Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3egd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 4.A OE1 no hydrogen 3.546 N/A PHE 5.A N THR 1.A O no hydrogen 2.884 N/A ILE 6.A N TYR 2.A O no hydrogen 3.145 N/A GLN 7.A N LEU 3.A O no hydrogen 2.885 N/A GLN 8.A N GLU 4.A O no hydrogen 2.903 N/A ASN 9.A N PHE 5.A O no hydrogen 3.003 N/A GLU 10.A N ILE 6.A O no hydrogen 3.184 N/A GLU 10.A N GLN 7.A O no hydrogen 2.973 N/A GLU 11.A N GLN 7.A O no hydrogen 3.073 N/A ARG 12.A N GLN 8.A O no hydrogen 2.929 N/A ARG 12.A NH1 ASP 13.A OD2 no hydrogen 3.124 N/A ASP 13.A N ASN 9.A O no hydrogen 2.899 N/A ARG 16.A N LEU 39.A O no hydrogen 3.096 N/A ARG 16.A NE ASP 490.A OD2 no hydrogen 3.197 N/A ARG 16.A NH1 GLU 10.A OE1 no hydrogen 3.022 N/A ARG 16.A NH2 ASP 490.A OD1 no hydrogen 2.971 N/A ARG 16.A NH2 ASP 490.A OD2 no hydrogen 3.121 N/A ARG 16.A NH2 GLU 492.A OE1 no hydrogen 3.119 N/A SER 18.A N ALA 37.A O no hydrogen 2.771 N/A SER 18.A OG PRO 35.A O no hydrogen 2.719 N/A SER 18.A OG ALA 37.A O no hydrogen 3.407 N/A TRP 19.A NE1 VAL 34.A O no hydrogen 2.880 N/A ASN 20.A N SER 488.A O no hydrogen 3.082 N/A ASN 20.A ND2 SER 488.A O no hydrogen 3.326 N/A VAL 21.A N SER 488.A OG no hydrogen 3.106 N/A TRP 22.A N ASN 474.A O no hydrogen 3.016 N/A TRP 22.A NE1 TRP 19.A O no hydrogen 2.807 N/A SER 24.A N GLN 481.A OE1 no hydrogen 3.470 N/A SER 24.A OG ALA 476.A O no hydrogen 2.627 N/A GLU 28.A N SER 25.A O no hydrogen 3.204 N/A ALA 29.A N SER 25.A O no hydrogen 3.082 N/A THR 30.A N ARG 26.A O no hydrogen 3.489 N/A THR 30.A OG1 ARG 26.A O no hydrogen 2.952 N/A ARG 31.A N GLU 28.A O no hydrogen 3.131 N/A MET 32.A N ALA 29.A O no hydrogen 3.279 N/A ALA 37.A N SER 18.A OG no hydrogen 2.714 N/A ALA 38.A N ILE 440.A O no hydrogen 3.086 N/A LEU 39.A N ARG 16.A O no hydrogen 2.979 N/A PHE 40.A N LEU 438.A O no hydrogen 2.721 N/A THR 41.A N GLY 14.A O no hydrogen 3.015 N/A THR 41.A OG1 THR 437.A OG1 no hydrogen 2.641 N/A LYS 44.A N THR 41.A O no hydrogen 3.149 N/A LYS 44.A NZ GLU 10.A O no hydrogen 3.321 N/A ASP 48.A N ARG 46.A O no hydrogen 2.933 N/A ILE 52.A N GLU 116.A O no hydrogen 2.969 N/A TYR 54.A OH GLU 107.A OE2 no hydrogen 2.289 N/A CYS 59.A N ALA 66.A O no hydrogen 2.812 N/A CYS 59.A SG ASN 90.A OD1 no hydrogen 3.621 N/A SER 60.A N ASN 90.A OD1 no hydrogen 2.768 N/A SER 60.A OG ASN 90.A OD1 no hydrogen 2.411 N/A ARG 61.A NE GLN 88.A OE1 no hydrogen 3.276 N/A ARG 61.A NH2 GLN 88.A OE1 no hydrogen 3.191 N/A VAL 67.A N GLN 452.A OE1 no hydrogen 2.978 N/A LEU 68.A N VAL 57.A O no hydrogen 3.073 N/A ASN 69.A ND2 VAL 67.A O no hydrogen 3.180 N/A ASN 69.A ND2 ASN 84.A OD1 no hydrogen 3.092 N/A LEU 71.A N ASN 69.A OD1 no hydrogen 2.606 N/A CYS 72.A N ASN 69.A O no hydrogen 3.075 N/A CYS 72.A SG ASN 84.A OD1 no hydrogen 3.315 N/A GLN 73.A N ALA 82.A O no hydrogen 3.296 N/A ASP 75.A N LEU 80.A O no hydrogen 2.919 N/A ARG 77.A N ASP 75.A OD1 no hydrogen 3.306 N/A LYS 79.A NZ TYR 76.A O no hydrogen 3.053 N/A LYS 79.A NZ ILE 99.A O no hydrogen 3.351 N/A LEU 80.A N ASP 75.A O no hydrogen 3.410 N/A TRP 81.A N ASN 90.A O no hydrogen 2.943 N/A ALA 82.A N GLN 73.A O no hydrogen 2.779 N/A CYS 83.A N GLN 88.A O no hydrogen 2.891 N/A GLN 88.A NE2 ARG 89.A O no hydrogen 3.171 N/A ASN 90.A N TRP 81.A O no hydrogen 2.592 N/A ASN 90.A ND2 TRP 81.A O no hydrogen 3.501 N/A GLN 91.A NE2 PHE 92.A O no hydrogen 3.510 N/A TYR 96.A N PRO 93.A O no hydrogen 2.662 N/A TYR 96.A OH GLU 107.A OE1 no hydrogen 2.541 N/A ALA 97.A N PRO 94.A O no hydrogen 2.920 N/A ILE 99.A N TYR 96.A O no hydrogen 3.043 N/A SER 100.A OG ASN 103.A O no hydrogen 3.058 N/A ASN 103.A N SER 100.A O no hydrogen 3.119 N/A GLU 107.A N GLU 107.A OE2 