#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n5o s MET 1650N 0.00 2.43 -0.12 -0.14 1.00 -1.26 -4.86 119.30 116.35 1n5o s MET 1650Ca 0.00 -0.83 0.02 0.00 0.00 0.00 0.00 55.69 54.88 1n5o s MET 1650Cb 0.00 -2.44 0.01 0.00 0.00 0.00 0.00 34.83 32.40 1n5o s MET 1650CO 0.00 -0.33 -0.19 0.45 0.00 0.00 0.00 175.02 174.96 1n5o s SER 1651N 1.35 2.78 -0.05 3.03 0.15 -1.26 -1.30 113.70 118.40 1n5o s SER 1651Ca 0.01 -0.52 0.02 0.00 0.70 0.00 0.00 55.95 56.17 1n5o s SER 1651Cb -0.15 -1.27 -0.03 0.00 -1.71 0.00 0.00 66.02 62.86 1n5o s SER 1651CO -0.10 0.05 -0.08 -0.04 1.20 0.00 0.00 173.24 174.27 1n5o s MET 1652N 0.88 2.67 0.42 5.44 1.00 0.80 -0.89 119.30 129.62 1n5o s MET 1652Ca -0.07 -0.60 0.07 0.00 0.00 0.00 0.00 55.69 55.08 1n5o s MET 1652Cb -0.15 -2.54 -0.06 0.00 0.00 0.00 0.00 34.83 32.08 1n5o s MET 1652CO -0.01 0.65 0.09 0.54 0.00 0.00 0.00 175.02 176.29 1n5o s VAL 1653N -0.83 2.07 -0.00 -6.03 0.11 0.50 -1.40 120.40 114.82 1n5o s VAL 1653Ca 0.13 -1.86 -0.02 0.00 -2.93 0.00 0.00 61.98 57.31 1n5o s VAL 1653Cb -0.11 -2.93 -0.00 0.00 -1.53 0.00 0.00 36.38 31.81 1n5o s VAL 1653CO 0.02 0.00 0.04 -0.69 -3.33 0.00 0.00 175.10 171.14 1n5o s VAL 1654N -2.67 0.05 -0.03 2.04 1.01 -1.26 -2.08 120.40 117.45 1n5o s VAL 1654Ca 0.36 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 1n5o s VAL 1654Cb 0.07 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 36.27 1n5o s VAL 1654CO 0.19 -0.22 0.08 -0.55 0.00 0.00 0.00 175.10 174.60 1n5o s SER 1655N -0.68 -0.06 -0.92 3.32 0.15 -0.26 -4.88 113.70 110.37 1n5o s SER 1655Ca -0.08 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.73 1n5o s SER 1655Cb -0.05 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 1n5o s SER 1655CO -0.00 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 174.99 1n5o n GLY 1656N 3.36 1.02 3.96 9.45 0.00 -1.26 -2.31 105.19 119.40 1n5o n GLY 1656Ca -0.16 -0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1n5o n GLY 1656CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n5o s LEU 1657N -1.97 4.23 0.60 0.99 1.43 -1.26 -4.67 118.68 118.03 1n5o s LEU 1657Ca 0.00 0.19 -0.03 0.00 -1.03 0.00 0.00 54.13 53.26 1n5o s LEU 1657Cb 0.00 -3.00 0.03 0.00 0.03 0.00 0.00 46.19 43.26 1n5o s LEU 1657CO 0.00 -0.12 0.87 0.42 0.23 0.00 0.00 176.35 177.75 1n5o s THR 1658N -2.06 2.87 0.22 5.49 -4.23 -1.26 -4.84 115.64 111.83 1n5o s THR 1658Ca 0.36 -0.38 -0.07 0.00 -1.18 0.00 0.00 61.69 60.41 1n5o s THR 1658Cb -0.09 -3.14 0.17 0.00 1.34 0.00 0.00 72.50 70.78 1n5o s THR 1658CO 0.31 -0.13 1.81 -0.65 -0.54 0.00 0.00 174.62 175.42 1n5o h PRO 1659N -0.17 0.70 0.00 3.99 0.11 -2.00 0.34 132.00 134.97 1n5o h PRO 1659Ca -0.44 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 1n5o h PRO 1659Cb 1.29 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1n5o h PRO 1659CO 0.57 0.46 -0.25 1.05 -0.21 0.00 0.00 178.00 179.63 1n5o h GLU 1660N 0.72 0.00 0.07 1.05 9.09 -1.99 -1.04 114.58 122.48 1n5o h GLU 1660Ca 0.34 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.50 1n5o h GLU 1660Cb 0.25 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.34 1n5o h GLU 1660CO -0.21 0.25 -1.16 0.93 0.05 0.00 0.00 179.01 178.86 1n5o h GLU 1661N 0.00 0.15 -0.39 1.06 5.08 -1.67 -3.15 114.58 115.66 1n5o h GLU 1661Ca -0.00 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.04 1n5o h GLU 1661Cb 0.65 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1n5o h GLU 1661CO 0.03 1.11 0.00 0.35 -1.00 0.00 0.00 179.01 179.51 1n5o h PHE 1662N 0.04 0.64 -0.34 4.33 3.57 0.59 -2.75 116.94 123.02 1n5o h PHE 1662Ca -0.09 -0.07 -0.08 0.00 3.53 0.00 0.00 57.97 61.25 1n5o h PHE 1662Cb 1.89 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 40.43 1n5o h PHE 1662CO 0.04 0.62 -0.15 0.52 -2.23 0.00 0.00 178.31 177.11 1n5o h MET 1663N 0.59 0.59 -0.27 1.11 2.86 -1.25 0.66 114.93 119.23 1n5o h MET 1663Ca 0.12 -0.19 -0.14 0.00 -2.06 0.00 0.00 59.70 57.43 1n5o h MET 1663Cb 0.37 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 1n5o h MET 1663CO 0.01 0.72 -0.42 -0.07 1.06 0.00 0.00 176.91 178.21 1n5o h LEU 1664N 0.54 0.70 -0.54 1.22 3.38 -1.46 -0.03 115.31 119.12 1n5o h LEU 1664Ca 0.09 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.69 1n5o h LEU 1664Cb 0.56 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1n5o h LEU 1664CO 0.04 1.03 0.16 0.58 0.09 0.00 0.00 178.44 180.33 1n5o h VAL 1665N 0.53 1.24 -0.41 1.22 2.07 -1.17 -1.26 116.25 118.48 1n5o h VAL 1665Ca 0.04 -0.82 0.04 0.00 0.82 0.00 0.00 66.70 66.78 1n5o h VAL 1665Cb 0.95 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 1n5o h VAL 1665CO 0.09 0.30 0.19 0.22 0.02 0.00 0.00 177.57 178.39 1n5o h TYR 1666N 0.75 0.35 0.05 1.57 3.20 -0.55 0.32 116.97 122.67 1n5o h TYR 1666Ca 0.17 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.08 1n5o h TYR 1666Cb 0.30 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 1n5o h TYR 1666CO 0.02 0.18 -0.17 -0.22 -1.64 0.00 0.00 178.16 176.33 1n5o h LYS 1667N 0.39 -0.29 -0.86 1.82 3.64 -0.70 -1.37 116.57 119.20 1n5o h LYS 1667Ca 0.18 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.69 1n5o h LYS 1667Cb 0.10 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.92 1n5o h LYS 1667CO -0.13 -0.19 0.56 0.35 -2.27 0.00 0.00 179.45 177.76 1n5o h PHE 1668N -0.30 0.84 -0.26 1.91 3.57 -0.79 -1.87 116.94 120.03 1n5o h PHE 1668Ca 0.04 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.44 1n5o h PHE 1668Cb 0.35 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1n5o h PHE 1668CO -0.20 0.36 -0.37 0.00 -2.23 0.00 0.00 178.31 175.86 1n5o h ALA 1669N 1.59 0.87 -0.10 2.41 0.00 0.44 -2.91 119.26 121.56 1n5o h ALA 1669Ca 0.41 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1n5o h ALA 1669Cb 0.55 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1n5o h ALA 1669CO -0.18 0.64 -0.36 0.07 0.00 0.00 0.00 179.25 179.42 1n5o h ARG 1670N 0.49 0.42 -0.25 0.00 -0.00 -0.52 -0.83 114.38 113.69 1n5o h ARG 1670Ca 0.05 -0.32 0.04 0.00 -0.00 0.00 0.00 59.98 59.75 1n5o h ARG 1670Cb 0.87 0.06 -0.01 0.00 -0.00 0.00 0.00 29.97 30.89 1n5o h ARG 1670CO 0.07 0.95 0.17 1.57 -0.00 0.00 0.00 179.97 182.74 1n5o h LYS 1671N -0.02 0.16 -0.14 0.08 2.10 -1.39 -3.15 116.57 114.20 1n5o h LYS 1671Ca -0.02 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1n5o h LYS 1671Cb 1.00 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.29 1n5o h LYS 1671CO 0.08 0.10 0.00 0.72 -2.00 0.00 0.00 179.45 178.35 1n5o n HIS 1672N -4.49 0.23 -3.68 0.07 -0.00 -1.10 -5.01 115.22 101.24 1n5o n HIS 1672Ca 0.02 -0.58 -0.21 0.00 -0.00 0.00 0.00 57.72 56.95 1n5o n HIS 1672Cb 0.21 -0.07 0.04 0.00 -0.00 0.00 0.00 29.99 30.17 1n5o n HIS 1672CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1n5o n HIS 1673N -0.26 -1.93 -3.90 4.41 8.25 -0.66 -4.98 115.22 116.16 1n5o n HIS 1673Ca 0.07 0.84 -0.36 0.00 -0.26 0.00 0.00 57.72 58.02 1n5o n HIS 1673Cb 0.40 -4.43 -0.12 0.00 1.12 0.00 0.00 29.99 26.96 1n5o n HIS 1673CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1n5o s ILE 1674N -3.65 4.34 0.22 