5m h VAL 1664CO 0.41 0.04 0.02 0.78 0.02 0.00 0.00 177.57 178.85 1k5m h ASN 1665N 0.23 0.00 0.46 0.57 2.35 -1.95 -0.52 115.58 116.72 1k5m h ASN 1665Ca 0.08 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1k5m h ASN 1665Cb 0.05 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 1k5m h ASN 1665CO -0.02 0.00 -0.08 0.28 -1.65 0.00 0.00 177.43 175.96 1k5m h SER 1666N 0.00 0.00 0.25 5.81 0.02 -1.55 -2.48 113.55 115.60 1k5m h SER 1666Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1k5m h SER 1666Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1k5m h SER 1666CO 0.00 0.08 -0.61 -1.22 -1.14 0.00 0.00 176.83 173.94 1k5m n TYR 1667N -3.44 0.00 -3.28 3.45 4.01 -0.20 -0.62 117.16 117.08 1k5m n TYR 1667Ca -0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 1k5m n TYR 1667Cb 0.23 -0.12 -0.08 0.00 -0.31 0.00 0.00 39.34 39.06 1k5m n TYR 1667CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1k5m s LEU 1668N -2.86 4.55 -0.37 7.72 1.43 -0.94 -4.46 118.68 123.75 1k5m s LEU 1668Ca 0.13 -0.31 -0.24 0.00 -1.03 0.00 0.00 54.13 52.68 1k5m s LEU 1668Cb 0.17 -2.50 0.01 0.00 0.03 0.00 0.00 46.19 43.91 1k5m s LEU 1668CO 0.71 -0.53 0.81 -0.63 0.23 0.00 0.00 176.35 176.94 1k5m s ILE 1669N 2.30 4.70 0.41 -0.59 1.01 -0.73 -4.66 121.20 123.65 1k5m s ILE 1669Ca 0.16 0.92 -0.26 0.00 0.00 0.00 0.00 60.65 61.47 1k5m s ILE 1669Cb -0.16 -4.24 -0.09 0.00 0.01 0.00 0.00 42.46 37.99 1k5m s ILE 1669CO 0.14 -0.47 1.30 -2.84 0.00 0.00 0.00 174.94 173.07 1k5m s PRO 1670N 3.18 3.95 -0.12 2.79 0.02 -1.26 -1.03 135.00 142.53 1k5m s PRO 1670Ca 0.33 2.15 -0.01 0.00 0.02 0.00 0.00 61.00 63.49 1k5m s PRO 1670Cb -0.13 -2.74 0.03 0.00 0.02 0.00 0.00 34.50 31.68 1k5m s PRO 1670CO 0.17 -0.51 -0.06 -1.17 -0.33 0.00 0.00 177.00 175.10 1k5m s LEU 1671N -2.46 1.17 -0.12 -5.54 2.96 -0.26 -4.88 118.68 109.55 1k5m s LEU 1671Ca 0.57 -0.33 -0.07 0.00 -0.22 0.00 0.00 54.13 54.09 1k5m s LEU 1671Cb -0.38 -0.80 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 1k5m s LEU 1671CO 0.49 -0.14 0.13 0.20 -1.32 0.00 0.00 176.35 175.71 1k5m s ASN 1672N 1.73 6.32 0.44 3.68 0.01 -1.26 -2.81 114.94 123.04 1k5m s ASN 1672Ca 0.04 0.44 -0.22 0.00 -0.71 0.00 0.00 52.86 52.42 1k5m s ASN 1672Cb -0.13 -2.04 -0.09 0.00 0.41 0.00 0.00 41.25 39.40 1k5m s ASN 1672CO -0.08 0.40 1.02 0.00 -1.51 0.00 0.00 177.10 176.93 1k5m s ALA 1673N -0.97 2.99 -1.12 0.60 0.00 -1.26 -4.26 121.76 117.73 1k5m s ALA 1673Ca 0.15 0.60 -0.09 0.00 0.00 0.00 0.00 51.96 52.62 1k5m s ALA 1673Cb -0.12 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1k5m s ALA 1673CO 0.04 -0.19 0.86 0.09 0.00 0.00 0.00 175.76 176.56 1k5m n ASN 1674N -0.53 -5.15 -3.92 0.00 4.13 -0.42 -4.93 115.26 104.44 1k5m n ASN 1674Ca 0.07 -0.81 -0.18 0.00 1.68 0.00 0.00 54.58 55.34 1k5m n ASN 1674Cb 0.52 -4.49 -0.15 0.00 -1.54 0.00 0.00 39.78 34.11 1k5m n ASN 1674CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1k5m s ARG 1675N -5.17 0.59 0.00 3.52 0.52 -1.26 -5.03 118.95 112.12 1k5m s ARG 1675Ca 0.37 -0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.44 1k5m s ARG 1675Cb -0.08 -0.60 0.00 0.00 0.52 0.00 0.00 34.95 34.79 1k5m s ARG 1675CO 0.79 0.02 0.00 1.04 0.02 0.00 0.00 175.30 177.17 1k5m n GLN 1676N 3.49 0.00 0.03 3.54 6.02 -1.26 -4.35 117.38 124.85 1k5m n GLN 1676Ca -0.19 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 56.91 1k5m n GLN 1676Cb 0.54 -0.33 0.09 0.00 1.02 0.00 0.00 30.24 31.56 1k5m n GLN 1676CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1k5m n ASN 1677N -0.81 0.63 -4.18 1.08 6.94 -1.26 -4.27 115.26 113.39 1k5m n ASN 1677Ca 0.00 -0.14 -0.35 0.00 -0.02 0.00 0.00 54.58 54.08 1k5m n ASN 1677Cb 0.00 0.53 0.08 0.00 -2.36 0.00 0.00 39.78 38.04 1k5m n ASN 1677CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1k5m n GLU 1678N -1.93 -0.27 -3.33 -3.83 1.02 -1.26 -4.18 120.64 106.86 1k5m n GLU 1678Ca 0.03 -0.06 -0.38 0.00 -0.02 0.00 0.00 57.16 56.73 1k5m n GLU 1678Cb 0.42 -1.39 -0.06 0.00 -0.02 0.00 0.00 31.44 30.40 1k5m n GLU 1678CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1k5m s GLN 1679N -2.75 4.12 -0.19 3.49 0.74 -1.26 -1.80 119.66 122.01 1k5m s GLN 1679Ca 0.47 0.65 -0.15 0.00 0.05 0.00 0.00 55.36 56.37 1k5m s GLN 1679Cb -0.15 -3.20 -0.21 0.00 1.10 0.00 0.00 33.01 30.55 1k5m s GLN 1679CO 0.74 0.63 0.21 0.28 -0.55 0.00 0.00 175.29 176.60 1k5m n VAL 1680N 1.64 1.62 -3.83 1.34 0.31 0.21 -4.94 118.33 114.67 1k5m n VAL 1680Ca -0.11 -0.28 -0.06 0.00 -0.01 0.00 0.00 64.34 63.88 1k5m n VAL 1680Cb 0.51 -1.91 -0.02 0.00 -0.91 0.00 0.00 33.84 31.51 1k5m n VAL 1680CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 1k5m s PHE 1681N -2.44 -0.18 0.08 3.52 -0.12 -1.22 -4.90 117.98 112.71 1k5m s PHE 1681Ca -0.28 -0.24 -0.25 0.00 -0.05 0.00 0.00 56.93 56.11 1k5m s PHE 1681Cb 0.07 0.69 0.07 0.00 -0.63 0.00 0.00 43.02 43.22 1k5m s PHE 1681CO 0.64 -1.15 0.60 0.20 -0.05 0.00 0.00 175.22 175.47 1k5m s GLY 1682N -2.92 -0.56 -0.23 1.99 0.00 -1.26 -1.84 107.32 102.50 1k5m s GLY 1682Ca 0.11 0.73 -0.28 0.00 0.00 0.00 0.00 44.72 45.28 1k5m s GLY 1682CO 0.06 0.40 1.13 -1.08 0.00 0.00 0.00 173.10 173.61 1k5m s THR 1683N -2.78 0.00 0.72 0.90 -1.32 -0.23 -4.99 115.64 107.94 1k5m s THR 1683Ca -0.03 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.34 1k5m s THR 1683Cb -0.01 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.02 1k5m s THR 1683CO -0.04 0.00 1.09 0.54 -2.21 0.00 0.00 174.62 174.00 1k5m s ASN 1684N -0.71 5.15 -0.67 8.08 2.20 -1.26 -0.74 114.94 126.99 1k5m s ASN 1684Ca 0.03 0.94 0.00 0.00 -0.94 0.00 0.00 52.86 52.89 1k5m s ASN 1684Cb -0.02 -1.66 0.39 0.00 -2.00 0.00 0.00 41.25 37.96 1k5m s ASN 1684CO -0.04 -1.49 1.73 0.18 -2.94 0.00 0.00 177.10 174.54 1k5m n LEU 1685N -3.04 6.64 -4.47 3.54 4.77 0.08 -4.77 117.00 119.74 1k5m n LEU 1685Ca 0.07 -4.84 -0.43 0.00 -0.03 0.00 0.00 56.01 50.78 1k5m n LEU 1685Cb 0.59 -0.84 -0.03 0.00 -2.33 0.00 