no hydrogen 2.566 N/A LEU 108.A N PRO 105.A O no hydrogen 2.995 N/A LEU 109.A N ALA 106.A O no hydrogen 2.904 N/A PHE 112.A N LEU 109.A O no hydrogen 2.964 N/A SER 113.A OG ASP 13.A OD1 no hydrogen 2.693 N/A SER 113.A OG ASP 13.A OD2 no hydrogen 3.080 N/A SER 114.A OG ARG 12.A O no hydrogen 3.542 N/A SER 114.A OG ASP 13.A OD1 no hydrogen 2.570 N/A SER 114.A OG THR 469.A OG1 no hydrogen 2.655 N/A ILE 115.A N VAL 468.A O no hydrogen 2.736 N/A TYR 117.A N ILE 466.A O no hydrogen 2.921 N/A VAL 118.A N ILE 52.A O no hydrogen 2.932 N/A VAL 119.A N ARG 464.A O no hydrogen 2.937 N/A PHE 129.A N LEU 161.A O no hydrogen 2.944 N/A LEU 130.A N ARG 266.A O no hydrogen 2.957 N/A TYR 131.A N GLY 163.A O no hydrogen 2.939 N/A TYR 131.A OH SER 152.A OG no hydrogen 2.791 N/A VAL 132.A N MET 268.A O no hydrogen 3.006 N/A VAL 133.A N ILE 165.A O no hydrogen 2.698 N/A ASP 134.A N PHE 270.A O no hydrogen 3.169 N/A THR 135.A N PHE 167.A O no hydrogen 2.802 N/A THR 135.A OG1 PHE 167.A O no hydrogen 2.680 N/A CYS 136.A N ASP 134.A OD1 no hydrogen 2.696 N/A CYS 136.A SG LEU 242.A O no hydrogen 3.600 N/A LEU 142.A N GLU 138.A O no hydrogen 2.892 N/A GLN 143.A N ASP 139.A O no hydrogen 2.804 N/A ALA 144.A N GLU 140.A O no hydrogen 3.136 N/A LEU 145.A N ASP 141.A O no hydrogen 3.095 N/A LYS 146.A N LEU 142.A O no hydrogen 2.894 N/A LYS 146.A NZ GLY 226.A O no hydrogen 2.704 N/A LYS 146.A NZ LEU 228.A O no hydrogen 2.921 N/A GLU 147.A N GLN 143.A O no hydrogen 2.967 N/A SER 148.A N ALA 144.A O no hydrogen 2.867 N/A SER 148.A OG ALA 144.A O no hydrogen 3.222 N/A MET 149.A N LEU 145.A O no hydrogen 3.001 N/A GLN 150.A N LYS 146.A O no hydrogen 2.832 N/A GLN 150.A NE2 THR 222.A O no hydrogen 2.927 N/A MET 151.A N GLU 147.A O no hydrogen 3.132 N/A SER 152.A N SER 148.A O no hydrogen 3.238 N/A SER 152.A OG TYR 131.A OH no hydrogen 2.791 N/A SER 152.A OG MET 149.A O no hydrogen 2.739 N/A LEU 153.A N MET 149.A O no hydrogen 3.208 N/A SER 154.A N MET 151.A O no hydrogen 2.824 N/A SER 154.A OG MET 151.A O no hydrogen 2.691 N/A LEU 155.A N SER 152.A O no hydrogen 3.241 N/A LEU 156.A N LEU 153.A O no hydrogen 3.431 N/A ALA 160.A N PRO 157.A O no hydrogen 2.981 N/A LEU 161.A N LEU 127.A O no hydrogen 2.886 N/A VAL 162.A N GLN 212.A O no hydrogen 2.742 N/A GLY 163.A N PHE 129.A O no hydrogen 3.001 N/A ILE 165.A N TYR 131.A O no hydrogen 2.861 N/A THR 166.A N GLN 172.A O no hydrogen 3.082 N/A THR 166.A OG1 HIS 174.A NE2 no hydrogen 2.827 N/A PHE 167.A N VAL 133.A O no hydrogen 2.878 N/A GLY 168.A N MET 170.A O no hydrogen 3.106 N/A VAL 171.A N PHE 187.A O no hydrogen 2.759 N/A GLN 172.A N THR 166.A O no hydrogen 2.837 N/A VAL 173.A N TYR 185.A O no hydrogen 2.944 N/A HIS 174.A N LEU 164.A O no hydrogen 2.985 N/A HIS 174.A NE2 THR 166.A OG1 no hydrogen 2.827 N/A GLU 175.A N LYS 183.A O no hydrogen 3.021 N/A LEU 176.A N ARG 209.A O no hydrogen 3.175 N/A CYS 178.A SG GLU 175.A OE2 no hydrogen 3.881 N/A ILE 181.A N GLU 179.A O no hydrogen 2.246 N/A SER 182.A OG ILE 181.A O no hydrogen 2.378 N/A SER 182.A OG SER 182.A O no hydrogen 2.424 N/A SER 184.A OG GLN 172.A OE1 no hydrogen 2.859 N/A TYR 185.A N VAL 173.A O no hydrogen 2.839 N/A PHE 187.A N VAL 171.A O no hydrogen 2.819 N/A LEU 193.A N ASP 192.A OD1 no hydrogen 2.461 N/A SER 194.A N GLN 197.A OE1 no hydrogen 2.324 N/A SER 194.A OG GLN 197.A OE1 no hydrogen 2.670 N/A GLN 197.A N SER 194.A OG no hydrogen 3.150 N/A GLN 199.A N ALA 195.A O no hydrogen 2.759 N/A GLU 200.A N LYS 196.A O no hydrogen 3.204 N/A MET 201.A N GLN 197.A O no hydrogen 2.865 N/A LEU 202.A N LEU 198.A O no hydrogen 2.775 N/A LEU 202.A N GLN 199.A O no hydrogen 3.287 N/A GLY 203.A N GLN 199.A O no hydrogen 