Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4doe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N TYR 442.A O no hydrogen 2.746 N/A ASN 6.A ND2 ASN 445.A O no hydrogen 2.814 N/A TYR 7.A N GLY 443.A O no hydrogen 3.327 N/A TYR 7.A OH ASP 352.A OD1 no hydrogen 2.478 N/A TYR 7.A OH ASP 352.A OD2 no hydrogen 3.402 N/A GLY 8.A N GLY 444.A O no hydrogen 3.132 N/A GLU 9.A N ASN 6.A OD1 no hydrogen 2.908 N/A ALA 10.A N ASN 6.A O no hydrogen 3.036 N/A LEU 11.A N TYR 7.A O no hydrogen 2.842 N/A GLN 12.A N GLY 8.A O no hydrogen 2.894 N/A GLN 12.A NE2 ILE 447.A O no hydrogen 2.777 N/A LYS 13.A N GLU 9.A O no hydrogen 2.915 N/A LYS 13.A NZ GLU 9.A OE2 no hydrogen 2.696 N/A LYS 13.A NZ GLY 365.A O no hydrogen 2.861 N/A ALA 14.A N ALA 10.A O no hydrogen 2.853 N/A ILE 15.A N LEU 11.A O no hydrogen 2.986 N/A MET 16.A N GLN 12.A O no hydrogen 3.079 N/A PHE 17.A N LYS 13.A O no hydrogen 2.919 N/A TYR 18.A N ILE 15.A O no hydrogen 3.137 N/A TYR 18.A OH CYS 425.A O no hydrogen 2.743 N/A GLU 19.A N MET 16.A O no hydrogen 2.764 N/A PHE 20.A N PHE 17.A O no hydrogen 2.958 N/A GLN 21.A N TYR 18.A O no hydrogen 3.029 N/A GLN 21.A NE2 PHE 55.A O no hydrogen 3.096 N/A GLN 21.A NE2 ALA 57.A O no hydrogen 2.912 N/A MET 22.A N GLU 19.A O no hydrogen 3.126 N/A SER 23.A N GLY 53.A O no hydrogen 3.021 N/A LEU 26.A N ASP 37.A OD1 no hydrogen 2.870 N/A VAL 30.A N PRO 27.A O no hydrogen 3.245 N/A ARG 31.A N GLU 19.A OE1 no hydrogen 3.292 N/A ARG 31.A N GLU 19.A OE2 no hydrogen 2.952 N/A ARG 31.A NE GLU 19.A OE2 no hydrogen 3.069 N/A ASN 32.A N GLU 19.A OE1 no hydrogen 3.086 N/A ASN 32.A ND2 GLU 19.A OE1 no hydrogen 3.039 N/A ASN 33.A ND2 GLU 454.A O no hydrogen 2.949 N/A TRP 34.A N ASN 32.A OD1 no hydrogen 2.934 N/A ARG 35.A N ASN 32.A OD1 no hydrogen 2.916 N/A ARG 35.A NE GLU 133.A OE2 no hydrogen 2.797 N/A ARG 35.A NH1 MET 22.A O no hydrogen 3.082 N/A ARG 35.A NH1 GLU 133.A OE2 no hydrogen 3.288 N/A ARG 35.A NH2 PHE 20.A O no hydrogen 2.899 N/A ARG 35.A NH2 MET 22.A O no hydrogen 2.751 N/A GLY 36.A N GLU 133.A OE2 no hydrogen 2.836 N/A SER 38.A N GLY 24.A O no hydrogen 3.198 N/A ASP 42.A N ALA 39.A O no hydrogen 3.382 N/A GLN 44.A N.A LYS 41.A O no hydrogen 2.905 N/A GLN 44.A N.B LYS 41.A O no hydrogen 2.891 N/A ASN 46.A N GLY 43.A O no hydrogen 2.842 N/A ASN 46.A ND2 SER 141.A OG no hydrogen 2.833 N/A GLY 47.A N GLN 44.A O.A no hydrogen 3.087 N/A GLY 47.A N GLN 44.A O.B no hydrogen 3.287 N/A LEU 48.A N GLY 43.A O no hydrogen 3.130 N/A LEU 50.A N ASP 42.A O no hydrogen 2.901 N/A THR 51.A N ASP 49.A OD1 no hydrogen 2.974 N/A THR 51.A OG1 ASP 49.A OD1 no hydrogen 2.712 N/A TRP 54.A NE1 GLN 97.A OE1 no hydrogen 2.897 N/A PHE 55.A N GLN 21.A O no hydrogen 2.831 N/A ASP 56.A N VAL 61.A O no hydrogen 3.034 N/A ALA 57.A N ASP 59.A OD1 no hydrogen 2.971 N/A GLY 58.A N GLU 422.A OE2 no hydrogen 2.853 N/A HIS 60.A N ASP 125.A OD2 no hydrogen 2.794 N/A HIS 60.A NE2 THR 378.A OG1 no hydrogen 2.777 N/A LYS 62.A N VAL 119.A O no hydrogen 2.911 N/A LYS 62.A NZ ASP 42.A OD2 no hydrogen 2.888 N/A LYS 62.A NZ LEU 50.A O no hydrogen 2.843 N/A LYS 62.A NZ GLY 52.A O no hydrogen 2.744 N/A ASN 64.A N TYR 117.A O no hydrogen 2.966 N/A ASN 64.A ND2 TYR 115.A OH no hydrogen 2.889 N/A MET 67.A N PHE 63.A O no hydrogen 3.187 N/A SER 68.A N ASN 64.A O no hydrogen 2.809 N/A SER 