1.59 1.01 -0.41 -4.81 121.20 119.50 1n5o s ILE 1674Ca 0.01 -0.17 -0.30 0.00 0.00 0.00 0.00 60.65 60.18 1n5o s ILE 1674Cb -0.00 -3.00 -0.10 0.00 0.01 0.00 0.00 42.46 39.37 1n5o s ILE 1674CO 0.81 0.39 1.48 -0.89 0.00 0.00 0.00 174.94 176.72 1n5o s THR 1675N 1.19 2.64 -0.07 2.92 2.01 -0.42 -4.68 115.64 119.23 1n5o s THR 1675Ca 0.04 0.51 0.05 0.00 0.31 0.00 0.00 61.69 62.60 1n5o s THR 1675Cb -0.14 -3.33 -0.01 0.00 0.01 0.00 0.00 72.50 69.03 1n5o s THR 1675CO 0.03 0.07 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.58 1n5o s LEU 1676N 0.09 2.19 0.29 4.42 2.96 -1.26 -0.14 118.68 127.22 1n5o s LEU 1676Ca 0.63 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 54.07 1n5o s LEU 1676Cb -0.42 -1.42 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1n5o s LEU 1676CO 0.40 0.23 0.29 0.28 -1.32 0.00 0.00 176.35 176.22 1n5o s THR 1677N -0.05 0.00 -0.19 3.68 -1.32 -0.49 -4.94 115.64 112.33 1n5o s THR 1677Ca -0.06 -1.88 -0.15 0.00 -1.21 0.00 0.00 61.69 58.39 1n5o s THR 1677Cb -0.15 -2.51 -0.21 0.00 -1.51 0.00 0.00 72.50 68.13 1n5o s THR 1677CO 0.05 0.00 0.20 0.59 -2.21 0.00 0.00 174.62 173.25 1n5o n ASN 1678N -1.06 1.96 -4.89 8.08 3.02 -1.26 -4.44 115.26 116.67 1n5o n ASN 1678Ca 0.04 0.32 -0.32 0.00 -0.03 0.00 0.00 54.58 54.59 1n5o n ASN 1678Cb 0.63 -0.90 -0.05 0.00 -0.61 0.00 0.00 39.78 38.85 1n5o n ASN 1678CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1n5o s LEU 1679N -7.52 4.26 -0.11 3.41 1.43 -1.26 -4.79 118.68 114.10 1n5o s LEU 1679Ca -0.28 0.69 -0.19 0.00 -1.03 0.00 0.00 54.13 53.33 1n5o s LEU 1679Cb 0.07 -3.34 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 1n5o s LEU 1679CO 0.64 0.04 0.51 -0.51 0.23 0.00 0.00 176.35 177.27 1n5o s ILE 1680N -1.65 5.16 0.29 -0.59 2.07 -1.26 -4.93 121.20 120.29 1n5o s ILE 1680Ca 0.41 1.03 0.03 0.00 -1.41 0.00 0.00 60.65 60.71 1n5o s ILE 1680Cb -0.12 -3.85 -0.06 0.00 0.13 0.00 0.00 42.46 38.56 1n5o s ILE 1680CO 0.23 0.32 0.07 0.42 -1.91 0.00 0.00 174.94 174.07 1n5o s THR 1681N 0.59 0.96 0.47 4.00 -4.23 -1.26 -5.01 115.64 111.16 1n5o s THR 1681Ca 0.28 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.06 1n5o s THR 1681Cb -0.16 -2.70 0.47 0.00 1.34 0.00 0.00 72.50 71.46 1n5o s THR 1681CO 0.12 -0.03 1.79 -0.33 -0.54 0.00 0.00 174.62 175.62 1n5o h GLU 1682N 2.24 0.18 0.00 3.99 3.07 -1.98 0.10 114.58 122.18 1n5o h GLU 1682Ca -0.40 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.45 1n5o h GLU 1682Cb 1.24 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.11 1n5o h GLU 1682CO 0.66 0.12 0.00 0.93 -1.40 0.00 0.00 179.01 179.32 1n5o h GLU 1683N 0.19 0.00 -6.78 2.33 3.07 -1.99 -3.44 114.58 107.95 1n5o h GLU 1683Ca 0.57 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.91 1n5o h GLU 1683Cb 1.88 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 29.84 1n5o h GLU 1683CO -0.15 0.00 0.68 0.99 -1.40 0.00 0.00 179.01 179.13 1n5o s THR 1684N -3.31 2.83 -0.16 1.13 2.01 0.35 -4.55 115.64 113.94 1n5o s THR 1684Ca 0.06 0.75 0.07 0.00 0.31 0.00 0.00 61.69 62.87 1n5o s THR 1684Cb 0.10 -3.48 -0.15 0.00 0.01 0.00 0.00 72.50 68.98 1n5o s THR 1684CO 0.51 0.14 -0.06 0.35 -0.69 0.00 0.00 174.62 174.88 1n5o n THR 1685N 1.78 1.03 -5.28 -0.82 -2.24 -0.07 -4.93 114.28 103.75 1n5o n THR 1685Ca 0.04 -0.51 -0.31 0.00 -2.27 0.00 0.00 64.05 61.00 1n5o n THR 1685Cb 0.42 -0.89 -0.16 0.00 -2.10 0.00 0.00 70.33 67.59 1n5o n THR 1685CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1n5o s HIS 1686N -2.36 2.41 -0.18 4.78 3.76 -0.42 -1.94 115.29 121.35 1n5o s HIS 1686Ca -0.16 -0.66 -0.01 0.00 -0.15 0.00 0.00 55.06 54.07 1n5o s HIS 1686Cb 0.05 -1.58 -0.00 0.00 1.11 0.00 0.00 32.58 32.16 1n5o s HIS 1686CO 0.51 -0.18 -0.11 0.08 -0.85 0.00 0.00 174.74 174.19 1n5o s VAL 1687N -0.27 2.97 -0.41 -0.90 1.01 0.19 -0.37 120.40 122.63 1n5o s VAL 1687Ca -0.00 -0.65 -0.12 0.00 0.00 0.00 0.00 61.98 61.20 1n5o s VAL 1687Cb -0.13 -2.30 0.04 0.00 0.00 0.00 0.00 36.38 34.00 1n5o s VAL 1687CO 0.03 0.48 0.27 -0.69 0.00 0.00 0.00 175.10 175.18 1n5o s VAL 1688N 1.06 4.77 -0.01 2.92 1.01 -0.88 -0.61 120.40 128.66 1n5o s VAL 1688Ca -0.00 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 60.95 1n5o s VAL 1688Cb -0.15 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 1n5o s VAL 1688CO -0.02 -0.35 0.29 -0.04 0.00 0.00 0.00 175.10 174.97 1n5o s MET 1689N 1.57 3.64 0.21 2.72 -1.94 0.39 -1.11 119.30 124.79 1n5o s MET 1689Ca 0.03 0.04 -0.30 0.00 -1.71 0.00 0.00 55.69 53.75 1n5o s MET 1689Cb -0.21 -3.12 -0.08 0.00 2.01 0.00 0.00 34.83 33.43 1n5o s MET 1689CO 0.07 0.67 1.18 0.21 -0.01 0.00 0.00 175.02 177.14 1n5o s LYS 1690N -1.51 4.51 0.31 2.03 2.47 -0.98 0.33 119.74 126.91 1n5o s LYS 1690Ca 0.25 1.88 0.04 0.00 -1.56 0.00 0.00 55.97 56.58 1n5o s LYS 1690Cb -0.14 -3.22 -0.03 0.00 -1.46 0.00 0.00 37.83 32.98 1n5o s LYS 1690CO 0.13 -0.04 0.28 0.95 0.16 0.00 0.00 175.35 176.84 1n5o s THR 1691N -0.32 0.00 0.54 3.43 -4.23 -1.26 -4.44 115.64 109.36 1n5o s THR 1691Ca 0.51 -1.93 0.09 0.00 -1.18 0.00 0.00 61.69 59.17 1n5o s THR 1691Cb -0.33 -2.52 0.07 0.00 1.34 0.00 0.00 72.50 71.06 1n5o s THR 1691CO 0.38 0.00 0.74 1.51 -0.54 0.00 0.00 174.62 176.71 1n5o s ASP 1692N -3.31 5.23 -0.03 3.99 -4.77 -1.06 -4.95 116.67 111.78 1n5o s ASP 1692Ca 0.39 -0.69 -0.01 0.00 -3.30 0.00 0.00 52.55 48.94 1n5o s ASP 1692Cb 0.03 -0.01 -0.02 0.00 -1.09 0.00 0.00 42.92 41.83 1n5o s ASP 1692CO 0.24 -1.20 0.87 0.00 0.70 0.00 0.00 175.17 175.78 1n5o n ALA 1693N -2.16 1.54 -2.87 2.11 0.00 -1.26 -4.08 120.51 113.79 1n5o n ALA 1693Ca 0.13 -0.21 -0.17 0.00 0.00 0.00 0.00 53.44 53.19 1n5o n ALA 1693Cb 0.61 -2.31 -0.01 0.00 0.00 0.00 0.00 19.45 17.74 1n5o n ALA 1693CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1n5o n PHE 1695N 3.27 1.52 -4.19 0.00 3.01 -1.26 -5.18 117.46 114.63 1n5o n PHE 1695Ca 0.05 -3.39 -0.35 0.00 1.01 0.00 0.00 57.45 54.77 1n5o n PHE 1695Cb 0.08 -0.37 -0.10 0.00 -0.01 0.00 0.00 39.48 39.08 1n5o n PHE 1695CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1n5o s VAL 1696N -3.39 4.54 0.41 -4.37 1.01 -1.26 -1.13 120.40 116.21 1n5o s VAL 1696Ca 0.38 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.27 1n5o s VAL 1696Cb 0.39 -2.98 -0.06 0.00 0.00 0.00 0.00 36.38 33.72 1n5o s VAL 1696CO -0.06 0.53 0.03 0.00 0.00 0.00 0.00 175.10 175.60 1n5o s GLU 1698N -3.78 4.25 -0.32 0.00 0.41 -1.26 -4.11 118.70 113.88 1n5o s GLU 1698Ca 0.29 1.35 -0.29 0.00 -0.41 0.00 0.00 54.97 55.92 1n5o s GLU 1698Cb 0.08 -2.47 -0.01 0.00 -1.78 0.00 0.00 34.13 29.95 1n5o s GLU 1698CO 0.14 -0.04 1.50 1.03 -0.49 0.00 0.00 175.26 177.40 1n5o s ARG 1699N -2.64 3.67 0.40 1.61 0.52 -1.26 -4.93 118.95 116.33 1n5o s ARG 1699Ca 0.58 1.27 0.03 0.00 -0.52 0.00 0.00 55.73 57.09 1n5o s ARG 1699Cb -0.17 -4.02 -0.03 0.00 0.52 0.00 0.00 34.95 31.24 1n5o s ARG 1699CO 0.22 -1.44 0.09 0.95 0.02 0.00 0.00 175.30 175.14 1n5o s THR 1700N 5.35 0.88 0.16 0.02 -4.23 -1.26 -5.00 115.64 111.56 1n5o s THR 1700Ca 0.66 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 59.06 1n5o s THR 1700Cb -0.19 -2.46 