2.885 N/A ASN 208.A N LEU 211.A O no hydrogen 2.901 N/A ARG 209.A NE GLU 175.A OE1 no hydrogen 2.803 N/A ARG 209.A NH1 LEU 202.A O no hydrogen 2.836 N/A ARG 209.A NH2 LEU 202.A O no hydrogen 2.761 N/A GLN 212.A N VAL 162.A O no hydrogen 3.112 N/A VAL 214.A N ALA 160.A O no hydrogen 2.713 N/A GLN 215.A N PRO 158.A O no hydrogen 3.139 N/A LYS 216.A N PRO 213.A O no hydrogen 3.285 N/A ILE 217.A N VAL 214.A O no hydrogen 2.709 N/A ASP 218.A N VAL 214.A O no hydrogen 2.657 N/A LEU 221.A N ILE 217.A O no hydrogen 2.987 N/A THR 222.A N ASP 218.A O no hydrogen 2.818 N/A ASP 223.A N MET 219.A O no hydrogen 3.040 N/A ASP 223.A N ASN 220.A O no hydrogen 3.024 N/A LEU 224.A N ASN 220.A O no hydrogen 2.883 N/A LEU 225.A N LEU 221.A O no hydrogen 2.912 N/A GLY 226.A N THR 222.A O no hydrogen 3.317 N/A GLU 227.A N ASP 223.A O no hydrogen 2.990 N/A GLU 227.A N LEU 224.A O no hydrogen 3.071 N/A ARG 230.A NH1 ASP 139.A OD1 no hydrogen 2.875 N/A ASP 231.A N THR 135.A O no hydrogen 2.942 N/A LYS 239.A N PRO 236.A O no hydrogen 2.993 N/A LYS 239.A NZ ASP 285.A OD1 no hydrogen 2.685 N/A LYS 239.A NZ ASP 285.A OD2 no hydrogen 3.247 N/A ARG 240.A N ASP 285.A O no hydrogen 2.648 N/A ARG 240.A NE GLY 284.A O no hydrogen 2.811 N/A ARG 243.A N THR 276.A OG1 no hydrogen 3.021 N/A ARG 243.A NE PRO 274.A O no hydrogen 2.762 N/A ARG 243.A NH1 ASP 134.A OD2 no hydrogen 3.504 N/A ARG 243.A NH2 PRO 274.A O no hydrogen 3.210 N/A SER 244.A N GLY 168.A O no hydrogen 2.936 N/A SER 244.A OG GLY 168.A O no hydrogen 3.217 N/A SER 244.A OG ARG 169.A O no hydrogen 2.709 N/A SER 244.A OG GLY 189.A O no hydrogen 3.243 N/A ALA 248.A N SER 244.A O no hydrogen 3.008 N/A LEU 249.A N SER 245.A O no hydrogen 3.019 N/A SER 250.A N GLY 246.A O no hydrogen 2.991 N/A SER 250.A OG ASP 192.A OD1 no hydrogen 2.921 N/A SER 250.A OG GLY 246.A O no hydrogen 3.106 N/A SER 250.A OG VAL 247.A O no hydrogen 2.589 N/A ILE 251.A N VAL 247.A O no hydrogen 2.766 N/A ALA 252.A N ALA 248.A O no hydrogen 2.966 N/A VAL 253.A N LEU 249.A O no hydrogen 3.041 N/A GLY 254.A N SER 250.A O no hydrogen 2.982 N/A LEU 255.A N ILE 251.A O no hydrogen 2.956 N/A LEU 256.A N ALA 252.A O no hydrogen 3.229 N/A GLU 257.A N VAL 253.A O no hydrogen 2.811 N/A CYS 258.A N GLY 254.A O no hydrogen 3.029 N/A CYS 258.A SG GLY 254.A O no hydrogen 3.790 N/A CYS 258.A SG LEU 255.A O no hydrogen 3.578 N/A THR 259.A N LEU 256.A O no hydrogen 3.037 N/A THR 259.A OG1 LEU 255.A O no hydrogen 2.694 N/A THR 259.A OG1 LEU 256.A O no hydrogen 3.249 N/A PHE 260.A N LEU 256.A O no hydrogen 2.789 N/A ASN 262.A N THR 322.A O no hydrogen 2.717 N/A THR 263.A OG1 PRO 261.A O no hydrogen 3.480 N/A ARG 266.A N ILE 128.A O no hydrogen 2.657 N/A ARG 266.A NE ASP 327.A OD2 no hydrogen 2.524 N/A ILE 267.A N VAL 325.A O no hydrogen 2.682 N/A MET 268.A N LEU 130.A O no hydrogen 2.999 N/A MET 269.A N ASP 327.A O no hydrogen 2.852 N/A PHE 270.A N VAL 132.A O no hydrogen 3.008 N/A ILE 271.A N TYR 329.A O no hydrogen 2.665 N/A GLY 272.A N ASP 134.A OD2 no hydrogen 2.978 N/A THR 276.A N ARG 243.A O no hydrogen 3.109 N/A THR 276.A OG1 PRO 241.A O no hydrogen 2.809 N/A GLN 277.A NE2 ARG 169.A O no hydrogen 3.572 N/A GLN 277.A NE2 GLY 189.A O no hydrogen 2.713 N/A VAL 282.A N ALA 275.A O no hydrogen 2.608 N/A VAL 283.A N ALA 275.A O no hydrogen 3.408 N/A LEU 287.A N GLY 238.A O no hydrogen 3.055 N/A THR 289.A N GLU 286.A O no hydrogen 2.907 N/A ARG 292.A NE GLU 340.A OE2 no hydrogen 2.735 N/A ARG 292.A NH1 ARG 292.A O no hydrogen 2.957 N/A ARG 292.A NH1 GLN 335.A OE1 no hydrogen 3.008 N/A ARG 292.A NH2 GLU 340.A OE1 no hydrogen 2.944 N/A ARG 292.A NH2 GLU 340.A OE2 no hydrogen 3.272 N/A ARG 292.A NH2 ASP 567.A OD1 