Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fie_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N GLY 1.A O no hydrogen 3.165 N/A ARG 4.A NH1 VAL 6.A O no hydrogen 3.490 N/A ASN 9.A ND2 ILE 83.A O no hydrogen 3.683 N/A SER 11.A OG ASP 221.A OD2 no hydrogen 3.515 N/A ASN 12.A N ASP 221.A OD1 no hydrogen 2.959 N/A ASN 12.A N ASP 221.A OD2 no hydrogen 3.189 N/A ASN 12.A ND2 LYS 134.A O no hydrogen 3.026 N/A ALA 13.A N ASP 221.A OD2 no hydrogen 3.177 N/A ALA 14.A N SER 11.A OG no hydrogen 3.093 N/A ASN 24.A N SER 67.A OG no hydrogen 3.131 N/A ASN 24.A ND2 LEU 23.A O no hydrogen 3.039 N/A THR 26.A N ASP 65.A O no hydrogen 2.690 N/A THR 26.A OG1 SER 27.A OG no hydrogen 3.001 N/A THR 26.A OG1 ASP 65.A O no hydrogen 3.015 N/A SER 27.A N ASP 65.A O no hydrogen 3.255 N/A SER 27.A OG THR 26.A OG1 no hydrogen 3.001 N/A SER 27.A OG ASP 65.A OD2 no hydrogen 3.221 N/A HIS 29.A N GLN 63.A O no hydrogen 2.636 N/A HIS 29.A NE2 ASP 65.A OD2 no hydrogen 2.858 N/A LYS 32.A NZ ASN 50.A O no hydrogen 3.118 N/A LYS 32.A NZ GLU 155.A O no hydrogen 3.520 N/A ARG 34.A NE ASP 45.A O no hydrogen 3.085 N/A ARG 34.A NH1 GLU 48.A OE2 no hydrogen 3.115 N/A ARG 34.A NH2 ASP 45.A O no hydrogen 2.831 N/A ARG 34.A NH2 GLU 48.A OE2 no hydrogen 3.552 N/A ASP 36.A N GLU 33.A O no hydrogen 2.881 N/A THR 37.A N ASP 36.A OD1 no hydrogen 3.346 N/A ASN 38.A ND2 TYR 61.A O no hydrogen 3.158 N/A LYS 39.A NZ LYS 51.A O no hydrogen 2.730 N/A VAL 40.A N ASP 36.A O no hydrogen 3.203 N/A ASP 41.A N THR 37.A O no hydrogen 2.708 N/A HIS 42.A N ASN 38.A O no hydrogen 2.741 N/A HIS 42.A NE2 SER 59.A O no hydrogen 2.830 N/A HIS 43.A N VAL 40.A O no hydrogen 2.898 N/A THR 44.A N LYS 39.A O no hydrogen 2.810 N/A THR 44.A OG1 LYS 39.A O no hydrogen 3.160 N/A THR 44.A OG1 ILE 53.A O no hydrogen 2.700 N/A TYR 47.A OH CYS 305.A O no hydrogen 2.482 N/A GLU 48.A N PHE 208.A O no hydrogen 2.692 N/A LYS 51.A NZ PRO 154.A O no hydrogen 3.156 N/A LYS 51.A NZ ASP 157.A OD2 no hydrogen 3.545 N/A VAL 54.A N TYR 159.A O no hydrogen 2.784 N/A ARG 55.A N HIS 42.A ND1 no hydrogen 3.051 N/A ARG 55.A NH1 PHE 162.A O no hydrogen 3.170 N/A ARG 55.A NH2 HIS 43.A O no hydrogen 3.306 N/A ARG 56.A N LEU 161.A O no hydrogen 2.895 N/A ARG 56.A NE ASP 169.A OD2 no hydrogen 2.734 N/A ARG 56.A NH1 CYS 130.A O no hydrogen 2.574 N/A ARG 56.A NH1 GLY 231.A O no hydrogen 2.961 N/A ARG 56.A NH2 ASP 169.A OD1 no hydrogen 2.910 N/A ARG 56.A NH2 ASP 169.A OD2 no hydrogen 3.559 N/A ARG 56.A NH2 GLY 231.A O no hydrogen 3.399 N/A GLY 57.A N SER 126.A OG no hydrogen 3.005 N/A PHE 60.A N ILE 124.A O no hydrogen 2.937 N/A TYR 61.A N ASN 38.A OD1 no hydrogen 3.171 N/A VAL 62.A N LEU 122.A O no hydrogen 3.233 N/A GLN 63.A N HIS 29.A O no hydrogen 2.672 N/A ILE 64.A N VAL 120.A O no hydrogen 3.220 N/A ASP 65.A N SER 27.A O no hydrogen 2.706 N/A PHE 66.A N ARG 118.A O no hydrogen 2.863 N/A SER 67.A N ASN 24.A O no hydrogen 2.637 N/A ARG 68.A NH1 ASP 75.A OD2 no hydrogen 2.973 N/A ARG 68.A NH2 ASP 75.A OD2 no hydrogen 2.956 N/A ASP 71.A N ASP 75.A OD2 no hydrogen 3.116 N/A ARG 73.A N ASP 71.A OD2 no hydrogen 3.239 N/A ARG 74.A N ASP 71.A O no hydrogen 3.490 N/A ARG 78.A N ALA 140.A O no hydrogen 2.937 N/A VAL 79.A N VAL 97.A O no hydrogen 3.254 N/A GLU 80.A N TYR 138.A O no hydrogen 2.664 N/A TYR 81.A N ILE 95.A O no hydrogen 2.862 N/A VAL 82.A N ARG 136.A O no hydrogen 3.181 N/A ILE 83.A N THR 93.A O no hydrogen 3.163 N/A TYR 86.A N ASN 9.A OD1 no hydrogen 3.036 N/A GLN 88.A N THR 93.A OG1 no hydrogen 2.799 N/A LYS 91.A N GLN 88.A O no hydrogen 2.896 N/A THR 93.A N GLN 88.A O no hydrogen 3.043 N/A THR 93.A OG1 GLN 88.A O no hydrogen 3.368 N/A TYR 94.A OH GLU 80.A OE2 no hydrogen 2.840 N/A ILE 95.A N TYR 81.A O no hydrogen 2.854 N/A VAL 97.A