Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nb4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 55.A OD1 no hydrogen 2.749 N/A SER 3.A N PHE 54.A O no hydrogen 3.024 N/A SER 3.A OG VAL 52.A O no hydrogen 2.698 N/A SER 3.A OG PHE 54.A O no hydrogen 3.562 N/A THR 5.A N TYR 276.A O no hydrogen 2.984 N/A TRP 6.A NE1 THR 53.A OG1 no hydrogen 2.896 N/A THR 7.A N CYS 274.A O no hydrogen 2.919 N/A THR 7.A OG1 ASN 273.A O no hydrogen 2.697 N/A ALA 9.A N THR 7.A OG1 no hydrogen 3.175 N/A THR 12.A OG1 SER 269.A OG no hydrogen 2.607 N/A SER 27.A OG ALA 396.A O no hydrogen 3.029 N/A SER 29.A N LEU 26.A O no hydrogen 2.970 N/A LEU 30.A N SER 27.A O no hydrogen 2.630 N/A LEU 31.A N SER 27.A O no hydrogen 2.645 N/A ARG 32.A N GLY 493.A O no hydrogen 3.242 N/A HIS 33.A N LEU 492.A O no hydrogen 3.218 N/A MET 36.A N HIS 33.A O no hydrogen 3.072 N/A VAL 37.A N HIS 34.A O no hydrogen 2.864 N/A TYR 38.A N PHE 145.A O no hydrogen 3.015 N/A ALA 39.A N SER 19.A O no hydrogen 2.969 N/A THR 40.A N GLU 143.A O no hydrogen 2.904 N/A THR 40.A OG1 LYS 141.A O no hydrogen 2.805 N/A THR 40.A OG1 GLU 143.A O no hydrogen 3.541 N/A SER 42.A N GLU 17.A OE1 no hydrogen 3.134 N/A SER 42.A OG GLU 17.A OE1 no hydrogen 2.978 N/A SER 42.A OG GLU 17.A OE2 no hydrogen 3.207 N/A ARG 43.A N THR 41.A OG1 no hydrogen 3.111 N/A SER 44.A N THR 41.A O no hydrogen 3.296 N/A SER 44.A OG THR 41.A O no hydrogen 3.374 N/A ALA 45.A N SER 42.A O no hydrogen 2.956 N/A ARG 48.A N SER 44.A O no hydrogen 3.372 N/A ARG 48.A NE ALA 157.A O no hydrogen 2.861 N/A ARG 48.A NH2 PRO 156.A O no hydrogen 3.086 N/A GLN 49.A N ALA 45.A O no hydrogen 2.813 N/A LYS 50.A N SER 46.A O no hydrogen 3.084 N/A LYS 51.A N LEU 47.A O no hydrogen 3.387 N/A VAL 52.A N ARG 48.A O no hydrogen 3.061 N/A THR 53.A OG1 GLN 49.A O no hydrogen 2.710 N/A PHE 54.A N SER 3.A OG no hydrogen 3.139 N/A ARG 56.A N SER 1.A O no hydrogen 3.134 N/A ARG 56.A NE SER 226.A O no hydrogen 3.128 N/A ARG 56.A NH1 SER 1.A OG no hydrogen 2.635 N/A GLN 58.A NE2 ASP 232.A OD1 no hydrogen 3.457 N/A GLN 58.A NE2 ASP 232.A OD2 no hydrogen 2.738 N/A GLN 58.A NE2 TYR 346.A O no hydrogen 2.982 N/A VAL 59.A N ARG 345.A O no hydrogen 2.998 N/A TYR 64.A N ASP 61.A OD2 no hydrogen 2.828 N/A ARG 65.A N ASP 61.A O no hydrogen 3.085 N/A ASP 66.A N ASP 62.A O no hydrogen 2.784 N/A VAL 67.A N HIS 63.A O no hydrogen 3.001 N/A LEU 68.A N TYR 64.A O no hydrogen 2.930 N/A LYS 69.A N ARG 65.A O no hydrogen 3.271 N/A GLU 70.A N ASP 66.A O no hydrogen 3.141 N/A MET 71.A N VAL 67.A O no hydrogen 3.035 N/A LYS 72.A N LEU 68.A O no hydrogen 2.939 N/A ALA 73.A N LYS 69.A O no hydrogen 2.965 N/A LYS 74.A N GLU 70.A O no hydrogen 3.344 N/A ALA 75.A N MET 71.A O no hydrogen 2.995 N/A SER 76.A N LYS 72.A O no hydrogen 2.977 N/A SER 76.A OG LYS 72.A O no hydrogen 3.117 N/A THR 77.A N LYS 74.A O no hydrogen 3.162 N/A VAL 78.A N ALA 75.A O no hydrogen 3.054 N/A ALA 80.A N ASP 244.A O no hydrogen 2.911 N/A LYS 81.A N ASP 177.A OD1 no hydrogen 2.893 N/A LEU 83.A N MET 173.A O no hydrogen 2.999 N/A SER 84.A N GLU 87.A OE2 no hydrogen 2.617 N/A GLU 87.A N SER 84.A OG no hydrogen 3.150 N/A ALA 88.A N SER 84.A O no hydrogen 3.124 N/A CYS 89.A N ILE 85.A O no hydrogen 2.985 N/A CYS 89.A SG ILE 85.A O no