Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9md2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 178.A OE2 no hydrogen 2.699 N/A ARG 4.A NH1 CYS 43.A O no hydrogen 3.308 N/A ARG 4.A NH2 CYS 43.A O no hydrogen 2.659 N/A ARG 4.A NH2 HIS 103.A O no hydrogen 3.285 N/A LYS 8.A NZ GLY 333.A O no hydrogen 2.586 N/A LYS 8.A NZ LYS 334.A O no hydrogen 3.184 N/A GLN 10.A NE2 ASP 274.A O no hydrogen 3.114 N/A GLN 10.A NE2 ASP 275.A OD1 no hydrogen 3.352 N/A THR 14.A N THR 368.A O no hydrogen 3.053 N/A THR 14.A OG1 THR 368.A O no hydrogen 3.520 N/A THR 14.A OG1 GLY 370.A O no hydrogen 3.347 N/A PHE 16.A N GLN 314.A OE1 no hydrogen 2.689 N/A ALA 17.A N CYS 366.A O no hydrogen 2.739 N/A PHE 19.A N VAL 364.A O no hydrogen 2.959 N/A SER 20.A N VAL 364.A O no hydrogen 3.172 N/A LYS 21.A NZ TRP 377.A O no hydrogen 3.050 N/A LYS 21.A NZ PRO 378.A O no hydrogen 3.436 N/A ASP 22.A N ILE 362.A O no hydrogen 3.134 N/A SER 24.A OG ASN 360.A O no hydrogen 2.459 N/A SER 28.A N ILE 25.A O no hydrogen 3.060 N/A GLY 30.A N LEU 27.A O no hydrogen 3.330 N/A TRP 34.A N PHE 86.A O no hydrogen 2.665 N/A VAL 35.A N THR 57.A O no hydrogen 2.988 N/A THR 36.A OG1 ASN 360.A OD1 no hydrogen 2.314 N/A ARG 37.A N LEU 53.A O no hydrogen 3.230 N/A GLU 38.A N GLU 344.A OE2 no hydrogen 3.446 N/A TYR 40.A N PHE 51.A O no hydrogen 2.753 N/A TYR 40.A OH SER 99.A OG no hydrogen 3.017 N/A SER 42.A N TYR 49.A O no hydrogen 3.004 N/A SER 42.A OG GLU 148.A OE1 no hydrogen 2.860 N/A TYR 49.A N SER 42.A O no hydrogen 2.795 N/A GLN 50.A N ASN 80.A O no hydrogen 2.488 N/A GLN 50.A NE2 ASP 22.A OD1 no hydrogen 3.465 N/A PHE 51.A N TYR 40.A O no hydrogen 2.666 N/A ALA 52.A N LEU 78.A O no hydrogen 3.417 N/A LEU 53.A N ARG 37.A O no hydrogen 3.239 N/A GLY 54.A N THR 76.A O no hydrogen 2.948 N/A GLN 55.A N VAL 35.A O no hydrogen 2.696 N/A GLN 55.A NE2 THR 67.A O no hydrogen 3.156 N/A GLN 55.A NE2 THR 358.A O no hydrogen 3.359 N/A THR 57.A OG1 THR 58.A O no hydrogen 3.189 N/A LEU 59.A N ILE 33.A O no hydrogen 3.180 N/A ASN 61.A ND2 THR 57.A OG1 no hydrogen 2.328 N/A SER 64.A OG LEU 59.A O no hydrogen 3.111 N/A SER 64.A OG ASN 61.A O no hydrogen 3.001 N/A ARG 71.A NE ASP 117.A OD2 no hydrogen 2.601 N/A ARG 75.A N THR 72.A O no hydrogen 3.383 N/A THR 76.A N GLY 54.A O no hydrogen 3.277 N/A THR 76.A OG1 GLN 92.A OE1 no hydrogen 2.543 N/A LEU 77.A N CYS 94.A O no hydrogen 3.145 N/A LEU 78.A N ALA 52.A O no hydrogen 2.732 N/A ASN 80.A N GLN 50.A O no hydrogen 2.984 