0.01 0.00 1.34 0.00 0.00 72.50 71.20 1n5o s THR 1700CO 0.30 0.00 1.56 0.25 -0.54 0.00 0.00 174.62 176.19 1n5o h LEU 1701N 1.82 1.02 -1.56 4.79 5.85 -1.98 -0.52 115.31 124.73 1n5o h LEU 1701Ca -0.38 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 57.92 1n5o h LEU 1701Cb 1.27 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.01 1n5o h LEU 1701CO 0.63 1.17 -0.16 0.11 -0.34 0.00 0.00 178.44 179.86 1n5o h LYS 1702N 0.87 0.00 0.23 1.25 1.57 -1.97 -1.04 116.57 117.47 1n5o h LYS 1702Ca 0.12 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1n5o h LYS 1702Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1n5o h LYS 1702CO 0.06 0.16 -0.11 -0.92 -0.57 0.00 0.00 179.45 178.08 1n5o h TYR 1703N 0.00 -0.28 -0.53 -1.35 3.20 -1.63 -1.17 116.97 115.20 1n5o h TYR 1703Ca -0.00 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1n5o h TYR 1703Cb 0.52 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1n5o h TYR 1703CO 0.00 0.08 0.23 0.74 -1.64 0.00 0.00 178.16 177.56 1n5o h PHE 1704N -0.70 0.79 -0.00 -3.82 -1.00 -0.78 -1.95 116.94 109.47 1n5o h PHE 1704Ca -0.03 -0.05 -0.11 0.00 2.81 0.00 0.00 57.97 60.59 1n5o h PHE 1704Cb 0.49 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.79 1n5o h PHE 1704CO 0.04 0.64 -0.50 -0.07 -1.61 0.00 0.00 178.31 176.81 1n5o h LEU 1705N 0.71 0.01 -0.11 1.54 3.38 -1.30 0.31 115.31 119.84 1n5o h LEU 1705Ca 0.18 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 1n5o h LEU 1705Cb 0.17 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1n5o h LEU 1705CO -0.02 0.51 -0.04 1.23 0.09 0.00 0.00 178.44 180.22 1n5o h GLY 1706N 1.50 0.24 0.97 0.83 0.00 -0.93 -1.59 103.07 104.10 1n5o h GLY 1706Ca -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1n5o h GLY 1706CO 0.07 0.19 0.23 -2.22 0.00 0.00 0.00 176.54 174.80 1n5o h ILE 1707N -0.11 1.16 -0.04 2.60 2.04 -1.19 -0.25 117.51 121.71 1n5o h ILE 1707Ca 0.03 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.49 1n5o h ILE 1707Cb 0.47 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1n5o h ILE 1707CO 0.01 0.17 0.05 0.00 0.00 0.00 0.00 178.15 178.38 1n5o h ALA 1708N 1.08 1.53 -0.02 1.87 0.00 -0.32 0.27 119.26 123.68 1n5o h ALA 1708Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1n5o h ALA 1708Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1n5o h ALA 1708CO -0.02 -0.08 -0.16 0.41 0.00 0.00 0.00 179.25 179.40 1n5o n GLY 1709N -1.31 0.41 3.06 0.00 0.00 -0.60 -4.41 105.19 102.33 1n5o n GLY 1709Ca -0.02 -0.61 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 1n5o n GLY 1709CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n5o n GLY 1710N 1.34 -0.80 2.58 -0.02 0.00 0.96 -5.00 105.19 104.25 1n5o n GLY 1710Ca 0.13 0.40 -0.17 0.00 0.00 0.00 0.00 46.02 46.38 1n5o n GLY 1710CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n5o n LYS 1711N -3.16 0.91 -2.83 1.61 5.02 -0.17 -4.49 118.16 115.04 1n5o n LYS 1711Ca -0.10 -2.29 -0.43 0.00 -2.02 0.00 0.00 58.31 53.47 1n5o n LYS 1711Cb 0.61 0.18 -0.04 0.00 -0.02 0.00 0.00 35.03 35.76 1n5o n LYS 1711CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1n5o s TRP 1712N -1.77 2.74 -0.54 2.13 0.52 -0.82 -4.68 118.94 116.51 1n5o s TRP 1712Ca 0.24 -0.15 -0.11 0.00 0.02 0.00 0.00 56.10 56.10 1n5o s TRP 1712Cb -0.02 -4.16 0.14 0.00 -1.15 0.00 0.00 33.47 28.28 1n5o s TRP 1712CO 0.16 -1.46 0.45 0.08 0.02 0.00 0.00 176.95 176.19 1n5o s VAL 1713N 4.07 4.65 -0.03 4.03 1.01 -1.26 0.56 120.40 133.43 1n5o s VAL 1713Ca 0.29 -1.85 0.06 0.00 0.00 0.00 0.00 61.98 60.48 1n5o s VAL 1713Cb -0.13 -4.01 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 1n5o s VAL 1713CO 0.17 -0.84 -0.20 -0.69 0.00 0.00 0.00 175.10 173.53 1n5o s VAL 1714N 1.21 2.54 0.62 2.92 1.01 0.22 -0.80 120.40 128.11 1n5o s VAL 1714Ca 0.07 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 60.95 1n5o s VAL 1714Cb -0.25 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1n5o s VAL 1714CO -0.01 0.58 1.15 -0.55 0.00 0.00 0.00 175.10 176.28 1n5o s SER 1715N -0.67 5.20 0.61 3.32 0.15 -0.34 -0.46 113.70 121.51 1n5o s SER 1715Ca 0.11 2.19 0.31 0.00 0.70 0.00 0.00 55.95 59.26 1n5o s SER 1715Cb -0.10 -2.58 1.77 0.00 -1.71 0.00 0.00 66.02 63.40 1n5o s SER 1715CO -0.00 -1.58 2.13 0.22 1.20 0.00 0.00 173.24 175.21 1n5o h TYR 1716N 0.56 0.00 -0.07 3.44 5.03 -0.43 0.01 116.97 125.51 1n5o h TYR 1716Ca -0.49 0.00 0.02 0.00 2.58 0.00 0.00 58.73 60.84 1n5o h TYR 1716Cb 1.27 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.55 1n5o h TYR 1716CO 0.51 0.00 0.08 0.74 -1.32 0.00 0.00 178.16 178.17 1n5o h PHE 1717N 0.00 0.00 -0.91 -3.82 0.05 -1.91 -0.77 116.94 109.57 1n5o h PHE 1717Ca 0.06 0.00 0.03 0.00 3.82 0.00 0.00 57.97 61.88 1n5o h PHE 1717Cb 0.42 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.32 1n5o h PHE 1717CO 0.00 0.00 0.60 2.35 -0.18 0.00 0.00 178.31 181.08 1n5o h TRP 1718N 0.00 1.12 0.23 -0.55 7.01 -1.30 -2.08 115.95 120.38 1n5o h TRP 1718Ca 0.03 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 1n5o h TRP 1718Cb 0.19 -0.38 0.00 0.00 -2.10 0.00 0.00 29.16 26.88 1n5o h TRP 1718CO 0.00 0.66 -0.11 0.28 -2.79 0.00 0.00 178.44 176.48 1n5o h VAL 1719N 1.18 0.00 -0.81 2.65 2.07 -1.32 -2.65 116.25 117.36 1n5o h VAL 1719Ca 0.36 -0.20 0.08 0.00 0.82 0.00 0.00 66.70 67.75 1n5o h VAL 1719Cb -0.04 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.68 1n5o h VAL 1719CO -0.11 0.00 0.53 0.71 0.02 0.00 0.00 177.57 178.72 1n5o h THR 1720N -0.51 1.00 -0.49 2.57 1.35 -1.61 0.18 112.91 115.41 1n5o h THR 1720Ca -0.03 -0.28 -0.07 0.00 -0.55 0.00 0.00 66.41 65.48 1n5o h THR 1720Cb 0.24 0.10 -0.02 0.00 -1.73 0.00 0.00 68.15 66.74 1n5o h THR 1720CO 0.05 0.15 0.03 -0.61 -0.25 0.00 0.00 175.52 174.90 1n5o h GLN 1721N 0.83 0.84 -0.76 4.72 5.75 -1.49 0.39 115.11 125.38 1n5o h GLN 1721Ca 0.36 -0.25 -0.04 0.00 -0.15 0.00 0.00 58.65 58.57 1n5o h GLN 1721Cb 0.33 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.76 1n5o h GLN 1721CO -0.14 0.86 0.32 0.77 -2.65 0.00 0.00 178.83 177.99 1n5o h SER 1722N 0.70 1.04 -0.79 -0.69 0.02 -0.75 0.42 113.55 113.50 1n5o h SER 1722Ca 0.14 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1n5o h SER 1722Cb 0.46 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.70 1n5o h SER 1722CO 0.02 0.91 0.42 0.40 -1.14 0.00 0.00 176.83 177.44 1n5o h ILE 1723N 1.11 1.24 0.01 3.27 2.04 -0.38 0.83 117.51 125.62 1n5o h ILE 1723Ca 0.26 -0.62 -0.19 0.00 1.00 0.00 0.00 64.86 65.30 1n5o h ILE 1723Cb 0.19 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 1n5o h ILE 1723CO -0.02 0.27 -0.92 0.50 0.00 0.00 0.00 178.15 177.98 1n5o h LYS 1724N 1.13 0.03 -0.23 2.37 3.64 -0.17 -3.20 116.57 120.13 1n5o h LYS 1724Ca 0.28 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1n5o h LYS 1724Cb 0.05 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1n5o h LYS 1724CO -0.04 0.93 0.00 0.39 -2.27 0.00 0.00 179.45 178.45 1n5o n GLU 1725N -3.48 2.41 -3.29 1.90 1.02 0.14 -4.98 120.64 114.37 1n5o n GLU 1725Ca -0.01 -2.09 -0.24 0.00 -0.02 0.00 0.00 57.16 54.80 1n5o n GLU 1725Cb 