hydrogen 3.273 N/A CYS 89.A SG VAL 108.A O no hydrogen 3.518 N/A LYS 90.A N GLU 86.A O no hydrogen 3.184 N/A LEU 91.A N GLU 87.A O no hydrogen 3.399 N/A THR 92.A N CYS 89.A O no hydrogen 3.220 N/A SER 96.A N PRO 93.A O no hydrogen 2.794 N/A SER 96.A OG ASP 559.A OD1 no hydrogen 2.529 N/A SER 96.A OG ASP 559.A OD2 no hydrogen 2.995 N/A SER 99.A N TYR 103.A O no hydrogen 2.984 N/A SER 99.A OG ASP 164.A OD1 no hydrogen 2.606 N/A SER 99.A OG ASP 164.A OD2 no hydrogen 3.339 N/A LYS 100.A N ASP 164.A OD2 no hydrogen 2.831 N/A LYS 100.A NZ ASP 135.A OD1 no hydrogen 3.264 N/A PHE 101.A N SER 99.A OG no hydrogen 2.945 N/A TYR 103.A OH HIS 118.A ND1 no hydrogen 2.552 N/A GLY 104.A N ASP 107.A OD1 no hydrogen 2.862 N/A LYS 106.A NZ ASP 107.A OD1 no hydrogen 3.530 N/A VAL 108.A N GLY 104.A O no hydrogen 2.936 N/A ARG 109.A N ALA 105.A O no hydrogen 2.957 N/A ARG 109.A NE THR 92.A O no hydrogen 2.683 N/A ARG 109.A NH2 THR 92.A O no hydrogen 3.240 N/A ASN 110.A N LYS 106.A O no hydrogen 3.122 N/A ASN 110.A N ASP 107.A O no hydrogen 3.234 N/A LEU 111.A N VAL 108.A O no hydrogen 2.936 N/A SER 112.A N ASP 107.A O no hydrogen 3.065 N/A SER 112.A OG ASP 107.A O no hydrogen 3.291 N/A ARG 114.A NE PHE 101.A O no hydrogen 3.139 N/A ARG 114.A NH2 PHE 101.A O no hydrogen 3.156 N/A VAL 116.A N SER 112.A O no hydrogen 2.934 N/A ASN 117.A N SER 113.A O no hydrogen 2.847 N/A HIS 118.A N ARG 114.A O no hydrogen 3.110 N/A HIS 118.A ND1 TYR 103.A OH no hydrogen 2.552 N/A ILE 119.A N ALA 115.A O no hydrogen 2.883 N/A ARG 120.A N VAL 116.A O no hydrogen 2.951 N/A SER 121.A N ASN 117.A O no hydrogen 3.126 N/A SER 121.A OG HIS 118.A O no hydrogen 2.881 N/A VAL 122.A N HIS 118.A O no hydrogen 2.974 N/A TRP 123.A N ILE 119.A O no hydrogen 2.970 N/A TRP 123.A NE1 GLU 248.A OE1 no hydrogen 2.941 N/A GLU 124.A N ARG 120.A O no hydrogen 2.857 N/A ASP 125.A N SER 121.A O no hydrogen 2.967 N/A LEU 126.A N VAL 122.A O no hydrogen 3.145 N/A LEU 127.A N TRP 123.A O no hydrogen 3.405 N/A LEU 127.A N GLU 124.A O no hydrogen 2.944 N/A GLU 128.A N GLU 124.A O no hydrogen 2.943 N/A ASP 129.A N ASP 125.A O no hydrogen 2.849 N/A GLU 131.A N ASP 129.A OD2 no hydrogen 2.836 N/A THR 132.A N ASP 129.A OD2 no hydrogen 2.861 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 2.632 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 3.255 N/A ILE 134.A N ARG 259.A O no hydrogen 2.908 N/A THR 136.A OG1 PRO 265.A O no hydrogen 2.784 N/A THR 137.A N PHE 162.A O no hydrogen 2.878 N/A ILE 138.A N THR 267.A O no hydrogen 3.030 N/A MET 139.A N ILE 160.A O no hydrogen 3.033 N/A LYS 141.A N ARG 158.A O no hydrogen 2.812 N/A GLU 143.A N THR 40.A OG1 no hydrogen 2.943 N/A PHE 145.A N TYR 38.A O no hydrogen 3.039 N/A CYS 146.A SG MET 36.A O no hydrogen 3.827 N/A CYS 146.A SG VAL 147.A O no hydrogen 3.713 N/A VAL 147.A N MET 36.A O no hydrogen 2.671 N/A GLN 148.A N GLY 153.A O no hydrogen 3.007 N/A LYS 155.A N TYR 38.A OH no hydrogen 3.065 N/A ALA 157.A N SER 44.A OG no hydrogen 2.853 N/A ILE 160.A N MET 139.A O no hydrogen 2.865 N/A VAL 161.A N SER 282.A OG no hydrogen 3.172 N/A PHE 162.A N THR 137.A O no hydrogen 3.090 N/A GLY 166.A N ASP 164.A OD1 no hydrogen 3.341 N/A ARG 168.A N ASP 164.A O no hydrogen 3.051 N/A ARG 168.A NE ASP 559.A