68.A OG ASN 64.A O no hydrogen 2.724 N/A SER 68.A OG LEU 65.A O no hydrogen 3.140 N/A TYR 69.A N LEU 65.A O no hydrogen 2.926 N/A THR 70.A N PRO 66.A O no hydrogen 2.869 N/A THR 70.A OG1 PRO 66.A O no hydrogen 2.744 N/A GLY 71.A N MET 67.A O no hydrogen 3.007 N/A THR 72.A N SER 68.A O no hydrogen 2.906 N/A THR 72.A OG1 SER 68.A O no hydrogen 3.007 N/A THR 72.A OG1 GLU 156.A OE2 no hydrogen 2.976 N/A MET 73.A N TYR 69.A O no hydrogen 3.009 N/A LEU 74.A N THR 70.A O no hydrogen 2.901 N/A SER 75.A N GLY 71.A O no hydrogen 3.180 N/A TRP 76.A N THR 72.A O no hydrogen 2.842 N/A TRP 76.A NE1 GLU 80.A OE2 no hydrogen 2.866 N/A ALA 77.A N MET 73.A O no hydrogen 2.970 N/A VAL 78.A N LEU 74.A O no hydrogen 3.279 N/A TYR 79.A N SER 75.A O no hydrogen 2.816 N/A GLU 80.A N TRP 76.A O no hydrogen 2.933 N/A TYR 81.A N ALA 77.A O no hydrogen 2.867 N/A TYR 81.A OH ASP 331.A OD2 no hydrogen 2.595 N/A LYS 82.A NZ ASP 170.A OD2 no hydrogen 3.520 N/A ALA 84.A N TYR 81.A O no hydrogen 2.966 N/A PHE 85.A N TYR 81.A O no hydrogen 3.285 N/A VAL 86.A N LYS 82.A O no hydrogen 2.884 N/A LYS 87.A N ASP 83.A O.A no hydrogen 2.987 N/A LYS 87.A N ASP 83.A O.B no hydrogen 2.750 N/A SER 88.A N ALA 84.A O no hydrogen 3.057 N/A SER 88.A OG ALA 84.A O no hydrogen 2.828 N/A SER 88.A OG PHE 85.A O no hydrogen 3.204 N/A GLY 89.A N VAL 86.A O no hydrogen 3.105 N/A GLN 90.A N PHE 85.A O no hydrogen 2.795 N/A GLN 90.A NE2 SER 88.A O no hydrogen 3.202 N/A LEU 91.A N PHE 85.A O no hydrogen 3.094 N/A ILE 94.A N GLN 90.A O no hydrogen 3.080 N/A LEU 95.A N LEU 91.A O no hydrogen 2.919 N/A ASN 96.A N GLU 92.A O no hydrogen 2.935 N/A GLN 97.A N HIS 93.A O no hydrogen 3.251 N/A ILE 98.A N ILE 94.A O no hydrogen 2.904 N/A GLU 99.A N LEU 95.A O no hydrogen 2.890 N/A TRP 100.A N ASN 96.A O no hydrogen 2.962 N/A TRP 100.A NE1 GLY 53.A O no hydrogen 2.894 N/A VAL 101.A N GLN 97.A O no hydrogen 2.996 N/A ASN 102.A N ILE 98.A O no hydrogen 3.036 N/A ASN 102.A ND2 ILE 98.A O no hydrogen 2.857 N/A ASP 103.A N GLU 99.A O no hydrogen 2.900 N/A TYR 104.A N TRP 100.A O no hydrogen 3.388 N/A TYR 104.A OH ASN 64.A OD1 no hydrogen 2.690 N/A PHE 105.A N VAL 101.A O no hydrogen 3.117 N/A VAL 106.A N ASN 102.A O no hydrogen 3.009 N/A LYS 107.A N ASP 103.A O no hydrogen 3.114 N/A LYS 107.A NZ ASP 49.A OD2 no hydrogen 3.532 N/A LYS 107.A NZ THR 51.A O no hydrogen 2.889 N/A LYS 107.A NZ THR 51.A OG1 no hydrogen 3.119 N/A CYS 108.A N TYR 104.A O no hydrogen 2.891 N/A CYS 108.A SG TYR 104.A O no hydrogen 3.404 N/A HIS 109.A N VAL 106.A O no hydrogen 3.024 N/A HIS 109.A ND1 HIS 182.A ND1 no hydrogen 2.720 N/A HIS 109.A NE2 LYS 112.A O no hydrogen 2.786 N/A LYS 112.A NZ GLU 188.A OE1 no hydrogen 2.298 N/A TYR 113.A OH GLU 188.A OE1 no hydrogen 2.796 N/A VAL 114.A N SER 111.A O.A no hydrogen 2.765 N/A TYR 115.A N VAL 144.A O no hydrogen 3.026 N/A TYR 116.A N CYS 108.A O no hydrogen 2.776 N/A TYR 117.A N PHE 142.A O no hydrogen 2.907 N/A GLN 118.A NE2 GLY 120.A O no hydrogen 2.903 N/A GLN 118.A NE2 ALA 201.A O no hydrogen 3.137 N/A VAL 119.A N LYS 62.A O no hydrogen 3.134 N/A GLY 120.A N PRO 140.A O no hydrogen 2.782 N/A SER 123.A N.A ASP 121.A OD1.B no hydrogen 3.278 N/A SER 123.A N.B ASP 121.A OD1.B no hydrogen 3.238 N/A LYS 124.A N ASP 121.A OD1.A no hydrogen 2.892 N/A ASP 125.A N ASP 121.A O.A no hydrogen 