0.00 43.42 40.80 1k5m n LEU 1685CO 0.56 1.86 1.00 -0.36 -1.33 0.00 0.00 177.39 179.13 1k5m s PHE 1686N -3.87 2.83 -1.30 -1.77 0.08 -1.26 -3.41 117.98 109.28 1k5m s PHE 1686Ca 0.53 -0.96 0.07 0.00 0.12 0.00 0.00 56.93 56.69 1k5m s PHE 1686Cb 0.44 -4.37 0.35 0.00 -0.57 0.00 0.00 43.02 38.86 1k5m s PHE 1686CO -0.26 -1.65 1.13 0.44 -0.10 0.00 0.00 175.22 174.78 1k5m n ILE 1687N 5.91 1.06 0.02 0.64 -5.35 -1.26 -1.63 119.36 118.75 1k5m n ILE 1687Ca 0.15 0.27 0.11 0.00 -0.27 0.00 0.00 62.75 63.01 1k5m n ILE 1687Cb 0.48 -1.15 0.24 0.00 -1.74 0.00 0.00 39.64 37.48 1k5m n ILE 1687CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1k5m n GLY 1688N -0.70 2.04 0.00 3.28 0.00 -1.26 -4.41 105.19 104.14 1k5m n GLY 1688Ca 0.03 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1k5m n GLY 1688CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1k5m n ASP 1689N 1.44 0.00 0.00 1.61 2.03 -0.65 -4.68 116.55 116.30 1k5m n ASP 1689Ca 0.20 -0.96 0.00 0.00 0.52 0.00 0.00 54.79 54.55 1k5m n ASP 1689Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1k5m n ASP 1689CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k5m n GLY 1690N 0.00 3.24 0.04 0.27 0.00 -1.26 -1.95 105.19 105.54 1k5m n GLY 1690Ca 0.00 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 45.90 1k5m n GLY 1690CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1k5m n VAL 1691N 0.00 0.63 0.04 1.61 0.24 -1.26 -3.21 118.33 116.37 1k5m n VAL 1691Ca 0.00 0.10 0.07 0.00 -2.04 0.00 0.00 64.34 62.47 1k5m n VAL 1691Cb 0.00 -0.83 -0.08 0.00 -1.47 0.00 0.00 33.84 31.45 1k5m n VAL 1691CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1k5m n PHE 1692N -1.77 0.60 -0.34 6.34 3.72 -0.82 -3.89 117.46 121.30 1k5m n PHE 1692Ca 0.04 0.18 0.23 0.00 -0.05 0.00 0.00 57.45 57.86 1k5m n PHE 1692Cb 0.27 -0.85 0.46 0.00 -0.94 0.00 0.00 39.48 38.42 1k5m n PHE 1692CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1k5m h LYS 1693N 0.00 0.36 -0.02 -1.08 3.64 -1.44 -1.80 116.57 116.25 1k5m h LYS 1693Ca -0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1k5m h LYS 1693Cb 1.23 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1k5m h LYS 1693CO 0.01 0.24 -0.33 0.25 -2.27 0.00 0.00 179.45 177.35 1k5m n THR 1694N -4.98 0.00 -1.52 1.00 -2.24 -1.26 -3.72 114.28 101.55 1k5m n THR 1694Ca 0.31 -0.26 -0.31 0.00 -2.27 0.00 0.00 64.05 61.52 1k5m n THR 1694Cb 0.95 1.04 0.07 0.00 -2.10 0.00 0.00 70.33 70.28 1k5m n THR 1694CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1k5m s THR 1695N -2.39 3.70 0.21 4.28 -4.23 -0.68 -4.78 115.64 111.74 1k5m s THR 1695Ca 0.22 0.55 -0.10 0.00 -1.18 0.00 0.00 61.69 61.19 1k5m s THR 1695Cb 0.19 -3.26 0.14 0.00 1.34 0.00 0.00 72.50 70.91 1k5m s THR 1695CO 0.51 -0.72 1.77 0.25 -0.54 0.00 0.00 174.62 175.89 1k5m h LEU 1696N -0.87 0.36 0.12 4.79 5.85 -1.91 0.16 115.31 123.81 1k5m h LEU 1696Ca -0.45 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 1k5m h LEU 1696Cb 1.23 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1k5m h LEU 1696CO 0.57 0.22 -0.06 0.25 -0.34 0.00 0.00 178.44 179.08 1k5m h LEU 1697N 0.51 -0.14 -1.27 2.25 5.85 -1.88 -1.45 115.31 119.18 1k5m h LEU 1697Ca 0.30 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 59.02 1k5m h LEU 1697Cb 0.29 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 1k5m h LEU 1697CO -0.24 -0.06 0.51 1.23 -0.34 0.00 0.00 178.44 179.53 1k5m h GLY 1698N -0.20 1.08 0.93 3.75 0.00 -1.51 0.42 103.07 107.55 1k5m h GLY 1698Ca -0.02 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 46.85 1k5m h GLY 1698CO 0.03 0.34 -0.13 -2.09 0.00 0.00 0.00 176.54 174.69 1k5m h GLU 1699N 0.97 0.65 -0.09 4.80 4.57 -0.40 -2.12 114.58 122.97 1k5m h GLU 1699Ca 0.30 -0.27 -0.19 0.00 -1.18 0.00 0.00 59.36 58.02 1k5m h GLU 1699Cb 0.00 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 1k5m h GLU 1699CO -0.08 0.86 -0.73 0.82 -1.18 0.00 0.00 179.01 178.69 1k5m h ILE 1700N 0.42 1.37 0.00 2.32 2.04 -1.01 -3.10 117.51 119.55 1k5m h ILE 1700Ca 0.08 -2.12 -0.03 0.00 1.00 0.00 0.00 64.86 63.79 1k5m h ILE 1700Cb 0.65 2.09 -0.00 0.00 -0.74 0.00 0.00 36.82 38.81 1k5m h ILE 1700CO 0.04 0.64 -0.12 0.58 0.00 0.00 0.00 178.15 179.29 1k5m h VAL 1701N 0.31 1.08 0.00 1.67 2.07 -0.82 -2.03 116.25 118.53 1k5m h VAL 1701Ca -0.03 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1k5m h VAL 1701Cb 1.31 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 1k5m h VAL 1701CO 0.13 0.12 0.00 0.00 0.02 0.00 0.00 177.57 177.84 1k5m n GLN 1702N -4.38 0.20 0.00 1.57 6.02 -0.81 -1.78 117.38 118.20 1k5m n GLN 1702Ca -0.03 0.10 0.13 0.00 -0.01 0.00 0.00 57.00 57.20 1k5m n GLN 1702Cb 0.19 -1.50 0.40 0.00 1.02 0.00 0.00 30.24 30.35 1k5m n GLN 1702CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1k5m n TYR 1703N -1.36 0.00 -4.27 1.08 4.01 -0.76 -4.12 117.16 111.74 1k5m n TYR 1703Ca 0.08 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.63 1k5m n TYR 1703Cb 0.20 -0.06 -0.11 0.00 -0.31 0.00 0.00 39.34 39.05 1k5m n TYR 1703CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1k5m s TYR 1704N -2.29 1.54 -0.08 -0.72 1.51 -0.73 -0.23 117.35 116.34 1k5m s TYR 1704Ca 0.29 -0.51 0.06 0.00 -1.01 0.00 0.00 57.07 55.90 1k5m s TYR 1704Cb 0.20 -0.80 -0.24 0.00 -0.11 0.00 0.00 41.96 41.01 1k5m s TYR 1704CO 0.44 0.19 0.52 2.41 -1.11 0.00 0.00 175.55 178.00 1k5m n THR 1705N 0.57 1.66 -4.40 -0.71 -1.04 0.17 -4.65 114.28 105.88 1k5m n THR 1705Ca -0.16 -0.74 -0.30 0.00 -2.04 0.00 0.00 64.05 60.81 1k5m n THR 1705Cb 0.56 -1.28 -0.12 0.00 -1.82 0.00 0.00 70.33 67.68 1k5m n THR 1705CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1k5m s HIS 1706N -2.58 2.50 0.06 -1.42 3.76 -0.64 -0.83 115.29 116.15 1k5m s HIS 1706Ca -0.12 -0.28 -0.01 0.00 -0.15 0.00 0.00 55.06 54.50 1k5m s HIS 1706Cb 0.07 -1.35 -0.04 0.00 1.11 0.00 0.00 32.58 32.37 1k5m s HIS 1706CO 0.80 0.35 -0.02 1.67 -0.85 0.00 0.00 174.74 176.69 1k5m s TRP 