0.87 -1.49 0.04 0.00 -0.02 0.00 0.00 31.44 30.84 1n5o n GLU 1725CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1n5o n ARG 1726N 1.39 -5.57 -3.62 3.49 -4.01 0.25 -4.98 116.66 103.60 1n5o n ARG 1726Ca 0.17 0.81 -0.03 0.00 -1.04 0.00 0.00 57.85 57.76 1n5o n ARG 1726Cb 0.60 -5.71 -0.01 0.00 -3.04 0.00 0.00 32.46 24.29 1n5o n ARG 1726CO 0.00 0.00 0.00 0.15 -3.04 0.00 0.00 177.63 174.74 1n5o s LYS 1727N -5.98 0.66 -0.38 2.89 -0.14 -0.97 -5.05 119.74 110.77 1n5o s LYS 1727Ca 0.42 -0.32 -0.29 0.00 -1.36 0.00 0.00 55.97 54.43 1n5o s LYS 1727Cb -0.19 0.26 -0.00 0.00 -1.68 0.00 0.00 37.83 36.21 1n5o s LYS 1727CO 0.52 -0.30 1.61 -1.64 -0.76 0.00 0.00 175.35 174.78 1n5o s MET 1728N -2.79 3.44 0.83 1.68 -1.94 -1.26 -4.50 119.30 114.76 1n5o s MET 1728Ca 0.10 1.16 -0.12 0.00 -1.71 0.00 0.00 55.69 55.13 1n5o s MET 1728Cb 0.01 -4.12 0.09 0.00 2.01 0.00 0.00 34.83 32.82 1n5o s MET 1728CO -0.04 -1.74 1.12 -0.51 -0.01 0.00 0.00 175.02 173.85 1n5o s LEU 1729N 6.22 2.39 -0.12 -0.03 1.43 -1.26 -5.00 118.68 122.31 1n5o s LEU 1729Ca 0.70 1.08 -0.29 0.00 -1.03 0.00 0.00 54.13 54.59 1n5o s LEU 1729Cb -0.18 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.45 1n5o s LEU 1729CO 0.33 -2.12 1.00 0.54 0.23 0.00 0.00 176.35 176.33 1n5o s ASN 1730N -4.10 7.22 0.53 2.29 4.22 -1.26 -4.91 114.94 118.93 1n5o s ASN 1730Ca 0.62 1.50 0.26 0.00 -2.14 0.00 0.00 52.86 53.09 1n5o s ASN 1730Cb -0.14 -2.55 1.41 0.00 1.28 0.00 0.00 41.25 41.25 1n5o s ASN 1730CO 0.53 -0.47 1.99 -0.33 -2.04 0.00 0.00 177.10 176.78 1n5o h GLU 1731N 7.14 0.00 -0.69 3.55 3.07 -1.98 -2.01 114.58 123.67 1n5o h GLU 1731Ca -0.30 0.00 0.15 0.00 -0.50 0.00 0.00 59.36 58.71 1n5o h GLU 1731Cb 1.14 0.00 -0.12 0.00 -0.84 0.00 0.00 28.75 28.92 1n5o h GLU 1731CO 0.87 0.00 -0.04 0.45 -1.40 0.00 0.00 179.01 178.88 1n5o h HIS 1732N 0.00 -0.13 -0.01 4.33 3.86 -1.99 -1.33 115.15 119.88 1n5o h HIS 1732Ca 0.26 0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.52 1n5o h HIS 1732Cb 1.05 0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.68 1n5o h HIS 1732CO 0.00 -0.23 -0.02 -0.25 0.86 0.00 0.00 177.93 178.29 1n5o n ASP 1733N -5.36 0.83 0.00 2.45 8.00 -0.75 -3.53 116.55 118.18 1n5o n ASP 1733Ca 0.11 -1.20 0.00 0.00 0.71 0.00 0.00 54.79 54.41 1n5o n ASP 1733Cb 0.41 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 1n5o n ASP 1733CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1n5o n PHE 1734N -0.40 0.00 -2.01 1.24 3.01 -0.64 -5.07 117.46 113.58 1n5o n PHE 1734Ca 0.20 -0.36 -0.40 0.00 1.01 0.00 0.00 57.45 57.90 1n5o n PHE 1734Cb 0.26 -0.04 -0.01 0.00 -0.01 0.00 0.00 39.48 39.68 1n5o n PHE 1734CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1n5o s GLU 1735N -0.71 4.10 0.34 -1.08 2.02 -0.60 -1.19 118.70 121.57 1n5o s GLU 1735Ca 0.00 2.26 -0.28 0.00 0.02 0.00 0.00 54.97 56.98 1n5o s GLU 1735Cb 0.00 -2.89 -0.09 0.00 0.10 0.00 0.00 34.13 31.25 1n5o s GLU 1735CO 0.00 -0.42 1.15 0.54 0.02 0.00 0.00 175.26 176.55 1n5o s VAL 1736N -1.19 3.28 -1.52 2.63 0.11 0.02 -4.77 120.40 118.95 1n5o s VAL 1736Ca 0.54 1.19 0.15 0.00 -2.93 0.00 0.00 61.98 60.92 1n5o s VAL 1736Cb -0.40 -3.72 0.04 0.00 -1.53 0.00 0.00 36.38 30.77 1n5o s VAL 1736CO 0.53 0.21 0.86 0.54 -3.33 0.00 0.00 175.10 173.91 1n5o n ARG 1737N 0.67 1.53 -3.31 1.54 1.74 -0.29 -4.40 116.66 114.14 1n5o n ARG 1737Ca 0.01 -0.99 0.00 0.00 -0.77 0.00 0.00 57.85 56.10 1n5o n ARG 1737Cb 0.45 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 1n5o n ARG 1737CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n5o n GLY 1738N 0.98 -0.77 0.41 -0.13 0.00 -1.23 -3.75 105.19 100.71 1n5o n GLY 1738Ca 0.07 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1n5o n GLY 1738CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n5o n ASP 1739N 0.29 0.00 0.00 1.61 5.68 0.50 -1.35 116.55 123.28 1n5o n ASP 1739Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1n5o n ASP 1739Cb 0.00 0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.08 1n5o n ASP 1739CO 0.00 0.00 0.00 0.55 -1.33 0.00 0.00 177.20 176.42 1n5o n VAL 1740N -1.27 0.00 0.04 2.12 3.14 -1.26 -4.81 118.33 116.29 1n5o n VAL 1740Ca 0.00 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.19 1n5o n VAL 1740Cb 0.00 0.00 -0.14 0.00 -1.06 0.00 0.00 33.84 32.64 1n5o n VAL 1740CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1n5o h VAL 1741N 0.00 0.93 -3.32 1.55 2.07 -1.97 -3.44 116.25 112.06 1n5o h VAL 1741Ca 0.00 -2.59 -0.54 0.00 0.82 0.00 0.00 66.70 64.38 1n5o h VAL 1741Cb 0.00 2.66 -0.38 0.00 -1.52 0.00 0.00 31.29 32.05 1n5o h VAL 1741CO 0.00 0.81 -0.79 0.54 0.02 0.00 0.00 177.57 178.16 1n5o s ASN 1742N -6.98 2.75 0.82 0.57 4.22 -1.26 -5.04 114.94 110.02 1n5o s ASN 1742Ca -0.14 -0.64 -0.11 0.00 -2.14 0.00 0.00 52.86 49.83 1n5o s ASN 1742Cb 0.06 -0.85 0.08 0.00 1.28 0.00 0.00 41.25 41.83 1n5o s ASN 1742CO 0.83 -0.20 1.09 -0.83 -2.04 0.00 0.00 177.10 175.95 1n5o s GLY 1743N 1.68 1.63 0.00 0.45 0.00 -1.26 0.19 107.32 110.01 1n5o s GLY 1743Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 44.72 44.68 1n5o s GLY 1743CO -0.07 0.38 0.00 -0.96 0.00 0.00 0.00 173.10 172.44 1n5o n ARG 1744N -3.57 0.00 -0.08 2.90 0.00 -1.26 -3.28 116.66 111.36 1n5o n ARG 1744Ca 0.07 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.79 1n5o n ARG 1744Cb 0.55 0.00 -0.05 0.00 -0.00 0.00 0.00 32.46 32.96 1n5o n ARG 1744CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.63 174.68 1n5o h ASN 1745N 0.00 0.62 -0.78 2.89 -1.07 -1.90 -3.29 115.58 112.06 1n5o h ASN 1745Ca 0.00 -0.46 -0.56 0.00 0.07 0.00 0.00 56.30 55.34 1n5o h ASN 1745Cb 0.00 -0.17 0.07 0.00 -2.07 0.00 0.00 38.32 36.14 1n5o h ASN 1745CO 0.00 0.96 -0.22 0.00 0.07 0.00 0.00 177.43 178.24 1n5o n HIS 1746N -4.37 -0.00 -2.68 4.14 1.44 -1.21 -4.79 115.22 107.74 1n5o n HIS 1746Ca -0.04 0.79 -0.36 0.00 -2.01 0.00 0.00 57.72 56.10 1n5o n HIS 1746Cb 0.42 -1.58 0.00 0.00 0.12 0.00 0.00 29.99 28.96 1n5o n HIS 1746CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1n5o n GLN 1747N 0.95 4.47 0.00 -1.40 6.02 -1.26 -4.23 117.38 121.93 1n5o n GLN 1747Ca 0.15 -4.65 0.00 0.00 -0.01 0.00 0.00 57.00 52.49 1n5o n GLN 1747Cb 0.14 -2.37 0.00 0.00 1.02 0.00 0.00 30.24 29.03 1n5o n GLN 1747CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1n5o n GLY 1748N -0.17 -2.61 0.38 1.08 0.00 -1.26 -1.19 105.19 101.41 1n5o n GLY 1748Ca 0.42 0.52 0.14 0.00 0.00 0.00 0.00 46.02 47.10 1n5o n GLY 1748CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n5o h PRO 1749N 0.00 0.57 0.05 1.61 0.11 -1.79 -2.79 132.00 129.76 1n5o h PRO 1749Ca 0.00 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 1n5o h PRO 1749Cb 0.00 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 30.98 1n5o h PRO 1749CO 0.00 0.37 -0.02 0.87 -0.21 0.00 0.00 178.00 179.01 1n5o h LYS 1750N 0.58 -0.06 -0.99 1.05 6.56 -1.43 -0.09 116.57 122.20 1n5o h LYS 1750Ca 0.44 0.00 0.19 0.00 -1.06 0.00 0.00 60.65 60.22 1n5o h LYS 1750Cb 0.82 0.01 -0.10 0.00 -0.57 0.00 0.00 32.23 32.40 1n5o h LYS 1750CO -0.18 0.16 0.61 0.07 -2.06 0.00 