OD2 no hydrogen 2.932 N/A ARG 168.A NH1 SER 96.A OG no hydrogen 2.897 N/A ARG 168.A NH1 ALA 97.A O no hydrogen 2.830 N/A ARG 168.A NH2 PRO 163.A O no hydrogen 2.897 N/A VAL 169.A N LEU 165.A O no hydrogen 3.179 N/A CYS 170.A N GLY 166.A O no hydrogen 3.293 N/A CYS 170.A SG ILE 119.A O no hydrogen 3.511 N/A CYS 170.A SG GLY 166.A O no hydrogen 3.646 N/A GLU 171.A N VAL 167.A O no hydrogen 2.974 N/A LYS 172.A N ARG 168.A O no hydrogen 3.291 N/A LYS 172.A NZ ASP 559.A O no hydrogen 2.789 N/A LYS 172.A NZ ASP 559.A OD2 no hydrogen 3.368 N/A MET 173.A N VAL 169.A O no hydrogen 3.087 N/A ALA 174.A N CYS 170.A O no hydrogen 3.037 N/A LEU 175.A N GLU 171.A O no hydrogen 2.756 N/A TYR 176.A N LYS 172.A O no hydrogen 3.066 N/A TYR 176.A OH HIS 562.A NE2 no hydrogen 3.324 N/A VAL 179.A N LEU 175.A O no hydrogen 2.810 N/A SER 180.A N TYR 176.A O no hydrogen 2.904 N/A SER 180.A N ASP 177.A O no hydrogen 3.045 N/A SER 180.A OG TYR 176.A O no hydrogen 2.883 N/A SER 180.A OG TYR 555.A OH no hydrogen 2.604 N/A THR 181.A N VAL 178.A O no hydrogen 3.258 N/A THR 181.A OG1 ASP 177.A O no hydrogen 3.263 N/A LEU 182.A N VAL 178.A O no hydrogen 2.982 N/A ALA 185.A N THR 181.A O no hydrogen 3.491 N/A VAL 186.A N LEU 182.A O no hydrogen 2.813 N/A MET 187.A N PRO 183.A O no hydrogen 2.798 N/A GLY 188.A N GLN 184.A O no hydrogen 2.951 N/A SER 190.A N MET 187.A O no hydrogen 3.038 N/A SER 190.A OG MET 313.A O no hydrogen 2.793 N/A TYR 191.A N GLY 188.A O no hydrogen 3.281 N/A GLY 192.A N VAL 315.A O no hydrogen 2.820 N/A GLN 194.A NE2 GLY 188.A O no hydrogen 2.822 N/A GLN 194.A NE2 TYR 191.A O no hydrogen 2.890 N/A TYR 195.A N GLY 192.A O no hydrogen 3.171 N/A TYR 195.A OH SER 189.A O no hydrogen 2.729 N/A SER 196.A N GLN 199.A OE1 no hydrogen 2.845 N/A GLN 199.A N SER 196.A OG no hydrogen 3.179 N/A ARG 200.A N SER 196.A O no hydrogen 2.916 N/A VAL 201.A N PRO 197.A O no hydrogen 3.033 N/A GLU 202.A N LYS 198.A O no hydrogen 3.188 N/A PHE 203.A N GLN 199.A O no hydrogen 2.956 N/A LEU 204.A N ARG 200.A O no hydrogen 2.873 N/A VAL 205.A N VAL 201.A O no hydrogen 2.780 N/A ASN 206.A N GLU 202.A O no hydrogen 2.884 N/A THR 207.A N PHE 203.A O no hydrogen 2.988 N/A THR 207.A OG1 PHE 203.A O no hydrogen 2.854 N/A TRP 208.A N LEU 204.A O no hydrogen 2.913 N/A LYS 209.A N VAL 205.A O no hydrogen 2.759 N/A SER 210.A N ASN 206.A O no hydrogen 2.756 N/A SER 210.A N THR 207.A O no hydrogen 2.986 N/A SER 210.A OG THR 207.A O no hydrogen 2.794 N/A LYS 211.A N TRP 208.A O no hydrogen 3.182 N/A LYS 211.A NZ ASP 310.A O no hydrogen 3.154 N/A LYS 212.A N GLU 325.A OE2 no hydrogen 2.589 N/A CYS 213.A N GLU 325.A OE1 no hydrogen 3.171 N/A MET 215.A N CYS 324.A O no hydrogen 3.086 N/A GLY 216.A N GLU 357.A O no hydrogen 3.069 N/A PHE 217.A N VAL 322.A O no hydrogen 3.007 N/A TYR 219.A N LEU 320.A O no hydrogen 2.928 N/A TYR 219.A OH ALA 348.A O no hydrogen 2.937 N/A ARG 222.A N PRO 349.A O no hydrogen 2.953 N/A SER 226.A OG VAL 52.A O no hydrogen 3.108 N/A THR 227.A N PHE 224.A O no hydrogen 2.765 N/A THR 227.A OG1 PHE 224.A O no hydrogen 2.611 N/A VAL 228.A N PHE 224.A O no hydrogen 3.299 N/A VAL 228.A N ASP 225.A O no hydrogen 3.263 N/A THR 229.A N ASP 232.A OD1 no hydrogen 3.078 N/A THR 229.A OG1 GLN 58.A OE1 no