N VAL 79.A O no hydrogen 2.743 N/A VAL 100.A N ALA 110.A O no hydrogen 2.694 N/A LYS 107.A N GLN 104.A O no hydrogen 3.265 N/A GLY 109.A N GLN 125.A O no hydrogen 3.205 N/A ALA 110.A N PRO 98.A O no hydrogen 2.891 N/A LYS 111.A NZ GLU 102.A OE2 no hydrogen 3.130 N/A VAL 113.A N ARG 121.A O no hydrogen 2.567 N/A MET 114.A N ARG 121.A O no hydrogen 3.225 N/A ARG 115.A NH2 TYR 70.A O no hydrogen 2.782 N/A GLU 116.A N SER 119.A O no hydrogen 3.234 N/A ARG 118.A NH1 SER 67.A O no hydrogen 2.566 N/A SER 119.A OG ASP 65.A OD1 no hydrogen 2.622 N/A VAL 120.A N ILE 64.A O no hydrogen 3.265 N/A ARG 121.A N MET 114.A O no hydrogen 2.535 N/A LEU 122.A N VAL 62.A O no hydrogen 2.792 N/A SER 123.A N LYS 111.A O no hydrogen 2.995 N/A ILE 124.A N PHE 60.A O no hydrogen 2.805 N/A GLN 125.A N GLY 109.A O no hydrogen 2.865 N/A GLN 125.A NE2 GLN 104.A O no hydrogen 3.333 N/A LYS 129.A N SER 127.A OG no hydrogen 3.131 N/A CYS 130.A N SER 127.A O no hydrogen 3.189 N/A CYS 130.A SG ILE 131.A O no hydrogen 3.606 N/A GLY 133.A N ILE 160.A O no hydrogen 3.242 N/A LYS 134.A N ASN 12.A OD1 no hydrogen 2.926 N/A PHE 135.A N THR 158.A O no hydrogen 2.697 N/A ARG 136.A N VAL 82.A O no hydrogen 2.911 N/A ARG 136.A NH1 GLY 84.A O no hydrogen 2.972 N/A TYR 138.A N GLU 80.A O no hydrogen 2.901 N/A VAL 139.A N THR 150.A OG1 no hydrogen 2.718 N/A ALA 140.A N ARG 78.A O no hydrogen 2.885 N/A VAL 141.A N LEU 148.A O no hydrogen 2.747 N/A TRP 142.A N LEU 76.A O no hydrogen 3.226 N/A THR 143.A OG1 GLY 146.A O no hydrogen 2.774 N/A LEU 148.A N VAL 141.A O no hydrogen 2.752 N/A ARG 149.A N THR 20.A O no hydrogen 2.873 N/A ARG 149.A NE GLU 80.A OE1 no hydrogen 2.675 N/A ARG 149.A NE GLU 80.A OE2 no hydrogen 3.267 N/A ARG 149.A NH1 PRO 19.A O no hydrogen 2.728 N/A ARG 149.A NH2 GLU 80.A OE2 no hydrogen 3.013 N/A THR 150.A OG1 VAL 139.A O no hydrogen 2.754 N/A ARG 152.A NH1 GLU 15.A OE2 no hydrogen 3.511 N/A ARG 152.A NH2 ASP 157.A OD2 no hydrogen 3.281 N/A THR 156.A N ASN 153.A O no hydrogen 3.080 N/A THR 156.A OG1 ASN 153.A O no hydrogen 2.777 N/A ASP 157.A N PRO 154.A O no hydrogen 3.051 N/A THR 158.A N PHE 135.A O no hydrogen 2.955 N/A THR 158.A OG1 THR 156.A O no hydrogen 3.144 N/A TYR 159.A N LEU 52.A O no hydrogen 3.069 N/A TYR 159.A OH ASP 214.A OD1 no hydrogen 2.753 N/A TYR 159.A OH ASP 214.A OD2 no hydrogen 3.115 N/A ILE 160.A N GLY 133.A O no hydrogen 2.915 N/A LEU 161.A N VAL 54.A O no hydrogen 2.953 N/A PHE 162.A N LEU 306.A O no hydrogen 3.011 N/A ASN 163.A N ASP 169.A OD2 no hydrogen 3.178 N/A ASN 163.A ND2 ARG 55.A O no hydrogen 3.448 N/A ASN 163.A ND2 ARG 56.A O no hydrogen 2.981 N/A TRP 165.A N ASN 163.A OD1 no hydrogen 2.906 N/A TRP 165.A NE1 GLU 176.A OE2 no hydrogen 3.133 N/A CYS 166.A N ASN 163.A O no hydrogen 3.101 N/A CYS 166.A SG GLY 57.A O no hydrogen 3.504 N/A ASP 169.A N CYS 166.A O no hydrogen 2.978 N/A VAL 171.A N ASP 169.A OD1 no hydrogen 3.169 N/A TYR 172.A N ASP 169.A O no hydrogen 3.184 N/A TYR 172.A OH ASP 174.A OD1 no hydrogen 3.227 N/A LEU 173.A N PRO 164.A O no hydrogen 2.778 N/A GLU 178.A N ASN 175.A OD1 no hydrogen 2.745 N/A ARG 179.A N ASN 175.A O no hydrogen 2.824 N/A ARG 179.A NE PRO 164.A O no hydrogen 3.397 N/A ARG 179.A NE LEU 173.A O no hydrogen 2.542 N/A GLU 180.A N GLU 176.A O no hydrogen 2.667 N/A GLU 181.A N LYS 177.A O no hydrogen 3.067 N/A TYR 182.A N GLU 178.A O no hydrogen 2.671 N/A VAL 183.A N ARG 179.A O no hydrogen 3.224 N/A LEU 184.A N ARG 179.A O no hydrogen 3.394 N/A ASN 185.A N GLU 180.A O no hydrogen 2.913 N/A ASN 185.A ND2 GLU 181.A OE2 no hydrogen 3.283 N/A ILE 187.A N ASN 185.A OD1 no hydrogen 3.124 N/A GLY 188.A N TRP 203.A O no hydrogen 2.777 N/A ILE 190.A N ARG 201.A O no hydrogen 3.182 N/A TYR 192.A N LYS 199.A O no hydrogen 