1707N -1.08 0.58 0.02 1.40 1.48 -0.11 -1.43 118.94 119.80 1k5m s TRP 1707Ca 0.17 -1.10 -0.28 0.00 -1.06 0.00 0.00 56.10 53.83 1k5m s TRP 1707Cb -0.10 -0.41 0.09 0.00 -1.16 0.00 0.00 33.47 31.89 1k5m s TRP 1707CO 0.08 -0.40 0.80 0.45 -4.06 0.00 0.00 176.95 173.82 1k5m s SER 1708N -2.94 -0.45 0.00 -2.66 0.15 -0.70 -0.97 113.70 106.13 1k5m s SER 1708Ca 0.10 0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1k5m s SER 1708Cb 0.08 0.45 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 1k5m s SER 1708CO -0.08 -0.69 0.00 0.61 1.20 0.00 0.00 173.24 174.29 1k5m n GLY 1709N -0.05 -0.60 3.88 9.45 0.00 -1.26 -0.22 105.19 116.40 1k5m n GLY 1709Ca -0.12 -2.26 -0.31 0.00 0.00 0.00 0.00 46.02 43.33 1k5m n GLY 1709CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k5m s SER 1710N -0.81 6.14 0.13 1.61 0.01 -1.26 -4.28 113.70 115.23 1k5m s SER 1710Ca 0.00 0.19 0.05 0.00 1.31 0.00 0.00 55.95 57.50 1k5m s SER 1710Cb 0.00 -1.83 -0.04 0.00 0.21 0.00 0.00 66.02 64.36 1k5m s SER 1710CO 0.00 0.17 0.09 -0.76 0.41 0.00 0.00 173.24 173.15 1k5m s LEU 1711N -2.48 3.73 -0.26 2.44 1.43 -0.70 -1.74 118.68 121.09 1k5m s LEU 1711Ca 0.33 -0.12 -0.03 0.00 -1.03 0.00 0.00 54.13 53.28 1k5m s LEU 1711Cb -0.13 -2.37 0.02 0.00 0.03 0.00 0.00 46.19 43.74 1k5m s LEU 1711CO 0.26 0.11 -0.01 -0.60 0.23 0.00 0.00 176.35 176.34 1k5m s ARG 1712N -2.79 2.90 -0.24 1.70 3.52 0.60 -0.40 118.95 124.24 1k5m s ARG 1712Ca 0.30 -0.95 -0.04 0.00 -0.13 0.00 0.00 55.73 54.91 1k5m s ARG 1712Cb -0.11 -3.11 0.00 0.00 -1.56 0.00 0.00 34.95 30.17 1k5m s ARG 1712CO 0.22 -0.42 -0.02 0.12 -0.81 0.00 0.00 175.30 174.40 1k5m s PHE 1713N 1.38 3.02 0.15 5.12 5.36 0.53 -1.59 117.98 131.95 1k5m s PHE 1713Ca 0.01 -1.04 0.08 0.00 -0.96 0.00 0.00 56.93 55.02 1k5m s PHE 1713Cb -0.17 -2.13 -0.04 0.00 -0.34 0.00 0.00 43.02 40.34 1k5m s PHE 1713CO -0.02 -0.58 -0.08 -1.12 -1.46 0.00 0.00 175.22 171.96 1k5m s SER 1714N 1.46 4.40 -0.04 6.13 0.01 -0.73 -0.54 113.70 124.39 1k5m s SER 1714Ca 0.04 -0.47 -0.00 0.00 1.31 0.00 0.00 55.95 56.83 1k5m s SER 1714Cb -0.15 -0.82 0.03 0.00 0.21 0.00 0.00 66.02 65.28 1k5m s SER 1714CO -0.02 0.13 0.01 -0.22 0.41 0.00 0.00 173.24 173.55 1k5m s LEU 1715N -2.61 0.82 -0.14 2.44 2.96 -0.47 -0.55 118.68 121.13 1k5m s LEU 1715Ca 0.24 -0.01 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 1k5m s LEU 1715Cb -0.10 -0.25 -0.00 0.00 0.50 0.00 0.00 46.19 46.34 1k5m s LEU 1715CO 0.15 -0.15 -0.17 -0.32 -1.32 0.00 0.00 176.35 174.54 1k5m s MET 1716N 1.47 3.20 0.11 1.98 -2.45 0.49 -1.39 119.30 122.71 1k5m s MET 1716Ca -0.04 -0.77 -0.26 0.00 -1.25 0.00 0.00 55.69 53.38 1k5m s MET 1716Cb -0.13 -2.56 -0.07 0.00 1.25 0.00 0.00 34.83 33.32 1k5m s MET 1716CO -0.03 0.07 0.80 -0.47 1.05 0.00 0.00 175.02 176.44 1k5m s TYR 1717N 0.67 3.83 -0.03 4.11 5.04 -0.74 -1.11 117.35 129.12 1k5m s TYR 1717Ca -0.08 1.59 0.05 0.00 -2.44 0.00 0.00 57.07 56.19 1k5m s TYR 1717Cb -0.16 -2.83 0.08 0.00 0.35 0.00 0.00 41.96 39.40 1k5m s TYR 1717CO 0.02 0.38 0.99 0.25 -1.34 0.00 0.00 175.55 175.84 1k5m n THR 1718N 2.23 1.08 -1.68 4.34 -2.24 -0.83 -4.95 114.28 112.22 1k5m n THR 1718Ca -0.03 -1.18 -0.30 0.00 -2.27 0.00 0.00 64.05 60.27 1k5m n THR 1718Cb 0.49 0.36 0.22 0.00 -2.10 0.00 0.00 70.33 69.30 1k5m n THR 1718CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1k5m s GLY 1719N -1.39 1.76 0.71 3.38 0.00 -1.26 -4.79 107.32 105.73 1k5m s GLY 1719Ca 0.09 -1.26 -0.16 0.00 0.00 0.00 0.00 44.72 43.38 1k5m s GLY 1719CO 0.01 -0.39 0.96 -1.05 0.00 0.00 0.00 173.10 172.62 1k5m n PRO 1720N -4.17 0.55 0.17 2.90 -0.02 -1.26 -4.90 135.00 128.27 1k5m n PRO 1720Ca 0.16 0.24 0.03 0.00 -2.02 0.00 0.00 63.50 61.91 1k5m n PRO 1720Cb 0.59 -2.21 0.38 0.00 -0.02 0.00 0.00 33.50 32.24 1k5m n PRO 1720CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k5m h ALA 1721N -0.18 1.44 -0.19 3.55 0.00 -2.01 -2.76 119.26 119.11 1k5m h ALA 1721Ca -0.47 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.15 1k5m h ALA 1721Cb 1.34 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1k5m h ALA 1721CO 0.47 0.41 0.00 1.28 0.00 0.00 0.00 179.25 181.41 1k5m n LEU 1722N -4.17 1.11 -4.97 0.00 4.77 -1.26 -4.84 117.00 107.64 1k5m n LEU 1722Ca -0.02 -0.56 -0.19 0.00 -0.03 0.00 0.00 56.01 55.22 1k5m n LEU 1722Cb 0.35 -0.16 -0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1k5m n LEU 1722CO 0.38 0.26 0.07 -0.94 -1.33 0.00 0.00 177.39 175.84 1k5m s SER 1723N -0.94 5.72 0.08 -1.43 1.04 -1.04 -4.03 113.70 113.09 1k5m s SER 1723Ca 0.13 -0.35 -0.07 0.00 0.48 0.00 0.00 55.95 56.14 1k5m s SER 1723Cb 0.07 -0.95 -0.01 0.00 0.10 0.00 0.00 66.02 65.23 1k5m s SER 1723CO 0.08 -0.56 0.14 -0.94 0.98 0.00 0.00 173.24 172.95 1k5m s SER 1724N -4.21 0.19 -0.17 7.02 1.04 -0.86 -4.96 113.70 111.75 1k5m s SER 1724Ca 0.48 -0.71 -0.32 0.00 0.48 0.00 0.00 55.95 55.88 1k5m s SER 1724Cb -0.09 0.31 0.14 0.00 0.10 0.00 0.00 66.02 66.48 1k5m s SER 1724CO 0.31 -0.69 1.14 0.00 0.98 0.00 0.00 173.24 174.97 1k5m s ALA 1725N -3.81 -2.01 -0.07 5.32 0.00 -1.26 -1.05 121.76 118.87 1k5m s ALA 1725Ca 0.05 1.55 -0.00 0.00 0.00 0.00 0.00 51.96 53.56 1k5m s ALA 1725Cb 0.05 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.80 1k5m s ALA 1725CO -0.11 -0.49 -0.04 0.15 0.00 0.00 0.00 175.76 175.28 1k5m s LYS 1726N -2.01 0.93 0.23 0.00 1.02 -1.25 -1.43 119.74 117.23 1k5m s LYS 1726Ca 0.06 -0.06 0.11 0.00 0.02 0.00 0.00 55.97 56.10 1k5m s LYS 1726Cb -0.01 -1.10 -0.05 0.00 -0.52 0.00 0.00 37.83 36.16 1k5m s LYS 1726CO -0.04 -0.21 -0.22 -0.51 -0.92 0.00 0.00 175.35 173.44 1k5m s LEU 1727N 1.55 2.50 -0.23 3.17 1.43 -0.28 -0.92 118.68 125.90 1k5m s LEU 1727Ca -0.01 -0.94 0.02 0.00 -1.03 0.00 0.00 54.13 52.17 1k5m s LEU 1727Cb -0.13 -1.09 0.05 0.00 0.03 0.00 0.00 46.19 45.04 1k5m s LEU 1727CO -0.04 0.06 -0.12 -0.51 0.23 0.00 0.00 176.35 175.97 1k5m s ILE 1728N -2.10 2.00 -0.09 -0.59 2.07 -0.13 0.37 121.20 122.73 1k5m s