N/A LEU 82.A N CYS 48.A O no hydrogen 3.140 N/A VAL 84.A N GLU 81.A O no hydrogen 3.222 N/A HIS 87.A N PRO 85.A O no hydrogen 2.640 N/A GLY 89.A N HIS 87.A ND1 no hydrogen 2.949 N/A THR 90.A OG1 MET 79.A O no hydrogen 3.308 N/A THR 90.A OG1 ASN 80.A OD1 no hydrogen 2.693 N/A VAL 93.A N LEU 77.A O no hydrogen 2.878 N/A ALA 96.A N ARG 75.A O no hydrogen 2.930 N/A TRP 97.A N ILE 113.A O no hydrogen 2.959 N/A TRP 97.A NE1 GLY 115.A O no hydrogen 3.023 N/A SER 98.A N ILE 113.A O no hydrogen 3.393 N/A SER 98.A OG GLU 146.A OE2 no hydrogen 2.823 N/A SER 99.A OG TYR 40.A OH no hydrogen 3.017 N/A SER 100.A N VAL 111.A O no hydrogen 2.925 N/A SER 100.A OG SER 147.A O no hydrogen 2.834 N/A SER 101.A OG HIS 110.A ND1 no hydrogen 2.882 N/A CYS 102.A N LEU 109.A O no hydrogen 2.747 N/A CYS 102.A SG LEU 109.A O no hydrogen 3.468 N/A ALA 107.A N ASP 104.A OD1 no hydrogen 3.348 N/A LEU 109.A N CYS 102.A O no hydrogen 2.432 N/A HIS 110.A N ILE 125.A O no hydrogen 2.932 N/A VAL 111.A N SER 100.A O no hydrogen 2.707 N/A CYS 112.A N SER 123.A O no hydrogen 3.030 N/A ILE 113.A N SER 98.A O no hydrogen 2.901 N/A THR 114.A N THR 121.A O no hydrogen 2.996 N/A ASN 119.A N ASN 116.A O no hydrogen 3.220 N/A THR 121.A N THR 114.A O no hydrogen 3.085 N/A ALA 122.A N ILE 134.A O no hydrogen 2.798 N/A SER 123.A N CYS 112.A O no hydrogen 2.881 N/A PHE 124.A N ASP 132.A O no hydrogen 2.755 N/A ILE 125.A N HIS 110.A O no hydrogen 2.868 N/A TYR 126.A N ARG 129.A O no hydrogen 2.939 N/A TYR 126.A OH ASP 104.A OD1 no hydrogen 3.272 N/A TYR 126.A OH ASP 104.A OD2 no hydrogen 3.206 N/A ARG 129.A N TYR 126.A O no hydrogen 3.022 N/A VAL 131.A N PHE 124.A O no hydrogen 3.065 N/A ILE 134.A N ALA 122.A O no hydrogen 3.093 N/A SER 136.A N ALA 120.A O no hydrogen 3.140 N/A SER 136.A OG ASP 162.A OD2 no hydrogen 2.368 N/A TRP 137.A NE1 ASP 170.A O no hydrogen 2.964 N/A SER 138.A N ASP 162.A OD2 no hydrogen 2.654 N/A LYS 139.A N SER 136.A OG no hydrogen 2.985 N/A LYS 139.A N ASP 162.A OD2 no hydrogen 3.215 N/A LYS 139.A NZ ASN 119.A OD1 no hydrogen 3.089 N/A LYS 139.A NZ SER 136.A O no hydrogen 3.181 N/A ASN 140.A N ASP 162.A OD1 no hydrogen 3.246 N/A ILE 141.A N ASP 117.A O no hydrogen 3.006 N/A ARG 143.A N THR 161.A O no hydrogen 2.663 N/A ARG 143.A NH1 GLY 163.A O no hydrogen 3.122 N/A ARG 143.A NH2 GLY 163.A O no hydrogen 3.284 N/A THR 144.A N SER 98.A OG no hydrogen 3.266 N/A GLN 145.A N VAL 159.A O no hydrogen 3.347 N/A SER 147.A OG ILE 328.A O no