2.902 N/A GLU 194.A N ASP 197.A O no hydrogen 3.269 N/A ASN 196.A N GLU 194.A OE1 no hydrogen 2.835 N/A ASP 197.A N GLU 194.A O no hydrogen 2.748 N/A LYS 199.A N TYR 192.A O no hydrogen 2.958 N/A LYS 199.A NZ ASP 197.A OD2 no hydrogen 2.915 N/A ARG 201.A NH1 SER 202.A O no hydrogen 2.804 N/A ARG 201.A NH1 TRP 270.A O no hydrogen 3.413 N/A ARG 201.A NH2 TRP 270.A O no hydrogen 2.638 N/A SER 202.A OG GLU 698.A OE1 no hydrogen 2.898 N/A TRP 203.A N GLY 188.A O no hydrogen 2.780 N/A TRP 203.A NE1 SER 273.A OG no hydrogen 2.765 N/A SER 204.A N THR 271.A O no hydrogen 3.419 N/A TYR 205.A N ASP 186.A O no hydrogen 2.770 N/A GLY 206.A N ASP 186.A O no hydrogen 3.097 N/A GLN 207.A N GLN 207.A OE1 no hydrogen 2.900 N/A GLN 207.A NE2 VAL 183.A O no hydrogen 2.791 N/A GLN 207.A NE2 ASN 185.A O no hydrogen 2.928 N/A GLU 209.A N GLY 206.A O no hydrogen 3.108 N/A ASP 214.A N GLY 211.A O no hydrogen 3.135 N/A THR 215.A N GLY 211.A O no hydrogen 3.065 N/A THR 215.A N ILE 212.A O no hydrogen 2.755 N/A THR 215.A OG1 ILE 212.A O no hydrogen 3.246 N/A CYS 216.A N ILE 212.A O no hydrogen 3.020 N/A CYS 216.A SG ILE 212.A O no hydrogen 3.451 N/A TYR 218.A N ASP 214.A O no hydrogen 3.144 N/A TYR 218.A OH GLU 284.A OE1 no hydrogen 2.620 N/A VAL 219.A N THR 215.A O no hydrogen 2.694 N/A MET 220.A N CYS 216.A O no hydrogen 3.361 N/A ASP 221.A N LEU 217.A O no hydrogen 3.019 N/A ARG 222.A N TYR 218.A O no hydrogen 2.764 N/A ARG 222.A NH1 TYR 218.A OH no hydrogen 2.926 N/A ARG 222.A NH1 GLU 284.A O no hydrogen 2.799 N/A ALA 223.A N VAL 219.A O no hydrogen 2.730 N/A GLN 224.A N ASP 221.A O no hydrogen 3.028 N/A MET 225.A N MET 220.A O no hydrogen 3.087 N/A LEU 227.A N ASN 9.A O no hydrogen 2.965 N/A SER 228.A OG LYS 91.A O no hydrogen 2.746 N/A GLY 229.A N ASP 226.A O no hydrogen 2.927 N/A ARG 230.A N LEU 227.A O no hydrogen 3.060 N/A ARG 230.A NE MET 225.A O no hydrogen 3.397 N/A ARG 230.A NH1 ASP 221.A OD1 no hydrogen 2.755 N/A ARG 230.A NH2 ASP 221.A OD1 no hydrogen 2.660 N/A ARG 230.A NH2 MET 225.A O no hydrogen 3.037 N/A ASN 232.A N GLY 229.A O no hydrogen 3.189 N/A VAL 236.A N ASN 232.A O no hydrogen 2.832 N/A SER 237.A N PRO 233.A O no hydrogen 2.810 N/A SER 237.A OG PRO 233.A O no hydrogen 2.916 N/A SER 237.A OG ILE 234.A O no hydrogen 2.913 N/A ARG 238.A N ILE 234.A O no hydrogen 2.759 N/A ARG 238.A NH1 GLY 388.A O no hydrogen 2.946 N/A ARG 238.A NH1 ASP 405.A OD2 no hydrogen 2.789 N/A ARG 238.A NH2 ASP 382.A OD2 no hydrogen 3.521 N/A VAL 239.A N LYS 235.A O no hydrogen 2.773 N/A GLY 240.A N VAL 236.A O no hydrogen 2.928 N/A SER 241.A N SER 237.A O no hydrogen 3.059 N/A SER 241.A OG SER 237.A O no hydrogen 2.782 N/A SER 241.A OG ARG 238.A O no hydrogen 3.461 N/A ALA 242.A N VAL 239.A O no hydrogen 3.292 N/A MET 243.A N GLY 240.A O no hydrogen 2.773 N/A ALA 246.A N LEU 253.A O no hydrogen 2.562 N/A ASP 248.A N ALA 246.A O no hydrogen 2.705 N/A VAL 252.A N MET 243.A O no hydrogen 2.573 N/A LEU 253.A N VAL 244.A O no hydrogen 2.799 N/A VAL 254.A N VAL 287.A O no hydrogen 3.077 N/A SER 256.A N GLY 290.A O no hydrogen 3.119 N/A SER 256.A OG ASP 258.A OD1 no hydrogen 2.622 N/A ASN 259.A ND2 ASN 259.A O no hydrogen 2.824 N/A TYR 261.A N ASP 258.A OD2 no hydrogen 3.186 N/A TYR 261.A OH GLU 578.A OE1 no hydrogen 2.551 N/A TYR 261.A OH GLU 578.A OE2 no hydrogen 3.087 N/A GLY 264.A N TYR 261.A O no hydrogen 3.247 N/A SER 268.A OG GLU 578.A OE2 no hydrogen 3.135 N/A SER 268.A OG HIS 694.A ND1 no hydrogen 2.441 N/A ALA 269.A N PRO 266.A O no hydrogen 2.620 N/A TRP 270.A NE1 TYR 289.A O no hydrogen 2.962 N/A THR 271.A OG1 ASP 275.A OD2 no hydrogen 3.221 N/A SER 273.A N SER 204.A O no hydrogen 3.081 N/A SER 273.A OG THR 301.A OG1 no hydrogen 2.768 N/A LEU 277.A N SER 273.A O no