ILE 1728Ca 0.24 -1.35 -0.19 0.00 -1.41 0.00 0.00 60.65 57.94 1k5m s ILE 1728Cb -0.06 -2.05 -0.04 0.00 0.13 0.00 0.00 42.46 40.43 1k5m s ILE 1728CO 0.12 0.12 0.53 -0.76 -1.91 0.00 0.00 174.94 173.03 1k5m s LEU 1729N 1.22 4.30 -0.02 8.50 1.02 -0.18 -1.13 118.68 132.39 1k5m s LEU 1729Ca -0.04 0.92 0.04 0.00 0.02 0.00 0.00 54.13 55.07 1k5m s LEU 1729Cb -0.18 -2.78 -0.01 0.00 0.02 0.00 0.00 46.19 43.24 1k5m s LEU 1729CO -0.07 -0.00 -0.16 0.00 0.02 0.00 0.00 176.35 176.14 1k5m s ALA 1730N 0.52 1.36 -0.21 4.21 0.00 0.40 -1.01 121.76 127.03 1k5m s ALA 1730Ca 0.29 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 1k5m s ALA 1730Cb -0.16 -0.40 -0.00 0.00 0.00 0.00 0.00 23.12 22.56 1k5m s ALA 1730CO 0.12 0.29 -0.07 -0.47 0.00 0.00 0.00 175.76 175.64 1k5m s TYR 1731N -0.17 2.93 -0.34 0.00 5.04 0.23 -1.54 117.35 123.51 1k5m s TYR 1731Ca 0.02 -1.01 -0.07 0.00 -2.44 0.00 0.00 57.07 53.57 1k5m s TYR 1731Cb -0.08 -2.07 0.04 0.00 0.35 0.00 0.00 41.96 40.19 1k5m s TYR 1731CO 0.00 -0.56 0.11 0.99 -1.34 0.00 0.00 175.55 174.75 1k5m s THR 1732N 1.40 3.85 0.84 4.34 2.01 0.51 -2.43 115.64 126.17 1k5m s THR 1732Ca 0.05 -1.07 -0.12 0.00 0.31 0.00 0.00 61.69 60.85 1k5m s THR 1732Cb -0.14 -3.16 0.10 0.00 0.01 0.00 0.00 72.50 69.31 1k5m s THR 1732CO -0.04 -0.16 1.17 -2.65 -0.69 0.00 0.00 174.62 172.25 1k5m n PRO 1733N 4.83 -0.01 -1.52 4.92 -0.02 -1.26 -0.44 135.00 141.49 1k5m n PRO 1733Ca -0.13 0.08 -0.34 0.00 -2.02 0.00 0.00 63.50 61.09 1k5m n PRO 1733Cb 0.45 -2.41 0.08 0.00 -0.02 0.00 0.00 33.50 31.60 1k5m n PRO 1733CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1k5m s PRO 1734N -4.25 2.30 0.00 0.52 0.04 -1.25 -4.20 135.00 128.16 1k5m s PRO 1734Ca 0.71 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.45 1k5m s PRO 1734Cb -0.27 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1k5m s PRO 1734CO 0.53 -1.70 0.00 0.41 0.04 0.00 0.00 177.00 176.29 1k5m n GLY 1735N 0.23 3.66 3.63 0.56 0.00 -1.26 -5.05 105.19 106.96 1k5m n GLY 1735Ca 0.13 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 1k5m n GLY 1735CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k5m s ALA 1736N 0.00 3.12 1.28 4.61 0.00 -1.26 -5.12 121.76 124.39 1k5m s ALA 1736Ca 0.00 -0.91 -0.15 0.00 0.00 0.00 0.00 51.96 50.90 1k5m s ALA 1736Cb 0.00 -1.29 0.23 0.00 0.00 0.00 0.00 23.12 22.06 1k5m s ALA 1736CO 0.00 0.60 0.58 2.89 0.00 0.00 0.00 175.76 179.83 1k5m n ARG 1737N 1.91 -3.52 -1.98 0.00 -4.01 -1.26 -4.93 116.66 102.87 1k5m n ARG 1737Ca -0.17 -0.96 -0.40 0.00 -1.04 0.00 0.00 57.85 55.29 1k5m n ARG 1737Cb 0.53 -1.16 -0.00 0.00 -3.04 0.00 0.00 32.46 28.79 1k5m n ARG 1737CO 0.00 0.00 0.00 0.20 -3.04 0.00 0.00 177.63 174.79 1k5m s GLY 1738N -2.91 2.93 0.29 2.89 0.00 -1.26 -4.94 107.32 104.32 1k5m s GLY 1738Ca 0.43 1.33 -0.30 0.00 0.00 0.00 0.00 44.72 46.17 1k5m s GLY 1738CO 0.35 1.93 1.57 -1.05 0.00 0.00 0.00 173.10 175.90 1k5m n PRO 1739N 0.16 2.63 0.03 2.90 -0.02 -1.26 -4.92 135.00 134.52 1k5m n PRO 1739Ca 0.03 0.94 0.11 0.00 -2.02 0.00 0.00 63.50 62.56 1k5m n PRO 1739Cb 0.42 -2.70 -0.08 0.00 -0.02 0.00 0.00 33.50 31.12 1k5m n PRO 1739CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1k5m n GLN 1740N 2.04 0.49 -3.99 -0.52 1.13 -1.26 -4.95 117.38 110.32 1k5m n GLN 1740Ca 0.08 -0.06 -0.10 0.00 -1.94 0.00 0.00 57.00 54.99 1k5m n GLN 1740Cb 0.36 -1.61 -0.07 0.00 0.11 0.00 0.00 30.24 29.03 1k5m n GLN 1740CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 1k5m s ASP 1741N -4.42 0.07 0.38 1.08 1.47 -1.26 -5.03 116.67 108.95 1k5m s ASP 1741Ca -0.02 -0.93 0.07 0.00 1.18 0.00 0.00 52.55 52.85 1k5m s ASP 1741Cb 0.13 0.42 0.79 0.00 -0.34 0.00 0.00 42.92 43.93 1k5m s ASP 1741CO 0.85 -0.88 1.98 -0.09 0.68 0.00 0.00 175.17 177.71 1k5m h ARG 1742N 2.57 0.67 -0.85 2.11 2.43 -1.94 -2.12 114.38 117.25 1k5m h ARG 1742Ca -0.32 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.78 1k5m h ARG 1742Cb 1.23 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.59 1k5m h ARG 1742CO 0.49 0.44 0.43 -0.09 -1.51 0.00 0.00 179.97 179.73 1k5m h ARG 1743N 0.69 1.21 -0.35 0.20 2.43 -1.96 0.14 114.38 116.73 1k5m h ARG 1743Ca 0.27 -0.17 -0.09 0.00 -0.81 0.00 0.00 59.98 59.19 1k5m h ARG 1743Cb 0.21 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1k5m h ARG 1743CO -0.08 0.91 -0.12 1.49 -1.51 0.00 0.00 179.97 180.67 1k5m h GLU 1744N 1.20 0.70 -0.35 0.20 4.81 -1.82 -3.24 114.58 116.08 1k5m h GLU 1744Ca 0.29 -0.28 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1k5m h GLU 1744Cb 0.09 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1k5m h GLU 1744CO -0.04 0.88 -0.06 0.00 -0.73 0.00 0.00 179.01 179.06 1k5m h ALA 1745N 0.81 0.48 -0.10 2.92 0.00 -0.99 -2.88 119.26 119.50 1k5m h ALA 1745Ca 0.09 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.74 1k5m h ALA 1745Cb 0.64 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1k5m h ALA 1745CO 0.04 0.30 0.26 1.98 0.00 0.00 0.00 179.25 181.83 1k5m h MET 1746N 0.45 0.00 0.00 0.00 1.85 -0.76 -1.54 114.93 114.93 1k5m h MET 1746Ca 0.09 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.18 1k5m h MET 1746Cb 0.55 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.58 1k5m h MET 1746CO 0.03 0.00 0.00 -0.07 -0.40 0.00 0.00 176.91 176.47 1k5m h LEU 1747N 0.00 0.00 0.00 3.39 3.38 -1.53 -3.45 115.31 117.09 1k5m h LEU 1747Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1k5m h LEU 1747Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1k5m h LEU 1747CO -0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1k5m n GLY 1748N 0.54 2.97 3.69 0.83 0.00 -0.58 -5.05 105.19 107.60 1k5m n GLY 1748Ca 0.03 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 1k5m n GLY 1748CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k5m s THR 1749N 1.49 3.19 0.19 2.61 2.01 -1.02 -4.87 115.64 119.24 1k5m s THR 1749Ca 0.00 0.66 -0.15 0.00 0.31 0.00 0.00 61.69 62.50 1k5m s THR 1749Cb 0.00 -3.42 