2.800 N/A ASP 125.A N ASP 121.A O.B no hydrogen 2.760 N/A HIS 126.A N GLY 122.A O no hydrogen 2.972 N/A HIS 126.A NE2 ASP 59.A OD2 no hydrogen 2.707 N/A ALA 127.A N SER 123.A O.A no hydrogen 3.203 N/A TRP 128.A N ASP 125.A O no hydrogen 3.504 N/A TRP 129.A N ASP 385.A OD1 no hydrogen 2.790 N/A TRP 129.A NE1 HIS 380.A ND1 no hydrogen 2.843 N/A ALA 132.A N THR 378.A OG1 no hydrogen 2.844 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.881 N/A VAL 134.A N PRO 131.A O no hydrogen 3.133 N/A MET 135.A N ALA 132.A O no hydrogen 3.402 N/A GLN 136.A NE2.A VAL 134.A O no hydrogen 3.223 N/A ARG 139.A NE ASP 42.A OD1 no hydrogen 2.786 N/A ARG 139.A NH1 ASP 42.A OD2 no hydrogen 2.962 N/A ARG 139.A NH1 HIS 60.A O no hydrogen 3.195 N/A ARG 139.A NH2 HIS 60.A O no hydrogen 2.798 N/A SER 141.A N ASP 45.A OD1 no hydrogen 2.901 N/A SER 141.A OG ASP 45.A OD1 no hydrogen 3.415 N/A SER 141.A OG ASP 45.A OD2 no hydrogen 2.681 N/A PHE 142.A N GLN 118.A O no hydrogen 2.981 N/A LYS 143.A NZ TYR 116.A OH no hydrogen 2.894 N/A VAL 144.A N TYR 115.A O no hydrogen 2.844 N/A THR 145.A N SER 148.A O no hydrogen 2.914 N/A SER 148.A N THR 145.A O no hydrogen 3.084 N/A SER 151.A N SER 195.A O no hydrogen 2.921 N/A SER 151.A OG ALA 190.A O no hydrogen 2.902 N/A SER 151.A OG THR 193.A OG1 no hydrogen 3.083 N/A SER 151.A OG SER 195.A O no hydrogen 3.290 N/A THR 152.A N ASP 196.A OD2 no hydrogen 2.931 N/A THR 152.A OG1 ASP 196.A OD1 no hydrogen 2.633 N/A THR 152.A OG1 ASP 196.A OD2 no hydrogen 3.403 N/A THR 152.A OG1 SER 208.A OG no hydrogen 2.710 N/A VAL 154.A N GLY 150.A O no hydrogen 3.014 N/A ALA 155.A N SER 151.A O no hydrogen 2.974 N/A GLU 156.A N THR 152.A O no hydrogen 2.977 N/A THR 157.A N VAL 153.A O no hydrogen 2.905 N/A THR 157.A OG1 TYR 115.A OH no hydrogen 2.705 N/A THR 157.A OG1 VAL 153.A O no hydrogen 2.765 N/A ALA 158.A N VAL 154.A O no hydrogen 2.870 N/A ALA 159.A N ALA 155.A O no hydrogen 2.940 N/A SER 160.A N GLU 156.A O no hydrogen 3.046 N/A SER 160.A OG ASN 102.A OD1 no hydrogen 2.789 N/A LEU 161.A N THR 157.A O no hydrogen 3.068 N/A ALA 162.A N ALA 158.A O no hydrogen 2.912 N/A ALA 163.A N ALA 159.A O no hydrogen 2.913 N/A ALA 164.A N SER 160.A O no hydrogen 2.896 N/A SER 165.A N LEU 161.A O no hydrogen 2.872 N/A SER 165.A OG ALA 162.A O no hydrogen 2.732 N/A ILE 166.A N ALA 162.A O no hydrogen 3.371 N/A ILE 166.A N ALA 163.A O no hydrogen 3.157 N/A VAL 167.A N ALA 163.A O no hydrogen 3.244 N/A LEU 168.A N.A ALA 164.A O no hydrogen 2.875 N/A LEU 168.A N.B ALA 164.A O no hydrogen 2.886 N/A ARG 171.A NH1 GLU 92.A O no hydrogen 3.445 N/A ARG 171.A NH1 ASN 96.A OD1 no hydrogen 3.142 N/A ARG 171.A NH2 ASN 96.A OD1 no hydrogen 2.904 N/A ARG 171.A NH2 GLU 99.A OE2 no hydrogen 2.863 N/A ASN 172.A N LEU 168.A O.A no hydrogen 2.888 N/A ASN 172.A N LEU 168.A O.B no hydrogen 2.840 N/A ASN 172.A ND2 GLU 99.A OE1 no hydrogen 3.527 N/A THR 174.A OG1.B ASN 172.A OD1 no hydrogen 3.445 N/A LYS 175.A N ASN 172.A OD1 no hydrogen 3.157 N/A LYS 175.A NZ GLU 99.A OE1 no hydrogen 2.583 N/A LYS 175.A NZ ASP 103.A OD1 no hydrogen 3.283 N/A LYS 175.A NZ ASP 103.A OD2 no hydrogen 2.872 N/A ALA 176.A N ASN 172.A O no hydrogen 2.914 N/A ALA 177.A N PRO 173.A O no hydrogen 3.076 N/A THR 178.A N THR 174.A O.A no hydrogen 3.117 N/A THR 178.A N THR 174.A O.B no hydrogen 