hydrogen 2.921 N/A LEU 278.A N VAL 274.A O no hydrogen 3.140 N/A GLU 279.A N ASP 275.A O no hydrogen 3.322 N/A TYR 280.A N ILE 276.A O no hydrogen 2.886 N/A ARG 281.A N LEU 277.A O no hydrogen 3.070 N/A ARG 281.A NH1 ARG 281.A O no hydrogen 3.211 N/A SER 282.A N LEU 278.A O no hydrogen 3.075 N/A SER 282.A OG LEU 278.A O no hydrogen 2.608 N/A SER 283.A N GLU 279.A O no hydrogen 2.817 N/A SER 283.A OG GLU 279.A O no hydrogen 2.567 N/A SER 283.A OG GLU 279.A OE1 no hydrogen 2.937 N/A SER 283.A OG TYR 280.A O no hydrogen 3.246 N/A SER 283.A OG ASN 285.A O no hydrogen 3.141 N/A GLU 284.A N TYR 280.A O no hydrogen 2.518 N/A ASN 285.A N SER 283.A OG no hydrogen 3.252 N/A VAL 287.A N VAL 252.A O no hydrogen 2.703 N/A GLN 291.A NE2 SER 256.A O no hydrogen 2.787 N/A CYS 292.A SG TYR 538.A OH no hydrogen 3.608 N/A VAL 294.A N GLN 291.A O no hydrogen 2.751 N/A PHE 295.A N GLN 291.A O no hydrogen 3.155 N/A ALA 296.A N CYS 292.A O no hydrogen 3.298 N/A GLY 297.A N VAL 294.A O no hydrogen 3.152 N/A VAL 298.A N VAL 294.A O no hydrogen 3.222 N/A PHE 299.A N PHE 295.A O no hydrogen 3.164 N/A ASN 300.A N ALA 296.A O no hydrogen 3.271 N/A ASN 300.A ND2 ALA 310.A O no hydrogen 3.524 N/A THR 301.A N GLY 297.A O no hydrogen 3.009 N/A THR 301.A OG1 TYR 205.A O no hydrogen 2.828 N/A THR 301.A OG1 SER 273.A OG no hydrogen 2.768 N/A THR 301.A OG1 GLY 297.A O no hydrogen 3.149 N/A PHE 302.A N VAL 298.A O no hydrogen 3.038 N/A LEU 303.A N PHE 299.A O no hydrogen 3.077 N/A ARG 304.A N ASN 300.A O no hydrogen 3.148 N/A ARG 304.A NE ALA 310.A O no hydrogen 2.793 N/A ARG 304.A NH1 ASN 185.A O no hydrogen 2.758 N/A ARG 304.A NH2 ALA 310.A O no hydrogen 2.648 N/A CYS 305.A N THR 301.A O no hydrogen 3.042 N/A CYS 305.A SG GLN 207.A O no hydrogen 3.544 N/A LEU 306.A N PHE 302.A O no hydrogen 3.388 N/A GLY 307.A N LEU 303.A O no hydrogen 2.976 N/A GLY 307.A N ARG 304.A O no hydrogen 2.909 N/A ILE 308.A N LEU 303.A O no hydrogen 2.752 N/A ALA 310.A N TYR 182.A O no hydrogen 3.266 N/A ARG 311.A N GLU 355.A O no hydrogen 2.973 N/A ARG 311.A NE GLU 355.A OE1 no hydrogen 2.731 N/A ARG 311.A NH1 TYR 182.A OH no hydrogen 3.226 N/A ARG 311.A NH2 GLU 355.A OE1 no hydrogen 2.720 N/A VAL 313.A N TRP 353.A O no hydrogen 2.711 N/A THR 314.A N VAL 443.A O no hydrogen 2.971 N/A THR 314.A OG1 PHE 191.A O no hydrogen 2.938 N/A ASN 315.A N HIS 351.A O no hydrogen 2.807 N/A ASN 315.A ND2 LEU 441.A O no hydrogen 3.336 N/A TYR 316.A N LEU 441.A O no hydrogen 2.931 N/A TYR 316.A OH TYR 192.A O no hydrogen 2.716 N/A PHE 317.A N ASN 349.A O no hydrogen 2.630 N/A SER 318.A N TRP 348.A O no hydrogen 2.969 N/A SER 318.A OG ASN 315.A OD1 no hydrogen 3.130 N/A SER 318.A OG GLU 412.A OE1 no hydrogen 2.663 N/A ALA 319.A N GLU 412.A O no hydrogen 3.095 N/A HIS 320.A N SER 318.A O no hydrogen 3.083 N/A HIS 320.A ND1 GLU 412.A OE2 no hydrogen 2.447 N/A HIS 320.A NE2 PRO 377.A O no hydrogen 2.811 N/A ASN 322.A N GLN 378.A OE1 no hydrogen 3.233 N/A ASN 322.A ND2 ALA 319.A O no hydrogen 3.061 N/A ASN 322.A ND2 PHE 408.A O no hydrogen 2.964 N/A ALA 324.A N ASN 322.A OD1 no hydrogen 2.868 N/A ASN 325.A N ASN 322.A O no hydrogen 2.976 N/A ASN 325.A ND2 LYS 481.A O no hydrogen 3.454 N/A LEU 326.A N LYS 481.A O no hydrogen 2.829 N/A GLN 327.A NE2 LEU 484.A O no hydrogen 2.541 N/A MET 328.A N ASP 416.A O no hydrogen 2.720 N/A ILE 330.A N ILE 418.A O no hydrogen 2.734 N/A PHE 331.A N THR 343.A OG1 no hydrogen 2.855 N/A LEU 332.A N ILE 420.A O no hydrogen 2.911 N/A GLU 333.A N ASN 337.A O no hydrogen 2.744 N/A GLY 336.A N GLU 333.A O no hydrogen 2.966 N/A ASN 337.A N ASP 335.A OD1 no hydrogen 2.982 N/A ASN 339.A N PHE 331.A O no hydrogen 2.700 N/A LYS 341.A N ASN 339.A OD1 no hydrogen 2.787 N/A LEU 342.A N ASN 339.A OD1 no hydrogen 