0.00 179.45 178.05 1n5o h ARG 1751N -0.28 0.70 0.01 3.15 0.11 -0.93 -2.91 114.38 114.22 1n5o h ARG 1751Ca -0.01 -0.04 -0.00 0.00 0.10 0.00 0.00 59.98 60.03 1n5o h ARG 1751Cb 0.25 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 31.18 1n5o h ARG 1751CO 0.01 0.46 -0.00 0.00 0.10 0.00 0.00 179.97 180.54 1n5o h ALA 1752N 1.63 -0.01 -0.67 0.08 0.00 -1.19 0.16 119.26 119.25 1n5o h ALA 1752Ca 0.55 -0.23 0.12 0.00 0.00 0.00 0.00 54.91 55.35 1n5o h ALA 1752Cb 0.91 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.62 1n5o h ALA 1752CO -0.33 -0.27 0.22 0.00 0.00 0.00 0.00 179.25 178.87 1n5o h ARG 1753N -0.48 0.35 0.38 0.00 3.08 -0.88 -3.10 114.38 113.73 1n5o h ARG 1753Ca -0.00 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1n5o h ARG 1753Cb 0.47 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1n5o h ARG 1753CO 0.00 0.23 -0.18 0.93 -1.07 0.00 0.00 179.97 179.88 1n5o h GLU 1754N 0.36 -0.49 -6.24 0.04 5.08 -1.45 -3.43 114.58 108.44 1n5o h GLU 1754Ca 0.36 0.03 -0.55 0.00 -1.00 0.00 0.00 59.36 58.20 1n5o h GLU 1754Cb 0.53 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1n5o h GLU 1754CO -0.39 -0.33 1.07 -1.12 -1.00 0.00 0.00 179.01 177.23 1n5o s SER 1755N -3.94 6.66 0.00 1.42 0.01 0.54 -4.58 113.70 113.81 1n5o s SER 1755Ca -0.07 2.04 0.00 0.00 1.31 0.00 0.00 55.95 59.23 1n5o s SER 1755Cb 0.01 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1n5o s SER 1755CO 0.22 -0.96 0.00 0.00 0.41 0.00 0.00 173.24 172.91 1n5o n GLN 1756N 7.14 3.51 0.00 12.44 6.02 -1.26 -4.70 117.38 140.53 1n5o n GLN 1756Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 1n5o n GLN 1756Cb 0.44 -0.31 0.00 0.00 1.02 0.00 0.00 30.24 31.39 1n5o n GLN 1756CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1n5o n ASP 1757N -0.03 0.00 -4.55 1.08 3.85 -1.26 -4.55 116.55 111.09 1n5o n ASP 1757Ca 0.00 0.28 -0.41 0.00 -0.71 0.00 0.00 54.79 53.95 1n5o n ASP 1757Cb 0.00 -0.07 -0.03 0.00 -1.35 0.00 0.00 41.12 39.67 1n5o n ASP 1757CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1n5o s ARG 1758N -0.63 3.19 0.07 0.11 1.70 -1.26 -4.99 118.95 117.14 1n5o s ARG 1758Ca 0.00 -0.26 -0.17 0.00 -0.47 0.00 0.00 55.73 54.82 1n5o s ARG 1758Cb 0.00 -4.19 -0.06 0.00 -0.57 0.00 0.00 34.95 30.12 1n5o s ARG 1758CO 0.00 -2.14 0.53 0.15 -1.08 0.00 0.00 175.30 172.76 1n5o s LYS 1759N 5.68 4.10 0.61 3.89 1.02 -1.26 -4.84 119.74 128.94 1n5o s LYS 1759Ca 0.35 0.63 0.32 0.00 0.02 0.00 0.00 55.97 57.28 1n5o s LYS 1759Cb -0.08 -3.18 1.83 0.00 -0.52 0.00 0.00 37.83 35.88 1n5o s LYS 1759CO 0.15 0.63 2.16 -0.84 -0.92 0.00 0.00 175.35 176.53 1n5o h ILE 1760N 3.45 0.35 -1.36 2.17 3.07 -1.90 -1.20 117.51 122.09 1n5o h ILE 1760Ca -0.50 0.00 -0.64 0.00 1.55 0.00 0.00 64.86 65.27 1n5o h ILE 1760Cb 1.21 0.88 -0.36 0.00 -0.27 0.00 0.00 36.82 38.28 1n5o h ILE 1760CO 0.63 0.00 -0.02 0.49 -1.05 0.00 0.00 178.15 178.20 1n5o n PHE 1761N -3.59 3.12 0.00 0.16 0.99 -0.40 -4.58 117.46 113.16 1n5o n PHE 1761Ca -0.01 -2.69 0.00 0.00 -0.00 0.00 0.00 57.45 54.75 1n5o n PHE 1761Cb 0.23 -0.66 0.00 0.00 -1.00 0.00 0.00 39.48 38.05 1n5o n PHE 1761CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 1n5o n ARG 1762N -0.63 0.00 -3.82 -1.08 3.00 -0.46 -2.18 116.66 111.49 1n5o n ARG 1762Ca 0.48 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 58.02 1n5o n ARG 1762Cb 0.63 -0.11 -0.11 0.00 0.00 0.00 0.00 32.46 32.87 1n5o n ARG 1762CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1n5o s GLY 1763N 0.00 2.91 0.08 5.14 0.00 -1.26 -4.45 107.32 109.74 1n5o s GLY 1763Ca 0.00 -3.76 0.07 0.00 0.00 0.00 0.00 44.72 41.03 1n5o s GLY 1763CO 0.00 1.10 -0.19 1.08 0.00 0.00 0.00 173.10 175.10 1n5o s LEU 1764N -1.24 2.27 -0.27 0.66 1.43 -1.18 -4.00 118.68 116.35 1n5o s LEU 1764Ca 0.24 -0.64 -0.04 0.00 -1.03 0.00 0.00 54.13 52.67 1n5o s LEU 1764Cb -0.08 -0.77 0.02 0.00 0.03 0.00 0.00 46.19 45.39 1n5o s LEU 1764CO -0.13 0.03 -0.00 -1.61 0.23 0.00 0.00 176.35 174.86 1n5o s GLU 1765N -1.75 2.91 -0.06 1.70 2.02 -0.76 0.36 118.70 123.11 1n5o s GLU 1765Ca 0.04 -0.95 0.03 0.00 0.02 0.00 0.00 54.97 54.11 1n5o s GLU 1765Cb -0.10 -3.15 -0.02 0.00 0.10 0.00 0.00 34.13 30.96 1n5o s GLU 1765CO 0.03 -0.43 -0.14 0.42 0.02 0.00 0.00 175.26 175.16 1n5o s ILE 1766N 1.39 3.04 -0.21 -1.63 1.01 0.07 -0.84 121.20 124.03 1n5o s ILE 1766Ca 0.01 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 59.94 1n5o s ILE 1766Cb -0.17 -2.20 0.05 0.00 0.01 0.00 0.00 42.46 40.15 1n5o s ILE 1766CO -0.02 0.58 -0.07 0.00 0.00 0.00 0.00 174.94 175.44 1n5o s TYR 1769N 4.06 3.11 0.00 0.00 5.04 -0.34 -4.99 117.35 124.23 1n5o s TYR 1769Ca 0.23 0.06 0.00 0.00 -2.44 0.00 0.00 57.07 54.93 1n5o s TYR 1769Cb -0.16 -1.83 0.00 0.00 0.35 0.00 0.00 41.96 40.32 1n5o s TYR 1769CO 0.12 0.33 0.00 0.41 -1.34 0.00 0.00 175.55 175.06 1n5o n GLY 1770N 2.53 -2.54 3.76 8.97 0.00 -1.26 -4.48 105.19 112.17 1n5o n GLY 1770Ca -0.18 -1.65 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 1n5o n GLY 1770CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1n5o s PRO 1771N -0.69 3.40 0.07 1.61 0.02 -1.26 -4.92 135.00 133.22 1n5o s PRO 1771Ca 0.00 1.96 0.03 0.00 0.02 0.00 0.00 61.00 63.01 1n5o s PRO 1771Cb 0.00 -2.28 -0.03 0.00 0.02 0.00 0.00 34.50 32.21 1n5o s PRO 1771CO 0.00 -0.90 -0.09 -0.06 -0.33 0.00 0.00 177.00 175.62 1n5o s PHE 1772N -1.46 0.89 0.00 6.54 0.40 -1.26 -4.28 117.98 118.81 1n5o s PHE 1772Ca 0.69 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 56.45 1n5o s PHE 1772Cb -0.34 -0.51 0.00 0.00 0.51 0.00 0.00 43.02 42.69 1n5o s PHE 1772CO 0.40 -0.04 0.00 0.25 0.70 0.00 0.00 175.22 176.52 1n5o n THR 1773N 1.06 0.00 0.10 0.64 -2.24 -1.26 -4.82 114.28 107.76 1n5o n THR 1773Ca -0.20 0.12 -0.01 0.00 -2.27 0.00 0.00 64.05 61.70 1n5o n THR 1773Cb 0.56 -0.99 -0.03 0.00 -2.10 0.00 0.00 70.33 67.76 1n5o n THR 1773CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1n5o h ASN 1774N 0.00 0.00 -3.84 3.42 4.21 -2.04 -3.40 115.58 113.94 1n5o h ASN 1774Ca 0.00 0.00 -0.68 0.00 1.21 0.00 0.00 56.30 56.83 1n5o h ASN 1774Cb 0.00 0.00 -0.37 0.00 -1.12 0.00 0.00 38.32 36.83 1n5o h ASN 1774CO 0.00 0.65 -0.54 -0.13 -1.29 0.00 0.00 177.43 176.12 1n5o s ARG 1775N -2.88 2.07 0.24 0.81 1.81 -1.26 -5.08 118.95 114.66 1n5o s ARG 1775Ca 0.02 -2.15 -0.25 0.00 -1.72 0.00 0.00 55.73 51.62 1n5o s ARG 1775Cb 0.08 -3.53 -0.16 0.00 -0.45 0.00 0.00 34.95 30.90 1n5o s ARG 1775CO 0.78 -1.09 0.40 -2.30 -0.68 0.00 0.00 175.30 172.41 1n5o n PRO 1776N 4.00 0.00 -0.29 3.54 -0.02 -1.26 -4.73 135.00 136.23 1n5o n PRO 1776Ca 0.03 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.62 1n5o n PRO 1776Cb 0.39 -0.96 0.27 0.00 -0.02 0.00 0.00 33.50 33.18 1n5o n PRO 1776CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1n5o h THR 1777N 0.81 0.49 0.00 3.45 2.02 -1.95 -0.42 112.91 117.31 1n5o h THR 1777Ca -0.29 -0.13 -0.07 0.00 0.77 0.00 0.00 66.41 66.69 1n5o h THR 1777Cb 1.39 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 1n5o h THR 1777CO 0.53 0.07 -0.34 -2.24 0.37 0.00 0.00 175.52 173.90 1n5o h ASP 1778N 0.38 