3.138 N/A THR 178.A OG1 THR 174.A O.A no hydrogen 3.494 N/A THR 178.A OG1 THR 174.A O.B no hydrogen 3.010 N/A TYR 179.A N LYS 175.A O no hydrogen 2.876 N/A TYR 179.A OH ASP 103.A OD1 no hydrogen 2.609 N/A LEU 180.A N ALA 176.A O no hydrogen 3.006 N/A GLN 181.A N.A ALA 177.A O no hydrogen 3.141 N/A GLN 181.A N.B ALA 177.A O no hydrogen 3.049 N/A GLN 181.A NE2.A GLU 185.A OE2 no hydrogen 3.273 N/A GLN 181.A NE2.B GLU 185.A OE2 no hydrogen 3.265 N/A HIS 182.A N THR 178.A O no hydrogen 3.088 N/A HIS 182.A ND1 HIS 109.A ND1 no hydrogen 2.720 N/A ALA 183.A N TYR 179.A O no hydrogen 2.877 N/A LYS 184.A N LEU 180.A O no hydrogen 2.922 N/A GLU 185.A N GLN 181.A O.A no hydrogen 3.108 N/A GLU 185.A N GLN 181.A O.B no hydrogen 3.152 N/A LEU 186.A N HIS 182.A O no hydrogen 2.811 N/A TYR 187.A N ALA 183.A O no hydrogen 2.914 N/A TYR 187.A OH LEU 216.A O no hydrogen 2.703 N/A GLU 188.A N LYS 184.A O no hydrogen 3.036 N/A PHE 189.A N GLU 185.A O no hydrogen 2.931 N/A ALA 190.A N LEU 186.A O no hydrogen 2.869 N/A GLU 191.A N TYR 187.A O no hydrogen 2.943 N/A VAL 192.A N.A GLU 188.A O no hydrogen 2.830 N/A VAL 192.A N.B GLU 188.A O no hydrogen 2.841 N/A THR 193.A N PHE 189.A O no hydrogen 3.249 N/A THR 193.A OG1 SER 151.A OG no hydrogen 3.083 N/A THR 193.A OG1 PHE 189.A O no hydrogen 2.744 N/A THR 193.A OG1 ALA 190.A O no hydrogen 3.247 N/A LYS 194.A N ALA 190.A O no hydrogen 2.899 N/A LYS 194.A NZ TYR 239.A OH no hydrogen 2.876 N/A SER 195.A N SER 151.A OG no hydrogen 2.984 N/A ALA 197.A N SER 195.A OG no hydrogen 3.083 N/A GLY 198.A N PRO 149.A O no hydrogen 2.786 N/A TYR 199.A N ASP 196.A O no hydrogen 2.949 N/A TYR 199.A OH TYR 206.A O no hydrogen 2.610 N/A THR 200.A N TYR 117.A OH no hydrogen 3.264 N/A ALA 201.A N TYR 117.A OH no hydrogen 2.940 N/A ASN 203.A N THR 200.A O no hydrogen 3.046 N/A GLY 204.A N ASN 207.A OD1 no hydrogen 2.869 N/A TYR 205.A N ALA 202.A O no hydrogen 2.890 N/A TYR 206.A N ALA 202.A O no hydrogen 2.859 N/A TYR 206.A OH ASP 56.A OD2 no hydrogen 2.531 N/A SER 208.A OG THR 152.A OG1 no hydrogen 2.710 N/A SER 208.A OG ASP 196.A OD1 no hydrogen 3.431 N/A TRP 209.A N ASP 261.A OD2 no hydrogen 2.906 N/A SER 210.A N ASP 261.A OD1 no hydrogen 2.924 N/A SER 210.A OG GLY 211.A O no hydrogen 3.554 N/A SER 210.A OG ASP 214.A OD1 no hydrogen 3.415 N/A SER 210.A OG ASP 261.A O no hydrogen 2.699 N/A SER 210.A OG ASP 261.A OD1 no hydrogen 2.843 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.733 N/A LEU 216.A N PHE 212.A O no hydrogen 2.868 N/A SER 217.A N TYR 213.A O no hydrogen 3.055 N/A SER 217.A OG ALA 236.A O no hydrogen 2.727 N/A TRP 218.A N ASP 214.A O no hydrogen 2.975 N/A TRP 218.A NE1 GLU 156.A OE2 no hydrogen 2.853 N/A ALA 219.A N GLU 215.A O no hydrogen 2.748 N/A ALA 220.A N LEU 216.A O no hydrogen 3.236 N/A VAL 221.A N SER 217.A O no hydrogen 2.916 N/A TRP 222.A N TRP 218.A O no hydrogen 3.136 N/A LEU 223.A N ALA 219.A O no hydrogen 2.895 N/A TYR 224.A N ALA 220.A O no hydrogen 2.777 N/A LEU 225.A N VAL 221.A O no hydrogen 2.865 N/A ALA 226.A N TRP 222.A O no hydrogen 2.890 N/A THR 227.A N TYR 224.A O no hydrogen 3.289 N/A THR 227.A OG1 LEU 223.A O no hydrogen 2.659 N/A ASN 228.A N TYR 224.A O no hydrogen 2.822 N/A ASP 229.A N THR 227.A OG1 no hydrogen 3.024 N/A THR 231.A N.A ASP 229.A OD1 no hydrogen 2.906 N/A