3.357 N/A THR 343.A OG1 PHE 331.A O no hydrogen 3.306 N/A THR 343.A OG1 ASN 339.A O no hydrogen 2.539 N/A THR 343.A OG1 LEU 342.A O no hydrogen 2.723 N/A LYS 344.A NZ SER 340.A O no hydrogen 3.460 N/A SER 346.A OG THR 539.A O no hydrogen 3.414 N/A TRP 348.A N SER 318.A O no hydrogen 2.981 N/A ASN 349.A N TYR 538.A O no hydrogen 2.738 N/A TYR 350.A OH GLN 579.A OE1 no hydrogen 2.641 N/A HIS 351.A N ASN 315.A O no hydrogen 2.778 N/A HIS 351.A NE2 ASP 374.A OD2 no hydrogen 3.082 N/A CYS 352.A SG THR 314.A OG1 no hydrogen 3.305 N/A TRP 353.A N VAL 313.A O no hydrogen 3.025 N/A TRP 353.A NE1 TYR 459.A OH no hydrogen 2.915 N/A ASN 354.A N VAL 373.A O no hydrogen 2.948 N/A ASN 354.A ND2 ALA 296.A O no hydrogen 2.718 N/A ASN 354.A ND2 ASN 300.A OD1 no hydrogen 3.264 N/A GLU 355.A N ARG 311.A O no hydrogen 3.011 N/A ALA 356.A N GLN 371.A O no hydrogen 2.995 N/A TRP 357.A N PRO 309.A O no hydrogen 2.693 N/A TRP 357.A NE1 TYR 172.A O no hydrogen 2.970 N/A MET 358.A N GLY 369.A O no hydrogen 2.990 N/A ARG 360.A NE GLN 371.A OE1 no hydrogen 2.769 N/A ARG 360.A NH1 ASP 362.A OD1 no hydrogen 2.874 N/A ARG 360.A NH2 GLN 403.A O no hydrogen 2.979 N/A LEU 363.A N ARG 360.A O no hydrogen 3.168 N/A GLY 369.A N MET 358.A O no hydrogen 2.844 N/A GLN 371.A N ALA 356.A O no hydrogen 2.800 N/A GLN 371.A NE2 PHE 367.A O no hydrogen 3.563 N/A ALA 372.A N ALA 390.A O no hydrogen 2.886 N/A VAL 373.A N ASN 354.A O no hydrogen 2.923 N/A ASP 374.A N CYS 387.A O no hydrogen 2.859 N/A THR 376.A N ASP 374.A OD1 no hydrogen 3.021 N/A GLN 378.A N TYR 385.A O no hydrogen 3.189 N/A ASN 380.A N GLY 383.A O no hydrogen 2.748 N/A ASN 380.A ND2 ARG 386.A O no hydrogen 3.487 N/A SER 381.A OG ASP 382.A OD1 no hydrogen 3.431 N/A ASP 382.A N ASN 380.A OD1 no hydrogen 2.887 N/A TYR 385.A N GLN 378.A O no hydrogen 2.846 N/A ARG 386.A NE ARG 238.A O no hydrogen 3.231 N/A ARG 386.A NH1 ARG 386.A O no hydrogen 3.118 N/A CYS 387.A N ASP 374.A O no hydrogen 2.879 N/A CYS 387.A SG TYR 385.A O no hydrogen 3.975 N/A GLY 388.A N ASP 405.A OD2 no hydrogen 2.939 N/A ALA 390.A N ALA 372.A O no hydrogen 2.971 N/A SER 391.A OG PHE 367.A O no hydrogen 2.817 N/A VAL 392.A N TRP 370.A O no hydrogen 2.911 N/A ALA 394.A N SER 391.A O no hydrogen 2.731 N/A ALA 394.A N SER 391.A OG no hydrogen 3.302 N/A ILE 395.A N SER 391.A O no hydrogen 3.114 N/A LYS 396.A N VAL 392.A O no hydrogen 3.020 N/A LYS 396.A NZ ASP 457.A O no hydrogen 2.326 N/A HIS 397.A N ALA 394.A O no hydrogen 2.822 N/A HIS 397.A ND1 GLN 393.A O no hydrogen 2.861 N/A GLY 398.A N ALA 394.A O no hydrogen 2.705 N/A GLY 398.A N ILE 395.A O no hydrogen 3.008 N/A HIS 399.A N ALA 394.A O no hydrogen 3.087 N/A PHE 402.A N HIS 399.A O no hydrogen 3.155 N/A GLN 403.A NE2 ASP 362.A OD2 no hydrogen 2.856 N/A PHE 408.A N ASP 405.A O no hydrogen 2.995 N/A VAL 409.A N ALA 406.A O no hydrogen 3.289 N/A PHE 410.A N ALA 406.A O no hydrogen 3.152 N/A ALA 411.A N PRO 407.A O no hydrogen 3.134 N/A VAL 413.A N VAL 409.A O no hydrogen 3.418 N/A VAL 413.A N PHE 410.A O no hydrogen 3.104 N/A ASN 414.A N PHE 410.A O no hydrogen 2.866 N/A ASN 414.A N ALA 411.A O no hydrogen 2.917 N/A ASN 414.A ND2 PHE 410.A O no hydrogen 3.614 N/A SER 415.A N ALA 411.A O no hydrogen 3.191 N/A SER 415.A OG ASN 325.A O no hydrogen 3.540 N/A SER 415.A OG ALA 411.A O no hydrogen 3.063 N/A ASP 416.A N LEU 326.A O no hydrogen 2.856 N/A LEU 417.A N ASP 434.A O no hydrogen 2.854 N/A ILE 418.A N MET 328.A O no hydrogen 2.728 N/A TYR 419.A N ASN 432.A O no hydrogen 2.744 N/A TYR 419.A OH GLN 600.A OE1 no hydrogen 3.295 N/A ILE 420.A N ILE 330.A O no hydrogen 3.020 N/A THR 421.A N VAL 429.A O no hydrogen 2.629 N/A THR 421.A OG1 GLU 431.A OE2 no hydrogen 2.396 N/A ALA 422.A N LEU 332.A O no hydrogen 2.936 