0.02 0.00 0.01 0.00 0.00 72.50 69.11 1k5m s THR 1749CO 0.00 0.00 0.46 -1.38 -0.69 0.00 0.00 174.62 173.01 1k5m s HIS 1750N 2.42 0.01 -0.04 4.92 -0.00 -1.26 0.78 115.29 122.13 1k5m s HIS 1750Ca 0.71 -0.36 0.01 0.00 -0.00 0.00 0.00 55.06 55.41 1k5m s HIS 1750Cb -0.38 0.27 0.02 0.00 -0.00 0.00 0.00 32.58 32.50 1k5m s HIS 1750CO 0.31 -0.86 -0.02 0.08 -0.00 0.00 0.00 174.74 174.24 1k5m s VAL 1751N -3.90 0.37 -0.32 -5.38 1.01 -0.18 -4.99 120.40 107.02 1k5m s VAL 1751Ca 0.11 -0.02 -0.17 0.00 0.00 0.00 0.00 61.98 61.90 1k5m s VAL 1751Cb 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 1k5m s VAL 1751CO -0.02 0.19 0.45 -0.69 0.00 0.00 0.00 175.10 175.03 1k5m s VAL 1752N 1.01 5.09 -0.24 2.92 1.01 -1.26 -1.01 120.40 127.91 1k5m s VAL 1752Ca -0.10 0.37 -0.09 0.00 0.00 0.00 0.00 61.98 62.16 1k5m s VAL 1752Cb -0.14 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1k5m s VAL 1752CO -0.01 -0.08 0.12 0.86 0.00 0.00 0.00 175.10 176.00 1k5m s TRP 1753N 2.23 3.20 -0.35 5.22 -0.00 0.16 -4.96 118.94 124.43 1k5m s TRP 1753Ca 0.16 -0.05 -0.13 0.00 -0.00 0.00 0.00 56.10 56.09 1k5m s TRP 1753Cb -0.16 -2.26 -0.01 0.00 -0.00 0.00 0.00 33.47 31.04 1k5m s TRP 1753CO 0.12 -0.13 0.23 0.34 -0.00 0.00 0.00 176.95 177.51 1k5m s ASP 1754N 1.33 5.98 0.01 5.86 2.15 -1.26 -1.13 116.67 129.61 1k5m s ASP 1754Ca 0.06 -0.53 -0.30 0.00 0.43 0.00 0.00 52.55 52.21 1k5m s ASP 1754Cb -0.15 -2.12 -0.06 0.00 -0.30 0.00 0.00 42.92 40.30 1k5m s ASP 1754CO 0.06 -0.26 1.44 -0.63 -0.17 0.00 0.00 175.17 175.60 1k5m s ILE 1755N 1.69 3.60 0.00 4.11 1.09 -0.51 -4.95 121.20 126.23 1k5m s ILE 1755Ca 0.06 0.99 0.00 0.00 -1.10 0.00 0.00 60.65 60.60 1k5m s ILE 1755Cb -0.18 -3.64 0.00 0.00 -1.06 0.00 0.00 42.46 37.59 1k5m s ILE 1755CO 0.10 -0.00 0.00 0.61 -0.10 0.00 0.00 174.94 175.54 1k5m n GLY 1756N 3.70 3.79 0.36 6.18 0.00 -1.26 -4.52 105.19 113.44 1k5m n GLY 1756Ca 0.14 -0.58 0.10 0.00 0.00 0.00 0.00 46.02 45.67 1k5m n GLY 1756CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1k5m h LEU 1757N 0.00 0.83 -8.76 0.99 3.38 -1.97 -3.33 115.31 106.45 1k5m h LEU 1757Ca 0.00 0.06 -0.61 0.00 0.09 0.00 0.00 57.88 57.41 1k5m h LEU 1757Cb 0.00 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 40.53 1k5m h LEU 1757CO 0.00 0.40 0.38 -1.10 0.09 0.00 0.00 178.44 178.21 1k5m s GLN 1758N -5.86 3.67 0.28 1.13 -0.21 -1.26 -4.95 119.66 112.46 1k5m s GLN 1758Ca -0.11 0.21 0.26 0.00 0.02 0.00 0.00 55.36 55.74 1k5m s GLN 1758Cb 0.23 -3.84 0.80 0.00 1.00 0.00 0.00 33.01 31.20 1k5m s GLN 1758CO 0.80 -0.92 1.75 0.66 -2.12 0.00 0.00 175.29 175.46 1k5m h SER 1759N 8.62 0.00 -4.19 5.90 4.64 -1.93 -3.46 113.55 123.13 1k5m h SER 1759Ca -0.25 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.38 1k5m h SER 1759Cb 1.09 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.89 1k5m h SER 1759CO 0.93 0.00 -0.85 -0.89 -0.87 0.00 0.00 176.83 175.14 1k5m s THR 1760N -3.20 2.35 -0.08 2.95 2.01 -1.26 -1.79 115.64 116.62 1k5m s THR 1760Ca 0.08 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.12 1k5m s THR 1760Cb 0.10 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.72 1k5m s THR 1760CO 0.56 0.58 -0.12 -0.51 -0.69 0.00 0.00 174.62 174.44 1k5m s ILE 1761N -0.42 3.25 -0.53 1.82 1.10 -0.49 -4.97 121.20 120.97 1k5m s ILE 1761Ca 0.04 -0.64 0.01 0.00 -0.51 0.00 0.00 60.65 59.55 1k5m s ILE 1761Cb -0.12 -2.31 0.14 0.00 0.15 0.00 0.00 42.46 40.31 1k5m s ILE 1761CO 0.01 0.57 0.30 -0.69 -2.11 0.00 0.00 174.94 173.02 1k5m s VAL 1762N -0.44 3.05 0.31 4.00 1.01 -1.26 -1.36 120.40 125.70 1k5m s VAL 1762Ca 0.06 -2.94 -0.21 0.00 0.00 0.00 0.00 61.98 58.89 1k5m s VAL 1762Cb -0.12 -3.07 -0.09 0.00 0.00 0.00 0.00 36.38 33.10 1k5m s VAL 1762CO 0.02 -0.79 0.83 -0.32 0.00 0.00 0.00 175.10 174.84 1k5m s MET 1763N 0.08 4.29 -0.04 2.72 1.75 0.30 -4.92 119.30 123.47 1k5m s MET 1763Ca 0.15 1.01 0.02 0.00 -1.25 0.00 0.00 55.69 55.62 1k5m s MET 1763Cb -0.23 -2.62 -0.03 0.00 2.84 0.00 0.00 34.83 34.80 1k5m s MET 1763CO -0.03 0.23 -0.09 -0.08 -0.65 0.00 0.00 175.02 174.40 1k5m s THR 1764N -1.78 3.49 -0.80 10.11 -1.32 -1.26 -0.35 115.64 123.73 1k5m s THR 1764Ca 0.51 -0.64 -0.09 0.00 -1.21 0.00 0.00 61.69 60.26 1k5m s THR 1764Cb -0.14 -2.43 0.21 0.00 -1.51 0.00 0.00 72.50 68.62 1k5m s THR 1764CO 0.19 0.54 0.70 -0.63 -2.21 0.00 0.00 174.62 173.21 1k5m s ILE 1765N -0.84 4.98 0.36 5.08 1.01 0.46 -4.93 121.20 127.32 1k5m s ILE 1765Ca 0.13 -2.82 -0.28 0.00 0.00 0.00 0.00 60.65 57.68 1k5m s ILE 1765Cb -0.11 -4.10 -0.11 0.00 0.01 0.00 0.00 42.46 38.14 1k5m s ILE 1765CO 0.03 -1.00 1.45 -2.65 0.00 0.00 0.00 174.94 172.77 1k5m n PRO 1766N 3.58 2.54 -1.58 2.79 -0.02 -1.26 -1.72 135.00 139.33 1k5m n PRO 1766Ca 0.14 0.89 -0.39 0.00 -2.02 0.00 0.00 63.50 62.11 1k5m n PRO 1766Cb 0.43 -2.59 -0.03 0.00 -0.02 0.00 0.00 33.50 31.29 1k5m n PRO 1766CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1k5m s TRP 1767N -0.97 1.11 -0.45 6.00 -0.11 -1.26 -4.88 118.94 118.38 1k5m s TRP 1767Ca 0.55 1.09 0.04 0.00 1.22 0.00 0.00 56.10 59.00 1k5m s TRP 1767Cb -0.50 -3.74 0.12 0.00 -1.50 0.00 0.00 33.47 27.84 1k5m s TRP 1767CO 0.62 -3.27 0.18 0.99 -4.62 0.00 0.00 176.95 170.84 1k5m s THR 1768N 10.40 2.45 0.02 5.86 2.01 -1.26 -5.03 115.64 130.10 1k5m s THR 1768Ca 0.99 -2.93 -0.23 0.00 0.31 0.00 0.00 61.69 59.83 1k5m s THR 1768Cb -0.25 -2.75 0.05 0.00 0.01 0.00 0.00 72.50 69.57 1k5m s THR 1768CO 0.30 -0.72 0.53 -0.55 -0.69 0.00 0.00 174.62 173.49 1k5m s SER 1769N 0.18 -0.46 -0.11 3.53 0.15 -1.26 -4.90 113.70 110.83 1k5m s SER 1769Ca 0.15 0.27 -0.04 0.00 0.70 0.00 0.00 55.95 57.03 1k5m s SER 1769Cb -0.23 0.48 -0.01 0.00 -1.71 0.00 0.00 66.02 64.55 1k5m s SER 1769CO -0.03 -0.67 -0.07 1.23 1.20 0.00 0.00 173.24 174.89 1k5m h GLY 1770N 2.92 0.00 -4.13 9.45 0.00 -1.98 -3.45 103.07 105.88 1k5m h GLY 1770Ca -0.30 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.51 1k5m h GLY 1770CO 0.41 0.00 