no hydrogen 2.978 N/A SER 293.A N ASP 296.A OD2 no hydrogen 3.241 N/A SER 293.A OG ASP 296.A OD2 no hydrogen 2.989 N/A TRP 294.A NE1 SER 569.A OG no hydrogen 2.894 N/A ASP 296.A N SER 293.A OG no hydrogen 3.157 N/A ILE 297.A N SER 293.A O no hydrogen 2.953 N/A ASP 298.A N TRP 294.A O no hydrogen 2.956 N/A ASP 298.A N HIS 295.A O no hydrogen 2.974 N/A LYS 299.A N HIS 295.A O no hydrogen 2.983 N/A ASN 301.A N ASP 296.A O no hydrogen 2.805 N/A GLY 308.A N TYR 304.A O no hydrogen 2.791 N/A THR 309.A N VAL 305.A O no hydrogen 2.760 N/A THR 309.A OG1 VAL 305.A O no hydrogen 2.649 N/A LYS 310.A N LYS 306.A O no hydrogen 3.060 N/A HIS 311.A N LYS 307.A O no hydrogen 3.268 N/A HIS 311.A NE2 GLY 246.A O no hydrogen 2.963 N/A PHE 312.A N GLY 308.A O no hydrogen 3.314 N/A GLU 313.A N THR 309.A O no hydrogen 3.100 N/A ALA 314.A N LYS 310.A O no hydrogen 3.131 N/A LEU 315.A N HIS 311.A O no hydrogen 3.290 N/A ALA 316.A N PHE 312.A O no hydrogen 2.684 N/A ASN 317.A N GLU 313.A O no hydrogen 2.945 N/A ARG 318.A N ALA 314.A O no hydrogen 2.739 N/A ARG 318.A NE GLU 257.A OE1 no hydrogen 3.563 N/A ARG 318.A NH2 SER 194.A O no hydrogen 3.000 N/A ALA 319.A N LEU 315.A O no hydrogen 2.891 N/A ALA 320.A N ALA 316.A O no hydrogen 2.814 N/A THR 321.A N ASN 317.A O no hydrogen 3.085 N/A THR 321.A OG1 ASN 317.A O no hydrogen 2.626 N/A THR 322.A N ARG 318.A O no hydrogen 3.243 N/A THR 322.A OG1 ARG 318.A O no hydrogen 3.074 N/A HIS 324.A N ALA 319.A O no hydrogen 2.930 N/A HIS 324.A NE2 PHE 260.A O no hydrogen 2.731 N/A VAL 325.A N ALA 265.A O no hydrogen 2.970 N/A ILE 326.A N THR 348.A OG1 no hydrogen 3.203 N/A ASP 327.A N ILE 267.A O no hydrogen 2.658 N/A ILE 328.A N TYR 351.A O no hydrogen 2.882 N/A TYR 329.A N MET 269.A O no hydrogen 2.666 N/A TYR 329.A OH ASP 327.A OD2 no hydrogen 3.113 N/A ALA 330.A N VAL 353.A O no hydrogen 2.955 N/A CYS 331.A N ILE 271.A O no hydrogen 3.036 N/A ALA 332.A N GLY 355.A O no hydrogen 3.134 N/A THR 336.A N ASP 567.A OD2 no hydrogen 2.721 N/A GLY 337.A N ASP 567.A OD2 no hydrogen 2.946 N/A LEU 339.A N ASP 567.A OD1 no hydrogen 2.890 N/A GLU 340.A N GLY 337.A O no hydrogen 2.989 N/A GLU 340.A N GLU 340.A OE1 no hydrogen 2.521 N/A MET 341.A N GLY 337.A O no hydrogen 3.116 N/A MET 341.A N LEU 338.A O no hydrogen 3.084 N/A LYS 342.A N LEU 338.A O no hydrogen 2.698 N/A LYS 342.A NZ GLU 507.A OE1 no hydrogen 3.163 N/A CYS 344.A N MET 341.A O no hydrogen 2.838 N/A CYS 344.A SG PHE 312.A O no hydrogen 3.423 N/A ASN 346.A N LYS 342.A O no hydrogen 2.884 N/A LEU 347.A N CYS 343.A O no hydrogen 2.638 N/A THR 348.A OG1 CYS 344.A O no hydrogen 2.387 N/A GLY 350.A N THR 348.A OG1 no hydrogen 3.309 N/A TYR 351.A N ASP 327.A OD1 no hydrogen 2.880 N/A VAL 353.A N ILE 328.A O no hydrogen 3.135 N/A GLY 355.A N ALA 330.A O no hydrogen 3.006 N/A SER 357.A OG ASP 141.A OD2 no hydrogen 2.348 N/A ASN 359.A N SER 357.A OG no hydrogen 3.027 N/A THR 360.A OG1 SER 357.A O no hydrogen 2.909 N/A PHE 363.A N THR 360.A OG1 no hydrogen 3.180 N/A LYS 364.A N THR 360.A O no hydrogen 2.862 N/A LYS 364.A NZ ASN 359.A OD1 no hydrogen 3.042 N/A GLN 365.A N SER 361.A O no hydrogen 2.741 N/A THR 366.A N LEU 362.A O no hydrogen 3.177 N/A THR 366.A OG1 LEU 362.A O no hydrogen 2.846 N/A PHE 367.A N PHE 363.A O no hydrogen 2.771 N/A GLN 368.A N LYS 364.A O no hydrogen 3.211 N/A ARG 369.A N GLN 365.A O no hydrogen 3.182 N/A ARG 369.A NH1 GLN 365.A OE1 no hydrogen 3.399 N/A ARG 369.A NH2 GLN 365.A OE1 no hydrogen 3.219 N/A VAL 370.A N PHE 367.A O no hydrogen 3.234 N/A PHE 371.A N GLN 368.A O no hydrogen 3.009 N/A THR 372.A N ARG 369.A O no hydrogen 2.785 N/A THR 372.A OG1 ARG 369.A O no hydrogen 2.570 N/A LYS 373.A NZ LEU 155.A O no hydrogen 3.464 N/A ASP 374.A N GLN 378.A O no hydrogen 3.146 N/A HIS 376.A N ASP 374.A OD1 no hydrogen 2.874 N/A GLY 377.A N ASP 374.A O no hydrogen 2.688 N/A GLN 378.A N ASP 374.A OD1 no hydrogen 3.343 N/A LYS 380.A N THR 372.A O no hydrogen 3.205 N/A GLY 382.A N LEU 432.A O no hydrogen 2.630 N/A PHE 383.A N GLN 458.A O no hydrogen 2.965 N/A GLY 384.A N CYS 430.A O no hydrogen 2.841 N/A GLY 385.A N ILE 429.A O no hydrogen 2.986 N/A THR 386.A N GLN 456.A O no hydrogen 2.704 N/A LEU 387.A N TRP 427.A O no hydrogen 2.687 N/A GLU 388.A N VAL 454.A O no hydrogen 2.791 N/A ILE 389.A N CYS 425.A O no hydrogen 3.017 N/A LYS 390.A N GLN 452.A O no hydrogen 2.911 N/A LYS 390.A NZ CYS 64.A O no hydrogen 2.480 N/A LYS 390.A NZ GLU 388.A OE2 no hydrogen 2.648 N/A THR 391.A OG1 SER 392.A O no hydrogen 3.050 N/A THR 391.A OG1 ILE 395.A O no hydrogen 2.770 N/A SER 392.A N ALA 450.A O no hydrogen 3.139 N/A SER 392.A OG ALA 450.A O no hydrogen 3.369 N/A ARG 393.A NE GLU 394.A OE2 no hydrogen 3.324 N/A ILE 395.A N SER 392.A O no hydrogen 3.069 N/A LYS 396.A N GLU 443.A O no hydrogen 2.931 N/A ILE 397.A N CYS 413.A O no hydrogen 2.625 N/A SER 398.A N TYR 441.A O no hydrogen 2.647 N/A SER 398.A OG GLU 443.A OE1 no hydrogen 3.532 N/A GLY 399.A N TYR 441.A O no hydrogen 3.370 N/A ALA 400.A N THR 421.A O no hydrogen 3.155 N/A ILE 401.A N ALA 439.A O no hydrogen 2.926 N/A CYS 404.A SG GLY 402.A O no hydrogen 3.859 N/A VAL 405.A N LYS 428.A O no hydrogen 2.845 N/A LEU 407.A N GLN 426.A O no hydrogen 3.175 N/A ASN 408.A N SER 406.A OG no hydrogen 2.777 N/A SER 409.A N THR 424.A OG1 no hydrogen 3.303 N/A SER 409.A OG THR 424.A OG1 no hydrogen 2.942 N/A LYS 410.A NZ ASN 408.A OD1 no hydrogen 3.526 N/A LYS 410.A NZ GLY 423.A O no hydrogen 2.810 N/A CYS 413.A SG THR 391.A OG1 no hydrogen 3.655 N/A VAL 414.A N GLY 411.A O no hydrogen 3.228 N/A SER 415.A N ILE 397.A O no hydrogen 2.831 N/A SER 415.A OG GLU 443.A OE1 no hydrogen 3.129 N/A ILE 419.A N SER 398.A O no hydrogen 2.955 N/A THR 421.A N ALA 400.A O no hydrogen 2.723 N/A THR 424.A OG1 SER 409.A OG no hydrogen 2.942 N/A THR 424.A OG1 GLN 426.A O no hydrogen 2.874 N/A CYS 425.A N SER 409.A OG no hydrogen 3.015 N/A GLN 426.A N THR 424.A OG1 no hydrogen 3.010 N/A TRP 427.A N LEU 387.A O no hydrogen 2.732 N/A TRP 427.A NE1 THR 421.A O no hydrogen 2.825 N/A LYS 428.A N VAL 405.A O no hydrogen 2.607 N/A LYS 428.A NZ THR 321.A O no hydrogen 2.991 N/A ILE 429.A N GLY 385.A O no hydrogen 2.482 N/A CYS 430.A SG ALA 320.A O no hydrogen 3.161 N/A CYS 430.A SG HIS 324.A O no hydrogen 3.777 N/A LEU 432.A N GLY 382.A O no hydrogen 3.090 N/A SER 433.A N THR 436.A OG1 no hydrogen 3.000 N/A THR 435.A N SER 433.A OG no hydrogen 3.092 N/A THR 436.A N SER 433.A O no hydrogen 3.146 N/A THR 436.A OG1 SER 433.A O no hydrogen 3.398 N/A THR 437.A N ARG 578.A O no hydrogen 2.640 N/A THR 437.A OG1 THR 41.A OG1 no hydrogen 2.641 N/A THR 437.A OG1 THR 435.A O no hydrogen 2.842 N/A LEU 438.A N PHE 40.A O no hydrogen 2.724 N/A ALA 439.A N ILE 401.A O no hydrogen 3.000 N/A ILE 440.A N ALA 38.A O no hydrogen 2.910 N/A TYR 441.A N GLY 399.A O no hydrogen 2.675 N/A TYR 441.A OH LEU 497.A O no hydrogen 2.647 N/A PHE 442.A N VAL 36.A O no hydrogen 2.887 N/A GLU 443.A N LYS 396.A O no hydrogen 2.817 N/A VAL 445.A N GLU 394.A O no hydrogen 3.040 N/A GLY 449.A N ARG 473.A O no hydrogen 2.597 N/A ALA 450.A N SER 392.A OG no hydrogen 2.902 N/A ILE 451.A N ILE 471.A O no hydrogen 3.295 N/A GLN 452.A N LYS 390.A O no hydrogen 2.773 N/A GLN 452.A NE2 VAL 67.A O no hydrogen 2.887 N/A GLN 452.A NE2 THR 470.A OG1 no hydrogen 3.405 N/A PHE 453.A N THR 469.A O no hydrogen 2.660 N/A VAL 454.A N