THR 231.A N.B ASP 229.A OD1 no hydrogen 2.886 N/A THR 231.A OG1.B ASP 229.A OD1 no hydrogen 2.906 N/A THR 231.A OG1.B ASP 229.A OD2 no hydrogen 3.423 N/A TYR 232.A N ASP 229.A O no hydrogen 2.928 N/A THR 234.A N SER 230.A O no hydrogen 3.022 N/A THR 234.A OG1 SER 230.A O no hydrogen 3.256 N/A LYS 235.A N.A THR 231.A O.A no hydrogen 2.934 N/A LYS 235.A N.A THR 231.A O.B no hydrogen 3.262 N/A LYS 235.A N.B THR 231.A O.A no hydrogen 2.925 N/A LYS 235.A N.B THR 231.A O.B no hydrogen 3.257 N/A LYS 235.A NZ.A GLU 191.A OE1 no hydrogen 2.719 N/A LYS 235.A NZ.B GLU 191.A OE1 no hydrogen 3.213 N/A LYS 235.A NZ.B GLU 191.A OE2 no hydrogen 2.976 N/A ALA 236.A N TYR 232.A O no hydrogen 2.889 N/A GLU 237.A N LEU 233.A O no hydrogen 2.958 N/A SER 238.A N THR 234.A O no hydrogen 2.886 N/A SER 238.A OG THR 234.A O no hydrogen 2.723 N/A TYR 239.A N LYS 235.A O.A no hydrogen 2.961 N/A TYR 239.A N LYS 235.A O.B no hydrogen 3.073 N/A TYR 239.A OH GLU 191.A OE2 no hydrogen 2.607 N/A VAL 240.A N GLU 237.A O no hydrogen 3.372 N/A GLN 241.A N SER 238.A O no hydrogen 3.285 N/A ASN 242.A N.A TYR 239.A O no hydrogen 2.957 N/A ASN 242.A N.B TYR 239.A O no hydrogen 2.981 N/A TRP 243.A N VAL 240.A O no hydrogen 3.065 N/A TRP 243.A NE1 SER 217.A OG no hydrogen 2.948 N/A LYS 245.A NZ GLN 241.A O no hydrogen 2.901 N/A LYS 245.A NZ TRP 243.A O no hydrogen 2.918 N/A ILE 246.A N THR 251.A O no hydrogen 2.874 N/A SER 249.A N.A ILE 246.A O no hydrogen 2.886 N/A SER 249.A N.B ILE 246.A O no hydrogen 2.893 N/A SER 249.A OG.A ILE 246.A O no hydrogen 2.742 N/A SER 249.A OG.B THR 251.A OG1 no hydrogen 3.183 N/A THR 251.A N SER 249.A OG.A no hydrogen 3.129 N/A THR 251.A N SER 249.A OG.B no hydrogen 2.790 N/A THR 251.A OG1 SER 249.A OG.B no hydrogen 3.183 N/A ASP 253.A N PRO 244.A O no hydrogen 2.937 N/A LYS 255.A N ASP 253.A OD1 no hydrogen 3.043 N/A LYS 255.A NZ GLU 298.A OE1.A no hydrogen 2.300 N/A LYS 255.A NZ GLU 298.A OE1.B no hydrogen 2.728 N/A LYS 255.A NZ GLU 298.A OE2.B no hydrogen 3.466 N/A CYS 259.A N ASP 262.A O no hydrogen 3.091 N/A CYS 259.A SG ALA 257.A O no hydrogen 3.570 N/A ASP 262.A N CYS 259.A O no hydrogen 3.054 N/A VAL 263.A N ASP 214.A OD2 no hydrogen 2.962 N/A HIS 264.A N ASP 262.A OD1 no hydrogen 3.199 N/A HIS 264.A ND1 ASP 262.A OD1 no hydrogen 2.630 N/A GLY 266.A N HIS 258.A ND1 no hydrogen 3.010 N/A ALA 267.A N VAL 263.A O no hydrogen 3.184 N/A ALA 268.A N HIS 264.A O no hydrogen 2.858 N/A LEU 269.A N ASN 265.A O no hydrogen 2.961 N/A LEU 270.A N GLY 266.A O no hydrogen 2.996 N/A LEU 271.A N ALA 267.A O no hydrogen 2.873 N/A ALA 272.A N ALA 268.A O no hydrogen 2.821 N/A LYS 273.A N LEU 269.A O no hydrogen 3.028 N/A LYS 273.A NZ GLU 80.A OE2 no hydrogen 2.766 N/A ILE 274.A N LEU 270.A O no hydrogen 2.845 N/A THR 275.A N LEU 271.A O no hydrogen 2.908 N/A THR 275.A OG1 LEU 271.A O no hydrogen 2.794 N/A GLY 276.A N ALA 272.A O no hydrogen 2.757 N/A LYS 277.A N THR 275.A OG1 no hydrogen 3.119 N/A LYS 277.A NZ GLU 237.A OE2 no hydrogen 2.722 N/A TYR 280.A N LYS 277.A O no hydrogen 3.131 N/A TYR 280.A OH GLU 237.A OE2 no hydrogen 2.603 N/A LYS 281.A N LYS 277.A O no hydrogen 3.328 N/A GLN 282.A N ASP 278.A O no hydrogen 2.821 N/A ILE 283.A N ILE 279.A O.A no hydrogen 3.248 N/A ILE 284.A N TYR 280.A O no hydrogen 3.055 N/A GLU 285.A N LYS 281.A O no