#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k16 s MET 1650N 0.00 3.26 -0.09 -0.14 -1.94 -1.26 -5.01 119.30 114.12 3k16 s MET 1650Ca 0.00 -0.74 -0.08 0.00 -1.71 0.00 0.00 55.69 53.16 3k16 s MET 1650Cb 0.00 -2.83 0.03 0.00 2.01 0.00 0.00 34.83 34.03 3k16 s MET 1650CO 0.00 0.48 0.24 0.45 -0.01 0.00 0.00 175.02 176.18 3k16 s SER 1651N -3.41 -0.25 0.16 3.03 0.15 -1.26 -2.90 113.70 109.22 3k16 s SER 1651Ca 0.33 0.48 0.10 0.00 0.70 0.00 0.00 55.95 57.57 3k16 s SER 1651Cb -0.10 0.46 -0.04 0.00 -1.71 0.00 0.00 66.02 64.63 3k16 s SER 1651CO 0.27 -0.10 -0.23 -0.04 1.20 0.00 0.00 173.24 174.34 3k16 s MET 1652N 0.34 1.37 0.19 5.44 -1.94 0.17 -0.30 119.30 124.58 3k16 s MET 1652Ca -0.02 -1.40 0.05 0.00 -1.71 0.00 0.00 55.69 52.62 3k16 s MET 1652Cb -0.03 -1.68 -0.05 0.00 2.01 0.00 0.00 34.83 35.08 3k16 s MET 1652CO -0.01 0.37 -0.08 0.14 -0.01 0.00 0.00 175.02 175.43 3k16 s VAL 1653N -1.50 1.27 0.22 -6.03 -7.23 -0.90 -1.32 120.40 104.91 3k16 s VAL 1653Ca 0.16 -2.09 0.08 0.00 -1.81 0.00 0.00 61.98 58.32 3k16 s VAL 1653Cb -0.08 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 3k16 s VAL 1653CO 0.07 -0.58 0.02 0.68 -0.31 0.00 0.00 175.10 174.99 3k16 s VAL 1654N -3.26 3.68 0.03 1.32 -7.23 -1.26 -0.86 120.40 112.82 3k16 s VAL 1654Ca 0.22 -1.64 0.01 0.00 -1.81 0.00 0.00 61.98 58.76 3k16 s VAL 1654Cb 0.03 -2.92 -0.02 0.00 0.56 0.00 0.00 36.38 34.02 3k16 s VAL 1654CO 0.05 -0.26 -0.05 -0.55 -0.31 0.00 0.00 175.10 173.98 3k16 s SER 1655N -3.37 0.50 -0.09 4.85 0.15 0.16 -4.86 113.70 111.03 3k16 s SER 1655Ca 0.30 -0.60 0.00 0.00 0.70 0.00 0.00 55.95 56.34 3k16 s SER 1655Cb -0.08 0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 3k16 s SER 1655CO 0.20 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.93 3k16 n GLY 1656N 1.29 0.47 0.00 9.45 0.00 -1.26 -2.43 105.19 112.71 3k16 n GLY 1656Ca -0.22 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.02 3k16 n GLY 1656CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k16 n LEU 1657N -0.10 0.00 -4.11 0.99 4.77 -1.26 -4.65 117.00 112.65 3k16 n LEU 1657Ca -0.01 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.88 3k16 n LEU 1657Cb 0.03 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.03 3k16 n LEU 1657CO 0.01 -0.15 -0.29 0.42 -1.33 0.00 0.00 177.39 176.05 3k16 s THR 1658N 1.65 0.14 0.18 -5.08 -4.23 -1.26 -4.97 115.64 102.07 3k16 s THR 1658Ca 0.00 -1.82 -0.26 0.00 -1.18 0.00 0.00 61.69 58.43 3k16 s THR 1658Cb 0.00 -1.83 0.04 0.00 1.34 0.00 0.00 72.50 72.05 3k16 s THR 1658CO 0.00 -0.64 1.53 -2.65 -0.54 0.00 0.00 174.62 172.32 3k16 n PRO 1659N -0.03 -0.36 -0.10 3.99 -0.02 -1.26 0.15 135.00 137.37 3k16 n PRO 1659Ca -0.09 1.51 -0.09 0.00 -2.02 0.00 0.00 63.50 62.81 3k16 n PRO 1659Cb 0.63 -2.23 -0.01 0.00 -0.02 0.00 0.00 33.50 31.87 3k16 n PRO 1659CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3k16 h GLU 1660N 0.00 0.44 0.08 -0.52 9.09 -1.98 1.30 114.58 122.99 3k16 h GLU 1660Ca 0.22 -0.04 0.02 0.00 0.05 0.00 0.00 59.36 59.62 3k16 h GLU 1660Cb 0.47 -0.09 -0.05 0.00 -1.65 0.00 0.00 28.75 27.43 3k16 h GLU 1660CO -0.95 0.32 -0.39 0.93 0.05 0.00 0.00 179.01 178.97 3k16 h GLU 1661N 0.43 -0.58 -0.35 1.06 5.08 -1.52 -0.99 114.58 117.71 3k16 h GLU 1661Ca 0.12 0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.58 3k16 h GLU 1661Cb -0.01 0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.29 3k16 h GLU 1661CO -0.02 -0.39 -0.44 0.35 -1.00 0.00 0.00 179.01 177.51 3k16 h PHE 1662N -0.60 -1.27 -1.13 4.33 3.04 0.26 -0.65 116.94 120.91 3k16 h PHE 1662Ca 0.03 0.07 0.32 0.00 3.98 0.00 0.00 57.97 62.37 3k16 h PHE 1662Cb 0.65 0.61 -0.10 0.00 2.56 0.00 0.00 35.95 39.66 3k16 h PHE 1662CO -0.37 -0.45 0.73 0.52 -2.02 0.00 0.00 178.31 176.72 3k16 h MET 1663N -0.36 0.27 -0.19 1.11 2.86 0.20 0.30 114.93 119.12 3k16 h MET 1663Ca 0.12 -0.02 -0.19 0.00 -2.06 0.00 0.00 59.70 57.55 3k16 h MET 1663Cb 0.59 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 32.20 3k16 h MET 1663CO -0.54 0.18 -0.63 -0.07 1.06 0.00 0.00 176.91 176.91 3k16 h LEU 1664N 0.28 0.88 -1.10 1.22 3.38 0.19 -0.51 115.31 119.65 3k16 h LEU 1664Ca 0.66 -0.60 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 3k16 h LEU 1664Cb 1.86 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 42.33 3k16 h LEU 1664CO -0.31 1.32 0.29 0.58 0.09 0.00 0.00 178.44 180.41 3k16 h VAL 1665N 0.48 1.22 0.18 1.22 2.07 0.82 -2.45 116.25 119.78 3k16 h VAL 1665Ca -0.03 -0.64 0.01 0.00 0.82 0.00 0.00 66.70 66.87 3k16 h VAL 1665Cb 1.25 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 3k16 h VAL 1665CO 0.13 0.26 -0.29 0.22 0.02 0.00 0.00 177.57 177.92 3k16 h TYR 1666N 0.92 -0.78 -0.73 1.57 3.20 -0.38 -0.38 116.97 120.39 3k16 h TYR 1666Ca 0.22 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.22 3k16 h TYR 1666Cb 0.13 0.32 -0.13 0.00 1.54 0.00 0.00 36.73 38.59 3k16 h TYR 1666CO 0.01 -0.40 -0.41 -0.22 -1.64 0.00 0.00 178.16 175.50 3k16 h LYS 1667N -0.54 -0.12 -0.76 1.82 3.64 -0.92 0.43 116.57 120.11 3k16 h LYS 1667Ca 0.02 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 3k16 h LYS 1667Cb 0.54 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.29 3k16 h LYS 1667CO -0.13 -0.08 -0.54 0.35 -2.27 0.00 0.00 179.45 176.78 3k16 h PHE 1668N -0.13 -1.71 0.90 1.91 3.57 -1.19 -1.58 116.94 118.71 3k16 h PHE 1668Ca 0.24 0.11 -0.04 0.00 3.53 0.00 0.00 57.97 61.81 3k16 h PHE 1668Cb 0.56 0.85 0.00 0.00 2.79 0.00 0.00 35.95 40.15 3k16 h PHE 1668CO -0.76 -0.38 -0.49 0.00 -2.23 0.00 0.00 178.31 174.45 3k16 h ALA 1669N 0.23 -1.31 -0.97 2.41 0.00 0.14 -0.45 119.26 119.32 3k16 h ALA 1669Ca 0.12 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.86 3k16 h ALA 1669Cb 0.43 0.57 -0.13 0.00 0.00 0.00 0.00 17.79 18.66 3k16 h ALA 1669CO -0.78 -1.24 -0.52 0.54 0.00 0.00 0.00 179.25 177.25 3k16 n ARG 1670N -5.65 -0.38 -0.11 0.00 5.12 0.89 0.27 116.66 116.81 3k16 n ARG 1670Ca -0.16 1.47 -0.05 0.00 -1.93 0.00 0.00 57.85 57.18 3k16 n ARG 1670Cb 0.52 -2.16 0.02 0.00 -1.16 0.00 0.00 32.46 29.67 3k16 n ARG 1670CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 3k16 h LYS 1671N 0.00 0.07 -0.09 5.56 3.64 -0.93 -3.02 116.57 121.80 3k16 h LYS 1671Ca 0.20 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 3k16 h LYS 1671Cb 0.44 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 3k16 h LYS 1671CO -0.92 0.05 0.00 0.72 -2.27 0.00 0.00 179.45 177.03 3k16 n HIS 1672N -5.21 0.10 -2.92 1.91 8.25 0.14 -4.88 115.22 112.61 3k16 n HIS 1672Ca 0.02 -0.05 -0.14 0.00 -0.26 0.00 0.00 57.72 57.29 3k16 n HIS 1672Cb 0.19 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.34 3k16 n HIS 1672CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3k16 n HIS 1673N 0.49 -1.45 -3.97 4.41 8.25 0.68 -5.02 115.22 118.61 3k16 n HIS 1673Ca 0.17 0.46 -0.36 0.00 -0.26 0.00 0.00 57.72 57.73 3k16 n HIS 1673Cb 0.40 -3.27 -0.07 0.00 1.12 0.00 0.00 29.99 28.17 3k16 n HIS 1673CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3k16 s ILE 1674N -3.05 5.25 0.29 1.59 1.01 -0.91 -4.78 121.20 120.61 3k16 s ILE 1674Ca 0.26 0.11 -0.26 0.00 0.00 0.00 0.00 60.65 60.77 3k16 s ILE 1674Cb -0.12 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.97 