GLU 388.A O no hydrogen 2.763 N/A THR 455.A N ARG 467.A O no hydrogen 2.811 N/A GLN 456.A N THR 386.A O no hydrogen 3.018 N/A TYR 457.A N ARG 465.A O no hydrogen 2.901 N/A TYR 457.A OH GLU 116.A OE2 no hydrogen 2.617 N/A GLN 458.A N PHE 383.A O no hydrogen 2.787 N/A HIS 459.A N GLN 463.A O no hydrogen 2.772 N/A SER 460.A OG PHE 379.A O no hydrogen 2.408 N/A SER 460.A OG MET 381.A O no hydrogen 2.799 N/A SER 461.A N HIS 459.A ND1 no hydrogen 3.086 N/A SER 461.A OG HIS 459.A ND1 no hydrogen 3.054 N/A GLY 462.A N HIS 459.A O no hydrogen 2.784 N/A GLN 463.A N SER 461.A OG no hydrogen 3.188 N/A ARG 465.A N TYR 457.A O no hydrogen 2.885 N/A ARG 465.A NH2 GLN 463.A OE1 no hydrogen 3.041 N/A ILE 466.A N TYR 117.A O no hydrogen 2.997 N/A ARG 467.A N THR 455.A O no hydrogen 2.609 N/A ARG 467.A NH1 PRO 42.A O no hydrogen 2.617 N/A ARG 467.A NH2 LYS 44.A O no hydrogen 2.951 N/A VAL 468.A N ILE 115.A O no hydrogen 2.790 N/A THR 469.A N PHE 453.A O no hydrogen 2.955 N/A THR 469.A OG1 SER 114.A OG no hydrogen 2.655 N/A ILE 471.A N ILE 451.A O no hydrogen 3.036 N/A ARG 473.A N GLY 449.A O no hydrogen 3.045 N/A ARG 473.A NE ASN 20.A OD1 no hydrogen 3.150 N/A ARG 473.A NH1 ALA 472.A O no hydrogen 2.764 N/A ALA 476.A N TRP 22.A O no hydrogen 2.660 N/A THR 480.A N ASP 477.A O no hydrogen 2.911 N/A GLN 481.A NE2 SER 25.A OG no hydrogen 2.621 N/A GLN 483.A N THR 480.A O no hydrogen 2.778 N/A ASN 484.A N THR 480.A O no hydrogen 3.222 N/A ASN 484.A ND2 ASP 477.A O no hydrogen 3.647 N/A ILE 485.A N GLN 481.A O no hydrogen 3.121 N/A ALA 486.A N ILE 482.A O no hydrogen 2.907 N/A SER 488.A N ILE 485.A O no hydrogen 3.059 N/A SER 488.A OG ILE 485.A O no hydrogen 2.646 N/A ASP 490.A N SER 18.A O no hydrogen 3.075 N/A ALA 493.A N ASP 490.A OD1 no hydrogen 3.160 N/A ALA 494.A N ASP 490.A O no hydrogen 2.850 N/A ALA 495.A N GLN 491.A O no hydrogen 2.851 N/A ILE 496.A N GLU 492.A O no hydrogen 3.102 N/A LEU 497.A N ALA 493.A O no hydrogen 2.940 N/A MET 498.A N ALA 494.A O no hydrogen 2.771 N/A ALA 499.A N ALA 495.A O no hydrogen 2.748 N/A ARG 500.A N ILE 496.A O no hydrogen 2.680 N/A ARG 500.A NH1 GLN 579.A O no hydrogen 3.435 N/A ARG 500.A NH1 SER 584.A OG no hydrogen 3.410 N/A ARG 500.A NH2 GLN 579.A O no hydrogen 3.236 N/A LEU 501.A N LEU 497.A O no hydrogen 3.281 N/A ALA 502.A N MET 498.A O no hydrogen 3.119 N/A ILE 503.A N ALA 499.A O no hydrogen 3.055 N/A TYR 504.A N ARG 500.A O no hydrogen 2.978 N/A ARG 505.A N LEU 501.A O no hydrogen 2.997 N/A ALA 506.A N ALA 502.A O no hydrogen 3.018 N/A GLU 507.A N ILE 503.A O no hydrogen 2.915 N/A THR 508.A OG1 TYR 504.A O no hydrogen 2.779 N/A GLU 509.A N ALA 506.A O no hydrogen 3.017 N/A LEU 512.A N ASP 510.A OD1 no hydrogen 2.898 N/A ARG 513.A NE ASP 510.A OD2 no hydrogen 2.742 N/A LEU 515.A N VAL 511.A O no hydrogen 3.129 N/A ASP 516.A N LEU 512.A O no hydrogen 3.047 N/A ARG 517.A N ARG 513.A O no hydrogen 3.048 N/A GLN 518.A N TRP 514.A O no hydrogen 3.264 N/A LEU 519.A N LEU 515.A O no hydrogen 3.120 N/A ILE 520.A N ASP 516.A O no hydrogen 2.862 N/A ARG 521.A N ARG 517.A O no hydrogen 2.982 N/A LEU 522.A N GLN 518.A O no hydrogen 2.804 N/A LEU 522.A N LEU 519.A O no hydrogen 3.217 N/A CYS 523.A N LEU 519.A O no hydrogen 3.051 N/A CYS 523.A SG LEU 519.A O no hydrogen 3.292 N/A GLN 524.A N ILE 520.A O no hydrogen 3.145 N/A GLN 524.A NE2 LEU 706.A O no hydrogen 3.554 N/A GLN 524.A NE2 ALA 707.A O no hydrogen 3.417 N/A GLN 524.A NE2 SER 710.A O no hydrogen 3.121 N/A LYS 525.A NZ GLU 28.A OE1 no hydrogen 3.192 N/A LYS 525.A NZ ARG 31.A O no hydrogen 2.847 N/A PHE 526.A N LEU 522.A O no hydrogen 3.084 N/A GLY 527.A N CYS 523.A O no hydrogen 2.934 N/A GLU 528.A N ARG 538.A