hydrogen 2.839 N/A SER 286.A N.A GLN 282.A O no hydrogen 3.004 N/A SER 286.A N.B GLN 282.A O no hydrogen 3.013 N/A SER 286.A OG.A GLN 282.A O no hydrogen 2.712 N/A SER 286.A OG.A GLN 282.A OE1 no hydrogen 2.984 N/A SER 286.A OG.B GLN 282.A O no hydrogen 3.319 N/A SER 286.A OG.B ILE 283.A O no hydrogen 2.715 N/A HIS 287.A N ILE 283.A O no hydrogen 3.296 N/A HIS 287.A ND1 TYR 254.A O no hydrogen 2.933 N/A LEU 288.A N ILE 284.A O no hydrogen 2.964 N/A ASP 289.A N GLU 285.A O no hydrogen 2.782 N/A TYR 290.A N SER 286.A O.A no hydrogen 2.854 N/A TYR 290.A N SER 286.A O.B no hydrogen 3.076 N/A TRP 291.A N HIS 287.A O no hydrogen 3.151 N/A TRP 291.A NE1 TRP 256.A O no hydrogen 2.908 N/A THR 292.A N ASP 289.A O no hydrogen 2.986 N/A THR 292.A OG1 LEU 288.A O no hydrogen 2.761 N/A THR 292.A OG1 ASP 289.A O no hydrogen 3.426 N/A GLY 294.A N ASP 289.A O no hydrogen 2.735 N/A TYR 295.A N GLU 298.A O.A no hydrogen 3.074 N/A TYR 295.A N GLU 298.A O.B no hydrogen 2.806 N/A GLU 298.A N.A TYR 295.A O no hydrogen 3.026 N/A GLU 298.A N.B TYR 295.A O no hydrogen 3.051 N/A ARG 299.A NE.A THR 292.A O no hydrogen 2.907 N/A ARG 299.A NE.B THR 292.A O no hydrogen 2.562 N/A ARG 299.A NH2.A THR 292.A O no hydrogen 3.000 N/A ARG 299.A NH2.B THR 292.A O no hydrogen 3.213 N/A ILE 300.A N TYR 290.A O no hydrogen 2.981 N/A TYR 302.A OH TRP 291.A O no hydrogen 2.619 N/A THR 303.A N LEU 307.A O no hydrogen 2.870 N/A THR 303.A OG1 ASP 409.A OD1 no hydrogen 2.622 N/A THR 303.A OG1 ASP 409.A OD2 no hydrogen 3.532 N/A LYS 305.A N ASP 409.A OD2 no hydrogen 2.862 N/A LYS 305.A NZ ALA 358.A O no hydrogen 3.014 N/A GLY 306.A N THR 303.A O no hydrogen 2.963 N/A LEU 307.A N THR 303.A OG1 no hydrogen 3.028 N/A ALA 308.A N GLN 350.A OE1 no hydrogen 2.852 N/A TRP 309.A N LYS 301.A O no hydrogen 2.845 N/A TRP 309.A NE1 PRO 405.A O no hydrogen 3.102 N/A TRP 313.A N ASP 311.A OD1 no hydrogen 2.882 N/A SER 315.A OG GLY 403.A O no hydrogen 3.508 N/A LEU 316.A N GLY 403.A O no hydrogen 2.976 N/A ARG 317.A NE GLY 314.A O no hydrogen 3.085 N/A ARG 317.A NH1 TRP 313.A O no hydrogen 2.980 N/A ARG 317.A NH2 ASP 426.A OD2 no hydrogen 2.753 N/A TYR 318.A N GLY 314.A O no hydrogen 3.319 N/A ALA 319.A N SER 315.A O no hydrogen 3.060 N/A THR 320.A N LEU 316.A O no hydrogen 2.828 N/A THR 320.A OG1 LEU 316.A O no hydrogen 2.804 N/A THR 320.A OG1 ARG 317.A O no hydrogen 3.422 N/A THR 321.A N ARG 317.A O no hydrogen 3.043 N/A THR 321.A OG1 ARG 317.A O no hydrogen 2.771 N/A THR 322.A N TYR 318.A O no hydrogen 3.052 N/A THR 322.A OG1 TYR 318.A O no hydrogen 2.886 N/A ALA 323.A N ALA 319.A O no hydrogen 2.943 N/A PHE 324.A N THR 320.A O no hydrogen 3.210 N/A LEU 325.A N THR 321.A O no hydrogen 3.091 N/A ALA 326.A N THR 322.A O no hydrogen 2.848 N/A PHE 327.A N ALA 323.A O no hydrogen 2.916 N/A VAL 328.A N PHE 324.A O no hydrogen 2.994 N/A TYR 329.A N LEU 325.A O no hydrogen 2.960 N/A TYR 329.A OH GLU 285.A OE1 no hydrogen 2.682 N/A SER 330.A N ALA 326.A O no hydrogen 2.933 N/A SER 330.A OG ALA 326.A O no hydrogen 2.736 N/A SER 330.A OG PHE 327.A O no hydrogen 3.163 N/A ASP 331.A N PHE 327.A O no hydrogen 2.892 N/A TRP 332.A N TYR 329.A O no hydrogen 2.992 N/A CYS 335.A N TRP 332.A O no hydrogen 3.006 N/A CYS 335.A SG PRO 336.A O no hydrogen 3.637 N/A LYS 339.A NZ GLU 285.A OE2 no hydrogen 2.907 N/A