hydrogen 2.747 N/A ASP 232.A N THR 229.A OG1 no hydrogen 2.958 N/A ILE 233.A N THR 229.A O no hydrogen 3.104 N/A ARG 234.A N GLU 230.A O no hydrogen 3.007 N/A ARG 234.A NE GLU 258.A OE1 no hydrogen 3.095 N/A ARG 234.A NH2 GLU 258.A OE1 no hydrogen 3.493 N/A ARG 234.A NH2 GLU 258.A OE2 no hydrogen 3.111 N/A VAL 235.A N SER 231.A O no hydrogen 2.940 N/A GLU 236.A N ASP 232.A O no hydrogen 2.894 N/A GLU 237.A N ILE 233.A O no hydrogen 3.127 N/A SER 238.A N ARG 234.A O no hydrogen 2.951 N/A SER 238.A OG VAL 235.A O no hydrogen 2.761 N/A ILE 239.A N VAL 235.A O no hydrogen 3.140 N/A ILE 239.A N GLU 236.A O no hydrogen 3.005 N/A TYR 240.A N GLU 236.A O no hydrogen 3.158 N/A TYR 240.A OH GLU 236.A OE2 no hydrogen 2.617 N/A GLN 241.A N GLU 237.A O no hydrogen 3.016 N/A GLN 241.A NE2 GLU 237.A OE2 no hydrogen 2.987 N/A CYS 242.A N ILE 239.A O no hydrogen 3.114 N/A CYS 242.A SG LYS 72.A O no hydrogen 4.013 N/A CYS 242.A SG SER 238.A O no hydrogen 3.517 N/A CYS 243.A N TYR 240.A O no hydrogen 3.187 N/A CYS 243.A SG TYR 240.A O no hydrogen 3.510 N/A ASP 244.A N VAL 78.A O no hydrogen 2.966 N/A ARG 250.A N ALA 246.A O no hydrogen 2.802 N/A ARG 250.A NH1 GLN 241.A O no hydrogen 2.946 N/A ARG 250.A NH1 GLN 241.A OE1 no hydrogen 2.810 N/A ARG 250.A NH2 CYS 243.A O no hydrogen 3.247 N/A GLN 251.A N PRO 247.A O no hydrogen 2.950 N/A GLN 251.A NE2 GLN 251.A O no hydrogen 3.282 N/A GLN 251.A NE2 SER 255.A OG no hydrogen 3.133 N/A ALA 252.A N GLU 248.A O no hydrogen 2.818 N/A ILE 253.A N ALA 249.A O no hydrogen 2.950 N/A ARG 254.A N ARG 250.A O no hydrogen 3.061 N/A ARG 254.A NH1 GLU 237.A OE2 no hydrogen 3.362 N/A ARG 254.A NH1 GLU 258.A OE1 no hydrogen 3.165 N/A SER 255.A N GLN 251.A O no hydrogen 2.861 N/A SER 255.A OG LEU 126.A O no hydrogen 2.719 N/A SER 255.A OG GLN 251.A O no hydrogen 3.322 N/A LEU 256.A N ALA 252.A O no hydrogen 2.751 N/A THR 257.A N ILE 253.A O no hydrogen 2.902 N/A THR 257.A OG1 ILE 253.A O no hydrogen 3.024 N/A GLU 258.A N ARG 254.A O no hydrogen 3.178 N/A ARG 259.A N SER 255.A O no hydrogen 2.864 N/A ARG 259.A NE ASP 129.A O no hydrogen 3.045 N/A ARG 259.A NH1 ASP 125.A OD1 no hydrogen 2.881 N/A ARG 259.A NH2 ASP 125.A OD1 no hydrogen 2.509 N/A LEU 260.A N LEU 256.A O no hydrogen 2.863 N/A TYR 261.A N LEU 256.A O no hydrogen 2.951 N/A TYR 261.A OH GLU 171.A OE2 no hydrogen 2.723 N/A ILE 262.A N THR 257.A O no hydrogen 3.156 N/A GLY 264.A N ARG 277.A O no hydrogen 3.043 N/A LEU 266.A N GLY 275.A O no hydrogen 2.839 N/A THR 267.A N THR 136.A O no hydrogen 2.995 N/A THR 267.A OG1 ASP 135.A OD1 no hydrogen 3.379 N/A THR 267.A OG1 ASP 135.A OD2 no hydrogen 2.737 N/A ASN 268.A N GLN 272.A O no hydrogen 2.929 N/A ASN 268.A ND2 LEU 10.A O no hydrogen 2.947 N/A SER 269.A OG THR 12.A O no hydrogen 3.373 N/A SER 269.A OG THR 12.A OG1 no hydrogen 2.607 N/A SER 269.A OG PRO 13.A O no hydrogen 3.208 N/A LYS 270.A N ASN 268.A OD1 no hydrogen 2.768 N/A LYS 270.A NZ GLN 272.A OE1 no hydrogen 3.505 N/A GLY 271.A N ASN 268.A O no hydrogen 3.106 N/A GLN 272.A N ASN 268.A OD1 no hydrogen 2.957 N/A ASN 273.A ND2 LEU 266.A O no hydrogen 3.054 N/A ASN 273.A ND2 GLY 275.A O no hydrogen 3.088 N/A CYS 274.A N LEU 266.A O no hydrogen 2.714 N/A CYS 274.A SG ALA 9.A O no hydrogen 3.790 N/A CYS 