O no hydrogen 2.957 N/A TYR 529.A OH GLN 524.A O no hydrogen 2.915 N/A HIS 530.A N SER 536.A OG no hydrogen 2.797 N/A LYS 531.A NZ ASP 532.A OD2 no hydrogen 3.387 N/A LYS 531.A NZ VAL 708.A O no hydrogen 3.530 N/A ASP 532.A N VAL 708.A O no hydrogen 2.655 N/A ASP 533.A N HIS 530.A O no hydrogen 3.022 N/A SER 536.A N ASP 533.A O no hydrogen 3.078 N/A SER 536.A OG HIS 530.A O no hydrogen 3.503 N/A SER 536.A OG ASP 533.A O no hydrogen 2.599 N/A PHE 537.A N PRO 534.A O no hydrogen 3.082 N/A ARG 538.A N GLU 528.A O no hydrogen 3.035 N/A ARG 538.A NE SER 536.A O no hydrogen 3.195 N/A PHE 543.A N SER 540.A O no hydrogen 3.103 N/A SER 544.A N SER 540.A O no hydrogen 2.998 N/A SER 544.A OG SER 540.A O no hydrogen 3.434 N/A LEU 545.A N GLN 491.A OE1 no hydrogen 3.079 N/A TYR 546.A N PHE 543.A O no hydrogen 2.890 N/A PHE 549.A N LEU 545.A O no hydrogen 2.973 N/A MET 550.A N TYR 546.A O no hydrogen 2.835 N/A PHE 551.A N PRO 547.A O no hydrogen 2.634 N/A HIS 552.A N GLN 548.A O no hydrogen 3.066 N/A LEU 553.A N PHE 549.A O no hydrogen 3.042 N/A ARG 554.A N MET 550.A O no hydrogen 3.044 N/A ARG 554.A N PHE 551.A O no hydrogen 3.141 N/A ARG 554.A NE ASP 516.A OD1 no hydrogen 3.155 N/A ARG 554.A NH2 ASP 516.A OD1 no hydrogen 3.552 N/A ARG 554.A NH2 ASP 516.A OD2 no hydrogen 2.848 N/A ARG 555.A N HIS 552.A O no hydrogen 3.290 N/A SER 556.A OG LEU 553.A O no hydrogen 2.818 N/A PHE 558.A N SER 556.A OG no hydrogen 3.422 N/A LEU 559.A N SER 556.A O no hydrogen 3.226 N/A GLN 560.A N SER 556.A O no hydrogen 3.190 N/A GLN 560.A NE2 ARG 554.A O no hydrogen 2.878 N/A SER 565.A N GLU 568.A OE1 no hydrogen 3.365 N/A ASP 567.A N GLN 335.A OE1 no hydrogen 3.019 N/A GLU 568.A N SER 565.A OG no hydrogen 3.202 N/A SER 569.A N SER 565.A O no hydrogen 3.105 N/A SER 569.A OG SER 565.A O no hydrogen 3.148 N/A SER 570.A N PRO 566.A O no hydrogen 3.073 N/A SER 570.A OG PRO 566.A O no hydrogen 2.990 N/A TYR 571.A N ASP 567.A O no hydrogen 2.894 N/A TYR 572.A N GLU 568.A O no hydrogen 2.959 N/A ARG 573.A N SER 569.A O no hydrogen 3.108 N/A ARG 573.A NE PHE 558.A O no hydrogen 3.058 N/A ARG 573.A NH2 PHE 558.A O no hydrogen 2.848 N/A HIS 574.A N SER 570.A O no hydrogen 3.050 N/A HIS 574.A ND1 ASN 346.A OD1 no hydrogen 2.595 N/A HIS 575.A N TYR 571.A O no hydrogen 3.280 N/A HIS 575.A NE2 MET 352.A O no hydrogen 2.985 N/A PHE 576.A N TYR 572.A O no hydrogen 3.203 N/A PHE 576.A N ARG 573.A O no hydrogen 2.982 N/A MET 577.A N ARG 573.A O no hydrogen 2.996 N/A MET 577.A N HIS 574.A O no hydrogen 3.238 N/A GLN 579.A N HIS 575.A O no hydrogen 3.255 N/A GLN 583.A N ASP 580.A OD2 no hydrogen 3.068 N/A SER 584.A N ASP 580.A O no hydrogen 3.062 N/A SER 584.A OG GLN 579.A O no hydrogen 3.423 N/A SER 584.A OG ASP 580.A O no hydrogen 2.743 N/A LEU 585.A N LEU 581.A O no hydrogen 2.897 N/A ILE 586.A N THR 582.A O no hydrogen 3.304 N/A MET 587.A N GLN 583.A O no hydrogen 3.051 N/A ILE 588.A N SER 584.A O no hydrogen 3.067 N/A GLN 589.A N LEU 585.A O no hydrogen 2.704 N/A GLN 589.A NE2 GLN 548.A OE1 no hydrogen 2.822 N/A ILE 591.A N ASP 620.A O no hydrogen 3.221 N/A TYR 593.A N LEU 618.A O no hydrogen 2.881 N/A ALA 594.A N GLU 602.A O no hydrogen 2.874 N/A TYR 595.A N ILE 616.A O no hydrogen 2.877 N/A TYR 595.A OH ASP 660.A OD2 no hydrogen 3.391 N/A SER 596.A OG SER 598.A OG no hydrogen 3.302 N/A SER 598.A OG SER 596.A OG no hydrogen 3.302 N/A GLY 599.A N PHE 597.A O no hydrogen 2.893 N/A GLU 602.A N ALA 594.A O no hydrogen 3.088 N/A VAL 604.A N LEU 592.A O no hydrogen 2.647 N/A SER 609.A N ASP 607.A OD1 no hydrogen 2.684 N/A SER 609.A OG ASP 607.A OD1 no hydrogen 2.741 N/A SER 610.A N ASP 607.A O no hydrogen 2.886 N/A SER 610.A OG LEU 605.A