3k16 s ILE 1674CO 0.33 0.60 0.91 -0.89 0.00 0.00 0.00 174.94 175.89 3k16 s THR 1675N -0.87 4.23 -0.09 2.92 2.01 -1.14 -4.49 115.64 118.22 3k16 s THR 1675Ca 0.14 1.82 -0.02 0.00 0.31 0.00 0.00 61.69 63.94 3k16 s THR 1675Cb -0.12 -4.07 0.03 0.00 0.01 0.00 0.00 72.50 68.36 3k16 s THR 1675CO 0.03 0.25 0.03 -0.22 -0.69 0.00 0.00 174.62 174.01 3k16 s LEU 1676N -1.81 0.53 0.38 4.42 2.96 -1.26 -0.65 118.68 123.25 3k16 s LEU 1676Ca 0.47 -0.17 0.05 0.00 -0.22 0.00 0.00 54.13 54.25 3k16 s LEU 1676Cb -0.20 -0.37 -0.06 0.00 0.50 0.00 0.00 46.19 46.06 3k16 s LEU 1676CO 0.25 -0.23 0.04 0.42 -1.32 0.00 0.00 176.35 175.51 3k16 s THR 1677N 2.02 1.39 -0.56 3.68 -4.23 -0.44 -4.96 115.64 112.54 3k16 s THR 1677Ca 0.04 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.79 3k16 s THR 1677Cb -0.13 -2.74 0.09 0.00 1.34 0.00 0.00 72.50 71.06 3k16 s THR 1677CO -0.05 0.00 1.35 0.78 -0.54 0.00 0.00 174.62 176.16 3k16 h ASN 1678N 1.87 0.00 -2.98 3.99 -0.26 -2.00 -3.40 115.58 112.80 3k16 h ASN 1678Ca -0.42 -0.13 -0.22 0.00 -0.56 0.00 0.00 56.30 54.97 3k16 h ASN 1678Cb 1.25 0.00 -0.32 0.00 -1.06 0.00 0.00 38.32 38.19 3k16 h ASN 1678CO 0.73 0.07 -0.53 -0.76 -1.06 0.00 0.00 177.43 175.87 3k16 s LEU 1679N -4.63 -0.14 0.27 1.61 1.43 -1.26 -4.95 118.68 111.01 3k16 s LEU 1679Ca 0.06 0.56 -0.29 0.00 -1.03 0.00 0.00 54.13 53.42 3k16 s LEU 1679Cb 0.12 0.67 -0.09 0.00 0.03 0.00 0.00 46.19 46.91 3k16 s LEU 1679CO 0.71 -0.23 1.09 -0.51 0.23 0.00 0.00 176.35 177.65 3k16 s ILE 1680N 2.18 3.52 0.25 -0.59 2.07 -1.26 -4.97 121.20 122.41 3k16 s ILE 1680Ca -0.01 1.53 -0.05 0.00 -1.41 0.00 0.00 60.65 60.71 3k16 s ILE 1680Cb -0.12 -3.97 -0.02 0.00 0.13 0.00 0.00 42.46 38.48 3k16 s ILE 1680CO -0.08 0.36 0.33 0.42 -1.91 0.00 0.00 174.94 174.06 3k16 s THR 1681N -1.14 0.00 0.17 4.00 -4.23 -1.26 -4.99 115.64 108.19 3k16 s THR 1681Ca 0.44 -1.71 0.11 0.00 -1.18 0.00 0.00 61.69 59.36 3k16 s THR 1681Cb -0.32 -2.42 0.18 0.00 1.34 0.00 0.00 72.50 71.28 3k16 s THR 1681CO 0.40 0.00 0.66 -0.62 -0.54 0.00 0.00 174.62 174.52 3k16 n GLU 1682N -0.39 -0.02 -0.03 3.99 1.02 -1.26 -1.62 120.64 122.32 3k16 n GLU 1682Ca 0.01 0.55 -0.01 0.00 -0.02 0.00 0.00 57.16 57.69 3k16 n GLU 1682Cb 0.63 -1.04 -0.09 0.00 -0.02 0.00 0.00 31.44 30.93 3k16 n GLU 1682CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3k16 n GLU 1683N -3.71 1.52 -1.64 3.49 1.02 -1.26 -4.91 120.64 115.15 3k16 n GLU 1683Ca 0.16 -0.04 -0.63 0.00 -0.02 0.00 0.00 57.16 56.63 3k16 n GLU 1683Cb 0.60 -1.27 -0.09 0.00 -0.02 0.00 0.00 31.44 30.66 3k16 n GLU 1683CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3k16 n THR 1684N -2.20 0.02 -0.01 2.62 -1.04 -0.64 -4.68 114.28 108.34 3k16 n THR 1684Ca -0.11 -0.00 0.05 0.00 -2.04 0.00 0.00 64.05 61.95 3k16 n THR 1684Cb 0.63 -0.35 -0.10 0.00 -1.82 0.00 0.00 70.33 68.69 3k16 n THR 1684CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 3k16 n THR 1685N 2.93 0.08 -4.29 12.58 -2.24 0.59 -4.86 114.28 119.06 3k16 n THR 1685Ca 0.26 -0.32 -0.18 0.00 -2.27 0.00 0.00 64.05 61.54 3k16 n THR 1685Cb 0.02 0.12 -0.10 0.00 -2.10 0.00 0.00 70.33 68.27 3k16 n THR 1685CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3k16 s HIS 1686N -2.85 1.52 -0.27 4.78 3.76 -0.15 -1.39 115.29 120.70 3k16 s HIS 1686Ca -0.05 -0.60 -0.04 0.00 -0.15 0.00 0.00 55.06 54.22 3k16 s HIS 1686Cb 0.08 -0.75 0.09 0.00 1.11 0.00 0.00 32.58 33.11 3k16 s HIS 1686CO 0.54 0.23 0.13 0.08 -0.85 0.00 0.00 174.74 174.86 3k16 s VAL 1687N -2.73 -0.08 -0.21 -0.90 1.01 0.11 -2.12 120.40 115.48 3k16 s VAL 1687Ca 0.17 -0.67 -0.22 0.00 0.00 0.00 0.00 61.98 61.26 3k16 s VAL 1687Cb -0.02 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 3k16 s VAL 1687CO 0.04 -0.66 0.68 -0.69 0.00 0.00 0.00 175.10 174.47 3k16 s VAL 1688N 2.11 4.97 -0.13 2.92 1.01 -0.04 -2.29 120.40 128.95 3k16 s VAL 1688Ca 0.08 1.28 -0.00 0.00 0.00 0.00 0.00 61.98 63.34 3k16 s VAL 1688Cb -0.16 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.22 3k16 s VAL 1688CO -0.33 0.06 -0.13 -0.04 0.00 0.00 0.00 175.10 174.66 3k16 s MET 1689N 2.20 3.38 -0.12 2.72 -1.94 0.86 0.38 119.30 126.78 3k16 s MET 1689Ca 0.30 -0.69 -0.41 0.00 -1.71 0.00 0.00 55.69 53.18 3k16 s MET 1689Cb -0.16 -2.62 -0.19 0.00 2.01 0.00 0.00 34.83 33.87 3k16 s MET 1689CO 0.10 0.21 1.32 1.17 -0.01 0.00 0.00 175.02 177.81 3k16 n LYS 1690N 3.53 0.39 -4.08 2.03 3.00 -1.02 0.13 118.16 122.15 3k16 n LYS 1690Ca -0.18 0.14 -0.10 0.00 -0.00 0.00 0.00 58.31 58.17 3k16 n LYS 1690Cb 0.53 -1.69 -0.09 0.00 0.00 0.00 0.00 35.03 33.78 3k16 n LYS 1690CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 3k16 s THR 1691N 1.16 0.09 0.83 3.15 -4.23 -1.26 -4.20 115.64 111.19 3k16 s THR 1691Ca 0.93 -1.72 -0.08 0.00 -1.18 0.00 0.00 61.69 59.65 3k16 s THR 1691Cb -1.23 -1.97 0.18 0.00 1.34 0.00 0.00 72.50 70.83 3k16 s THR 1691CO 0.61 -0.40 1.14 -0.90 -0.54 0.00 0.00 174.62 174.53 3k16 n ASP 1692N -0.14 0.70 0.00 3.99 5.68 -0.60 -4.82 116.55 121.37 3k16 n ASP 1692Ca -0.06 -1.79 0.00 0.00 -0.50 0.00 0.00 54.79 52.44 3k16 n ASP 1692Cb 0.63 -0.81 0.00 0.00 -1.14 0.00 0.00 41.12 39.80 3k16 n ASP 1692CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k16 n ALA 1693N -3.38 0.00 -3.01 2.12 0.00 -1.26 -1.71 120.51 113.27 3k16 n ALA 1693Ca -0.19 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.10 3k16 n ALA 1693Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.01 3k16 n ALA 1693CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3k16 n GLU 1694N -2.43 1.08 -2.70 0.00 0.28 -1.26 -5.01 120.64 110.61 3k16 n GLU 1694Ca 0.00 -3.37 -0.11 0.00 -0.16 0.00 0.00 57.16 53.52 3k16 n GLU 1694Cb 0.00 -1.57 0.02 0.00 1.43 0.00 0.00 31.44 31.32 3k16 n GLU 1694CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 3k16 n PHE 1695N 0.16 -1.02 -3.77 -1.84 0.99 -0.69 -4.78 117.46 106.52 3k16 n PHE 1695Ca 0.20 0.29 -0.36 0.00 -0.00 0.00 0.00 57.45 57.58 3k16 n PHE 1695Cb 0.71 -2.71 -0.12 0.00 -1.00 0.00 0.00 39.48 36.36 3k16 n PHE 1695CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 3k16 s VAL 1696N -2.90 4.49 0.62 -4.37 1.01 -1.26 -0.37 120.40 117.62 3k16 s VAL 1696Ca 0.17 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.10 3k16 s VAL 1696Cb -0.07 -3.10 0.10 0.00 0.00 0.00 0.00 36.38 33.31 3k16 s VAL 1696CO 0.21 0.34 0.86 0.00 0.00 0.00 0.00 175.10 176.51 3k16 s GLU 1698N -4.82 2.63 -0.53 0.00 2.02 -1.26 -2.44 118.70 114.30 3k16 s GLU 1698Ca 0.63 -0.65 -0.20 0.00 0.02 0.00 0.00 54.97 54.78 3k16 s GLU 1698Cb -0.05 -2.46 0.06 0.00 0.10 0.00 0.00 34.13 31.77 3k16 s GLU 1698CO 0.41 -0.67 0.71 1.03 0.02 0.00 0.00 175.26 176.75 3k16 s ARG 1699N -4.77 3.15 0.26 1.61 0.52 -1.26 -4.93 118.95 113.53 3k16 s ARG 1699Ca 0.56 -0.83 0.11 0.00 -0.52 0.00 0.00 55.73 55.05 3k16 s ARG 1699Cb -0.10 -4.12 -0.05 0.00 0.52 0.00 0.00 34.95 31.20 3k16 s ARG 1699CO 0.39 -1.34 -0.20 0.95 0.02 0.00 0.00 175.30 175.13 3k16 s THR 1700N 2.94 2.37 0.22 0.02 -4.23 -1.26 -5.00 115.64 110.70 3k16 s THR 1700Ca 0.18 -2.35 -0.17 0.00 -1.18 0.00 0.00 61.69 58.17 3k16 s THR 1700Cb -0.19 -2.25 0.22 0.00 1.34 0.00 0.00 72.50 71.62 3k16 s THR 1700CO 0.12 -0.40 1.58 0.25 -0.54 0.00 