0.00 0.66 4.18 3.04 -1.98 -0.50 116.42 122.20 1n5o h ASP 1778Ca 0.52 0.00 -0.20 0.00 -3.24 0.00 0.00 57.03 54.11 1n5o h ASP 1778Cb 0.96 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.24 1n5o h ASP 1778CO -0.52 0.34 -0.90 1.56 -2.04 0.00 0.00 179.24 177.68 1n5o h GLN 1779N 0.00 0.15 0.00 4.15 1.08 -1.48 0.31 115.11 119.32 1n5o h GLN 1779Ca -0.00 -0.18 -0.16 0.00 -1.45 0.00 0.00 58.65 56.86 1n5o h GLN 1779Cb 1.02 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 28.47 1n5o h GLN 1779CO 0.04 0.95 -0.78 -0.07 -0.95 0.00 0.00 178.83 178.03 1n5o h LEU 1780N 0.08 0.00 -0.17 1.46 3.38 -1.00 -1.52 115.31 117.54 1n5o h LEU 1780Ca -0.04 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.74 1n5o h LEU 1780Cb 1.54 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.30 1n5o h LEU 1780CO 0.13 0.78 -0.65 -0.33 0.09 0.00 0.00 178.44 178.46 1n5o h GLU 1781N 0.00 0.74 -0.59 1.13 5.08 -0.87 -0.38 114.58 119.69 1n5o h GLU 1781Ca -0.01 -0.57 -0.10 0.00 -1.00 0.00 0.00 59.36 57.68 1n5o h GLU 1781Cb 1.38 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.71 1n5o h GLU 1781CO 0.10 1.19 -0.03 2.35 -1.00 0.00 0.00 179.01 181.62 1n5o h TRP 1782N 0.46 1.17 0.37 4.33 7.01 -0.89 0.15 115.95 128.53 1n5o h TRP 1782Ca -0.03 -0.21 -0.01 0.00 2.11 0.00 0.00 58.89 60.75 1n5o h TRP 1782Cb 1.28 -0.30 -0.00 0.00 -2.10 0.00 0.00 29.16 28.03 1n5o h TRP 1782CO 0.09 1.04 -0.22 1.98 -2.79 0.00 0.00 178.44 178.53 1n5o h MET 1783N 0.97 -0.54 -0.96 2.65 4.05 -1.21 -0.28 114.93 119.61 1n5o h MET 1783Ca 0.17 0.04 0.01 0.00 -0.28 0.00 0.00 59.70 59.63 1n5o h MET 1783Cb 0.59 0.12 -0.05 0.00 -0.80 0.00 0.00 31.60 31.47 1n5o h MET 1783CO 0.04 -0.36 0.62 0.28 0.23 0.00 0.00 176.91 177.71 1n5o h VAL 1784N -0.56 1.25 -0.29 -5.77 2.07 -0.87 -2.14 116.25 109.94 1n5o h VAL 1784Ca -0.04 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1n5o h VAL 1784Cb 0.46 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 1n5o h VAL 1784CO 0.04 0.25 0.15 1.56 0.02 0.00 0.00 177.57 179.59 1n5o h GLN 1785N 1.31 0.41 -0.08 1.57 4.20 -0.53 -2.55 115.11 119.43 1n5o h GLN 1785Ca 0.35 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 59.03 1n5o h GLN 1785Cb -0.12 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 27.58 1n5o h GLN 1785CO -0.07 0.37 0.08 -0.07 -0.67 0.00 0.00 178.83 178.47 1n5o h LEU 1786N 0.34 0.00 -2.00 1.46 4.07 -0.43 0.21 115.31 118.97 1n5o h LEU 1786Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.06 1n5o h LEU 1786Cb 0.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.82 1n5o h LEU 1786CO -0.01 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.35 1n5o n GLY 1788N 1.06 0.28 3.84 0.00 0.00 0.75 -1.28 105.19 109.84 1n5o n GLY 1788Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1n5o n GLY 1788CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n5o s ALA 1789N -2.00 2.15 -0.07 4.61 0.00 -0.93 -4.44 121.76 121.08 1n5o s ALA 1789Ca 0.00 -0.63 0.03 0.00 0.00 0.00 0.00 51.96 51.36 1n5o s ALA 1789Cb 0.00 -2.98 -0.02 0.00 0.00 0.00 0.00 23.12 20.12 1n5o s ALA 1789CO 0.00 -2.07 -0.17 0.45 0.00 0.00 0.00 175.76 173.97 1n5o s SER 1790N -4.31 3.81 -0.11 0.00 0.15 0.16 -4.42 113.70 108.97 1n5o s SER 1790Ca 0.64 -0.29 -0.17 0.00 0.70 0.00 0.00 55.95 56.83 1n5o s SER 1790Cb -0.12 -0.97 -0.04 0.00 -1.71 0.00 0.00 66.02 63.17 1n5o s SER 1790CO 0.52 0.29 0.43 -0.69 1.20 0.00 0.00 173.24 174.98 1n5o s VAL 1791N -0.40 5.19 -0.08 4.45 1.01 -1.26 -0.75 120.40 128.56 1n5o s VAL 1791Ca 0.04 0.85 0.01 0.00 0.00 0.00 0.00 61.98 62.88 1n5o s VAL 1791Cb -0.12 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1n5o s VAL 1791CO 0.02 0.37 -0.10 -0.69 0.00 0.00 0.00 175.10 174.70 1n5o s VAL 1792N 0.37 3.36 -0.17 2.92 1.01 -0.14 -4.92 120.40 122.83 1n5o s VAL 1792Ca 0.23 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 1n5o s VAL 1792Cb -0.15 -2.37 -0.23 0.00 0.00 0.00 0.00 36.38 33.63 1n5o s VAL 1792CO 0.09 0.57 0.19 2.29 0.00 0.00 0.00 175.10 178.24 1n5o n LYS 1793N 2.65 0.70 -4.96 2.72 0.00 -1.26 -4.31 118.16 113.70 1n5o n LYS 1793Ca -0.18 0.29 -0.32 0.00 -0.00 0.00 0.00 58.31 58.10 1n5o n LYS 1793Cb 0.53 -1.67 -0.14 0.00 -0.00 0.00 0.00 35.03 33.75 1n5o n LYS 1793CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1n5o s GLU 1794N -2.52 2.49 0.39 -1.58 0.41 -1.26 -4.92 118.70 111.72 1n5o s GLU 1794Ca -0.27 -0.74 0.16 0.00 -0.41 0.00 0.00 54.97 53.72 1n5o s GLU 1794Cb 0.07 -2.33 1.04 0.00 -1.78 0.00 0.00 34.13 31.13 1n5o s GLU 1794CO 0.70 0.58 1.81 -0.07 -0.49 0.00 0.00 175.26 177.79 1n5o h LEU 1795N 5.47 0.48 0.00 1.80 3.38 -1.95 0.44 115.31 124.92 1n5o h LEU 1795Ca -0.44 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1n5o h LEU 1795Cb 1.15 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1n5o h LEU 1795CO 0.50 0.15 0.00 -1.54 0.09 0.00 0.00 178.44 177.64 1n5o n SER 1796N -4.58 0.00 -1.09 -0.43 3.41 -1.26 -3.46 113.62 106.20 1n5o n SER 1796Ca 0.22 -0.78 0.12 0.00 -0.26 0.00 0.00 58.87 58.17 1n5o n SER 1796Cb 0.75 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.94 1n5o n SER 1796CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1n5o n SER 1797N -0.99 3.26 -4.71 4.04 7.64 0.15 -4.93 113.62 118.08 1n5o n SER 1797Ca 0.18 -1.96 -0.42 0.00 1.01 0.00 0.00 58.87 57.68 1n5o n SER 1797Cb 0.08 -0.25 -0.03 0.00 -1.01 0.00 0.00 64.21 63.00 1n5o n SER 1797CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1n5o s PHE 1798N -1.50 2.87 0.14 1.43 2.99 -1.23 -4.93 117.98 117.75 1n5o s PHE 1798Ca 0.39 0.46 -0.34 0.00 0.00 0.00 0.00 56.93 57.43 1n5o s PHE 1798Cb 0.22 -4.01 -0.16 0.00 0.00 0.00 0.00 43.02 39.07 1n5o s PHE 1798CO 0.31 -3.85 1.24 2.41 -0.00 0.00 0.00 175.22 175.34 1n5o n THR 1799N 4.12 0.50 0.47 0.64 -1.04 -1.26 -4.87 114.28 112.85 1n5o n THR 1799Ca 0.15 -0.13 -0.05 0.00 -2.04 0.00 0.00 64.05 61.98 1n5o n THR 1799Cb 0.38 -0.84 0.05 0.00 -1.82 0.00 0.00 70.33 68.10 1n5o n THR 1799CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1n5o n LEU 1800N 2.24 3.74 -4.32 -4.42 -0.00 -1.26 -4.85 117.00 108.13 1n5o n LEU 1800Ca 0.16 -1.92 -0.30 0.00 -0.00 0.00 0.00 56.01 53.96 1n5o n LEU 1800Cb 0.22 -0.58 -0.15 0.00 -0.00 0.00 0.00 43.42 42.91 1n5o n LEU 1800CO 0.62 0.60 -0.56 -0.83 -0.00 0.00 0.00 177.39 177.22 1n5o s GLY 1801N 0.39 1.31 0.48 1.47 0.00 -1.26 -5.05 107.32 104.65 1n5o s GLY 1801Ca 0.14 -1.17 0.23 0.00 0.00 0.00 0.00 44.72 43.91 1n5o s GLY 1801CO 0.03 -1.03 1.89 0.00 0.00 0.00 0.00 173.10 173.99 1n5o h THR 1802N 4.35 0.65 0.00 0.90 1.03 -2.04 -3.20 112.91 114.60 1n5o h THR 1802Ca -0.44 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 65.88 1n5o h THR 1802Cb 1.14 0.42 0.00 0.00 -1.07 0.00 0.00 68.15 68.64 1n5o h THR 1802CO 0.45 0.04 0.00 1.23 -0.01 0.00 0.00 175.52 177.23 1n5o h GLY 1803N 0.21 0.00 -2.70 2.99 0.00 -1.97 -3.45 103.07 98.16 1n5o h GLY 1803Ca 0.41 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.19 1n5o h GLY 1803CO -0.09 0.00 -0.64 0.54 0.00 0.00 0.00 176.54 176.35 1n5o s VAL 1804N -3.63 3.57 -0.17 4.60 0.11 -1.21 -4.97 120.40 