O no hydrogen 2.646 N/A ILE 611.A N SER 608.A O no hydrogen 3.017 N/A ARG 615.A NH2 SER 610.A O no hydrogen 2.622 N/A ILE 616.A N TYR 595.A O no hydrogen 2.982 N/A LEU 617.A N TYR 628.A O no hydrogen 2.778 N/A LEU 618.A N TYR 593.A O no hydrogen 2.822 N/A MET 619.A N LEU 626.A O no hydrogen 2.759 N/A ASP 620.A N ILE 591.A O no hydrogen 3.016 N/A THR 621.A N GLN 624.A O no hydrogen 2.848 N/A GLN 624.A N THR 621.A O no hydrogen 2.216 N/A ILE 625.A N ARG 673.A O no hydrogen 3.010 N/A LEU 626.A N MET 619.A O no hydrogen 2.911 N/A ILE 627.A N ILE 675.A O no hydrogen 2.875 N/A TYR 628.A N LEU 617.A O no hydrogen 2.793 N/A HIS 629.A N THR 677.A O no hydrogen 3.247 N/A GLY 630.A N ARG 615.A O no hydrogen 3.027 N/A ILE 633.A N ALA 613.A O no hydrogen 3.238 N/A ALA 634.A N GLY 630.A O no hydrogen 2.950 N/A ALA 634.A N GLU 631.A O no hydrogen 2.936 N/A GLN 635.A N GLU 631.A O no hydrogen 3.344 N/A GLN 635.A N THR 632.A O no hydrogen 2.942 N/A TRP 636.A N THR 632.A O no hydrogen 3.348 N/A ARG 637.A N ALA 634.A O no hydrogen 3.115 N/A ARG 637.A NH2 ASP 676.A OD1 no hydrogen 2.411 N/A LYS 638.A N ALA 634.A O no hydrogen 2.777 N/A SER 639.A N GLN 635.A O no hydrogen 2.510 N/A SER 639.A OG GLN 635.A O no hydrogen 3.010 N/A GLY 640.A N ARG 637.A O no hydrogen 3.192 N/A TYR 641.A N TRP 636.A O no hydrogen 3.423 N/A TYR 647.A N MET 644.A O no hydrogen 2.701 N/A ARG 651.A N TYR 647.A O no hydrogen 3.263 N/A ARG 651.A NE GLN 642.A O no hydrogen 3.376 N/A ARG 651.A NH2 GLN 642.A O no hydrogen 3.502 N/A HIS 652.A N GLU 648.A O no hydrogen 3.295 N/A LEU 653.A N ASN 649.A O no hydrogen 3.338 N/A LEU 654.A N PHE 650.A O no hydrogen 3.249 N/A GLN 655.A N ARG 651.A O no hydrogen 3.138 N/A ALA 656.A N LEU 653.A O no hydrogen 3.243 N/A ASP 659.A N GLN 655.A O no hydrogen 2.822 N/A ASP 660.A N ALA 656.A O no hydrogen 3.257 N/A ALA 661.A N PRO 657.A O no hydrogen 2.849 N/A GLN 662.A N ASP 659.A O no hydrogen 2.758 N/A GLN 662.A NE2 VAL 658.A O no hydrogen 3.658 N/A GLU 663.A N ASP 659.A O no hydrogen 3.452 N/A LEU 665.A N ALA 661.A O no hydrogen 3.301 N/A HIS 666.A N ILE 664.A O no hydrogen 2.372 N/A SER 667.A OG ILE 664.A O no hydrogen 3.484 N/A ARG 668.A N ILE 664.A O no hydrogen 3.304 N/A ARG 668.A NH1 ASP 620.A OD1 no hydrogen 2.551 N/A ARG 668.A NH1 PHE 622.A O no hydrogen 2.621 N/A ARG 668.A NH2 ASP 620.A OD1 no hydrogen 3.316 N/A ARG 668.A NH2 ASP 620.A OD2 no hydrogen 2.719 N/A MET 671.A N THR 366.A OG1 no hydrogen 3.080 N/A ARG 673.A N PHE 623.A O no hydrogen 3.017 N/A ILE 675.A N ILE 625.A O no hydrogen 2.852 N/A THR 677.A N ILE 627.A O no hydrogen 3.010 N/A THR 677.A OG1 GLU 678.A O no hydrogen 3.268 N/A HIS 679.A N HIS 629.A O no hydrogen 3.117 N/A GLY 681.A N GLU 678.A O no hydrogen 2.713 N/A ALA 684.A N GLY 681.A O no hydrogen 3.336 N/A PHE 686.A N GLN 683.A O no hydrogen 3.324 N/A LEU 688.A N ALA 684.A O no hydrogen 3.029 N/A SER 689.A N ARG 685.A O no hydrogen 2.762 N/A SER 689.A OG ARG 685.A O no hydrogen 2.855 N/A SER 689.A OG PHE 686.A O no hydrogen 3.021 N/A LYS 690.A N LEU 687.A O no hydrogen 3.079 N/A VAL 691.A N LEU 687.A O no hydrogen 3.166 N/A GLN 697.A N GLN 697.A OE1 no hydrogen 2.533 N/A PHE 699.A N SER 695.A O no hydrogen 2.799 N/A MET 700.A N LEU 696.A O no hydrogen 2.642 N/A ASP 701.A N GLN 697.A O no hydrogen 2.928 N/A HIS 702.A N VAL 698.A O no hydrogen 2.950 N/A LEU 703.A N PHE 699.A O no hydrogen 3.038 N/A LYS 704.A N MET 700.A O no hydrogen 2.884 N/A LYS 705.A N ASP 701.A O no hydrogen 3.036 N/A LEU 706.A N HIS 702.A O no hydrogen 3.076 N/A ALA 707.A N LEU 703.A O no hydrogen 2.798 N/A VAL 708.A N LYS 704.A O no hydrogen 3.059 N/A SER 709.A OG LEU 706.A O no hydrogen 2.889 N/A