N/A LYS 423.A N THR 427.A O no hydrogen 2.953 N/A LYS 424.A N GLU 334.A OE2 no hydrogen 2.792 N/A GLY 426.A N LYS 423.A O no hydrogen 2.876 N/A THR 427.A N ASP 425.A OD1 no hydrogen 3.107 N/A THR 427.A OG1 ASP 425.A OD1 no hydrogen 2.539 N/A THR 427.A OG1 ASP 425.A OD2 no hydrogen 2.953 N/A VAL 429.A N THR 421.A O no hydrogen 2.953 N/A GLU 431.A N TYR 419.A O no hydrogen 2.744 N/A ASN 432.A N TYR 419.A O no hydrogen 3.394 N/A ASN 432.A ND2 GLU 431.A O no hydrogen 3.166 N/A ASP 434.A N LEU 417.A O no hydrogen 2.683 N/A THR 436.A N ASP 434.A OD1 no hydrogen 3.010 N/A THR 436.A OG1 ASP 434.A OD1 no hydrogen 2.685 N/A GLY 439.A N PHE 317.A O no hydrogen 2.773 N/A LYS 440.A N TYR 316.A O no hydrogen 3.238 N/A ILE 442.A N THR 456.A OG1 no hydrogen 2.920 N/A VAL 443.A N THR 314.A O no hydrogen 2.934 N/A THR 444.A N MET 453.A O no hydrogen 2.990 N/A THR 444.A OG1 ILE 312.A O no hydrogen 2.883 N/A LYS 445.A NZ GLU 181.A OE1 no hydrogen 3.211 N/A LYS 445.A NZ GLN 446.A O no hydrogen 3.551 N/A LYS 445.A NZ GLY 449.A O no hydrogen 2.941 N/A GLN 446.A N GLY 451.A O no hydrogen 2.865 N/A MET 453.A N THR 444.A O no hydrogen 2.640 N/A ILE 455.A N MET 453.A O no hydrogen 3.233 N/A THR 456.A OG1 ILE 442.A O no hydrogen 2.929 N/A THR 456.A OG1 ASP 454.A OD1 no hydrogen 3.167 N/A THR 456.A OG1 ASP 454.A OD2 no hydrogen 3.150 N/A THR 458.A N ILE 455.A O no hydrogen 3.153 N/A THR 458.A OG1 ILE 455.A O no hydrogen 2.618 N/A TYR 459.A N THR 456.A O no hydrogen 3.105 N/A TYR 459.A OH GLU 355.A OE2 no hydrogen 2.797 N/A LYS 460.A NZ GLY 439.A O no hydrogen 3.362 N/A GLY 464.A N GLU 468.A OE1 no hydrogen 2.977 N/A GLY 464.A N GLU 468.A OE2 no hydrogen 3.281 N/A GLN 465.A N GLN 462.A O no hydrogen 3.459 N/A ARG 469.A N GLN 465.A O no hydrogen 3.147 N/A LEU 470.A N GLU 466.A O no hydrogen 2.833 N/A ALA 471.A N GLU 467.A O no hydrogen 2.865 N/A LEU 472.A N GLU 468.A O no hydrogen 3.098 N/A GLU 473.A N ARG 469.A O no hydrogen 3.042 N/A THR 474.A N LEU 470.A O no hydrogen 2.985 N/A THR 474.A OG1 LEU 470.A O no hydrogen 2.768 N/A ALA 475.A N ALA 471.A O no hydrogen 3.126 N/A LEU 476.A N LEU 472.A O no hydrogen 2.974 N/A MET 477.A N THR 474.A O no hydrogen 2.799 N/A TYR 478.A N THR 474.A O no hydrogen 3.291 N/A ALA 480.A N ALA 475.A O no hydrogen 3.216 N/A LYS 481.A N ALA 324.A O no hydrogen 3.227 N/A LYS 481.A NZ ASP 323.A O no hydrogen 3.024 N/A LEU 484.A N GLN 327.A OE1 no hydrogen 2.827 N/A THR 486.A OG1 ASN 485.A OD1 no hydrogen 3.179 N/A GLY 488.A N THR 486.A O no hydrogen 2.518 N/A LYS 491.A NZ ASP 595.A OD1 no hydrogen 2.745 N/A ARG 493.A NH1 VAL 496.A O no hydrogen 3.009 N/A SER 494.A OG THR 593.A OG1 no hydrogen 3.305 N/A SER 494.A OG ASP 595.A OD2 no hydrogen 3.207 N/A ASN 495.A N SER 492.A O no hydrogen 3.320 N/A ASP 497.A N ARG 518.A O no hydrogen 2.712 N/A ASP 499.A N THR 516.A O no hydrogen 2.911 N/A GLU 501.A N SER 514.A O no hydrogen 3.234 N/A GLU 503.A N LYS 512.A O no hydrogen 3.216 N/A LEU 507.A N THR 606.A O no hydrogen 2.779 N/A LYS 509.A N VAL 506.A O no hydrogen 2.974 N/A PHE 511.A N ILE 567.A O no hydrogen 3.038 N/A LYS 512.A N GLU 503.A OE1 no hydrogen 3.455 N/A LEU 513.A N VAL 565.A O no hydrogen 3.115 N/A ILE 515.A N GLU 563.A O no hydrogen 2.940 N/A THR 516.A N ASP 499.A O no hydrogen 2.781 N/A THR 516.A OG1 ASP 499.A O no hydrogen 2.703 N/A PHE 517.A N LYS 561.A O no hydrogen 2.839 N/A ARG 518.A N ASP 497.A O no hydrogen 2.593 N/A ARG 518.A NH1 ASP 497.A OD2 no hydrogen 3.325 N/A ARG 518.A NH1 THR 516.A OG1 no hydrogen 3.421 N/A ASN 519.A N SER 559.A O no hydrogen 2.841 N/A ASN 519.A ND2 SER 521.A OG no hydrogen 2.792 N/A ASN 520.A N ASN 495.A O no hydrogen 2.522 N/A ASN 520.A ND2 ASN 495.A O no hydrogen 3.164 N/A SER 521.A OG SER 494.A O no hydrogen 