118.70 1n5o s VAL 1804Ca 0.02 -1.81 0.00 0.00 -2.93 0.00 0.00 61.98 57.25 1n5o s VAL 1804Cb 0.09 -2.90 0.01 0.00 -1.53 0.00 0.00 36.38 32.04 1n5o s VAL 1804CO 0.55 -0.34 -0.16 -1.00 -3.33 0.00 0.00 175.10 170.82 1n5o s HIS 1805N -2.24 2.80 0.16 1.54 0.09 -1.26 -4.97 115.29 111.41 1n5o s HIS 1805Ca 0.31 -1.25 -0.30 0.00 -0.00 0.00 0.00 55.06 53.82 1n5o s HIS 1805Cb -0.07 -1.93 -0.07 0.00 -0.00 0.00 0.00 32.58 30.51 1n5o s HIS 1805CO 0.20 -0.61 0.96 -1.25 -0.00 0.00 0.00 174.74 174.04 1n5o s PRO 1806N 1.08 4.75 -0.02 8.40 0.04 -1.26 -1.84 135.00 146.15 1n5o s PRO 1806Ca -0.00 1.47 0.02 0.00 0.04 0.00 0.00 61.00 62.53 1n5o s PRO 1806Cb -0.14 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.06 1n5o s PRO 1806CO -0.05 0.32 -0.09 0.42 0.04 0.00 0.00 177.00 177.64 1n5o s ILE 1807N -0.42 0.75 -0.25 0.56 1.01 -0.02 -4.02 121.20 118.81 1n5o s ILE 1807Ca 0.45 -0.35 -0.05 0.00 0.00 0.00 0.00 60.65 60.70 1n5o s ILE 1807Cb -0.24 -0.66 -0.01 0.00 0.01 0.00 0.00 42.46 41.56 1n5o s ILE 1807CO 0.31 0.23 0.01 -0.69 0.00 0.00 0.00 174.94 174.80 1n5o s VAL 1808N 0.16 3.66 -0.16 2.92 1.01 0.64 -1.28 120.40 127.35 1n5o s VAL 1808Ca -0.02 -0.52 -0.08 0.00 0.00 0.00 0.00 61.98 61.35 1n5o s VAL 1808Cb -0.08 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1n5o s VAL 1808CO 0.00 0.31 0.13 -0.69 0.00 0.00 0.00 175.10 174.85 1n5o s VAL 1809N 1.50 5.42 0.04 2.92 1.01 0.06 0.11 120.40 131.46 1n5o s VAL 1809Ca 0.05 0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.22 1n5o s VAL 1809Cb -0.15 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 1n5o s VAL 1809CO -0.01 0.54 -0.05 -0.69 0.00 0.00 0.00 175.10 174.89 1n5o s VAL 1810N -0.37 0.30 -0.47 2.92 1.01 0.45 -1.20 120.40 123.03 1n5o s VAL 1810Ca 0.11 -1.21 0.02 0.00 0.00 0.00 0.00 61.98 60.90 1n5o s VAL 1810Cb -0.12 -0.71 0.12 0.00 0.00 0.00 0.00 36.38 35.68 1n5o s VAL 1810CO 0.01 -0.60 0.22 -1.58 0.00 0.00 0.00 175.10 173.16 1n5o s GLN 1811N -2.16 1.94 0.24 2.72 0.74 -1.26 0.87 119.66 122.74 1n5o s GLN 1811Ca -0.08 -2.28 -0.09 0.00 0.05 0.00 0.00 55.36 52.97 1n5o s GLN 1811Cb -0.05 -3.40 0.37 0.00 1.10 0.00 0.00 33.01 31.03 1n5o s GLN 1811CO -0.03 -1.07 1.39 -2.30 -0.55 0.00 0.00 175.29 172.73 1n5o n PRO 1812N 3.72 -0.11 -0.31 1.67 -0.02 -1.26 -2.42 135.00 136.26 1n5o n PRO 1812Ca 0.04 1.38 0.05 0.00 -2.02 0.00 0.00 63.50 62.96 1n5o n PRO 1812Cb 0.37 -2.06 0.20 0.00 -0.02 0.00 0.00 33.50 31.99 1n5o n PRO 1812CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1n5o h ASP 1813N 0.00 0.71 0.18 2.55 5.19 -1.95 -3.01 116.42 120.10 1n5o h ASP 1813Ca 0.40 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.87 1n5o h ASP 1813Cb 0.62 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.06 1n5o h ASP 1813CO -0.91 0.38 0.00 0.00 -3.12 0.00 0.00 179.24 175.59 1n5o h ALA 1814N 1.50 1.00 -2.46 3.45 0.00 -1.76 -3.44 119.26 117.55 1n5o h ALA 1814Ca 0.44 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.83 1n5o h ALA 1814Cb 0.47 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1n5o h ALA 1814CO -0.28 0.00 -0.46 1.67 0.00 0.00 0.00 179.25 180.18 1n5o s TRP 1815N -3.98 3.45 0.00 0.00 -0.00 -1.14 -4.83 118.94 112.44 1n5o s TRP 1815Ca -0.03 0.07 0.06 0.00 -0.00 0.00 0.00 56.10 56.20 1n5o s TRP 1815Cb 0.11 -1.63 0.10 0.00 -0.00 0.00 0.00 33.47 32.05 1n5o s TRP 1815CO 0.41 0.50 0.96 2.41 -0.00 0.00 0.00 176.95 181.23 1n5o n THR 1816N -0.77 0.00 -0.86 0.66 -1.04 -1.26 -5.08 114.28 105.93 1n5o n THR 1816Ca -0.08 -0.23 -0.26 0.00 -2.04 0.00 0.00 64.05 61.45 1n5o n THR 1816Cb 0.55 0.54 0.05 0.00 -1.82 0.00 0.00 70.33 69.64 1n5o n THR 1816CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1n5o n GLY 1820N 0.11 -2.38 1.73 3.41 0.00 -1.26 -5.25 105.19 101.55 1n5o n GLY 1820Ca -0.15 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.52 1n5o n GLY 1820CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1n5o n PHE 1821N -3.55 -0.09 -0.07 1.61 7.35 -1.26 -4.93 117.46 116.53 1n5o n PHE 1821Ca -0.01 -1.14 0.08 0.00 -0.76 0.00 0.00 57.45 55.62 1n5o n PHE 1821Cb 0.51 -0.18 0.27 0.00 0.35 0.00 0.00 39.48 40.44 1n5o n PHE 1821CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 1n5o n HIS 1822N -0.79 1.10 -1.53 -5.13 -0.00 -1.26 -4.21 115.22 103.40 1n5o n HIS 1822Ca -0.06 -0.45 0.01 0.00 -0.00 0.00 0.00 57.72 57.21 1n5o n HIS 1822Cb 0.30 -0.17 0.20 0.00 -0.00 0.00 0.00 29.99 30.32 1n5o n HIS 1822CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1n5o n ALA 1823N 0.88 4.00 0.09 -1.41 0.00 -1.26 -0.67 120.51 122.14 1n5o n ALA 1823Ca 0.20 -3.23 -0.17 0.00 0.00 0.00 0.00 53.44 50.24 1n5o n ALA 1823Cb 0.68 -0.54 -0.10 0.00 0.00 0.00 0.00 19.45 19.49 1n5o n ALA 1823CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1n5o h ILE 1824N 1.00 1.41 -0.02 0.00 1.08 -1.92 -3.11 117.51 115.94 1n5o h ILE 1824Ca 0.11 -2.69 0.01 0.00 -0.39 0.00 0.00 64.86 61.90 1n5o h ILE 1824Cb 1.33 2.70 -0.00 0.00 -3.07 0.00 0.00 36.82 37.78 1n5o h ILE 1824CO 0.20 0.80 0.03 1.23 -0.69 0.00 0.00 178.15 179.71 1n5o h GLY 1825N 1.11 0.00 2.00 5.37 0.00 -1.81 0.26 103.07 110.01 1n5o h GLY 1825Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1n5o h GLY 1825CO 0.20 0.00 0.00 1.46 0.00 0.00 0.00 176.54 178.20 1n5o h GLN 1826N 0.00 0.00 -0.00 4.80 4.20 -1.77 -3.28 115.11 119.06 1n5o h GLN 1826Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1n5o h GLN 1826Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1n5o h GLN 1826CO -0.00 0.00 -0.28 -1.33 -0.67 0.00 0.00 178.83 176.55 1n5o n MET 1827N -2.61 4.24 -3.67 1.46 2.81 0.86 -5.06 117.12 115.15 1n5o n MET 1827Ca 0.03 -0.11 -0.08 0.00 -1.81 0.00 0.00 57.70 55.73 1n5o n MET 1827Cb 0.35 -0.86 -0.02 0.00 -0.71 0.00 0.00 33.22 31.98 1n5o n MET 1827CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1n5o n GLU 1829N -0.41 4.59 -4.24 0.00 -0.58 -1.26 -4.39 120.64 114.34 1n5o n GLU 1829Ca -0.09 -4.61 -0.20 0.00 -0.42 0.00 0.00 57.16 51.85 1n5o n GLU 1829Cb 0.61 -2.39 -0.12 0.00 -0.57 0.00 0.00 31.44 28.97 1n5o n GLU 1829CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n5o s ALA 1830N -4.07 1.26 0.29 0.62 0.00 -1.26 -4.93 121.76 113.66 1n5o s ALA 1830Ca 0.43 -0.99 -0.29 0.00 0.00 0.00 0.00 51.96 51.11 1n5o s ALA 1830Cb 0.24 -0.14 -0.10 0.00 0.00 0.00 0.00 23.12 23.12 1n5o s ALA 1830CO -0.16 0.21 1.40 -1.25 0.00 0.00 0.00 175.76 175.96 1n5o s PRO 1831N -1.60 4.28 -0.28 0.00 0.04 -1.26 -4.82 135.00 131.36 1n5o s PRO 1831Ca 0.00 2.30 -0.06 0.00 0.04 0.00 0.00 61.00 63.28 1n5o s PRO 1831Cb -0.09 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1n5o s PRO 1831CO 0.02 -0.36 0.05 0.08 0.04 0.00 0.00 177.00 176.83 1n5o s VAL 1832N -0.45 3.83 0.26 -0.36 1.01 -1.26 -0.26 120.40 123.17 1n5o s VAL 1832Ca 0.55 -0.64 0.11 0.00 0.00 0.00 0.00 61.98 62.01 1n5o s VAL 1832Cb -0.42 -2.