0.00 174.62 175.63 3k16 h LEU 1701N 2.39 -1.13 -1.62 4.79 5.85 -1.96 2.26 115.31 125.90 3k16 h LEU 1701Ca -0.40 0.26 0.03 0.00 0.84 0.00 0.00 57.88 58.60 3k16 h LEU 1701Cb 1.25 0.61 -0.02 0.00 0.37 0.00 0.00 40.66 42.87 3k16 h LEU 1701CO 0.59 -0.29 0.29 0.11 -0.34 0.00 0.00 178.44 178.81 3k16 h LYS 1702N -0.07 0.49 -0.37 1.25 1.57 -1.97 0.12 116.57 117.58 3k16 h LYS 1702Ca 0.31 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 59.14 3k16 h LYS 1702Cb 0.58 -0.11 -0.08 0.00 0.08 0.00 0.00 32.23 32.70 3k16 h LYS 1702CO -0.81 0.33 -0.15 -0.92 -0.57 0.00 0.00 179.45 177.32 3k16 h TYR 1703N 0.51 -0.36 0.04 -1.35 3.20 0.34 0.27 116.97 119.62 3k16 h TYR 1703Ca 0.18 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 3k16 h TYR 1703Cb 0.08 0.22 0.01 0.00 1.54 0.00 0.00 36.73 38.57 3k16 h TYR 1703CO -0.00 -0.23 -0.38 0.74 -1.64 0.00 0.00 178.16 176.66 3k16 h PHE 1704N -0.08 0.31 0.00 -3.82 -1.00 -0.01 -2.59 116.94 109.75 3k16 h PHE 1704Ca 0.18 -0.19 -0.03 0.00 2.81 0.00 0.00 57.97 60.74 3k16 h PHE 1704Cb 0.36 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 39.89 3k16 h PHE 1704CO -0.38 1.07 -0.14 -0.07 -1.61 0.00 0.00 178.31 177.18 3k16 h LEU 1705N -0.54 0.00 0.00 1.54 3.38 -1.16 0.16 115.31 118.69 3k16 h LEU 1705Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3k16 h LEU 1705Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3k16 h LEU 1705CO 0.07 0.14 0.00 0.61 0.09 0.00 0.00 178.44 179.35 3k16 n GLY 1706N -1.00 -3.24 0.13 0.83 0.00 0.08 -1.53 105.19 100.46 3k16 n GLY 1706Ca -0.02 0.53 -0.08 0.00 0.00 0.00 0.00 46.02 46.44 3k16 n GLY 1706CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3k16 h ILE 1707N 0.00 0.74 -1.24 -0.61 5.03 -1.00 -1.31 117.51 119.12 3k16 h ILE 1707Ca 0.00 0.00 0.41 0.00 -0.12 0.00 0.00 64.86 65.15 3k16 h ILE 1707Cb 0.00 0.74 -0.13 0.00 -3.03 0.00 0.00 36.82 34.39 3k16 h ILE 1707CO 0.00 0.00 0.78 0.00 -0.68 0.00 0.00 178.15 178.25 3k16 h ALA 1708N 1.17 2.58 -0.36 1.87 0.00 -0.67 0.97 119.26 124.82 3k16 h ALA 1708Ca 0.11 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3k16 h ALA 1708Cb 0.20 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3k16 h ALA 1708CO -0.24 -1.21 0.00 0.41 0.00 0.00 0.00 179.25 178.21 3k16 n GLY 1709N -1.47 1.05 3.68 0.00 0.00 -0.58 -4.47 105.19 103.40 3k16 n GLY 1709Ca 0.36 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 3k16 n GLY 1709CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k16 n GLY 1710N 1.28 -0.46 3.70 -0.02 0.00 0.34 -4.95 105.19 105.08 3k16 n GLY 1710Ca 0.17 0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 3k16 n GLY 1710CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k16 s LYS 1711N -6.33 0.78 -0.42 1.61 -0.14 -0.57 -4.58 119.74 110.09 3k16 s LYS 1711Ca 0.51 0.57 -0.29 0.00 -1.36 0.00 0.00 55.97 55.40 3k16 s LYS 1711Cb -0.28 -1.77 0.01 0.00 -1.68 0.00 0.00 37.83 34.10 3k16 s LYS 1711CO 0.63 -2.51 1.42 -1.58 -0.76 0.00 0.00 175.35 172.55 3k16 s TRP 1712N -3.00 2.38 -0.54 3.18 0.52 -0.48 -4.78 118.94 116.22 3k16 s TRP 1712Ca 0.64 0.66 -0.12 0.00 0.02 0.00 0.00 56.10 57.31 3k16 s TRP 1712Cb -0.18 -4.32 0.13 0.00 -1.15 0.00 0.00 33.47 27.96 3k16 s TRP 1712CO 0.57 -1.99 0.45 0.08 0.02 0.00 0.00 176.95 176.08 3k16 s VAL 1713N 5.50 4.71 0.05 4.03 1.01 -1.26 0.06 120.40 134.50 3k16 s VAL 1713Ca 0.61 -1.79 0.09 0.00 0.00 0.00 0.00 61.98 60.89 3k16 s VAL 1713Cb -0.13 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 3k16 s VAL 1713CO 0.32 -0.84 -0.26 0.68 0.00 0.00 0.00 175.10 175.01 3k16 s VAL 1714N 1.28 2.08 0.16 2.92 -7.23 -0.97 -1.48 120.40 117.16 3k16 s VAL 1714Ca 0.06 -1.37 -0.27 0.00 -1.81 0.00 0.00 61.98 58.59 3k16 s VAL 1714Cb -0.26 -1.78 -0.08 0.00 0.56 0.00 0.00 36.38 34.83 3k16 s VAL 1714CO -0.00 0.34 0.86 -0.94 -0.31 0.00 0.00 175.10 175.05 3k16 s SER 1715N -1.24 7.46 0.02 4.85 1.04 -1.16 -0.10 113.70 124.58 3k16 s SER 1715Ca 0.11 1.73 0.02 0.00 0.48 0.00 0.00 55.95 58.29 3k16 s SER 1715Cb -0.10 -2.54 0.08 0.00 0.10 0.00 0.00 66.02 63.56 3k16 s SER 1715CO 0.02 0.12 0.08 0.00 0.98 0.00 0.00 173.24 174.45 3k16 n TYR 1716N 1.93 0.04 0.23 5.02 -0.00 0.36 -0.37 117.16 124.38 3k16 n TYR 1716Ca -0.03 0.04 0.06 0.00 -0.00 0.00 0.00 57.90 57.98 3k16 n TYR 1716Cb 0.48 -0.41 0.53 0.00 -0.00 0.00 0.00 39.34 39.95 3k16 n TYR 1716CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.86 177.60 3k16 h PHE 1717N 0.00 0.00 -0.93 2.98 0.05 -1.90 0.80 116.94 117.94 3k16 h PHE 1717Ca 0.05 0.00 0.14 0.00 3.82 0.00 0.00 57.97 61.98 3k16 h PHE 1717Cb 0.14 0.00 -0.15 0.00 2.00 0.00 0.00 35.95 37.94 3k16 h PHE 1717CO -0.00 0.18 -0.40 2.35 -0.18 0.00 0.00 178.31 180.26 3k16 h TRP 1718N 0.00 -1.15 0.59 -0.55 7.01 -1.03 -1.76 115.95 119.06 3k16 h TRP 1718Ca -0.00 0.10 -0.03 0.00 2.11 0.00 0.00 58.89 61.07 3k16 h TRP 1718Cb 0.34 0.64 0.01 0.00 -2.10 0.00 0.00 29.16 28.04 3k16 h TRP 1718CO 0.00 -0.40 -0.28 0.28 -2.79 0.00 0.00 178.44 175.25 3k16 h VAL 1719N -0.03 0.00 0.00 2.65 2.07 -1.03 -1.01 116.25 118.90 3k16 h VAL 1719Ca 0.31 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.79 3k16 h VAL 1719Cb 0.58 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.34 3k16 h VAL 1719CO -0.93 0.00 -0.01 0.71 0.02 0.00 0.00 177.57 177.35 3k16 h THR 1720N -0.82 0.99 -0.02 2.57 1.35 -1.44 0.24 112.91 115.78 3k16 h THR 1720Ca -0.08 -0.04 -0.11 0.00 -0.55 0.00 0.00 66.41 65.63 3k16 h THR 1720Cb 0.60 1.02 0.01 0.00 -1.73 0.00 0.00 68.15 68.05 3k16 h THR 1720CO 0.13 0.01 -0.43 -0.61 -0.25 0.00 0.00 175.52 174.37 3k16 h GLN 1721N 0.00 0.33 0.00 4.72 5.75 -1.37 0.31 115.11 124.85 3k16 h GLN 1721Ca -0.00 -0.33 -0.02 0.00 -0.15 0.00 0.00 58.65 58.15 3k16 h GLN 1721Cb 0.02 0.09 -0.00 0.00 1.07 0.00 0.00 27.48 28.65 3k16 h GLN 1721CO 0.00 1.01 -0.08 0.77 -2.65 0.00 0.00 178.83 177.88 3k16 h SER 1722N -0.21 0.00 -0.02 -0.69 0.02 0.37 0.46 113.55 113.48 3k16 h SER 1722Ca -0.05 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.82 3k16 h SER 1722Cb 1.14 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.69 3k16 h SER 1722CO 0.09 0.08 -0.31 0.40 -1.14 0.00 0.00 176.83 175.95 3k16 h ILE 1723N 0.00 1.49 -0.62 3.27 2.04 -0.58 -0.58 117.51 122.53 3k16 h ILE 1723Ca -0.00 -1.87 -0.05 0.00 1.00 0.00 0.00 64.86 63.94 3k16 h ILE 1723Cb 0.23 2.