hydrogen 3.352 N/A GLU 148.A N SER 147.A OG no hydrogen 2.538 N/A VAL 150.A N THR 157.A O no hydrogen 3.442 N/A ASN 153.A N ARG 4.A O no hydrogen 2.544 N/A CYS 156.A N VAL 176.A O no hydrogen 2.667 N/A THR 157.A N VAL 150.A O no hydrogen 3.107 N/A THR 157.A OG1 VAL 150.A O no hydrogen 3.236 N/A VAL 158.A N LEU 174.A O no hydrogen 3.121 N/A MET 160.A N LYS 172.A O no hydrogen 2.947 N/A THR 161.A N ARG 143.A O no hydrogen 2.555 N/A THR 161.A OG1 THR 171.A OG1 no hydrogen 3.250 N/A THR 161.A OG1 VAL 194.A O no hydrogen 2.715 N/A ASP 162.A N ASP 170.A O no hydrogen 3.227 N/A GLY 163.A N ASN 140.A O no hydrogen 3.191 N/A LYS 168.A NZ ASP 170.A OD1 no hydrogen 2.890 N/A ASP 170.A N ASP 162.A O no hydrogen 2.594 N/A THR 171.A OG1 THR 161.A OG1 no hydrogen 3.250 N/A THR 171.A OG1 VAL 194.A O no hydrogen 3.129 N/A LYS 172.A N MET 160.A O no hydrogen 2.763 N/A ILE 173.A N SER 185.A O no hydrogen 2.730 N/A LEU 174.A N VAL 158.A O no hydrogen 2.775 N/A PHE 175.A N HIS 183.A O no hydrogen 2.856 N/A VAL 176.A N CYS 156.A O no hydrogen 2.899 N/A GLU 177.A N LYS 180.A O no hydrogen 2.842 N/A LYS 180.A NZ ASP 132.A OD2 no hydrogen 2.399 N/A VAL 182.A N PHE 175.A O no hydrogen 3.006 N/A HIS 183.A N PHE 175.A O no hydrogen 3.374 N/A SER 185.A N ILE 173.A O no hydrogen 3.037 N/A SER 185.A OG HIS 183.A ND1 no hydrogen 2.899 N/A SER 185.A OG TYR 229.A O no hydrogen 3.287 N/A LEU 187.A N THR 171.A O no hydrogen 2.881 N/A SER 190.A N SER 233.A O no hydrogen 3.075 N/A SER 190.A OG SER 233.A O no hydrogen 3.234 N/A SER 190.A OG LEU 257.A O no hydrogen 3.046 N/A ALA 191.A N SER 233.A OG no hydrogen 3.246 N/A GLU 195.A N ARG 211.A O no hydrogen 3.192 N/A SER 198.A N VAL 209.A O no hydrogen 3.004 N/A SER 198.A OG SER 198.A O no hydrogen 2.627 N/A SER 198.A OG VAL 209.A O no hydrogen 2.791 N/A SER 198.A OG GLY 270.A O no hydrogen 2.850 N/A CYS 199.A SG GLN 145.A OE1 no hydrogen 3.209 N/A TYR 200.A N ARG 207.A O no hydrogen 3.117 N/A ARG 202.A N TYR 200.A O no hydrogen 2.934 N/A ARG 202.A NH2 ASP 274.A OD2 no hydrogen 2.515 N/A ARG 207.A NE ASP 223.A OD1 no hydrogen 2.696 N/A CYS 208.A N VAL 222.A O no hydrogen 2.991 N/A VAL 209.A N SER 198.A O no hydrogen 3.463 N/A CYS 210.A N PRO 220.A O no hydrogen 2.710 N/A CYS 210.A SG CYS 208.A O no hydrogen 3.696 N/A CYS 210.A SG PRO 220.A O no hydrogen 3.785 N/A ARG 211.A N GLU 195.A O no hydrogen 2.938 N/A ARG 211.A NH1 ASN 213.A OD1 no hydrogen 3.064 N/A ARG 211.A NH2 TYR 325.A OH no hydrogen 2.809 