274.A SG LEU 10.A O no hydrogen 3.599 N/A TYR 276.A N THR 5.A O no hydrogen 2.993 N/A ARG 277.A N GLY 264.A O no hydrogen 2.985 N/A ARG 277.A NH1 LEU 260.A O no hydrogen 3.269 N/A ARG 277.A NH1 TYR 261.A O no hydrogen 3.205 N/A ARG 277.A NH1 CYS 279.A O no hydrogen 2.839 N/A ARG 277.A NH2 LEU 260.A O no hydrogen 2.620 N/A ARG 278.A N SER 3.A O no hydrogen 3.078 N/A ARG 278.A NH1 MET 2.A O no hydrogen 3.081 N/A ARG 278.A NH1 THR 5.A OG1 no hydrogen 3.189 N/A ARG 278.A NH2 THR 5.A OG1 no hydrogen 3.144 N/A CYS 279.A SG SER 3.A O no hydrogen 3.725 N/A CYS 279.A SG TYR 4.A OH no hydrogen 3.411 N/A CYS 279.A SG ARG 280.A O no hydrogen 3.872 N/A ARG 280.A N ASP 225.A O no hydrogen 3.279 N/A ARG 280.A NH1 GLU 236.A OE1 no hydrogen 3.212 N/A ARG 280.A NH1 ASN 291.A OD1 no hydrogen 3.119 N/A ARG 280.A NH2 GLU 236.A OE1 no hydrogen 2.621 N/A SER 282.A OG LEU 159.A O no hydrogen 3.247 N/A GLY 283.A N VAL 161.A O no hydrogen 2.931 N/A LEU 285.A N GLU 171.A OE2 no hydrogen 3.145 N/A THR 287.A N VAL 284.A O no hydrogen 3.194 N/A CYS 289.A SG TYR 240.A OH no hydrogen 3.772 N/A GLY 290.A N THR 286.A O no hydrogen 2.813 N/A ASN 291.A N THR 287.A O no hydrogen 2.965 N/A ASN 291.A ND2 ASP 225.A OD1 no hydrogen 2.875 N/A THR 292.A N SER 288.A O no hydrogen 2.777 N/A THR 292.A OG1 SER 288.A O no hydrogen 2.636 N/A LEU 293.A N CYS 289.A O no hydrogen 2.887 N/A THR 294.A N GLY 290.A O no hydrogen 2.933 N/A THR 294.A OG1 GLY 290.A O no hydrogen 3.026 N/A CYS 295.A N ASN 291.A O no hydrogen 2.846 N/A TYR 296.A N THR 292.A O no hydrogen 2.978 N/A LEU 297.A N LEU 293.A O no hydrogen 2.915 N/A LYS 298.A N THR 294.A O no hydrogen 3.087 N/A LYS 298.A NZ ASP 232.A OD1 no hydrogen 2.783 N/A LYS 298.A NZ TYR 346.A O no hydrogen 2.996 N/A ALA 299.A N CYS 295.A O no hydrogen 2.985 N/A THR 300.A N TYR 296.A O no hydrogen 2.939 N/A THR 300.A OG1 TYR 296.A O no hydrogen 2.829 N/A ALA 301.A N LEU 297.A O no hydrogen 3.228 N/A ALA 302.A N LYS 298.A O no hydrogen 2.876 N/A CYS 303.A N ALA 299.A O no hydrogen 2.930 N/A CYS 303.A SG ALA 299.A O no hydrogen 3.399 N/A ARG 304.A N THR 300.A O no hydrogen 3.479 N/A ARG 304.A NH2 GLU 70.A OE1 no hydrogen 3.443 N/A ARG 304.A NH2 GLU 70.A OE2 no hydrogen 2.952 N/A ALA 305.A N ALA 301.A O no hydrogen 3.123 N/A ALA 306.A N ALA 302.A O no hydrogen 2.932 N/A LYS 307.A N ARG 304.A O no hydrogen 3.177 N/A LEU 308.A N CYS 303.A O no hydrogen 2.985 N/A CYS 311.A SG LEU 308.A O no hydrogen 3.645 N/A THR 312.A N ILE 323.A O no hydrogen 2.914 N/A LEU 314.A N VAL 321.A O no hydrogen 3.012 N/A VAL 315.A N SER 190.A O no hydrogen 3.090 N/A ASN 316.A N ASP 319.A O no hydrogen 3.061 N/A GLY 317.A N THR 292.A OG1 no hydrogen 2.959 N/A ASP 319.A N ASN 316.A O no hydrogen 2.724 N/A VAL 321.A N LEU 314.A O no hydrogen 3.036 N/A VAL 322.A N PHE 217.A O no hydrogen 3.019 N/A ILE 323.A N THR 312.A O no hydrogen 3.073 N/A CYS 324.A N MET 215.A O no hydrogen 2.902 N/A GLU 325.A N GLN 309.A O no hydrogen 2.837 N/A SER 326.A N CYS 213.A O no hydrogen 2.681 N/A SER 326.A OG ASP 332.A OD1 no hydrogen 2.543 N/A ALA 327.A N ASP 332.A OD2 no hydrogen 2.944 N/A GLY 328.A N SER 326.A OG no hydrogen 3.415 N/A ASP 332.A N GLY 328.A O no hydrogen 2.759 N/A ALA 333.A N THR 329.A O no hydrogen 3.257 N/A ALA 