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.87 3k16 h ILE 1723CO 0.01 0.52 0.19 0.50 0.00 0.00 0.00 178.15 179.37 3k16 h LYS 1724N -0.35 0.95 -0.64 2.37 3.64 0.14 0.31 116.57 122.99 3k16 h LYS 1724Ca -0.03 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 3k16 h LYS 1724Cb 1.02 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 3k16 h LYS 1724CO 0.06 0.82 0.00 0.39 -2.27 0.00 0.00 179.45 178.45 3k16 n GLU 1725N -4.27 3.63 -4.32 1.90 1.02 0.14 -4.95 120.64 113.78 3k16 n GLU 1725Ca 0.05 -2.51 -0.31 0.00 -0.02 0.00 0.00 57.16 54.36 3k16 n GLU 1725Cb 0.22 -1.91 -0.10 0.00 -0.02 0.00 0.00 31.44 29.63 3k16 n GLU 1725CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 3k16 n ARG 1726N 0.82 -1.00 -2.12 3.49 -4.01 0.10 -4.88 116.66 109.05 3k16 n ARG 1726Ca 0.23 0.10 0.00 0.00 -1.04 0.00 0.00 57.85 57.14 3k16 n ARG 1726Cb 0.86 -3.67 0.00 0.00 -3.04 0.00 0.00 32.46 26.62 3k16 n ARG 1726CO 0.00 0.00 0.00 1.63 -3.04 0.00 0.00 177.63 176.22 3k16 n LYS 1727N -4.56 0.05 -3.05 2.89 4.76 -0.26 -5.04 118.16 112.95 3k16 n LYS 1727Ca -0.31 -0.15 -0.43 0.00 -2.87 0.00 0.00 58.31 54.55 3k16 n LYS 1727Cb 0.69 0.24 -0.06 0.00 -1.84 0.00 0.00 35.03 34.05 3k16 n LYS 1727CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3k16 s MET 1728N -2.00 3.31 0.91 1.97 -1.94 -1.26 -4.26 119.30 116.03 3k16 s MET 1728Ca 0.05 -0.30 -0.15 0.00 -1.71 0.00 0.00 55.69 53.58 3k16 s MET 1728Cb -0.00 -3.96 0.16 0.00 2.01 0.00 0.00 34.83 33.04 3k16 s MET 1728CO 0.00 -1.07 1.28 -0.51 -0.01 0.00 0.00 175.02 174.71 3k16 s LEU 1729N 3.00 2.64 -0.52 -0.03 1.43 -1.26 -4.96 118.68 118.98 3k16 s LEU 1729Ca 0.25 0.44 -0.26 0.00 -1.03 0.00 0.00 54.13 53.53 3k16 s LEU 1729Cb -0.14 -2.63 0.03 0.00 0.03 0.00 0.00 46.19 43.49 3k16 s LEU 1729CO 0.20 -2.47 1.03 0.21 0.23 0.00 0.00 176.35 175.55 3k16 s ASN 1730N -4.78 6.46 0.40 2.29 2.47 -1.26 -4.83 114.94 115.69 3k16 s ASN 1730Ca 0.70 0.03 0.31 0.00 0.42 0.00 0.00 52.86 54.32 3k16 s ASN 1730Cb -0.06 -2.49 1.33 0.00 -1.45 0.00 0.00 41.25 38.58 3k16 s ASN 1730CO 0.52 -1.24 1.36 -0.62 -3.72 0.00 0.00 177.10 173.39 3k16 n GLU 1731N 7.67 -0.03 -0.35 0.43 4.71 -1.26 0.13 120.64 131.94 3k16 n GLU 1731Ca 0.06 1.07 0.10 0.00 -0.01 0.00 0.00 57.16 58.39 3k16 n GLU 1731Cb 0.48 -2.16 0.29 0.00 -1.01 0.00 0.00 31.44 29.05 3k16 n GLU 1731CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 3k16 h HIS 1732N 0.00 1.10 -0.66 -0.32 2.76 -2.02 -1.71 115.15 114.29 3k16 h HIS 1732Ca 0.78 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.98 3k16 h HIS 1732Cb 2.60 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 31.22 3k16 h HIS 1732CO -0.00 0.33 0.00 -0.25 -1.30 0.00 0.00 177.93 176.71 3k16 n ASP 1733N -4.69 4.12 0.00 3.26 8.00 0.35 -4.28 116.55 123.30 3k16 n ASP 1733Ca 0.21 -2.20 0.00 0.00 0.71 0.00 0.00 54.79 53.51 3k16 n ASP 1733Cb 0.48 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 3k16 n ASP 1733CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3k16 n PHE 1734N 1.31 0.00 -1.10 1.24 3.01 -0.65 -5.04 117.46 116.23 3k16 n PHE 1734Ca 0.24 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.35 3k16 n PHE 1734Cb 0.71 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 40.27 3k16 n PHE 1734CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3k16 n GLU 1735N -0.12 0.09 -3.11 -1.08 1.02 -1.19 -2.97 120.64 113.27 3k16 n GLU 1735Ca 0.00 0.07 -0.41 0.00 -0.02 0.00 0.00 57.16 56.80 3k16 n GLU 1735Cb 0.08 -1.75 -0.06 0.00 -0.02 0.00 0.00 31.44 29.68 3k16 n GLU 1735CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3k16 s VAL 1736N -2.07 4.97 -0.06 2.62 0.11 -0.55 -4.72 120.40 120.71 3k16 s VAL 1736Ca 0.61 1.06 0.28 0.00 -2.93 0.00 0.00 61.98 60.99 3k16 s VAL 1736Cb -0.30 -3.95 0.33 0.00 -1.53 0.00 0.00 36.38 30.93 3k16 s VAL 1736CO 0.63 -0.02 1.82 0.03 -3.33 0.00 0.00 175.10 174.23 3k16 h ARG 1737N 7.98 0.00 0.00 1.54 3.08 -1.01 -3.41 114.38 122.55 3k16 h ARG 1737Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 3k16 h ARG 1737Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.17 3k16 h ARG 1737CO 0.78 0.07 0.00 0.41 -1.07 0.00 0.00 179.97 180.16 3k16 n GLY 1738N 0.42 -1.47 3.43 0.04 0.00 -1.24 0.43 105.19 106.80 3k16 n GLY 1738Ca 0.02 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.88 3k16 n GLY 1738CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3k16 s ASP 1739N -3.00 -0.57 0.44 1.61 1.47 -0.89 -2.52 116.67 113.21 3k16 s ASP 1739Ca 0.00 0.05 0.21 0.00 1.18 0.00 0.00 52.55 53.99 3k16 s ASP 1739Cb 0.00 0.58 1.18 0.00 -0.34 0.00 0.00 42.92 44.34 3k16 s ASP 1739CO 0.00 -0.92 1.84 -0.37 0.68 0.00 0.00 175.17 176.40 3k16 h VAL 1740N 2.07 0.62 0.13 2.11 -1.51 -1.78 -2.64 116.25 115.25 3k16 h VAL 1740Ca -0.33 -0.11 -0.28 0.00 -1.23 0.00 0.00 66.70 64.75 3k16 h VAL 1740Cb 1.29 0.27 0.00 0.00 -2.13 0.00 0.00 31.29 30.73 3k16 h VAL 1740CO 0.38 0.06 -1.42 0.58 -1.23 0.00 0.00 177.57 175.93 3k16 h VAL 1741N 0.32 1.05 -0.57 7.19 2.07 -1.96 -3.40 116.25 120.94 3k16 h VAL 1741Ca 0.49 -2.42 0.00 0.00 0.82 0.00 0.00 66.70 65.58 3k16 h VAL 1741Cb 1.37 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 33.89 3k16 h VAL 1741CO -0.16 0.73 0.00 0.59 0.02 0.00 0.00 177.57 178.74 3k16 n ASN 1742N -3.89 3.98 0.00 0.57 3.02 -1.05 -5.00 115.26 112.89 3k16 n ASN 1742Ca -0.24 -2.23 0.00 0.00 -0.03 0.00 0.00 54.58 52.08 3k16 n ASN 1742Cb 0.92 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 3k16 n ASN 1742CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k16 n GLY 1743N 1.02 2.73 0.00 7.41 0.00 -1.02 -4.81 105.19 110.53 3k16 n GLY 1743Ca 0.22 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3k16 n GLY 1743CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k16 n ARG 1744N 1.55 0.00 -2.73 1.61 1.74 -1.26 -2.10 116.66 115.48 3k16 n ARG 1744Ca 0.00 0.26 -0.05 0.00 -0.77 0.00 0.00 57.85 57.29 3k16 n ARG 1744Cb 0.00 -1.53 0.04 0.00 -1.02 0.00 0.00 32.46 29.95 3k16 n ARG 1744CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3k16 n ASN 1745N -1.25 -2.60 0.00 0.55 2.85 -1.26 -4.40 115.26 109.15 3k16 n ASN 1745Ca 0.00 -2.59 0.00 0.00 -0.11 0.00 0.00 54.58 51.88 3k16 n ASN 1745Cb 0.03 1.47 0.00 0.00 1.24 0.00 0.00 39.78 42.51 3k16 n ASN 1745CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3k16 n HIS 1746N 2.17 0.00 -1.53 1.20 1.44 0.10 -4.99 115.22 113.61 3k16 n HIS 1746Ca 0.11 -0.05 -0.18 0.00 -2.01 0.00 0.00 57.72 55.59 3k16 n HIS 1746Cb 0.62 -0.01 -0.07 0.00 0.12 0.00 0.00 29.99 30.65 3k16 n HIS 1746CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 3k16 n GLN 1747N -0.05 -1.23 0.00 -1.40 1.13 0.17 -4.88 117.38 111.12 3k16 n GLN 1747Ca 0.00 1.12 0.00 0.00 -1.94 0.00 0.00 57.00 56.18 3k16 n GLN 1747Cb 0.47 -5.37 0.00 0.00 0.11 0.00 0.00 30.24 25.45 3k16 n GLN 1747CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k16 n GLY 1748N -0.80 -3.35 0.37 1.08 0.00 -1.25 -1.85 105.19 99.38 3k16 n GLY 1748Ca -0.18 0.69 0.01 0.00 0.00 0.00 0.00 46.02 46.55 3k16 n GLY 1748CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3k16 h PRO 1749N 0.00 1.11 0.00 1.61 0.11 -1.80 -2.30 132.00 130.73 3k16 h PRO 1749Ca 0.00 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3k16 h PRO 1749Cb 0.00 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 30.86 3k16 h PRO 1749CO 0.00 0.73 0.00 1.17 -0.21 0.00 0.00 178.00 179.69 3k16 n LYS 1750N -4.45 0.00 -0.29 1.05 4.81 -1.08 0.12 118.16 118.33 3k16 n LYS 1750Ca 0.12 0.55 -0.02 0.00 -0.87 0.00 0.00 58.31 58.09 3k16 n LYS 1750Cb 0.11 -1.00 0.01 0.00 0.02 0.00 0.00 35.03 34.17 3k16 n LYS 1750CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 3k16 n ARG 1751N -1.38 -0.21 -0.03 1.64 5.12 -0.77 -1.68 116.66 119.35 3k16 n ARG 1751Ca 0.00 1.12 -0.12 0.00 -1.93 0.00 0.00 57.85 56.92 3k16 n ARG 1751Cb 0.00 -1.66 -0.07 0.00 -1.16 0.00 0.00 32.46 29.57 3k16 n ARG 1751CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3k16 h ALA 1752N 0.86 0.13 -1.00 7.54 0.00 -0.98 -1.16 119.26 124.66 3k16 h ALA 1752Ca 0.22 -0.19 0.22 0.00 0.00 0.00 0.00 