LYS 339.A NZ ASP 289.A OD2 no hydrogen 2.897 N/A LYS 340.A N.A PRO 336.A O no hydrogen 2.907 N/A LYS 340.A N.A SER 337.A O.A no hydrogen 3.082 N/A LYS 340.A N.A SER 337.A O.C no hydrogen 3.106 N/A LYS 340.A N.B PRO 336.A O no hydrogen 2.935 N/A LYS 340.A N.B SER 337.A O.A no hydrogen 3.103 N/A LYS 340.A NZ.A CYS 335.A O no hydrogen 2.794 N/A LYS 340.A NZ.B SER 330.A O no hydrogen 2.736 N/A LYS 340.A NZ.B TRP 332.A O no hydrogen 2.865 N/A GLU 341.A N.A THR 338.A O.A no hydrogen 3.134 N/A GLU 341.A N.B THR 338.A O.A no hydrogen 3.241 N/A ILE 342.A N THR 338.A O.A no hydrogen 3.179 N/A ILE 342.A N THR 338.A O.B no hydrogen 3.296 N/A TYR 343.A N LYS 339.A O no hydrogen 2.772 N/A TYR 343.A OH ASP 289.A OD1 no hydrogen 2.622 N/A ARG 344.A N LYS 340.A O.A no hydrogen 3.027 N/A ARG 344.A N LYS 340.A O.B no hydrogen 3.152 N/A ARG 344.A NE GLU 348.A OE1 no hydrogen 2.838 N/A ARG 344.A NH2 GLU 341.A OE1.A no hydrogen 3.026 N/A LYS 345.A N.A GLU 341.A O.A no hydrogen 3.013 N/A LYS 345.A N.A GLU 341.A O.B no hydrogen 2.932 N/A LYS 345.A N.B GLU 341.A O.A no hydrogen 2.992 N/A LYS 345.A N.B GLU 341.A O.B no hydrogen 2.910 N/A LYS 345.A NZ.B GLU 341.A OE2.B no hydrogen 2.750 N/A PHE 346.A N ILE 342.A O no hydrogen 2.934 N/A GLY 347.A N TYR 343.A O no hydrogen 2.935 N/A GLU 348.A N ARG 344.A O no hydrogen 2.935 N/A SER 349.A N LYS 345.A O.A no hydrogen 2.964 N/A SER 349.A N LYS 345.A O.B no hydrogen 2.978 N/A SER 349.A OG LYS 345.A O.A no hydrogen 3.475 N/A SER 349.A OG LYS 345.A O.B no hydrogen 3.531 N/A SER 349.A OG PHE 346.A O no hydrogen 2.635 N/A GLN 350.A N PHE 346.A O no hydrogen 3.012 N/A GLN 350.A N GLY 347.A O no hydrogen 3.170 N/A GLN 350.A NE2 GLY 306.A O no hydrogen 2.974 N/A GLN 350.A NE2 SER 349.A OG no hydrogen 3.048 N/A ILE 351.A N GLY 347.A O no hydrogen 3.082 N/A ASP 352.A N GLU 348.A O no hydrogen 2.816 N/A TYR 353.A N SER 349.A O no hydrogen 2.961 N/A TYR 353.A OH ASP 409.A OD1 no hydrogen 2.577 N/A ALA 354.A N GLN 350.A O no hydrogen 3.053 N/A LEU 355.A N ILE 351.A O no hydrogen 3.025 N/A GLY 356.A N TYR 353.A O no hydrogen 3.149 N/A SER 357.A N ASP 352.A O no hydrogen 2.848 N/A GLY 359.A N GLY 356.A O no hydrogen 3.022 N/A ARG 360.A NE.A ASN 369.A O no hydrogen 3.069 N/A ARG 360.A NE.B SER 361.A O no hydrogen 2.788 N/A SER 361.A N THR 368.A O no hydrogen 2.817 N/A SER 361.A OG VAL 363.A O no hydrogen 3.200 N/A SER 361.A OG PHE 366.A O no hydrogen 2.751 N/A PHE 362.A N ALA 354.A O no hydrogen 2.930 N/A VAL 363.A N SER 361.A OG no hydrogen 2.958 N/A VAL 364.A N ALA 400.A O no hydrogen 2.915 N/A PHE 366.A N VAL 363.A O no hydrogen 3.135 N/A LYS 372.A N.A ASP 413.A OD2 no hydrogen 2.760 N/A LYS 372.A N.B ASP 413.A OD2 no hydrogen 2.804 N/A LYS 372.A NZ.A ASN 369.A OD1 no hydrogen 2.559 N/A LYS 372.A NZ.A PRO 370.A O no hydrogen 2.568 N/A LYS 372.A NZ.B PRO 370.A O no hydrogen 2.939 N/A ARG 373.A N ASP 413.A OD1 no hydrogen 2.916 N/A ARG 373.A NH1 GLN 387.A O no hydrogen 3.048 N/A ARG 373.A NH2 PRO 390.A O no hydrogen 3.334 N/A ARG 373.A NH2 HIS 393.A ND1 no hydrogen 3.019 N/A HIS 375.A N ASN 421.A O no hydrogen 2.812 N/A HIS 375.A ND1 ILE 415.A O no hydrogen 2.709 N/A HIS 376.A NE2 GLN 21.A OE1 no hydrogen 2.679 N/A ARG 377.A N GLY 58.A O no hydrogen 3.016 N/A ARG 377.A NE TRP 128.A O no hydrogen 2.846 N/A ARG 377.A NH1 HIS 