3.294 N/A TYR 525.A N LEU 555.A O no hydrogen 2.811 N/A THR 526.A N GLU 592.A OE1 no hydrogen 2.984 N/A THR 526.A OG1 GLU 592.A OE2 no hydrogen 2.651 N/A ILE 527.A N VAL 553.A O no hydrogen 2.737 N/A TYR 530.A N THR 587.A O no hydrogen 3.043 N/A TYR 530.A OH ASP 335.A O no hydrogen 2.726 N/A LEU 531.A N GLU 549.A O no hydrogen 2.755 N/A SER 532.A N PHE 585.A O no hydrogen 3.348 N/A SER 532.A OG GLU 545.A OE2 no hydrogen 2.504 N/A ALA 533.A N LYS 547.A O no hydrogen 2.879 N/A ASN 534.A N HIS 583.A O no hydrogen 2.969 N/A ILE 535.A N ALA 544.A O no hydrogen 2.717 N/A THR 536.A N SER 581.A O no hydrogen 3.489 N/A THR 536.A OG1 PHE 537.A O no hydrogen 3.209 N/A THR 536.A OG1 SER 581.A OG no hydrogen 3.410 N/A PHE 537.A N VAL 541.A O no hydrogen 2.891 N/A GLY 540.A N PHE 537.A O no hydrogen 3.043 N/A LYS 543.A N ILE 535.A O no hydrogen 2.608 N/A LYS 543.A NZ GLN 575.A O no hydrogen 3.244 N/A LYS 547.A N ALA 533.A O no hydrogen 3.342 N/A LYS 547.A NZ GLU 549.A OE1 no hydrogen 3.081 N/A LYS 548.A NZ ASN 337.A OD1 no hydrogen 3.419 N/A LYS 548.A NZ GLU 545.A OE1 no hydrogen 3.521 N/A LYS 548.A NZ GLU 545.A OE2 no hydrogen 2.756 N/A GLU 549.A N LEU 531.A O no hydrogen 3.056 N/A THR 550.A OG1 ALA 529.A O no hydrogen 3.499 N/A PHE 551.A N ALA 529.A O no hydrogen 2.852 N/A VAL 553.A N ILE 527.A O no hydrogen 2.912 N/A LEU 555.A N TYR 525.A O no hydrogen 2.819 N/A LEU 558.A N ASN 519.A OD1 no hydrogen 3.028 N/A LEU 558.A N SER 521.A O no hydrogen 3.249 N/A SER 559.A N GLU 556.A O no hydrogen 3.081 N/A LYS 561.A N PHE 517.A O no hydrogen 2.974 N/A LYS 561.A NZ THR 554.A O no hydrogen 3.163 N/A LYS 561.A NZ SER 559.A OG no hydrogen 2.951 N/A GLU 563.A N ILE 515.A O no hydrogen 2.976 N/A VAL 565.A N LEU 513.A O no hydrogen 2.944 N/A ILE 567.A N PHE 511.A O no hydrogen 2.889 N/A GLN 568.A N GLU 571.A OE2 no hydrogen 2.794 N/A ALA 569.A N ASP 510.A OD1 no hydrogen 2.835 N/A GLU 571.A N GLN 568.A O no hydrogen 2.698 N/A TYR 572.A N ALA 569.A O no hydrogen 3.181 N/A TYR 572.A OH LYS 509.A O no hydrogen 2.490 N/A MET 573.A N ALA 569.A O no hydrogen 2.958 N/A GLN 575.A N TYR 572.A O no hydrogen 2.983 N/A GLN 575.A NE2 GLU 571.A O no hydrogen 3.115 N/A LEU 576.A N TYR 572.A O no hydrogen 3.380 N/A GLU 578.A N ASN 259.A OD1 no hydrogen 2.868 N/A ALA 580.A N LEU 577.A O no hydrogen 2.793 N/A SER 581.A OG THR 536.A O no hydrogen 2.866 N/A SER 581.A OG THR 536.A OG1 no hydrogen 3.410 N/A LEU 582.A N THR 603.A O no hydrogen 2.828 N/A HIS 583.A N ASN 534.A O no hydrogen 3.216 N/A HIS 583.A ND1 LYS 601.A O no hydrogen 2.727 N/A PHE 584.A N LYS 601.A O no hydrogen 2.968 N/A PHE 585.A N SER 532.A O no hydrogen 3.061 N/A VAL 586.A N LYS 599.A O no hydrogen 2.936 N/A THR 587.A OG1 GLY 336.A O no hydrogen 2.572 N/A ALA 588.A N LEU 597.A O no hydrogen 2.904 N/A ARG 589.A N THR 528.A O no hydrogen 3.379 N/A ARG 589.A NH1 ARG 594.A O no hydrogen 2.618 N/A ILE 590.A N ASP 595.A O no hydrogen 2.921 N/A ASN 591.A N THR 526.A O no hydrogen 2.941 N/A ASN 591.A ND2 THR 526.A O no hydrogen 2.872 N/A ASN 591.A ND2 THR 528.A OG1 no hydrogen 3.332 N/A THR 593.A OG1 SER 494.A OG no hydrogen 3.305 N/A LEU 597.A N ALA 588.A O no hydrogen 2.959 N/A LYS 599.A N VAL 586.A O no hydrogen 3.025 N/A LYS 599.A NZ ASP 499.A OD1 no hydrogen 3.021 N/A LYS 601.A N PHE 584.A O no hydrogen 3.444 N/A SER 602.A OG ASN 349.A OD1 no hydrogen 2.781 N/A THR 603.A N LEU 582.A O no hydrogen 2.831 N/A LEU 605.A N ALA 580.A O no hydrogen 2.827 N/A THR 606.A N ALA 505.A O no hydrogen 3.371 N/A THR 606.A OG1 ALA 505.A O no hydrogen 3.076 N/A ILE 611.A N GLN 629.A O no hydrogen 2.899 N/A LYS 613.A N THR 627.A O no hydrogen 2.769 N/A ARG 615.A N THR 625.A O no hydrogen 2.777 N/A ARG 615.A NH1 GLU 670.A OE2 no hydrogen 2.884 N/A