334.A N GLN 330.A O no hydrogen 3.011 N/A ALA 335.A N GLU 331.A O no hydrogen 2.917 N/A LEU 336.A N ASP 332.A O no hydrogen 3.203 N/A ARG 337.A N ALA 333.A O no hydrogen 3.406 N/A ALA 338.A N ALA 334.A O no hydrogen 3.220 N/A PHE 339.A N ALA 335.A O no hydrogen 2.786 N/A THR 340.A N LEU 336.A O no hydrogen 2.690 N/A THR 340.A OG1 LEU 336.A O no hydrogen 3.028 N/A GLU 341.A N ARG 337.A O no hydrogen 2.924 N/A ALA 342.A N ALA 338.A O no hydrogen 2.947 N/A MET 343.A N PHE 339.A O no hydrogen 2.985 N/A THR 344.A N THR 340.A O no hydrogen 2.884 N/A THR 344.A OG1 THR 340.A O no hydrogen 2.722 N/A ARG 345.A N GLU 341.A O no hydrogen 3.023 N/A TYR 346.A N ALA 342.A O no hydrogen 2.949 N/A TYR 346.A OH ASP 61.A OD1 no hydrogen 2.955 N/A TYR 346.A OH ASP 61.A OD2 no hydrogen 2.625 N/A SER 347.A N THR 344.A O no hydrogen 2.930 N/A SER 347.A OG THR 227.A O no hydrogen 2.882 N/A SER 347.A OG SER 347.A O no hydrogen 2.416 N/A ALA 348.A N MET 343.A O no hydrogen 2.872 N/A GLY 351.A N ASP 220.A O no hydrogen 3.020 N/A GLU 357.A N GLY 216.A O no hydrogen 2.680 N/A TYR 358.A OH ASP 332.A OD1 no hydrogen 2.828 N/A GLU 361.A N ASP 359.A OD1 no hydrogen 3.017 N/A LEU 362.A N ASP 359.A O no hydrogen 2.805 N/A ILE 363.A N LEU 360.A O no hydrogen 3.256 N/A SER 365.A N SER 368.A O no hydrogen 2.911 N/A CYS 366.A N ASP 319.A OD2 no hydrogen 3.326 N/A SER 368.A N SER 365.A O no hydrogen 3.205 N/A SER 368.A OG SER 365.A O no hydrogen 2.965 N/A ASN 369.A N THR 385.A O no hydrogen 2.802 N/A ASN 369.A ND2 VAL 370.A O no hydrogen 3.044 N/A SER 371.A N TYR 383.A O no hydrogen 2.925 N/A SER 371.A OG GLU 361.A OE1 no hydrogen 2.976 N/A ALA 373.A N VAL 381.A O no hydrogen 3.128 N/A ALA 376.A N THR 473.A OG1 no hydrogen 3.306 N/A SER 377.A N ASP 375.A OD2 no hydrogen 3.200 N/A SER 377.A OG ASP 375.A OD1 no hydrogen 3.301 N/A SER 377.A OG ASP 375.A OD2 no hydrogen 3.550 N/A GLY 378.A N ASP 375.A O no hydrogen 2.586 N/A LYS 379.A N ASP 375.A OD1 no hydrogen 2.765 N/A ARG 380.A NH2 TYR 382.A OH no hydrogen 3.347 N/A VAL 381.A N ALA 373.A O no hydrogen 2.856 N/A TYR 383.A N SER 371.A O no hydrogen 3.236 N/A THR 385.A N ASN 369.A O no hydrogen 2.826 N/A THR 385.A OG1 ARG 386.A O no hydrogen 3.510 N/A THR 385.A OG1 GLU 481.A OE2 no hydrogen 2.897 N/A ARG 386.A NE ASP 387.A O no hydrogen 2.904 N/A THR 389.A N ASP 387.A OD2 no hydrogen 3.021 N/A THR 389.A OG1 ASP 387.A OD2 no hydrogen 2.846 N/A LEU 392.A N PRO 388.A O no hydrogen 2.968 N/A ALA 393.A N THR 389.A O no hydrogen 2.968 N/A ARG 394.A N THR 390.A O no hydrogen 3.083 N/A ARG 394.A NE VAL 144.A O no hydrogen 2.859 N/A ARG 394.A NH2 VAL 144.A O no hydrogen 3.152 N/A ALA 395.A N PRO 391.A O no hydrogen 2.841 N/A ALA 396.A N LEU 392.A O no hydrogen 2.899 N/A TRP 397.A N ALA 393.A O no hydrogen 2.939 N/A GLU 398.A N ARG 394.A O no hydrogen 2.927 N/A THR 399.A N ALA 395.A O no hydrogen 3.096 N/A THR 399.A N ALA 396.A O no hydrogen 3.053 N/A THR 399.A OG1 ALA 395.A O no hydrogen 2.938 N/A ALA 400.A N ALA 396.A O no hydrogen 3.154 N/A ARG 401.A N TRP 397.A O no hydrogen 2.910 N/A THR 403.A OG1 ILE 405.A O no hydrogen 3.380 N/A ASN 406.A N ASP 444.A O no hydrogen 3.097 N/A ASN 406.A ND2 ASP 444.A O no hydrogen 3.307 N/A SER 407.A N GLU 398.A OE1 no hydrogen 2.979 