N/A ASN 213.A ND2 ALA 165.A O no hydrogen 2.876 N/A LYS 215.A N ASP 212.A OD2 no hydrogen 3.428 N/A LYS 215.A NZ GLN 192.A OE1 no hydrogen 3.305 N/A GLY 216.A N ASP 212.A OD2 no hydrogen 2.568 N/A SER 217.A N ASN 260.A OD1 no hydrogen 2.921 N/A ASN 218.A N ASN 260.A OD1 no hydrogen 3.373 N/A ASN 218.A ND2 SER 254.A OG no hydrogen 3.058 N/A ARG 219.A NH1 VAL 268.A O no hydrogen 2.940 N/A ARG 219.A NH2 GLY 242.A O no hydrogen 3.049 N/A ARG 219.A NH2 VAL 268.A O no hydrogen 3.073 N/A ILE 221.A N SER 234.A O no hydrogen 2.736 N/A VAL 222.A N CYS 208.A O no hydrogen 2.732 N/A ASP 223.A N VAL 232.A O no hydrogen 2.775 N/A ILE 224.A N VAL 206.A O no hydrogen 2.406 N/A ASN 225.A N SER 230.A O no hydrogen 2.955 N/A LYS 227.A N ASN 225.A OD1 no hydrogen 3.398 N/A VAL 232.A N ASP 223.A O no hydrogen 3.054 N/A SER 233.A OG SER 188.A O no hydrogen 2.346 N/A SER 234.A N ILE 221.A O no hydrogen 2.868 N/A SER 234.A OG TYR 235.A O no hydrogen 3.497 N/A SER 234.A OG CYS 256.A O no hydrogen 2.321 N/A TYR 235.A N SER 234.A OG no hydrogen 2.612 N/A TYR 235.A N CYS 256.A O no hydrogen 2.999 N/A TYR 235.A OH ASP 212.A OD1 no hydrogen 2.589 N/A VAL 236.A N ARG 219.A O no hydrogen 2.758 N/A CYS 237.A SG TYR 235.A O no hydrogen 3.865 N/A CYS 237.A SG TRP 302.A O no hydrogen 3.394 N/A SER 238.A OG LEU 240.A O no hydrogen 2.817 N/A GLY 239.A N SER 307.A O no hydrogen 2.973 N/A ASP 243.A N SER 217.A O no hydrogen 3.183 N/A THR 244.A N ASP 243.A OD1 no hydrogen 2.739 N/A THR 244.A OG1 THR 284.A OG1 no hydrogen 2.582 N/A ARG 246.A N GLU 287.A O no hydrogen 3.104 N/A ARG 246.A NH1 ASP 243.A O no hydrogen 2.750 N/A ARG 246.A NH2 THR 284.A O no hydrogen 2.352 N/A VAL 251.A N SER 248.A O no hydrogen 3.195 N/A SER 252.A N SER 248.A O no hydrogen 2.914 N/A SER 252.A OG SER 248.A O no hydrogen 3.262 N/A SER 254.A N ASN 306.A OD1 no hydrogen 3.267 N/A SER 254.A OG VAL 236.A O no hydrogen 2.535 N/A CYS 256.A SG LYS 304.A O no hydrogen 4.019 N/A ASN 260.A ND2 SER 217.A OG no hydrogen 2.527 N/A ASN 260.A ND2 SER 253.A O no hydrogen 2.550 N/A ASN 261.A ND2 PRO 259.A O no hydrogen 3.378 N/A LYS 263.A NZ ARG 246.A O no hydrogen 2.969 N/A LYS 263.A NZ GLU 287.A O no hydrogen 3.512 N/A HIS 266.A N GLY 264.A O no hydrogen 2.895 N/A VAL 268.A N ASP 243.A OD1 no hydrogen 2.957 N/A LYS 269.A NZ SER 326.A O no hydrogen 3.416 N/A PHE 273.A N TRP 280.A O no hydrogen 2.984 N/A ASP 274.A N ASP 274.A OD1 no hydrogen 2.484 N/A ASP 275.A N ASP 278.A O no hydrogen 3.095 