126.A O no hydrogen 2.990 N/A ARG 377.A NH2 GLY 58.A O no hydrogen 2.947 N/A THR 378.A OG1 HIS 60.A NE2 no hydrogen 2.777 N/A ALA 379.A N HIS 376.A ND1 no hydrogen 2.968 N/A HIS 380.A N HIS 376.A O no hydrogen 3.169 N/A HIS 380.A NE2 PRO 390.A O no hydrogen 2.774 N/A SER 381.A N ARG 377.A O no hydrogen 3.021 N/A SER 382.A OG SER 386.A O no hydrogen 3.084 N/A SER 382.A OG ILE 389.A O no hydrogen 2.702 N/A ALA 384.A N SER 382.A OG no hydrogen 3.021 N/A SER 386.A N SER 382.A OG no hydrogen 3.298 N/A SER 386.A OG SER 388.A OG no hydrogen 2.953 N/A SER 388.A N SER 386.A OG no hydrogen 3.053 N/A SER 388.A OG SER 386.A OG no hydrogen 2.953 N/A ILE 389.A N SER 386.A O no hydrogen 3.404 N/A HIS 393.A NE2 PRO 374.A O no hydrogen 2.707 N/A ARG 394.A N.A HIS 380.A O no hydrogen 3.105 N/A ARG 394.A N.B HIS 380.A O no hydrogen 3.172 N/A HIS 395.A N ALA 379.A O no hydrogen 3.005 N/A HIS 395.A ND1 GLU 454.A OE2 no hydrogen 2.547 N/A TYR 398.A N THR 396.A O no hydrogen 2.949 N/A GLY 399.A N VAL 364.A O no hydrogen 2.881 N/A ALA 400.A N LEU 397.A O no hydrogen 3.182 N/A LEU 401.A N ASN 428.A OD1 no hydrogen 2.945 N/A VAL 402.A N PHE 362.A O no hydrogen 3.102 N/A GLY 404.A N ASN 420.A O no hydrogen 2.978 N/A GLY 406.A N SER 410.A O no hydrogen 2.816 N/A ASP 409.A N GLY 406.A O no hydrogen 2.949 N/A SER 410.A N ASP 408.A OD1 no hydrogen 2.968 N/A SER 410.A OG ASP 408.A OD1 no hydrogen 2.652 N/A SER 410.A OG ASP 408.A OD2 no hydrogen 3.539 N/A TYR 411.A OH.A ASN 421.A OD1 no hydrogen 2.467 N/A ASP 414.A N THR 412.A O.B no hydrogen 3.207 N/A ASN 417.A N ASP 414.A O no hydrogen 3.218 N/A ASN 417.A ND2 ASN 420.A OD1 no hydrogen 3.133 N/A VAL 419.A N ASN 417.A OD1 no hydrogen 2.953 N/A ASN 420.A N ASN 417.A OD1 no hydrogen 2.854 N/A ASN 420.A ND2 GLY 404.A O no hydrogen 2.934 N/A ASN 421.A N ASN 417.A O no hydrogen 2.972 N/A ASN 421.A ND2 ASP 413.A OD1 no hydrogen 2.964 N/A ASN 421.A ND2 ASP 414.A O no hydrogen 3.280 N/A CYS 425.A N ASP 56.A O no hydrogen 3.020 N/A CYS 425.A SG PHE 55.A O no hydrogen 3.387 N/A CYS 425.A SG ASP 56.A O no hydrogen 3.535 N/A ASN 428.A N ALA 424.A O no hydrogen 3.350 N/A ASN 428.A N CYS 425.A O no hydrogen 3.261 N/A ASN 428.A ND2 ALA 14.A O no hydrogen 3.120 N/A ASN 428.A ND2 GLY 399.A O no hydrogen 2.825 N/A ALA 429.A N ASP 426.A O no hydrogen 3.478 N/A VAL 432.A N ASN 428.A O no hydrogen 2.917 N/A ALA 434.A N GLY 430.A O no hydrogen 2.993 N/A LEU 435.A N PHE 431.A O no hydrogen 2.864 N/A ALA 436.A N VAL 432.A O no hydrogen 2.996 N/A LYS 437.A N GLY 433.A O no hydrogen 3.234 N/A LYS 437.A NZ ASP 331.A OD1 no hydrogen 2.869 N/A LYS 437.A NZ ASP 331.A OD2 no hydrogen 3.053 N/A LYS 437.A NZ GLN 440.A OE1.A no hydrogen 2.791 N/A MET 438.A N ALA 434.A O no hydrogen 2.974 N/A TYR 439.A N LEU 435.A O no hydrogen 2.840 N/A GLN 440.A N.A ALA 436.A O no hydrogen 2.881 N/A GLN 440.A N.B ALA 436.A O no hydrogen 2.903 N/A LEU 441.A N LYS 437.A O no hydrogen 2.970 N/A TYR 442.A N MET 438.A O no hydrogen 2.802 N/A TYR 442.A OH GLU 348.A OE1 no hydrogen 2.598 N/A GLY 443.A N TYR 439.A O no hydrogen 2.784 N/A ILE 447.A N GLN 12.A OE1 no hydrogen 2.931 N/A PHE 450.A N ILE 447.A O no hydrogen 3.137 N/A ILE 453.A N.A LYS 451.A O no hydrogen 2.961 N/A ILE 453.A N.B LYS 451.A O no hydrogen 2.919 N/A GLU 454.A N ASN 33.A OD1 no hydrogen 2.812 N/A