N/A SER 407.A OG GLU 398.A OE1 no hydrogen 2.807 N/A SER 407.A OG GLU 398.A OE2 no hydrogen 3.565 N/A TRP 408.A N GLU 398.A OE2 no hydrogen 3.227 N/A LEU 409.A N ASN 406.A O no hydrogen 3.006 N/A GLY 410.A N ASN 406.A O no hydrogen 3.469 N/A ASN 411.A N SER 407.A O no hydrogen 2.776 N/A ILE 412.A N TRP 408.A O no hydrogen 2.962 N/A ILE 413.A N LEU 409.A O no hydrogen 3.077 N/A MET 414.A N GLY 410.A O no hydrogen 2.821 N/A TYR 415.A N ASN 411.A O no hydrogen 2.823 N/A THR 418.A N TYR 415.A O no hydrogen 2.877 N/A THR 418.A OG1 TYR 415.A O no hydrogen 2.765 N/A TRP 420.A NE1 THR 385.A OG1 no hydrogen 3.142 N/A ALA 421.A N THR 418.A OG1 no hydrogen 3.120 N/A ARG 422.A N THR 418.A O no hydrogen 3.147 N/A ARG 422.A NH1 LEU 474.A O no hydrogen 3.204 N/A ARG 422.A NH1 TYR 477.A OH no hydrogen 2.856 N/A MET 423.A N LEU 419.A O no hydrogen 3.078 N/A ILE 424.A N TRP 420.A O no hydrogen 2.980 N/A LEU 425.A N TRP 420.A O no hydrogen 3.372 N/A MET 426.A N ALA 421.A O no hydrogen 2.903 N/A THR 427.A OG1 ARG 422.A O no hydrogen 3.498 N/A THR 427.A OG1 MET 423.A O no hydrogen 2.734 N/A HIS 428.A N ILE 424.A O no hydrogen 2.886 N/A PHE 429.A N LEU 425.A O no hydrogen 3.089 N/A PHE 430.A N MET 426.A O no hydrogen 2.896 N/A SER 431.A N THR 427.A O no hydrogen 3.076 N/A SER 431.A OG HIS 428.A O no hydrogen 2.805 N/A ILE 432.A N HIS 428.A O no hydrogen 3.221 N/A LEU 433.A N PHE 429.A O no hydrogen 2.929 N/A LEU 434.A N PHE 430.A O no hydrogen 2.874 N/A ALA 435.A N SER 431.A O no hydrogen 2.955 N/A GLN 436.A N ILE 432.A O no hydrogen 3.071 N/A GLU 437.A N LEU 433.A O no hydrogen 2.657 N/A GLU 437.A N LEU 434.A O no hydrogen 2.951 N/A GLN 438.A N LEU 433.A O no hydrogen 3.097 N/A LYS 441.A NZ HIS 402.A NE2 no hydrogen 3.144 N/A LEU 443.A N ILE 454.A O no hydrogen 2.677 N/A CYS 445.A N TYR 452.A O no hydrogen 2.704 N/A CYS 445.A SG TYR 452.A O no hydrogen 3.991 N/A ILE 447.A N ALA 450.A O no hydrogen 3.047 N/A TYR 448.A OH TYR 195.A O no hydrogen 2.792 N/A ALA 450.A N ILE 447.A O no hydrogen 3.240 N/A CYS 451.A N ILE 560.A O no hydrogen 2.928 N/A TYR 452.A N CYS 445.A O no hydrogen 2.554 N/A ILE 454.A N LEU 443.A O no hydrogen 2.708 N/A GLU 455.A N ARG 566.A O no hydrogen 2.730 N/A ASP 458.A N GLU 455.A O no hydrogen 2.917 N/A LEU 459.A N PRO 456.A O no hydrogen 3.332 N/A GLN 461.A N GLN 461.A OE1 no hydrogen 2.393 N/A ILE 462.A N ASP 458.A O no hydrogen 3.027 N/A ILE 463.A N LEU 459.A O no hydrogen 2.714 N/A GLU 464.A N PRO 460.A O no hydrogen 2.923 N/A ARG 465.A N GLN 461.A O no hydrogen 3.018 N/A LEU 466.A N ILE 462.A O no hydrogen 2.989 N/A HIS 467.A N ILE 463.A O no hydrogen 2.834 N/A HIS 467.A NE2 ILE 413.A O no hydrogen 2.919 N/A GLY 468.A N GLU 464.A O no hydrogen 2.756 N/A ALA 471.A N GLY 468.A O no hydrogen 3.185 N/A PHE 472.A N LEU 469.A O no hydrogen 2.694 N/A THR 473.A N SER 470.A O no hydrogen 2.839 N/A THR 473.A OG1 SER 470.A O no hydrogen 3.366 N/A HIS 475.A N HIS 374.A O no hydrogen 2.789 N/A HIS 475.A ND1 SER 476.A OG no hydrogen 2.933 N/A SER 476.A OG HIS 475.A ND1 no hydrogen 2.933 N/A TYR 477.A OH PRO 417.A O no hydrogen 2.836 N/A SER 478.A OG GLU 361.A OE1 no hydrogen 3.456 N/A GLU 481.A N SER 478.A OG no hydrogen 3.245 N/A ILE 482.A N SER 478.A O no hydrogen 3.044 N/A