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 1n5o s VAL 1832CO 0.48 0.16 -0.17 0.68 0.00 0.00 0.00 175.10 176.26 1n5o s VAL 1833N 1.49 2.66 0.53 2.92 -7.23 0.30 -0.70 120.40 120.38 1n5o s VAL 1833Ca 0.03 -2.25 -0.15 0.00 -1.81 0.00 0.00 61.98 57.80 1n5o s VAL 1833Cb -0.16 -2.39 -0.07 0.00 0.56 0.00 0.00 36.38 34.32 1n5o s VAL 1833CO 0.01 -0.35 0.97 0.28 -0.31 0.00 0.00 175.10 175.70 1n5o s THR 1834N -2.36 4.60 0.29 5.32 -1.32 -0.88 -0.41 115.64 120.89 1n5o s THR 1834Ca 0.29 1.07 0.35 0.00 -1.21 0.00 0.00 61.69 62.19 1n5o s THR 1834Cb -0.06 -3.76 0.36 0.00 -1.51 0.00 0.00 72.50 67.53 1n5o s THR 1834CO 0.15 -0.79 2.08 0.08 -2.21 0.00 0.00 174.62 173.94 1n5o h ARG 1835N 0.64 0.00 -0.04 7.08 0.11 0.12 -1.10 114.38 121.20 1n5o h ARG 1835Ca -0.46 0.00 0.01 0.00 0.10 0.00 0.00 59.98 59.63 1n5o h ARG 1835Cb 1.19 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.26 1n5o h ARG 1835CO 0.62 0.00 0.04 0.93 0.10 0.00 0.00 179.97 181.66 1n5o h GLU 1836N 0.00 0.00 0.10 0.08 3.07 -1.92 -1.60 114.58 114.31 1n5o h GLU 1836Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n5o h GLU 1836Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1n5o h GLU 1836CO 0.00 0.00 -0.05 2.35 -1.40 0.00 0.00 179.01 179.91 1n5o h TRP 1837N 0.00 -0.12 0.03 4.33 7.01 -1.56 -0.73 115.95 124.91 1n5o h TRP 1837Ca 0.02 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 1n5o h TRP 1837Cb 0.11 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.21 1n5o h TRP 1837CO 0.00 0.02 -0.01 0.28 -2.79 0.00 0.00 178.44 175.93 1n5o h VAL 1838N -0.24 0.97 0.05 2.65 2.07 -1.51 -1.29 116.25 118.94 1n5o h VAL 1838Ca -0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.51 1n5o h VAL 1838Cb 0.20 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1n5o h VAL 1838CO 0.02 0.00 -0.07 -0.07 0.02 0.00 0.00 177.57 177.47 1n5o h LEU 1839N -0.04 -0.20 -0.11 2.57 3.38 -1.30 0.20 115.31 119.81 1n5o h LEU 1839Ca -0.00 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1n5o h LEU 1839Cb 0.03 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1n5o h LEU 1839CO 0.01 -0.11 0.06 0.44 0.09 0.00 0.00 178.44 178.93 1n5o h ASP 1840N -0.15 0.14 -0.82 -0.43 3.32 -1.13 0.51 116.42 117.87 1n5o h ASP 1840Ca 0.01 -0.07 0.11 0.00 0.02 0.00 0.00 57.03 57.11 1n5o h ASP 1840Cb 0.16 -0.04 -0.08 0.00 0.22 0.00 0.00 39.33 39.60 1n5o h ASP 1840CO -0.04 0.17 0.44 0.28 -1.72 0.00 0.00 179.24 178.36 1n5o h SER 1841N 0.10 0.58 -0.03 6.45 0.02 -0.87 0.12 113.55 119.93 1n5o h SER 1841Ca 0.04 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 1n5o h SER 1841Cb 0.06 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1n5o h SER 1841CO -0.01 0.30 -0.09 0.58 -1.14 0.00 0.00 176.83 176.48 1n5o h VAL 1842N 0.70 1.46 -0.45 2.27 2.07 -0.80 -1.52 116.25 119.97 1n5o h VAL 1842Ca 0.42 -1.49 0.09 0.00 0.82 0.00 0.00 66.70 66.53 1n5o h VAL 1842Cb 0.48 2.38 -0.10 0.00 -1.52 0.00 0.00 31.29 32.53 1n5o h VAL 1842CO -0.30 0.40 -0.25 0.00 0.02 0.00 0.00 177.57 177.45 1n5o h ALA 1843N 0.42 0.04 -0.00 1.67 0.00 0.09 -1.09 119.26 120.38 1n5o h ALA 1843Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1n5o h ALA 1843Cb 0.70 0.58 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1n5o h ALA 1843CO 0.02 -0.61 -0.03 1.28 0.00 0.00 0.00 179.25 179.91 1n5o n LEU 1844N -5.41 0.33 -4.35 0.00 4.77 -0.06 -4.28 117.00 108.00 1n5o n LEU 1844Ca 0.03 -0.01 -0.38 0.00 -0.03 0.00 0.00 56.01 55.62 1n5o n LEU 1844Cb 0.32 -0.11 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1n5o n LEU 1844CO 0.08 0.06 -0.12 0.00 -1.33 0.00 0.00 177.39 176.07 1n5o n TYR 1845N -0.89 -1.47 -3.69 -1.77 9.36 -0.42 -4.54 117.16 113.74 1n5o n TYR 1845Ca 0.19 0.74 -0.11 0.00 3.32 0.00 0.00 57.90 62.03 1n5o n TYR 1845Cb 0.21 -2.55 -0.12 0.00 -0.63 0.00 0.00 39.34 36.26 1n5o n TYR 1845CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 1n5o s GLN 1846N -7.07 0.27 -0.01 2.98 1.11 -0.78 -4.85 119.66 111.30 1n5o s GLN 1846Ca 0.69 0.74 -0.30 0.00 0.01 0.00 0.00 55.36 56.51 1n5o s GLN 1846Cb -0.39 0.00 -0.08 0.00 -1.01 0.00 0.00 33.01 31.53 1n5o s GLN 1846CO 0.97 -0.20 1.93 0.00 0.01 0.00 0.00 175.29 178.00 1n5o s GLN 1848N 4.60 4.27 -0.19 0.00 2.00 -1.26 -4.99 119.66 124.09 1n5o s GLN 1848Ca 0.87 0.94 -0.29 0.00 -2.00 0.00 0.00 55.36 54.88 1n5o s GLN 1848Cb -0.40 -2.75 -0.02 0.00 0.80 0.00 0.00 33.01 30.65 1n5o s GLN 1848CO 0.39 0.31 1.41 -1.83 -0.50 0.00 0.00 175.29 175.06 1n5o s GLU 1849N -2.23 4.05 0.58 1.67 -1.05 -1.26 -4.87 118.70 115.60 1n5o s GLU 1849Ca 0.47 1.64 0.34 0.00 -0.15 0.00 0.00 54.97 57.27 1n5o s GLU 1849Cb -0.15 -3.88 1.32 0.00 -0.44 0.00 0.00 34.13 30.97 1n5o s GLU 1849CO 0.20 -0.96 1.57 -0.07 0.95 0.00 0.00 175.26 176.96 1n5o h LEU 1850N 10.51 0.00 -0.80 1.83 3.38 -2.00 -3.19 115.31 125.04 1n5o h LEU 1850Ca -0.30 0.00 0.15 0.00 0.09 0.00 0.00 57.88 57.82 1n5o h LEU 1850Cb 1.12 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.73 1n5o h LEU 1850CO 0.99 0.00 -0.22 0.47 0.09 0.00 0.00 178.44 179.77 1n5o n ASP 1851N -3.64 -0.34 -0.06 -0.43 9.92 -1.26 -0.91 116.55 119.83 1n5o n ASP 1851Ca 0.25 1.38 0.14 0.00 -0.53 0.00 0.00 54.79 56.03 1n5o n ASP 1851Cb 1.39 -0.40 0.63 0.00 -0.64 0.00 0.00 41.12 42.11 1n5o n ASP 1851CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1n5o n THR 1852N -5.28 0.00 0.11 -3.53 -2.24 -1.21 -3.62 114.28 98.53 1n5o n THR 1852Ca 0.12 -0.03 0.01 0.00 -2.27 0.00 0.00 64.05 61.88 1n5o n THR 1852Cb 0.38 -0.23 -0.01 0.00 -2.10 0.00 0.00 70.33 68.38 1n5o n THR 1852CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1n5o n TYR 1853N -1.14 0.00 -1.87 4.78 4.02 -0.09 -5.05 117.16 117.81 1n5o n TYR 1853Ca 0.13 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.63 1n5o n TYR 1853Cb 0.28 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.61 1n5o n TYR 1853CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1n5o s LEU 1854N -1.62 4.10 -0.08 7.72 1.43 -0.72 -2.07 118.68 127.44 1n5o s LEU 1854Ca 0.01 2.82 -0.01 0.00 -1.03 0.00 0.00 54.13 55.92 1n5o s LEU 1854Cb 0.02 -3.98 -0.03 0.00 0.03 0.00 0.00 46.19 42.23 1n5o s LEU 1854CO 0.08 -1.13 -0.01 -0.63 0.23 0.00 0.00 176.35 174.89 1n5o s ILE 1855N -1.24 4.22 -0.54 -0.59 1.01 0.12 -4.92 121.20 119.26 1n5o s ILE 1855Ca 0.61 -0.28 -0.38 0.00 0.00 0.00 0.00 60.65 60.60 1n5o s ILE 1855Cb -0.41 -2.77 -0.17 0.00 0.01 0.00 0.00 42.46 39.12 1n5o s ILE 1855CO 0.53 0.60 2.26 -2.65 0.00 0.00 0.00 174.94 175.68 1n5o n PRO 1856N 2.19 0.36 -3.70 2.79 -0.02 -1.26 -4.80 135.00 130.56 1n5o n PRO 1856Ca -0.18 0.08 -0.37 0.00 -2.02 0.00 0.00 63.50 61.01 1n5o n PRO 1856Cb 0.53 -1.87 -0.12 0.00 -0.02 0.00 0.00 33.50 32.03 1n5o n PRO 1856CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1n5o s GLN 1857N 6.69 3.61 -0.00 -0.52 -1.52 -1.26 -4.57 119.66 122.08 1n5o s GLN 1857Ca 1.19 -0.52 -0.30 0.00 -1.95 0.00 0.00 55.36 53.78 1n5o s GLN 1857Cb -1.21 -3.44 -0.05 0.00 -0.22 0.00 0.00 33.01 28.10 1n5o s GLN 1857CO 0.56 -0.25 1.27 0.42 -0.25 0.00 0.00 175.29 177.05 1n5o s ILE 1858N 1.63 3.99 -2.00 1.08 1.01 0.16 -5.00 121.20 122.07 1n5o s ILE 1858Ca 0.06 1.37 0.00 0.00 0.00 0.00 0.00 60.65 62.09 1n5o s ILE 1858Cb -0.16 -3.88 0.01 0.00 0.01 0.00 0.00 42.46 38.44 1n5o s ILE 1858CO 0.05 0.03 0.53 -2.65 0.00 0.00 0.00 174.94 172.90