54.91 55.16 3k16 h ALA 1752Cb 0.41 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.06 3k16 h ALA 1752CO -0.72 -0.17 0.62 -0.09 0.00 0.00 0.00 179.25 178.90 3k16 h ARG 1753N -0.12 0.56 0.00 0.00 2.43 0.19 -2.01 114.38 115.44 3k16 h ARG 1753Ca 0.03 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3k16 h ARG 1753Cb 0.38 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3k16 h ARG 1753CO 0.01 0.37 -1.32 0.39 -1.51 0.00 0.00 179.97 177.91 3k16 n GLU 1754N -4.70 0.43 -0.95 0.20 1.02 -0.57 -4.31 120.64 111.77 3k16 n GLU 1754Ca 0.24 -0.04 -0.20 0.00 -0.02 0.00 0.00 57.16 57.13 3k16 n GLU 1754Cb 0.70 -1.60 0.10 0.00 -0.02 0.00 0.00 31.44 30.61 3k16 n GLU 1754CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3k16 n SER 1755N -2.14 4.95 0.00 1.62 7.64 -0.55 -4.48 113.62 120.66 3k16 n SER 1755Ca -0.00 -3.23 0.14 0.00 1.01 0.00 0.00 58.87 56.79 3k16 n SER 1755Cb 0.49 -0.86 0.81 0.00 -1.01 0.00 0.00 64.21 63.64 3k16 n SER 1755CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k16 n GLN 1756N -0.47 0.71 -0.59 1.43 1.13 -1.26 -2.49 117.38 115.84 3k16 n GLN 1756Ca 0.43 0.01 0.10 0.00 -1.94 0.00 0.00 57.00 55.60 3k16 n GLN 1756Cb 1.04 -1.50 0.36 0.00 0.11 0.00 0.00 30.24 30.25 3k16 n GLN 1756CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3k16 n ASP 1757N -1.12 4.69 -2.65 1.08 8.00 -1.26 -4.71 116.55 120.58 3k16 n ASP 1757Ca 0.18 -2.37 -0.03 0.00 0.71 0.00 0.00 54.79 53.28 3k16 n ASP 1757Cb 0.15 -0.57 0.05 0.00 -0.02 0.00 0.00 41.12 40.72 3k16 n ASP 1757CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3k16 n ARG 1758N 1.26 0.01 -2.34 -1.24 1.85 -1.04 -5.15 116.66 110.01 3k16 n ARG 1758Ca 0.26 -0.54 -0.38 0.00 -1.00 0.00 0.00 57.85 56.19 3k16 n ARG 1758Cb 0.86 0.36 -0.02 0.00 -1.05 0.00 0.00 32.46 32.60 3k16 n ARG 1758CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3k16 s LYS 1759N 0.82 4.12 0.66 2.89 -0.14 -1.25 -4.89 119.74 121.95 3k16 s LYS 1759Ca 0.23 1.80 0.29 0.00 -1.36 0.00 0.00 55.97 56.93 3k16 s LYS 1759Cb 0.16 -2.71 1.59 0.00 -1.68 0.00 0.00 37.83 35.19 3k16 s LYS 1759CO -0.11 -0.25 1.90 -0.84 -0.76 0.00 0.00 175.35 175.29 3k16 h ILE 1760N 2.38 0.01 -0.18 2.17 3.07 -1.87 0.23 117.51 123.31 3k16 h ILE 1760Ca -0.48 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.93 3k16 h ILE 1760Cb 1.23 0.65 0.00 0.00 -0.27 0.00 0.00 36.82 38.43 3k16 h ILE 1760CO 0.63 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 178.22 3k16 n PHE 1761N -2.90 0.60 -0.54 0.16 0.99 -0.30 -4.78 117.46 110.69 3k16 n PHE 1761Ca -0.02 -0.86 -0.20 0.00 -0.00 0.00 0.00 57.45 56.36 3k16 n PHE 1761Cb 0.40 -0.23 -0.02 0.00 -1.00 0.00 0.00 39.48 38.63 3k16 n PHE 1761CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3k16 n ARG 1762N -0.69 0.00 -3.62 -1.08 1.74 0.06 -1.63 116.66 111.45 3k16 n ARG 1762Ca 0.18 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.99 3k16 n ARG 1762Cb 0.76 -0.49 0.02 0.00 -1.02 0.00 0.00 32.46 31.72 3k16 n ARG 1762CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k16 n GLY 1763N 0.61 -0.50 3.34 -0.13 0.00 -1.23 -4.86 105.19 102.41 3k16 n GLY 1763Ca 0.07 0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 3k16 n GLY 1763CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k16 s LEU 1764N -6.99 2.15 -0.40 0.99 1.43 -1.06 -3.88 118.68 110.92 3k16 s LEU 1764Ca 0.54 -0.57 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 3k16 s LEU 1764Cb -0.27 -1.30 0.10 0.00 0.03 0.00 0.00 46.19 44.76 3k16 s LEU 1764CO 0.66 0.27 0.20 -0.70 0.23 0.00 0.00 176.35 177.01 3k16 s GLU 1765N -1.14 2.13 -0.01 1.70 2.12 0.31 -1.59 118.70 122.22 3k16 s GLU 1765Ca 0.11 -1.73 -0.02 0.00 0.36 0.00 0.00 54.97 53.69 3k16 s GLU 1765Cb -0.10 -3.58 -0.04 0.00 0.26 0.00 0.00 34.13 30.67 3k16 s GLU 1765CO 0.02 -1.03 0.18 0.42 -0.54 0.00 0.00 175.26 174.31 3k16 s ILE 1766N 1.19 5.41 -0.10 -3.70 1.01 -0.83 -0.54 121.20 123.63 3k16 s ILE 1766Ca 0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.50 3k16 s ILE 1766Cb -0.23 -3.53 0.04 0.00 0.01 0.00 0.00 42.46 38.75 3k16 s ILE 1766CO -0.03 0.31 0.06 0.00 0.00 0.00 0.00 174.94 175.29 3k16 s TYR 1769N 3.75 2.76 0.12 0.00 5.04 0.19 -4.95 117.35 124.26 3k16 s TYR 1769Ca 0.42 -0.37 0.00 0.00 -2.44 0.00 0.00 57.07 54.68 3k16 s TYR 1769Cb -0.11 -1.73 0.00 0.00 0.35 0.00 0.00 41.96 40.47 3k16 s TYR 1769CO 0.21 0.01 0.00 0.41 -1.34 0.00 0.00 175.55 174.84 3k16 n GLY 1770N 2.87 -1.62 3.85 8.97 0.00 -1.26 -4.48 105.19 113.52 3k16 n GLY 1770Ca -0.18 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.31 3k16 n GLY 1770CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k16 s PRO 1771N -0.90 3.91 0.46 1.61 0.05 -1.26 -4.92 135.00 133.94 3k16 s PRO 1771Ca 0.00 0.38 0.04 0.00 0.05 0.00 0.00 61.00 61.47 3k16 s PRO 1771Cb 0.00 -2.95 -0.04 0.00 0.05 0.00 0.00 34.50 31.55 3k16 s PRO 1771CO 0.00 0.51 0.02 -0.06 0.05 0.00 0.00 177.00 177.51 3k16 s PHE 1772N -1.44 2.13 0.12 0.56 0.40 -1.26 -4.53 117.98 113.95 3k16 s PHE 1772Ca 0.36 -0.86 0.05 0.00 -0.60 0.00 0.00 56.93 55.88 3k16 s PHE 1772Cb -0.15 -1.64 -0.04 0.00 0.51 0.00 0.00 43.02 41.71 3k16 s PHE 1772CO 0.19 0.28 -0.12 0.95 0.70 0.00 0.00 175.22 177.21 3k16 s THR 1773N -2.85 1.18 0.00 0.64 -4.23 -1.26 -4.73 115.64 104.38 3k16 s THR 1773Ca 0.20 -1.75 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 3k16 s THR 1773Cb 0.05 -1.53 0.00 0.00 1.34 0.00 0.00 72.50 72.36 3k16 s THR 1773CO 0.10 -0.52 0.00 0.59 -0.54 0.00 0.00 174.62 174.25 3k16 n ASN 1774N 0.41 -0.83 -3.38 3.99 5.03 -1.26 -4.79 115.26 114.44 3k16 n ASN 1774Ca -0.15 0.00 -0.13 0.00 0.87 0.00 0.00 54.58 55.17 3k16 n ASN 1774Cb 0.58 -1.83 -0.09 0.00 -1.02 0.00 0.00 39.78 37.42 3k16 n ASN 1774CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 3k16 s MET 1775N -0.80 0.33 0.23 3.52 1.75 -1.26 -4.96 119.30 118.11 3k16 s MET 1775Ca 0.00 0.18 -0.32 0.00 -1.25 0.00 0.00 55.69 54.31 3k16 s MET 1775Cb 0.00 -0.60 -0.13 0.00 2.84 0.00 0.00 34.83 36.94 3k16 s MET 1775CO 0.00 -0.85 1.57 -0.35 -0.65 0.00 0.00 175.02 174.74 3k16 n PRO 1776N 5.34 2.42 -0.23 4.11 -0.04 -1.26 -4.73 135.00 140.60 3k16 n PRO 1776Ca -0.02 0.87 0.02 0.00 -0.04 0.00 0.00 63.50 64.32 3k16 n PRO 1776Cb 0.49 -2.63 0.11 0.00 -0.04 0.00 0.00 33.50 31.43 3k16 n PRO 1776CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3k16 h THR 1777N 3.43 0.38 -0.13 0.52 2.02 -1.97 0.20 112.91 117.35 3k16 h THR 1777Ca -0.45 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 66.74 3k16 h THR 1777Cb 1.24 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 3k16 h THR 1777CO 0.84 0.01 0.15 -2.24 0.37 0.00 0.00 175.52 174.65 3k16 h ASP 1778N 0.07 0.00 0.08 4.18 2.03 -1.98 0.30 116.42 121.10 3k16 h ASP 1778Ca 0.36 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.44 3k16 h ASP 1778Cb 0.59 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.11 3k16 h ASP 1778CO -0.63 0.00 -0.89 1.56 -1.03 0.00 0.00 179.24 178.25 3k16 h GLN 1779N 0.00 0.46 -0.31 4.15 1.08 -1.33 0.93 115.11 120.09 3k16 h GLN 1779Ca 0.06 -0.60 0.05 0.00 -1.45 0.00 0.00 58.65 56.71 3k16 h GLN 1779Cb 0.36 0.20 -0.05 0.00 -0.05 0.00 0.00 27.48 27.94 3k16 h GLN 1779CO -0.00 1.24 -0.01 