ASN 483.A N PRO 479.A O no hydrogen 2.776 N/A ARG 484.A N GLY 480.A O no hydrogen 3.022 N/A ARG 484.A NH1 ASN 369.A OD1 no hydrogen 3.192 N/A ARG 484.A NH2 ASN 369.A OD1 no hydrogen 2.930 N/A ARG 484.A NH2 GLU 481.A OE1 no hydrogen 3.058 N/A VAL 485.A N GLU 481.A O no hydrogen 2.982 N/A ALA 486.A N ILE 482.A O no hydrogen 2.993 N/A SER 487.A N ASN 483.A O no hydrogen 2.962 N/A CYS 488.A N ARG 484.A O no hydrogen 3.047 N/A CYS 488.A SG THR 389.A OG1 no hydrogen 3.445 N/A LEU 489.A N VAL 485.A O no hydrogen 2.972 N/A ARG 490.A N ALA 486.A O no hydrogen 3.156 N/A LYS 491.A N SER 487.A O no hydrogen 3.250 N/A LYS 491.A NZ THR 389.A OG1 no hydrogen 2.638 N/A LEU 492.A N CYS 488.A O no hydrogen 3.217 N/A GLY 493.A N ARG 490.A O no hydrogen 3.254 N/A VAL 494.A N LEU 489.A O no hydrogen 2.802 N/A THR 499.A N PRO 496.A O no hydrogen 3.055 N/A THR 499.A OG1 PRO 496.A O no hydrogen 3.211 N/A TRP 500.A N LEU 497.A O no hydrogen 2.880 N/A TRP 500.A NE1 PRO 495.A O no hydrogen 2.999 N/A HIS 502.A N THR 499.A O no hydrogen 3.193 N/A ALA 504.A N TRP 500.A O no hydrogen 2.976 N/A ARG 505.A N ARG 501.A O no hydrogen 3.428 N/A VAL 507.A N ARG 503.A O no hydrogen 3.111 N/A ARG 508.A N ALA 504.A O no hydrogen 2.724 N/A ALA 509.A N ARG 505.A O no hydrogen 2.926 N/A LYS 510.A N SER 506.A O no hydrogen 3.029 N/A LEU 511.A N VAL 507.A O no hydrogen 2.921 N/A LEU 511.A N ARG 508.A O no hydrogen 3.126 N/A LEU 512.A N ARG 508.A O no hydrogen 3.021 N/A SER 513.A N ALA 509.A O no hydrogen 3.047 N/A SER 513.A OG ALA 509.A O no hydrogen 2.848 N/A GLY 515.A N LEU 512.A O no hydrogen 3.329 N/A ARG 517.A NH1 GLU 455.A OE1 no hydrogen 2.596 N/A ARG 517.A NH1 ASP 458.A OD1 no hydrogen 3.104 N/A ARG 517.A NH2 GLU 455.A OE1 no hydrogen 3.368 N/A ALA 519.A N GLY 515.A O no hydrogen 3.001 N/A THR 520.A N GLY 516.A O no hydrogen 3.338 N/A THR 520.A OG1 GLY 516.A O no hydrogen 3.536 N/A CYS 521.A N ARG 517.A O no hydrogen 3.153 N/A CYS 521.A N ALA 518.A O no hydrogen 3.121 N/A CYS 521.A SG LEU 457.A O no hydrogen 3.741 N/A CYS 521.A SG ARG 517.A O no hydrogen 3.475 N/A GLY 522.A N ALA 518.A O no hydrogen 3.177 N/A ARG 523.A N ALA 519.A O no hydrogen 3.154 N/A TYR 524.A N THR 520.A O no hydrogen 3.154 N/A TYR 524.A OH THR 537.A O no hydrogen 2.587 N/A LEU 525.A N CYS 521.A O no hydrogen 2.867 N/A ASN 527.A ND2 LEU 534.A O no hydrogen 3.598 N/A TRP 528.A NE1 LEU 525.A O no hydrogen 3.024 N/A ALA 529.A N PHE 526.A O no hydrogen 2.821 N/A VAL 530.A N ASN 527.A O no hydrogen 3.217 N/A LYS 533.A NZ ASN 527.A O no hydrogen 3.068 N/A LYS 533.A NZ VAL 530.A O no hydrogen 3.315 N/A LEU 534.A N ASN 527.A OD1 no hydrogen 2.957 N/A ILE 539.A N GLU 464.A OE1 no hydrogen 2.972 N/A ILE 539.A N GLU 464.A OE2 no hydrogen 3.274 N/A SER 543.A OG ILE 539.A O no hydrogen 2.779 N/A GLN 544.A N ALA 541.A O no hydrogen 3.103 N/A GLN 544.A N ALA 542.A O no hydrogen 2.501 N/A ASP 546.A N GLN 544.A O no hydrogen 2.519 N/A GLY 549.A N SER 548.A OG no hydrogen 2.403 N/A GLY 554.A N TYR 191.A OH no hydrogen 3.338 N/A TYR 555.A N TYR 448.A O no hydrogen 3.057 N/A TYR 555.A OH SER 180.A OG no hydrogen 2.604 N/A GLY 558.A N TYR 555.A O no hydrogen 2.685 N/A TYR 561.A N LEU 91.A O no hydrogen 2.829 N/A HIS 562.A N CYS 451.A O no hydrogen 3.111 N/A