0.71 0.54 0.00 0.00 0.00 176.54 178.20 1k5m s VAL 1771N -1.80 2.73 -1.40 4.60 0.11 -1.26 -4.91 120.40 118.48 1k5m s VAL 1771Ca -0.06 0.65 0.17 0.00 -2.93 0.00 0.00 61.98 59.81 1k5m s VAL 1771Cb 0.01 -3.41 0.29 0.00 -1.53 0.00 0.00 36.38 31.74 1k5m s VAL 1771CO 0.09 0.12 1.52 0.00 -3.33 0.00 0.00 175.10 173.49 1k5m n GLN 1772N 1.87 0.23 -3.92 1.54 0.00 -1.26 -4.75 117.38 111.10 1k5m n GLN 1772Ca 0.04 0.13 -0.10 0.00 0.00 0.00 0.00 57.00 57.07 1k5m n GLN 1772Cb 0.41 -1.50 -0.10 0.00 0.00 0.00 0.00 30.24 29.05 1k5m n GLN 1772CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 1k5m s PHE 1773N -2.60 0.14 0.26 2.61 0.08 -1.26 -4.80 117.98 112.42 1k5m s PHE 1773Ca 0.16 -0.34 0.10 0.00 0.12 0.00 0.00 56.93 56.97 1k5m s PHE 1773Cb 0.12 -0.11 -0.05 0.00 -0.57 0.00 0.00 43.02 42.40 1k5m s PHE 1773CO 0.27 -0.28 -0.16 1.03 -0.10 0.00 0.00 175.22 175.97 1k5m s ARG 1774N -1.75 1.56 0.24 0.44 0.52 -0.14 -4.95 118.95 114.87 1k5m s ARG 1774Ca -0.12 -1.72 -0.28 0.00 -0.52 0.00 0.00 55.73 53.09 1k5m s ARG 1774Cb -0.06 -1.50 -0.09 0.00 0.52 0.00 0.00 34.95 33.82 1k5m s ARG 1774CO -0.01 0.24 0.89 0.71 0.02 0.00 0.00 175.30 177.16 1k5m s TYR 1775N -2.71 3.90 0.03 -0.53 2.02 -1.26 -0.94 117.35 117.86 1k5m s TYR 1775Ca 0.28 1.81 0.17 0.00 -0.37 0.00 0.00 57.07 58.96 1k5m s TYR 1775Cb -0.02 -2.91 0.41 0.00 -0.40 0.00 0.00 41.96 39.04 1k5m s TYR 1775CO 0.12 0.42 1.60 1.15 -1.57 0.00 0.00 175.55 177.28 1k5m h THR 1776N 3.07 0.88 -2.34 -0.71 2.02 -1.25 -3.45 112.91 111.13 1k5m h THR 1776Ca -0.46 -1.86 -0.56 0.00 0.77 0.00 0.00 66.41 64.30 1k5m h THR 1776Cb 1.20 2.16 0.04 0.00 -1.74 0.00 0.00 68.15 69.81 1k5m h THR 1776CO 0.67 0.43 1.06 -0.67 0.37 0.00 0.00 175.52 177.38 1k5m n ASP 1777N -3.38 3.75 0.23 4.18 2.03 -1.26 -4.08 116.55 118.02 1k5m n ASP 1777Ca 0.01 1.00 0.13 0.00 0.52 0.00 0.00 54.79 56.44 1k5m n ASP 1777Cb 0.61 -1.48 0.37 0.00 -0.72 0.00 0.00 41.12 39.90 1k5m n ASP 1777CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1k5m h PRO 1778N 8.36 0.00 -1.30 -0.67 0.13 -1.88 -3.23 132.00 133.41 1k5m h PRO 1778Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1k5m h PRO 1778Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1k5m h PRO 1778CO 0.94 0.09 0.00 -0.25 -0.23 0.00 0.00 178.00 178.54 1k5m n ASP 1779N -3.15 3.32 -4.94 1.44 9.92 -1.26 -4.82 116.55 117.05 1k5m n ASP 1779Ca 0.02 -1.96 -0.20 0.00 -0.53 0.00 0.00 54.79 52.12 1k5m n ASP 1779Cb 0.46 -0.61 -0.02 0.00 -0.64 0.00 0.00 41.12 40.31 1k5m n ASP 1779CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1k5m s THR 1780N 0.09 4.10 0.14 -3.53 2.01 -1.22 -5.05 115.64 112.18 1k5m s THR 1780Ca 0.00 -1.12 -0.12 0.00 0.31 0.00 0.00 61.69 60.76 1k5m s THR 1780Cb 0.00 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 69.11 1k5m s THR 1780CO 0.00 -0.19 1.57 1.88 -0.69 0.00 0.00 174.62 177.19 1k5m h TYR 1781N 1.06 0.96 -3.98 4.92 0.05 -1.92 -3.46 116.97 114.59 1k5m h TYR 1781Ca -0.46 -0.19 -0.21 0.00 0.05 0.00 0.00 58.73 57.92 1k5m h TYR 1781Cb 1.25 -0.24 -0.20 0.00 1.01 0.00 0.00 36.73 38.55 1k5m h TYR 1781CO 0.46 0.93 -0.71 0.99 -1.05 0.00 0.00 178.16 178.78 1k5m s THR 1782N -4.90 0.34 0.00 -2.88 2.01 -1.26 -5.16 115.64 103.78 1k5m s THR 1782Ca -0.12 -1.11 0.00 0.00 0.31 0.00 0.00 61.69 60.76 1k5m s THR 1782Cb 0.11 -0.59 0.00 0.00 0.01 0.00 0.00 72.50 72.03 1k5m s THR 1782CO 0.83 -0.51 0.00 -1.54 -0.69 0.00 0.00 174.62 172.71 1k5m n SER 1783N 1.33 1.09 0.25 3.53 3.41 -1.26 -4.98 113.62 116.99 1k5m n SER 1783Ca -0.22 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.55 1k5m n SER 1783Cb 0.56 0.00 0.65 0.00 -0.26 0.00 0.00 64.21 65.16 1k5m n SER 1783CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k5m h ALA 1784N 0.71 1.00 0.00 7.33 0.00 -1.95 -3.43 119.26 122.92 1k5m h ALA 1784Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1k5m h ALA 1784Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1k5m h ALA 1784CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1k5m n GLY 1785N 0.04 0.29 3.20 0.00 0.00 -1.26 -3.86 105.19 103.60 1k5m n GLY 1785Ca 0.01 -1.49 -0.16 0.00 0.00 0.00 0.00 46.02 44.38 1k5m n GLY 1785CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k5m s PHE 1786N -1.97 1.18 -0.03 1.61 0.40 0.42 -0.74 117.98 118.85 1k5m s PHE 1786Ca 0.00 -0.61 0.03 0.00 -0.60 0.00 0.00 56.93 55.75 1k5m s PHE 1786Cb 0.00 -0.63 -0.00 0.00 0.51 0.00 0.00 43.02 42.90 1k5m s PHE 1786CO 0.00 0.05 -0.12 -1.17 0.70 0.00 0.00 175.22 174.69 1k5m s LEU 1787N -2.43 1.85 0.08 -0.37 2.96 0.08 -0.36 118.68 120.49 1k5m s LEU 1787Ca 0.06 -0.24 -0.15 0.00 -0.22 0.00 0.00 54.13 53.59 1k5m s LEU 1787Cb -0.04 -0.69 0.02 0.00 0.50 0.00 0.00 46.19 45.99 1k5m s LEU 1787CO 0.01 0.10 0.34 -0.94 -1.32 0.00 0.00 176.35 174.54 1k5m s SER 1788N 0.09 -0.15 -0.02 3.68 1.04 -0.59 -1.07 113.70 116.67 1k5m s SER 1788Ca -0.02 -0.26 0.03 0.00 0.48 0.00 0.00 55.95 56.17 1k5m s SER 1788Cb -0.09 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1k5m s SER 1788CO 0.01 -0.72 -0.09 0.00 0.98 0.00 0.00 173.24 173.42 1k5m s TRP 1790N 0.16 1.17 -0.33 0.00 0.52 -0.28 0.64 118.94 120.82 1k5m s TRP 1790Ca -0.03 -0.64 -0.29 0.00 0.02 0.00 0.00 56.10 55.16 1k5m s TRP 1790Cb -0.08 -0.63 0.00 0.00 -1.15 0.00 0.00 33.47 31.61 1k5m s TRP 1790CO 0.00 0.05 1.37 0.71 0.02 0.00 0.00 176.95 179.10 1k5m s TYR 1791N -2.47 2.53 0.07 -1.98 2.02 -0.74 -0.96 117.35 115.82 1k5m s TYR 1791Ca 0.08 0.77 -0.13 0.00 -0.37 0.00 0.00 57.07 57.42 1k5m s TYR 1791Cb -0.03 -4.04 -0.25 0.00 -0.40 0.00 0.00 41.96 37.24 1k5m s TYR 1791CO 0.01 -1.93 1.16 0.37 -1.57 0.00 0.00 175.55 173.58 1k5m h GLN 1792N 9.90 0.63 0.00 -0.62 5.75 -1.24 -3.39 115.11 126.14 1k5m h GLN 1792Ca -0.27 -0.76 0.00 0.00 -0.15 0.00 0.00 58.65 57.46 1k5m h GLN 1792Cb 1.11 0.24 0.00 0.00 1.07 0.00 0.00 27.48 29.89 1k5m h GLN 1792CO 1.05 1.33 0.00 2.41 -2.65 0.00 0.00 178.83 180.97 1k5m n THR 1793N -3.80 0.00 0.00 