1.25 -0.95 0.00 0.00 178.83 180.36 3k16 h LEU 1780N -0.03 -0.14 -0.95 1.46 5.85 -0.63 0.36 115.31 121.22 3k16 h LEU 1780Ca -0.13 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.67 3k16 h LEU 1780Cb 1.62 0.13 -0.05 0.00 0.37 0.00 0.00 40.66 42.73 3k16 h LEU 1780CO 0.17 -0.04 0.63 -0.33 -0.34 0.00 0.00 178.44 178.53 3k16 h GLU 1781N 0.08 1.24 -0.92 1.25 5.08 -0.47 -0.91 114.58 119.93 3k16 h GLU 1781Ca 0.15 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3k16 h GLU 1781Cb 0.20 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 3k16 h GLU 1781CO -0.26 0.82 0.56 2.35 -1.00 0.00 0.00 179.01 181.49 3k16 h TRP 1782N 1.28 1.20 0.53 4.33 7.01 -0.29 -1.29 115.95 128.71 3k16 h TRP 1782Ca 0.35 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.34 3k16 h TRP 1782Cb -0.13 -0.40 -0.02 0.00 -2.10 0.00 0.00 29.16 26.52 3k16 h TRP 1782CO -0.01 0.79 -0.43 1.98 -2.79 0.00 0.00 178.44 177.99 3k16 h MET 1783N 1.26 -0.91 -0.50 2.65 4.05 0.42 -0.99 114.93 120.92 3k16 h MET 1783Ca 0.33 0.06 -0.07 0.00 -0.28 0.00 0.00 59.70 59.74 3k16 h MET 1783Cb -0.07 0.21 -0.02 0.00 -0.80 0.00 0.00 31.60 30.91 3k16 h MET 1783CO -0.06 -0.60 0.03 -0.39 0.23 0.00 0.00 176.91 176.11 3k16 h VAL 1784N -0.94 1.24 -0.84 -5.77 -1.51 -1.16 0.18 116.25 107.45 3k16 h VAL 1784Ca -0.06 -0.97 0.16 0.00 -1.23 0.00 0.00 66.70 64.60 3k16 h VAL 1784Cb 0.80 0.83 -0.06 0.00 -2.13 0.00 0.00 31.29 30.73 3k16 h VAL 1784CO -0.01 0.35 0.55 1.56 -1.23 0.00 0.00 177.57 178.79 3k16 h GLN 1785N 0.76 0.48 -0.06 5.19 4.20 -1.08 -1.07 115.11 123.53 3k16 h GLN 1785Ca 0.15 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.72 3k16 h GLN 1785Cb 0.42 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3k16 h GLN 1785CO 0.02 0.32 -0.47 -0.07 -0.67 0.00 0.00 178.83 177.95 3k16 h LEU 1786N 0.50 0.15 -3.40 1.46 3.38 0.75 -2.10 115.31 116.05 3k16 h LEU 1786Ca 0.42 -0.07 -0.32 0.00 0.09 0.00 0.00 57.88 58.01 3k16 h LEU 1786Cb 0.90 -0.04 -0.19 0.00 0.09 0.00 0.00 40.66 41.42 3k16 h LEU 1786CO -0.16 0.60 0.40 0.00 0.09 0.00 0.00 178.44 179.37 3k16 n GLY 1788N -0.51 -0.51 3.16 0.00 0.00 -0.79 -1.14 105.19 105.40 3k16 n GLY 1788Ca 0.41 0.05 -0.26 0.00 0.00 0.00 0.00 46.02 46.22 3k16 n GLY 1788CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k16 n ALA 1789N -2.72 -2.48 -3.00 4.61 0.00 -0.64 -2.62 120.51 113.66 3k16 n ALA 1789Ca -0.15 -1.46 -0.12 0.00 0.00 0.00 0.00 53.44 51.71 3k16 n ALA 1789Cb 0.63 -0.09 -0.12 0.00 0.00 0.00 0.00 19.45 19.86 3k16 n ALA 1789CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k16 s SER 1790N -4.46 -0.06 0.25 0.00 1.04 -0.62 -4.42 113.70 105.42 3k16 s SER 1790Ca 0.63 0.09 -0.09 0.00 0.48 0.00 0.00 55.95 57.06 3k16 s SER 1790Cb -0.05 0.21 -0.07 0.00 0.10 0.00 0.00 66.02 66.21 3k16 s SER 1790CO 0.47 -0.11 0.56 -0.69 0.98 0.00 0.00 173.24 174.45 3k16 s VAL 1791N -0.30 4.93 -0.02 5.02 1.01 -1.26 -1.97 120.40 127.80 3k16 s VAL 1791Ca -0.04 0.45 0.05 0.00 0.00 0.00 0.00 61.98 62.44 3k16 s VAL 1791Cb -0.03 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 3k16 s VAL 1791CO 0.00 -0.12 -0.16 -0.69 0.00 0.00 0.00 175.10 174.13 3k16 s VAL 1792N -1.87 1.31 -0.16 2.92 1.01 -0.36 -4.89 120.40 118.36 3k16 s VAL 1792Ca 0.47 -0.70 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 3k16 s VAL 1792Cb -0.11 -1.10 -0.21 0.00 0.00 0.00 0.00 36.38 34.96 3k16 s VAL 1792CO 0.22 0.37 0.49 0.11 0.00 0.00 0.00 175.10 176.30 3k16 h LYS 1793N 5.82 0.00 -6.77 2.72 1.79 -1.93 -3.39 116.57 114.81 3k16 h LYS 1793Ca -0.36 0.00 -0.68 0.00 -2.18 0.00 0.00 60.65 57.44 3k16 h LYS 1793Cb 1.16 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.61 3k16 h LYS 1793CO 0.48 0.90 -0.83 -1.83 -1.08 0.00 0.00 179.45 177.09 3k16 s GLU 1794N -2.23 1.60 0.34 3.15 1.03 -1.26 -4.89 118.70 116.44 3k16 s GLU 1794Ca -0.21 -1.30 0.06 0.00 0.03 0.00 0.00 54.97 53.55 3k16 s GLU 1794Cb 0.00 -1.99 0.74 0.00 -0.80 0.00 0.00 34.13 32.08 3k16 s GLU 1794CO 0.59 0.45 1.88 -0.07 -1.33 0.00 0.00 175.26 176.79 3k16 h LEU 1795N 3.67 0.73 -2.26 1.83 3.38 -1.94 0.93 115.31 121.65 3k16 h LEU 1795Ca -0.50 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.41 3k16 h LEU 1795Cb 1.18 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.76 3k16 h LEU 1795CO 0.44 0.39 0.12 -1.54 0.09 0.00 0.00 178.44 177.94 3k16 n SER 1796N -4.55 2.91 -0.39 -0.43 3.41 -1.26 -2.79 113.62 110.52 3k16 n SER 1796Ca 0.16 -2.36 0.04 0.00 -0.26 0.00 0.00 58.87 56.46 3k16 n SER 1796Cb 0.39 -0.57 0.06 0.00 -0.26 0.00 0.00 64.21 63.83 3k16 n SER 1796CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3k16 n SER 1797N 0.11 2.03 -4.68 4.04 7.64 0.32 -5.02 113.62 118.06 3k16 n SER 1797Ca 0.13 -1.56 -0.42 0.00 1.01 0.00 0.00 58.87 58.03 3k16 n SER 1797Cb 0.71 -0.06 -0.03 0.00 -1.01 0.00 0.00 64.21 63.83 3k16 n SER 1797CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3k16 s PHE 1798N -0.80 2.12 -0.40 1.43 2.99 -1.12 -4.90 117.98 117.29 3k16 s PHE 1798Ca 0.12 0.14 -0.29 0.00 0.00 0.00 0.00 56.93 56.90 3k16 s PHE 1798Cb 0.08 -4.01 -0.08 0.00 0.00 0.00 0.00 43.02 39.00 3k16 s PHE 1798CO 0.11 -4.21 2.32 2.41 -0.00 0.00 0.00 175.22 175.85 3k16 n THR 1799N 5.03 0.13 -1.60 0.64 -1.04 -1.26 -4.97 114.28 111.20 3k16 n THR 1799Ca 0.17 -0.51 -0.30 0.00 -2.04 0.00 0.00 64.05 61.37 3k16 n THR 1799Cb 0.41 -2.30 0.18 0.00 -1.82 0.00 0.00 70.33 66.80 3k16 n THR 1799CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3k16 s LEU 1800N 9.58 1.98 0.00 -4.42 1.43 -1.26 -4.78 118.68 121.21 3k16 s LEU 1800Ca 1.04 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 54.70 3k16 s LEU 1800Cb -0.46 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.16 3k16 s LEU 1800CO 0.36 -3.03 0.00 0.61 0.23 0.00 0.00 176.35 174.52 3k16 n GLY 1801N -2.60 2.75 0.04 -3.19 0.00 -1.26 -4.78 105.19 96.15 3k16 n GLY 1801Ca 0.12 -1.96 0.14 0.00 0.00 0.00 0.00 46.02 44.32 3k16 n GLY 1801CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k16 n THR 1802N 0.22 0.00 -0.27 2.61 -2.24 -1.26 -4.54 114.28 108.80 3k16 n THR 1802Ca 0.00 -0.02 -0.10 0.00 -2.27 0.00 0.00 64.05 61.66 3k16 n THR 1802Cb 0.00 -0.32 -0.09 0.00 -2.10 0.00 0.00 70.33 67.82 3k16 n THR 1802CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3k16 h GLY 1803N 4.99 -1.12 -0.06 3.38 0.00 -1.92 -3.45 103.07 104.88 3k16 h GLY 1803Ca 0.00 0.81 -0.25 0.00 0.00 0.00 0.00 47.33 47.88 3k16 h GLY 1803CO 0.00 -0.15 -0.19 -0.62 0.00 0.00 0.00 176.54 175.59 3k16 n VAL 1804N -4.96 0.00 -3.83 4.60 0.31 -1.26 -5.14 118.33 108.05 3k16 n VAL 1804Ca -0.00 -0.93 -0.29 0.00 -0.01 0.00 0.00 64.34 63.11 3k16 n VAL 1804Cb 0.25 0.20 -0.16 0.00 -0.91 0.00 0.00 33.84 33.22 3k16 n VAL 1804CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 3k16 s HIS 1805N -1.74 1.60 0.25 3.52 0.09 -1.25 -5.02 115.29 112.74 3k16 s HIS 1805Ca 0.01 -1.20 -0.00 0.00 -0.00 0.00 0.00 55.06 53.87 3k16 s HIS 1805Cb 0.00 -1.26 -0.04 0.00 -0.00 0.00 0.00 32.58 31.28 3k16 s HIS 1805CO 0.00 -0.66 0.45 -1.25 -0.00 0.00 0.00 174.74 173.28 3k16 s PRO 1806N 1.66 3.52 -0.13 8.40 0.04 -1.26 -0.53 135.00 146.70 3k16 s PRO 1806Ca -0.02 -0.34 -0.08 0.00 0.04 0.00 0.00 61.00 60.60 3k16 s PRO 1806Cb -0.17 -2.78 0.05 0.00 0.04 0.00 0.00 34.50 31.64 3k16 s PRO 1806CO -0.07 0.32 0.32 0.42 0.04 0.00 0.00 177.00 178.03 3k16 s ILE 1807N -2.02 -0.02 -0.21 0.56 1.01 0.30 -4.10 121.20 116.72 3k16 s ILE 1807Ca 0.39 0.09 -0.15 0.00 0.00 0.00 0.00 60.65 60.97 3k16 s ILE 1807Cb -0.10 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 41.85 3k16 s ILE 1807CO 0.31 0.04 0.38 -0.69 0.00 0.00 0.00 174.94 174.97 3k16 s VAL 1808N 0.97 5.21 -0.22 2.92 1.01 0.11 -1.39 120.40 129.02 3k16 s VAL 1808Ca -0.07 0.66 -0.06 0.00 0.00 0.00 0.00 61.98 62.51 3k16 s VAL 1808Cb -0.07 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 3k16 s VAL 1808CO -0.07 0.25 0.03 -0.69 0.00 0.00 0.00 175.10 174.62 3k16 s VAL 1809N 1.33 4.14 0.31 2.92 1.01 -0.48 -1.21 120.40 128.43 3k16 s VAL 1809Ca 0.18 -0.24 0.08 0.00 0.00 0.00 0.00 61.98 61.99 3k16 s VAL 1809Cb -0.15 -2.90 -0.06 0.00 0.00 0.00 0.00 36.38 33.28 3k16 s VAL 1809CO 0.08 0.40 -0.06 0.68 0.00 0.00 0.00 175.10 176.19 3k16 s VAL 1810N 1.20 1.87 -0.22 2.92 -7.23 -0.39 0.56 120.40 119.10 3k16 s VAL 1810Ca 0.04 -2.14 -0.01 0.00 -1.81 0.00 0.00 61.98 58.06 3k16 s VAL 1810Cb -0.14 -2.57 0.06 0.00 0.56 0.00 0.00 36.38 34.29 3k16 s VAL 1810CO 0.02 -0.23 -0.01 -1.58 -0.31 0.00 0.00 175.10 172.99 3k16 s GLN 1811N -3.69 1.18 0.54 4.82 0.74 -1.26 -0.63 119.66 121.36 3k16 s GLN 1811Ca 0.31 -0.78 0.36 0.00 0.05 0.00 0.00 55.36 55.30 3k16 s GLN 1811Cb 0.04 -2.38 1.71 0.00 1.10 0.00 0.00 33.01 33.48 3k16 s GLN 1811CO 0.14 -0.64 2.07 -1.35 -0.55 0.00 0.00 175.29 174.96 3k16 h PRO 1812N 8.07 0.00 0.00 1.67 0.11 -1.96 -3.07 132.00 136.82 3k16 h PRO 1812Ca -0.17 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.87 3k16 h PRO 1812Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3k16 h PRO 1812CO 0.39 0.00 -0.35 -0.44 -0.21 0.00 0.00 178.00 177.39 3k16 h ASP 1813N 0.00 0.00 -0.34 -2.05 5.19 -1.96 -3.04 116.42 114.23 3k16 h ASP 1813Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 3k16 h ASP 1813Cb 0.25 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.74 3k16 h ASP 1813CO 0.00 0.35 0.03 0.00 -3.12 0.00 0.00 179.24 176.49 3k16 n ALA 1814N -2.38 3.34 -2.81 3.45 0.00 -1.16 -4.92 120.51 116.04 3k16 n ALA 1814Ca -0.01 -1.10 -0.26 0.00 0.00 0.00 0.00 53.44 52.07 3k16 n ALA 1814Cb 0.42 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.74 3k16 n ALA 1814CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3k16 s TRP 1815N -1.96 3.15 -0.17 0.00 0.52 -1.15 -4.79 118.94 114.54 3k16 s TRP 1815Ca 0.30 -0.03 0.15 0.00 0.02 0.00 0.00 56.10 56.55 3k16 s TRP 1815Cb 0.23 -1.50 0.37 0.00 -1.15 0.00 0.00 33.47 31.42 3k16 s TRP 1815CO 0.09 0.52 1.21 2.41 0.02 0.00 0.00 176.95 181.20 3k16 n THR 1816N -0.49 2.08 -4.82 2.01 -1.04 -1.26 -5.09 114.28 105.67 3k16 n THR 1816Ca -0.08 -2.64 -0.25 0.00 -2.04 0.00 0.00 64.05 59.04 3k16 n THR 1816Cb 0.55 -0.25 -0.15 0.00 -1.82 0.00 0.00 70.33 68.66 3k16 n THR 1816CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3k16 s GLU 1817N -3.03 1.47 -0.20 -2.82 0.41 -1.26 -5.04 118.70 108.23 3k16 s GLU 1817Ca 0.36 -0.61 0.00 0.00 -0.41 0.00 0.00 54.97 54.31 3k16 s GLU 1817Cb 0.33 -1.39 -0.13 0.00 -1.78 0.00 0.00 34.13 31.16 3k16 s GLU 1817CO -0.01 0.34 -0.19 -0.25 -0.49 0.00 0.00 175.26 174.66 3k16 n ASP 1818N 2.77 2.32 -0.41 -0.19 9.92 -1.26 -3.70 116.55 125.99 3k16 n ASP 1818Ca -0.15 -0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.04 3k16 n ASP 1818Cb 0.54 -0.36 0.00 0.00 -0.64 0.00 0.00 41.12 40.66 3k16 n ASP 1818CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 3k16 n ASN 1819N -3.20 0.60 0.00 -2.24 5.15 -1.26 -4.69 115.26 109.62 3k16 n ASN 1819Ca -0.37 -1.46 0.00 0.00 -0.60 0.00 0.00 54.58 52.16 3k16 n ASN 1819Cb 0.87 -0.30 0.00 0.00 -0.53 0.00 0.00 39.78 39.82 3k16 n ASN 1819CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k16 n GLY 1820N 0.15 1.08 0.37 8.20 0.00 -1.24 -4.72 105.19 109.03 3k16 n GLY 1820Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 3k16 n GLY 1820CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3k16 n PHE 1821N 0.00 0.00 1.57 1.61 1.16 -1.26 -3.62 117.46 116.93 3k16 n PHE 1821Ca 0.00 0.00 0.15 0.00 -1.87 0.00 0.00 57.45 55.73 3k16 n PHE 1821Cb 0.00 0.00 0.80 0.00 -1.61 0.00 0.00 39.48 38.67 3k16 n PHE 1821CO 0.00 0.00 0.00 0.72 -1.87 0.00 0.00 176.76 175.61 3k16 n HIS 1822N 0.36 0.00 0.02 2.97 -0.00 -1.26 -4.12 115.22 113.19 3k16 n HIS 1822Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.78 3k16 n HIS 1822Cb 0.25 -0.19 0.00 0.00 -0.00 0.00 0.00 29.99 30.06 3k16 n HIS 1822CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3k16 n ALA 1823N -1.19 2.41 -0.33 -1.41 0.00 -1.24 0.37 120.51 119.13 3k16 n ALA 1823Ca 0.17 -0.59 -0.02 0.00 0.00 0.00 0.00 53.44 53.00 3k16 n ALA 1823Cb 0.19 -0.02 0.13 0.00 0.00 0.00 0.00 19.45 19.75 3k16 n ALA 1823CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3k16 h ILE 1824N 0.11 1.25 0.00 0.00 2.04 -1.75 -2.32 117.51 116.84 3k16 h ILE 1824Ca 0.00 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.36 3k16 h ILE 1824Cb 0.11 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.11 3k16 h ILE 1824CO 0.00 0.25 0.00 0.61 0.00 0.00 0.00 178.15 179.01 3k16 n GLY 1825N -1.31 -0.69 0.13 5.37 0.00 -1.26 0.05 105.19 107.46 3k16 n GLY 1825Ca 0.10 0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 3k16 n GLY 1825CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3k16 h GLN 1826N 0.00 0.38 0.00 1.61 4.20 -1.61 -3.30 115.11 116.39 3k16 h GLN 1826Ca 0.00 -0.65 0.00 0.00 0.06 0.00 0.00 58.65 58.06 3k16 h GLN 1826Cb 0.05 0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.07 3k16 h GLN 1826CO 0.00 1.31 0.00 -1.33 -0.67 0.00 0.00 178.83 178.14 3k16 n MET 1827N -3.98 0.89 -3.80 1.46 2.81 0.11 -4.93 117.12 109.68 3k16 n MET 1827Ca -0.15 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 3k16 n MET 1827Cb 0.92 -1.06 0.00 0.00 -0.71 0.00 0.00 33.22 32.38 3k16 n MET 1827CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3k16 n GLU 1829N 0.00 2.00 -4.37 0.00 4.07 -1.26 -4.46 120.64 116.62 3k16 n GLU 1829Ca 0.00 -3.40 -0.27 0.00 -0.06 0.00 0.00 57.16 53.43 3k16 n GLU 1829Cb 0.00 -1.55 -0.12 0.00 -0.06 0.00 0.00 31.44 29.70 3k16 n GLU 1829CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3k16 s ALA 1830N -2.90 2.27 0.44 4.31 0.00 -1.26 -4.96 121.76 119.66 3k16 s ALA 1830Ca 0.40 -1.47 -0.24 0.00 0.00 0.00 0.00 51.96 50.65 3k16 s ALA 1830Cb 0.38 -0.32 -0.10 0.00 0.00 0.00 0.00 23.12 23.07 3k16 s ALA 1830CO -0.05 0.45 0.97 -2.30 0.00 0.00 0.00 175.76 174.84 3k16 n PRO 1831N 0.74 1.26 -5.08 0.00 -0.02 -1.26 -4.80 135.00 125.84 3k16 n PRO 1831Ca -0.17 0.45 -0.32 0.00 -2.02 0.00 0.00 63.50 61.45 3k16 n PRO 1831Cb 0.54 -2.02 -0.16 0.00 -0.02 0.00 0.00 33.50 31.85 3k16 n PRO 1831CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3k16 s VAL 1832N -1.31 2.43 0.20 -1.45 1.01 -1.26 -0.71 120.40 119.31 3k16 s VAL 1832Ca 0.64 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 3k16 s VAL 1832Cb -0.55 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 3k16 s VAL 1832CO 0.56 0.56 0.21 0.68 0.00 0.00 0.00 175.10 177.10 3k16 s