THR 617.A OG1 ASP 623.A O no hydrogen 3.341 N/A GLN 618.A NE2 GLN 702.A O no hydrogen 2.691 N/A VAL 619.A N THR 617.A O no hydrogen 2.873 N/A VAL 620.A N GLN 704.A O no hydrogen 2.833 N/A GLY 621.A N PRO 675.A O no hydrogen 2.921 N/A SER 622.A N VAL 619.A O no hydrogen 2.937 N/A SER 622.A OG VAL 619.A O no hydrogen 3.094 N/A SER 622.A OG VAL 620.A O no hydrogen 3.502 N/A THR 625.A N ARG 615.A O no hydrogen 3.284 N/A VAL 626.A N GLU 671.A O no hydrogen 2.818 N/A THR 627.A N LYS 613.A O no hydrogen 2.446 N/A THR 627.A OG1 LYS 613.A O no hydrogen 3.134 N/A THR 627.A OG1 GLU 670.A OE1 no hydrogen 3.206 N/A ILE 628.A N TRP 669.A O no hydrogen 2.754 N/A GLN 629.A N ILE 611.A O no hydrogen 2.801 N/A PHE 630.A N VAL 667.A O no hydrogen 3.042 N/A THR 631.A OG1 THR 666.A OG1 no hydrogen 2.585 N/A ASN 632.A N SER 665.A O no hydrogen 2.904 N/A ASN 632.A ND2 GLU 636.A O no hydrogen 2.566 N/A ASN 632.A ND2 ILE 661.A O no hydrogen 3.178 N/A ASN 632.A ND2 ARG 662.A O no hydrogen 3.647 N/A LYS 635.A NZ ASN 664.A OD1 no hydrogen 2.678 N/A THR 637.A OG1 ILE 661.A O no hydrogen 3.372 N/A LEU 638.A N ILE 661.A O no hydrogen 2.937 N/A ASN 640.A N ARG 659.A O no hydrogen 2.919 N/A ASN 640.A ND2 ASP 690.A OD1 no hydrogen 3.494 N/A VAL 641.A N PHE 658.A O no hydrogen 2.837 N/A TRP 642.A N SER 688.A O no hydrogen 2.720 N/A VAL 643.A N LYS 656.A O no hydrogen 2.782 N/A HIS 644.A N SER 686.A O no hydrogen 2.937 N/A LEU 645.A N MET 654.A O no hydrogen 2.685 N/A ASP 646.A N ILE 684.A O no hydrogen 2.857 N/A VAL 650.A N GLY 647.A O no hydrogen 3.038 N/A THR 651.A N GLY 647.A O no hydrogen 2.745 N/A THR 651.A OG1 ARG 652.A O no hydrogen 2.626 N/A ARG 652.A NH1 ASP 210.A O no hydrogen 3.552 N/A ARG 652.A NH2 GLU 209.A OE1 no hydrogen 2.842 N/A MET 654.A N LEU 645.A O no hydrogen 2.771 N/A LYS 656.A N VAL 643.A O no hydrogen 2.826 N/A PHE 658.A N VAL 641.A O no hydrogen 2.752 N/A ILE 661.A N LEU 638.A O no hydrogen 2.837 N/A ARG 662.A NH2 GLU 660.A OE2 no hydrogen 2.651 N/A ASN 664.A N ASN 632.A O no hydrogen 3.141 N/A ASN 664.A ND2 ASN 632.A O no hydrogen 3.198 N/A ASN 664.A ND2 PRO 633.A O no hydrogen 3.359 N/A SER 665.A N ARG 662.A O no hydrogen 3.009 N/A SER 665.A OG ARG 662.A O no hydrogen 2.605 N/A THR 666.A OG1 THR 631.A OG1 no hydrogen 2.585 N/A VAL 667.A N PHE 630.A O no hydrogen 2.848 N/A GLN 668.A NE2 GLN 629.A OE1 no hydrogen 3.033 N/A GLU 671.A N VAL 626.A O no hydrogen 3.100 N/A CYS 673.A N MET 624.A O no hydrogen 2.755 N/A TRP 676.A N GLY 649.A O no hydrogen 2.783 N/A GLY 679.A N ILE 703.A O no hydrogen 2.764 N/A HIS 680.A ND1 VAL 701.A O no hydrogen 3.324 N/A ARG 681.A N VAL 701.A O no hydrogen 3.067 N/A ARG 681.A NE HIS 680.A O no hydrogen 2.995 N/A ARG 681.A NH2 ASP 186.A OD1 no hydrogen 3.169 N/A LYS 682.A NZ ASP 450.A OD1 no hydrogen 3.315 N/A LYS 682.A NZ ASP 450.A OD2 no hydrogen 3.322 N/A LYS 682.A NZ GLU 698.A OE2 no hydrogen 3.359 N/A LEU 683.A N LEU 699.A O no hydrogen 2.951 N/A ILE 684.A N ASP 646.A O no hydrogen 2.678 N/A ALA 685.A N GLY 697.A O no hydrogen 2.583 N/A SER 686.A N HIS 644.A O no hydrogen 3.184 N/A SER 686.A OG ALA 269.A O no hydrogen 2.656 N/A MET 687.A N VAL 695.A O no hydrogen 2.768 N/A SER 688.A N TRP 642.A O no hydrogen 2.880 N/A SER 689.A N LEU 692.A O no hydrogen 2.889 N/A SER 689.A OG LEU 692.A O no hydrogen 2.491 N/A ASP 690.A N ARG 639.A O no hydrogen 2.918 N/A ARG 693.A NH1 ASN 259.A O no hydrogen 3.115 N/A ARG 693.A NH2 SER 689.A O no hydrogen 3.222 N/A HIS 694.A ND1 SER 268.A OG no hydrogen 2.441 N/A TYR 696.A OH SER 268.A O no hydrogen 2.595 N/A GLY 697.A N ALA 685.A O no hydrogen 2.800 N/A LEU 699.A N LEU 683.A O no hydrogen 3.041 N/A ILE 703.A N GLY 679.A O no hydrogen 3.356 N/A GLN 704.A N GLN 618.A O no hydrogen 2.996 N/A