2.39 -1.04 -0.99 -5.00 114.28 105.84 1k5m n THR 1793Ca -0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1k5m n THR 1793Cb 0.94 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 69.28 1k5m n THR 1793CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1k5m n SER 1794N -0.38 0.00 -4.66 8.00 3.41 -1.26 -4.40 113.62 114.34 1k5m n SER 1794Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 1k5m n SER 1794Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1k5m n SER 1794CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1k5m s LEU 1795N 0.00 4.13 -0.28 1.04 2.96 -1.26 -3.97 118.68 121.30 1k5m s LEU 1795Ca 0.00 1.00 -0.03 0.00 -0.22 0.00 0.00 54.13 54.87 1k5m s LEU 1795Cb 0.00 -3.09 0.03 0.00 0.50 0.00 0.00 46.19 43.64 1k5m s LEU 1795CO 0.00 -0.39 0.00 -0.63 -1.32 0.00 0.00 176.35 174.01 1k5m s ILE 1796N 2.28 3.21 0.14 6.68 -1.09 -0.22 -1.30 121.20 130.91 1k5m s ILE 1796Ca 0.33 -1.09 -0.18 0.00 -2.23 0.00 0.00 60.65 57.49 1k5m s ILE 1796Cb -0.16 -2.72 -0.07 0.00 -1.58 0.00 0.00 42.46 37.92 1k5m s ILE 1796CO 0.10 0.04 0.61 -0.76 -1.23 0.00 0.00 174.94 173.70 1k5m s LEU 1797N 1.34 4.42 0.87 2.97 1.43 -1.26 -2.03 118.68 126.42 1k5m s LEU 1797Ca -0.01 1.25 -0.12 0.00 -1.03 0.00 0.00 54.13 54.22 1k5m s LEU 1797Cb -0.18 -3.22 0.11 0.00 0.03 0.00 0.00 46.19 42.93 1k5m s LEU 1797CO -0.01 0.15 1.10 -2.16 0.23 0.00 0.00 176.35 175.66 1k5m s PRO 1798N -1.64 1.47 0.73 1.29 0.04 -1.26 -4.97 135.00 130.66 1k5m s PRO 1798Ca 0.36 0.64 -0.15 0.00 0.04 0.00 0.00 61.00 61.89 1k5m s PRO 1798Cb -0.17 -1.85 0.04 0.00 0.04 0.00 0.00 34.50 32.56 1k5m s PRO 1798CO 0.20 -2.05 1.24 -2.14 0.04 0.00 0.00 177.00 174.29 1k5m s PRO 1799N -5.07 2.09 -0.19 0.56 0.02 -1.26 -2.80 135.00 128.35 1k5m s PRO 1799Ca 0.63 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.53 1k5m s PRO 1799Cb -0.16 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1k5m s PRO 1799CO 0.55 -1.90 0.00 0.39 -0.33 0.00 0.00 177.00 175.71 1k5m n GLU 1800N -2.64 -0.77 -4.74 5.54 -0.58 -1.26 -5.00 120.64 111.19 1k5m n GLU 1800Ca 0.14 0.33 -0.24 0.00 -0.42 0.00 0.00 57.16 56.97 1k5m n GLU 1800Cb 0.49 -4.00 -0.15 0.00 -0.57 0.00 0.00 31.44 27.22 1k5m n GLU 1800CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1k5m s THR 1801N -1.75 1.37 0.16 2.62 2.01 -1.12 -5.15 115.64 113.79 1k5m s THR 1801Ca 0.00 -0.83 -0.13 0.00 0.31 0.00 0.00 61.69 61.04 1k5m s THR 1801Cb 0.00 -1.16 0.01 0.00 0.01 0.00 0.00 72.50 71.36 1k5m s THR 1801CO 0.00 0.32 0.38 0.28 -0.69 0.00 0.00 174.62 174.91 1k5m s THR 1802N -0.51 0.06 0.00 -0.82 -1.32 -1.26 -4.80 115.64 106.99 1k5m s THR 1802Ca 0.06 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 59.53 1k5m s THR 1802Cb -0.07 -1.59 0.00 0.00 -1.51 0.00 0.00 72.50 69.33 1k5m s THR 1802CO -0.00 -0.27 0.00 0.61 -2.21 0.00 0.00 174.62 172.75 1k5m n GLY 1803N -0.25 -1.79 3.88 6.08 0.00 -1.26 -4.96 105.19 106.88 1k5m n GLY 1803Ca -0.10 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 43.78 1k5m n GLY 1803CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k5m s GLN 1804N 0.00 3.74 0.39 1.61 -0.21 -1.26 -4.70 119.66 119.22 1k5m s GLN 1804Ca 0.00 0.13 0.08 0.00 0.02 0.00 0.00 55.36 55.59 1k5m s GLN 1804Cb 0.00 -2.87 -0.05 0.00 1.00 0.00 0.00 33.01 31.10 1k5m s GLN 1804CO 0.00 0.47 0.18 0.14 -2.12 0.00 0.00 175.29 173.96 1k5m s VAL 1805N -1.58 2.56 0.11 1.09 -7.23 -1.12 -4.96 120.40 109.27 1k5m s VAL 1805Ca 0.39 -1.67 0.06 0.00 -1.81 0.00 0.00 61.98 58.94 1k5m s VAL 1805Cb -0.13 -2.98 -0.04 0.00 0.56 0.00 0.00 36.38 33.80 1k5m s VAL 1805CO 0.21 -0.06 -0.14 -0.31 -0.31 0.00 0.00 175.10 174.49 1k5m s TYR 1806N -2.53 1.34 0.05 2.82 2.02 -1.26 -1.10 117.35 118.70 1k5m s TYR 1806Ca 0.41 -0.55 0.06 0.00 -0.37 0.00 0.00 57.07 56.61 1k5m s TYR 1806Cb 0.01 -0.71 -0.04 0.00 -0.40 0.00 0.00 41.96 40.82 1k5m s TYR 1806CO 0.23 0.12 -0.11 -0.51 -1.57 0.00 0.00 175.55 173.71 1k5m s LEU 1807N -2.36 2.97 -0.12 -1.29 1.43 -0.20 -1.97 118.68 117.15 1k5m s LEU 1807Ca 0.07 -0.32 -0.00 0.00 -1.03 0.00 0.00 54.13 52.85 1k5m s LEU 1807Cb -0.05 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 1k5m s LEU 1807CO 0.03 0.23 -0.10 -0.76 0.23 0.00 0.00 176.35 175.98 1k5m s LEU 1808N -1.73 2.90 -0.03 1.79 1.02 -0.27 -1.76 118.68 120.60 1k5m s LEU 1808Ca 0.18 -0.22 0.02 0.00 0.02 0.00 0.00 54.13 54.12 1k5m s LEU 1808Cb -0.11 -1.65 -0.03 0.00 0.02 0.00 0.00 46.19 44.41 1k5m s LEU 1808CO 0.09 0.22 -0.05 -0.94 0.02 0.00 0.00 176.35 175.69 1k5m s SER 1809N 0.06 4.78 0.18 2.29 1.04 -1.26 -0.38 113.70 120.42 1k5m s SER 1809Ca -0.03 -0.05 0.08 0.00 0.48 0.00 0.00 55.95 56.42 1k5m s SER 1809Cb -0.14 -1.19 -0.04 0.00 0.10 0.00 0.00 66.02 64.74 1k5m s SER 1809CO 0.04 0.32 -0.16 -0.36 0.98 0.00 0.00 173.24 174.05 1k5m s PHE 1810N -0.95 1.75 -0.01 5.02 0.40 0.29 -1.25 117.98 123.23 1k5m s PHE 1810Ca 0.16 -0.52 -0.01 0.00 -0.60 0.00 0.00 56.93 55.96 1k5m s PHE 1810Cb -0.11 -0.84 0.00 0.00 0.51 0.00 0.00 43.02 42.58 1k5m s PHE 1810CO 0.06 0.34 0.03 -1.50 0.70 0.00 0.00 175.22 174.85 1k5m s ILE 1811N -2.51 -0.00 0.29 0.64 1.10 -0.77 -1.77 121.20 118.18 1k5m s ILE 1811Ca 0.19 0.01 -0.19 0.00 -0.51 0.00 0.00 60.65 60.15 1k5m s ILE 1811Cb -0.03 -0.05 0.02 0.00 0.15 0.00 0.00 42.46 42.55 1k5m s ILE 1811CO 0.07 0.01 0.70 -0.94 -2.11 0.00 0.00 174.94 172.66 1k5m s SER 1812N 0.08 -0.20 0.01 4.50 1.04 -0.62 -2.43 113.70 116.08 1k5m s SER 1812Ca -0.01 -0.71 -0.01 0.00 0.48 0.00 0.00 55.95 55.70 1k5m s SER 1812Cb -0.01 0.73 -0.04 0.00 0.10 0.00 0.00 66.02 66.80 1k5m s SER 1812CO -0.00 -1.36 0.16 0.00 0.98 0.00 0.00 173.24 173.01 1k5m s ALA 1813N -3.75 3.86 0.77 5.32 0.00 0.10 -0.29 121.76 127.76 1k5m s ALA 1813Ca 0.13 -0.82 -0.11 0.00 0.00 0.00 0.00 51.96 51.16 1k5m s ALA 1813Cb -0.05 -1.77 0.06 0.00 0.00 0.00 0.00 23.12 21.36 1k5m s ALA 1813CO 0.08 0.75 1.14 0.00 0.00 0.00 0.00 175.76 177.73 1k5m n PRO 1815N -3.19 0.15 0.00 0.00 -0.02 -1.26 -2.01 135.00 128.67 1k5m n PRO 1815Ca 0.08 0.61 0.14 0.00 -2.02 0.00 0.00 63.50 62.31 1k5m n PRO 1815Cb 0.60 -1.96 0.61 0.00 -0.02 0.00 0.00 33.50 32.73 1k5m n PRO 1815CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1k5m n ASP 1816N -2.28 0.93 -4.77 2.55 5.75 -1.26 -4.95 116.55 112.51 1k5m n ASP 1816Ca -0.01 -1.14 -0.40 0.00 -0.01 0.00 0.00 54.79 53.23 1k5m n ASP 1816Cb 0.07 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.16 1k5m n ASP 1816CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1k5m s PHE 1817N -2.16 2.54 0.04 2.11 5.36 -0.85 -4.42 117.98 120.60 1k5m s PHE 1817Ca 0.37 1.21 0.04 0.00 -0.96 0.00 0.00 56.93 57.59 1k5m s PHE 1817Cb 0.21 -3.97 -0.02 0.00 -0.34 0.00 0.00 43.02 38.89 1k5m s PHE 1817CO 0.39 -2.95 -0.12 0.15 -1.46 0.00 0.00 175.22 171.23 1k5m s LYS 1818N -2.24 0.79 -0.03 10.12 1.02 0.70 -4.95 119.74 125.14 1k5m s LYS 1818Ca 0.56 -0.74 -0.01 0.00 0.02 0.00 0.00 55.97 55.80 1k5m s LYS 1818Cb -0.45 -0.75 0.03 0.00 -0.52 0.00 0.00 37.83 36.14 1k5m s LYS 1818CO 0.60 0.18 0.05 -0.51 -0.92 0.00 0.00 175.35 174.75 1k5m s LEU 1819N -1.24 0.87 0.16 3.17 1.02 -1.26 -1.71 118.68 119.69 1k5m s LEU 1819Ca -0.01 0.09 0.04 0.00 0.02 0.00 0.00 54.13 54.27 1k5m s LEU 1819Cb -0.08 -0.00 -0.05 0.00 0.02 0.00 0.00 46.19 46.08 1k5m s LEU 1819CO 0.01 -0.15 -0.07 -0.13 0.02 0.00 0.00 176.35 176.03 1k5m s ARG 1820N 1.26 1.10 -0.28 1.70 0.52 -0.51 -4.99 118.95 117.75 1k5m s ARG 1820Ca -0.07 -1.49 -0.04 0.00 -0.52 0.00 0.00 55.73 53.61 1k5m s ARG 1820Cb -0.13 -0.55 0.01 0.00 0.52 0.00 0.00 34.95 34.80 1k5m s ARG 1820CO -0.04 0.01 0.12 -0.11 0.02 0.00 0.00 175.30 175.31 1k5m n LEU 1821N -0.23 -7.01 -4.77 2.53 0.00 -1.26 -0.97 117.00 105.29 1k5m n LEU 1821Ca -0.09 1.05 -0.41 0.00 0.00 0.00 0.00 56.01 56.56 1k5m n LEU 1821Cb 0.61 -2.98 -0.01 0.00 0.00 0.00 0.00 43.42 41.05 1k5m n LEU 1821CO 0.33 -2.65 1.14 -0.32 0.00 0.00 0.00 177.39 175.90 1k5m s MET 1822N -1.71 4.14 0.15 1.96 1.75 -1.26 -0.66 119.30 123.67 1k5m s MET 1822Ca 0.06 2.53 -0.09 0.00 -1.25 0.00 0.00 55.69 56.93 1k5m s MET 1822Cb -0.01 -2.99 -0.01 0.00 2.84 0.00 0.00 34.83 34.66 1k5m s MET 1822CO 0.65 -0.52 0.28 -1.59 -0.65 0.00 0.00 175.02 173.19 1k5m s LYS 1823N -1.69 1.12 0.37 4.11 -2.85 0.68 -4.86 119.74 116.61 1k5m s LYS 1823Ca 0.55 -1.12 -0.25 0.00 -1.00 0.00 0.00 55.97 54.14 1k5m s LYS 1823Cb -0.46 0.38 -0.09 0.00 -2.06 0.00 0.00 37.83 35.60 1k5m s LYS 1823CO 0.59 -0.41 1.02 -0.51 0.10 0.00 0.00 175.35 176.14 1k5m s ASP 1824N -2.95 6.97 0.24 0.03 1.01 -1.26 -4.48 116.67 116.23 1k5m s ASP 1824Ca 0.15 2.00 -0.10 0.00 0.71 0.00 0.00 52.55 55.31 1k5m s ASP 1824Cb 0.03 -2.59 -0.07 0.00 1.01 0.00 0.00 42.92 41.30 1k5m s ASP 1824CO -0.02 -0.34 0.57 0.28 0.21 0.00 0.00 175.17 175.87 1k5m s THR 1825N -1.61 4.91 -0.38 -1.27 -1.32 -1.26 -4.87 115.64 109.84 1k5m s THR 1825Ca 0.55 0.50 0.06 0.00 -1.21 0.00 0.00 61.69 61.58 1k5m s THR 1825Cb -0.22 -3.62 0.63 0.00 -1.51 0.00 0.00 72.50 67.78 1k5m s THR 1825CO 0.27 -0.10 1.77 0.00 -2.21 0.00 0.00 174.62 174.36 1k5m n GLN 1826N -0.21 2.69 -0.01 7.08 10.64 -1.26 -4.24 117.38 132.07 1k5m n GLN 1826Ca 0.01 -2.71 0.09 0.00 -1.83 0.00 0.00 57.00 52.56 1k5m n GLN 1826Cb 0.53 -2.08 0.08 0.00 -0.86 0.00 0.00 30.24 27.91 1k5m n GLN 1826CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1k5m n THR 1827N -0.60 0.03 -3.85 -0.39 -2.24 -1.26 -4.94 114.28 101.04 1k5m n THR 1827Ca 0.46 -0.52 -0.12 0.00 -2.27 0.00 0.00 64.05 61.61 1k5m n THR 1827Cb 1.44 1.37 -0.13 0.00 -2.10 0.00 0.00 70.33 70.91 1k5m n THR 1827CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1k5m s ILE 1828N -1.56 0.01 0.27 2.28 1.10 -1.26 -5.16 121.20 116.88 1k5m s ILE 1828Ca 0.23 -0.10 -0.21 0.00 -0.51 0.00 0.00 60.65 60.05 1k5m s ILE 1828Cb 0.16 -0.18 0.02 0.00 0.15 0.00 0.00 42.46 42.61 1k5m s ILE 1828CO 0.24 -0.06 0.73 -0.94 -2.11 0.00 0.00 174.94 172.80 1k5m s SER 1829N -0.14 -0.25 0.05 4.50 1.04 -1.26 -4.99 113.70 112.65 1k5m s SER 1829Ca -0.02 -0.60 -0.24 0.00 0.48 0.00 0.00 55.95 55.57 1k5m s SER 1829Cb -0.02 0.72 0.06 0.00 0.10 0.00 0.00 66.02 66.88 1k5m s SER 1829CO 0.00 -1.33 0.57 0.00 0.98 0.00 0.00 173.24 173.46 1k5m s GLN 1830N -3.88 1.09 -0.07 4.02 -2.07 -1.26 -5.06 119.66 112.43 1k5m s GLN 1830Ca 0.11 -0.19 0.15 0.00 -1.82 0.00 0.00 55.36 53.60 1k5m s GLN 1830Cb -0.06 0.50 -0.22 0.00 -1.09 0.00 0.00 33.01 32.15 1k5m s GLN 1830CO 0.07 -0.41 0.22 0.25 -1.32 0.00 0.00 175.29 174.10 1k5m n THR 1831N 0.33 0.43 -3.97 3.63 -2.24 -1.26 -5.00 114.28 106.19 1k5m n THR 1831Ca -0.18 -0.47 -0.09 0.00 -2.27 0.00 0.00 64.05 61.04 1k5m n THR 1831Cb 0.61 -0.18 -0.10 0.00 -2.10 0.00 0.00 70.33 68.55 1k5m n THR 1831CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1k5m s VAL 1832N -2.77 0.12 0.40 2.28 -7.23 -1.26 -5.14 120.40 106.80 1k5m s VAL 1832Ca -0.06 -1.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.83 1k5m s VAL 1832Cb 0.08 -0.53 -0.09 0.00 0.56 0.00 0.00 36.38 36.39 1k5m s VAL 1832CO 0.63 -0.55 1.37 0.00 -0.31 0.00 0.00 175.10 176.23 1k5m s ALA 1833N -1.91 3.36 0.38 1.32 0.00 -1.26 -4.99 121.76 118.66 1k5m s ALA 1833Ca -0.11 1.36 -0.24 0.00 0.00 0.00 0.00 51.96 52.96 1k5m s ALA 1833Cb -0.06 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.43 1k5m s ALA 1833CO -0.02 -0.92 0.97 -0.51 0.00 0.00 0.00 175.76 175.28 1k5m s LEU 1834N -2.31 4.16 0.41 0.00 1.43 -1.26 -5.08 118.68 116.04 1k5m s LEU 1834Ca 0.55 1.84 0.07 0.00 -1.03 0.00 0.00 54.13 55.56 1k5m s LEU 1834Cb -0.41 -4.22 -0.08 0.00 0.03 0.00 0.00 46.19 41.51 1k5m s LEU 1834CO 0.54 -0.26 0.01 0.42 0.23 0.00 0.00 176.35 177.29 1k5m s THR 1835N -1.80 1.95 -2.00 5.49 -4.23 -1.26 -5.29 115.64 108.49 1k5m s THR 1835Ca 0.56 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.16 1k5m s THR 1835Cb -0.16 -2.95 0.26 0.00 1.34 0.00 0.00 72.50 70.99 1k5m s THR 1835CO 0.21 0.00 1.00 -0.62 -0.54 0.00 0.00 174.62 174.67