VAL 1833N 0.10 0.01 0.48 2.92 -7.23 -0.35 -0.36 120.40 115.97 3k16 s VAL 1833Ca -0.10 -1.83 -0.10 0.00 -1.81 0.00 0.00 61.98 58.15 3k16 s VAL 1833Cb -0.16 -2.35 -0.05 0.00 0.56 0.00 0.00 36.38 34.38 3k16 s VAL 1833CO 0.06 -0.06 0.84 0.42 -0.31 0.00 0.00 175.10 176.05 3k16 s THR 1834N -4.11 4.78 0.42 5.32 -4.23 -1.18 -1.26 115.64 115.39 3k16 s THR 1834Ca 0.33 0.60 0.17 0.00 -1.18 0.00 0.00 61.69 61.61 3k16 s THR 1834Cb 0.05 -3.79 0.37 0.00 1.34 0.00 0.00 72.50 70.47 3k16 s THR 1834CO 0.10 -0.74 1.88 -0.09 -0.54 0.00 0.00 174.62 175.22 3k16 h ARG 1835N 0.64 0.40 -1.13 3.99 2.43 -1.23 0.31 114.38 119.80 3k16 h ARG 1835Ca -0.47 -0.02 0.34 0.00 -0.81 0.00 0.00 59.98 59.02 3k16 h ARG 1835Cb 1.19 -0.09 -0.12 0.00 -0.42 0.00 0.00 29.97 30.53 3k16 h ARG 1835CO 0.63 0.27 0.71 1.49 -1.51 0.00 0.00 179.97 181.55 3k16 h GLU 1836N 0.42 0.27 -0.48 0.20 4.22 -1.93 0.54 114.58 117.82 3k16 h GLU 1836Ca 0.43 -0.02 0.09 0.00 0.08 0.00 0.00 59.36 59.95 3k16 h GLU 1836Cb 1.05 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 30.16 3k16 h GLU 1836CO -0.16 0.18 -0.03 2.35 -2.18 0.00 0.00 179.01 179.17 3k16 h TRP 1837N 0.27 -0.09 -0.19 0.92 7.01 -0.74 -0.53 115.95 122.60 3k16 h TRP 1837Ca 0.71 0.04 -0.08 0.00 2.11 0.00 0.00 58.89 61.66 3k16 h TRP 1837Cb 1.91 0.11 -0.00 0.00 -2.10 0.00 0.00 29.16 29.08 3k16 h TRP 1837CO -0.01 -0.13 -0.20 0.28 -2.79 0.00 0.00 178.44 175.59 3k16 h VAL 1838N 0.08 1.33 0.09 2.65 2.07 -0.08 -1.59 116.25 120.80 3k16 h VAL 1838Ca 0.24 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.38 3k16 h VAL 1838Cb 0.36 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3k16 h VAL 1838CO -0.42 0.42 -0.04 -0.07 0.02 0.00 0.00 177.57 177.47 3k16 h LEU 1839N 0.13 -0.10 -0.63 2.57 3.38 -1.10 0.30 115.31 119.87 3k16 h LEU 1839Ca 0.03 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.72 3k16 h LEU 1839Cb 0.75 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.48 3k16 h LEU 1839CO 0.05 0.29 0.35 0.74 0.09 0.00 0.00 178.44 179.96 3k16 h THR 1840N -0.51 0.98 -0.48 0.22 2.02 -1.22 0.71 112.91 114.63 3k16 h THR 1840Ca -0.01 -0.22 0.06 0.00 0.77 0.00 0.00 66.41 67.00 3k16 h THR 1840Cb 0.43 0.27 -0.05 0.00 -1.74 0.00 0.00 68.15 67.05 3k16 h THR 1840CO 0.02 0.12 0.19 0.28 0.37 0.00 0.00 175.52 176.50 3k16 h SER 1841N 0.65 0.21 -0.08 4.18 0.02 -0.98 -2.00 113.55 115.56 3k16 h SER 1841Ca 0.28 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 61.21 3k16 h SER 1841Cb 0.15 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.72 3k16 h SER 1841CO -0.17 0.15 -0.21 0.58 -1.14 0.00 0.00 176.83 176.05 3k16 h VAL 1842N 0.37 1.42 -0.43 2.27 2.07 0.11 -0.86 116.25 121.20 3k16 h VAL 1842Ca 0.23 -1.56 0.04 0.00 0.82 0.00 0.00 66.70 66.22 3k16 h VAL 1842Cb 0.21 2.24 -0.05 0.00 -1.52 0.00 0.00 31.29 32.17 3k16 h VAL 1842CO -0.21 0.44 -0.26 0.00 0.02 0.00 0.00 177.57 177.56 3k16 h ALA 1843N 0.47 -0.25 0.00 1.67 0.00 0.48 0.55 119.26 122.18 3k16 h ALA 1843Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3k16 h ALA 1843Cb 0.82 1.16 0.00 0.00 0.00 0.00 0.00 17.79 19.77 3k16 h ALA 1843CO 0.05 -0.43 0.00 1.28 0.00 0.00 0.00 179.25 180.15 3k16 n LEU 1844N -3.98 0.00 -0.78 0.00 4.77 -0.76 -4.39 117.00 111.86 3k16 n LEU 1844Ca 0.01 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 3k16 n LEU 1844Cb 0.11 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 3k16 n LEU 1844CO -0.07 -0.15 0.00 0.00 -1.33 0.00 0.00 177.39 175.84 3k16 n TYR 1845N -1.33 -0.78 -3.36 -1.77 9.36 0.18 -4.71 117.16 114.76 3k16 n TYR 1845Ca 0.07 0.00 -0.46 0.00 3.32 0.00 0.00 57.90 60.83 3k16 n TYR 1845Cb 0.14 -0.89 -0.04 0.00 -0.63 0.00 0.00 39.34 37.92 3k16 n TYR 1845CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 3k16 s GLN 1846N -1.57 3.21 0.00 2.98 2.00 -0.81 -4.80 119.66 120.68 3k16 s GLN 1846Ca 0.00 -2.10 0.00 0.00 -2.00 0.00 0.00 55.36 51.26 3k16 s GLN 1846Cb 0.00 -4.30 0.00 0.00 0.80 0.00 0.00 33.01 29.51 3k16 s GLN 1846CO 0.00 -1.29 0.60 0.00 -0.50 0.00 0.00 175.29 174.10 3k16 n GLN 1848N 2.77 -0.05 -4.43 0.00 3.00 -1.26 -5.03 117.38 112.39 3k16 n GLN 1848Ca 0.00 -0.01 -0.21 0.00 -0.01 0.00 0.00 57.00 56.77 3k16 n GLN 1848Cb 0.30 -1.17 -0.10 0.00 0.00 0.00 0.00 30.24 29.27 3k16 n GLN 1848CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 3k16 s GLU 1849N -2.27 1.65 0.00 -1.09 2.02 -1.26 -5.00 118.70 112.74 3k16 s GLU 1849Ca 0.44 -1.93 0.23 0.00 0.02 0.00 0.00 54.97 53.73 3k16 s GLU 1849Cb -0.20 -0.64 0.08 0.00 0.10 0.00 0.00 34.13 33.47 3k16 s GLU 1849CO 0.79 -0.28 1.17 1.28 0.02 0.00 0.00 175.26 178.24 3k16 n LEU 1850N -0.67 2.43 -0.17 1.80 4.32 -1.26 -4.24 117.00 119.20 3k16 n LEU 1850Ca -0.02 -0.85 -0.05 0.00 -0.02 0.00 0.00 56.01 55.07 3k16 n LEU 1850Cb 0.66 -0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.48 3k16 n LEU 1850CO 0.40 0.43 0.68 0.44 -1.22 0.00 0.00 177.39 178.11 3k16 h ASP 1851N 3.37 -0.90 1.17 -1.43 5.19 -1.98 0.45 116.42 122.30 3k16 h ASP 1851Ca 0.00 0.20 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 3k16 h ASP 1851Cb 0.86 0.47 0.00 0.00 0.18 0.00 0.00 39.33 40.84 3k16 h ASP 1851CO 0.00 -0.27 0.00 0.71 -3.12 0.00 0.00 179.24 176.56 3k16 h THR 1852N -0.14 0.00 0.00 0.35 1.35 -2.04 -3.17 112.91 109.27 3k16 h THR 1852Ca 0.23 -0.43 -0.00 0.00 -0.55 0.00 0.00 66.41 65.66 3k16 h THR 1852Cb 0.51 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3k16 h THR 1852CO -0.60 0.00 -1.63 -1.22 -0.25 0.00 0.00 175.52 171.81 3k16 n TYR 1853N -2.43 0.00 -1.37 4.73 4.02 -0.19 -5.01 117.16 116.90 3k16 n TYR 1853Ca 0.03 0.00 -0.46 0.00 -0.01 0.00 0.00 57.90 57.46 3k16 n TYR 1853Cb 0.34 -0.32 -0.02 0.00 -0.02 0.00 0.00 39.34 39.32 3k16 n TYR 1853CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3k16 n LEU 1854N -1.99 -1.68 -4.64 7.72 4.77 0.14 -3.10 117.00 118.23 3k16 n LEU 1854Ca -0.03 1.04 -0.35 0.00 -0.03 0.00 0.00 56.01 56.65 3k16 n LEU 1854Cb 0.37 -0.93 -0.10 0.00 -2.33 0.00 0.00 43.42 40.43 3k16 n LEU 1854CO 0.29 -3.30 -0.30 -0.63 -1.33 0.00 0.00 177.39 172.12 3k16 s ILE 1855N -1.18 4.39 -0.12 -0.08 1.01 0.51 -4.87 121.20 120.87 3k16 s ILE 1855Ca 0.63 -0.20 -0.29 0.00 0.00 0.00 0.00 60.65 60.78 3k16 s ILE 1855Cb -0.85 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 3k16 s ILE 1855CO 0.58 0.55 1.57 -2.16 0.00 0.00 0.00 174.94 175.48 3k16 s PRO 1856N -0.33 4.09 -0.24 2.79 0.04 -1.26 -4.76 135.00 135.33 3k16 s PRO 1856Ca 0.07 1.96 -0.13 0.00 0.04 0.00 0.00 61.00 62.94 3k16 s PRO 1856Cb -0.12 -3.96 -0.04 0.00 0.04 0.00 0.00 34.50 30.42 3k16 s PRO 1856CO 0.02 -0.94 0.28 -0.65 0.04 0.00 0.00 177.00 175.75 3k16 s GLN 1857N 4.10 4.08 -0.26 4.56 -1.52 -1.26 -4.57 119.66 124.79 3k16 s GLN 1857Ca 0.69 -0.06 -0.36 0.00 -1.95 0.00 0.00 55.36 53.68 3k16 s GLN 1857Cb -0.29 -3.57 -0.13 0.00 -0.22 0.00 0.00 33.01 28.80 3k16 s GLN 1857CO 0.27 -0.06 1.98 -0.89 -0.25 0.00 0.00 175.29 176.34 3k16 n ILE 1858N 4.54 0.32 1.96 1.08 5.41 0.16 -4.99 119.36 127.84 3k16 n ILE 1858Ca -0.12 -0.16 0.16 0.00 1.00 0.00 0.00 62.75 63.63 3k16 n ILE 1858Cb 0.51 -1.58 0.92 0.00 -0.71 0.00 0.00 39.64 38.78 3k16 n ILE 1858CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90