N/A TRP 280.A N PHE 273.A O no hydrogen 2.638 N/A MET 281.A N PHE 296.A O no hydrogen 3.115 N/A ARG 283.A N GLU 294.A O no hydrogen 2.905 N/A ARG 283.A NE GLU 294.A OE2 no hydrogen 3.113 N/A ARG 283.A NH1 VAL 241.A O no hydrogen 3.171 N/A ARG 283.A NH1 ASP 249.A OD1 no hydrogen 3.124 N/A ARG 283.A NH2 ASP 249.A OD1 no hydrogen 3.114 N/A ARG 283.A NH2 ASP 249.A OD2 no hydrogen 2.721 N/A THR 284.A OG1 THR 244.A OG1 no hydrogen 2.582 N/A THR 284.A OG1 ASN 286.A O no hydrogen 3.363 N/A ASN 286.A N LEU 291.A O no hydrogen 3.322 N/A LEU 291.A N LEU 289.A O no hydrogen 2.880 N/A GLY 292.A N ASP 321.A O no hydrogen 2.628 N/A TYR 293.A N VAL 317.A O no hydrogen 3.053 N/A TYR 293.A OH SER 326.A OG no hydrogen 2.662 N/A GLU 294.A N ARG 283.A O no hydrogen 2.848 N/A THR 295.A N GLN 314.A O no hydrogen 3.116 N/A PHE 296.A N MET 281.A O no hydrogen 3.028 N/A LYS 297.A N THR 311.A O no hydrogen 2.793 N/A VAL 298.A N VAL 279.A O no hydrogen 3.039 N/A ILE 299.A N LEU 309.A O no hydrogen 2.953 N/A GLU 300.A N ASP 278.A OD1 no hydrogen 2.488 N/A TRP 302.A N ASN 277.A O no hydrogen 3.039 N/A SER 303.A OG ASN 277.A OD1 no hydrogen 2.962 N/A SER 307.A OG GLU 300.A O no hydrogen 3.107 N/A LYS 308.A NZ ASP 249.A O no hydrogen 2.897 N/A LYS 308.A NZ SER 252.A O no hydrogen 3.251 N/A THR 311.A OG1 GLN 310.A O no hydrogen 2.618 N/A ARG 313.A NE GLU 294.A OE1 no hydrogen 2.676 N/A ARG 313.A NH2 GLU 294.A OE1 no hydrogen 2.724 N/A GLN 314.A N THR 295.A O no hydrogen 2.726 N/A GLN 314.A NE2 PHE 16.A O no hydrogen 3.048 N/A ILE 316.A N TYR 293.A O no hydrogen 2.974 N/A VAL 317.A N TYR 293.A O no hydrogen 3.367 N/A GLU 318.A N SER 376.A OG no hydrogen 3.227 N/A ASP 321.A N GLU 318.A O no hydrogen 3.099 N/A ARG 322.A NH1 GLY 348.A O no hydrogen 2.479 N/A SER 323.A N ARG 290.A O no hydrogen 3.342 N/A SER 323.A OG GLY 292.A O no hydrogen 2.658 N/A TYR 325.A N GLU 344.A OE1 no hydrogen 3.344 N/A TYR 325.A OH GLU 196.A OE2 no hydrogen 3.384 N/A SER 326.A N LYS 269.A O no hydrogen 3.011 N/A SER 326.A OG LYS 269.A O no hydrogen 3.251 N/A SER 326.A OG TYR 293.A OH no hydrogen 2.662 N/A GLY 327.A N TYR 342.A O no hydrogen 3.439 N/A PHE 329.A N CYS 340.A O no hydrogen 3.175 N/A SER 330.A N GLU 148.A OE2 no hydrogen 3.328 N/A VAL 331.A N ASN 338.A O no hydrogen 2.833 N/A GLY 333.A N CYS 336.A O no hydrogen 2.784 N/A ILE 337.A N PRO 9.A O no hydrogen 3.115 N/A ASN 338.A ND2 GLY 367.A O no hydrogen 2.627 N/A ARG 339.A NE GLN 10.A OE1 no hydrogen 2.958 N/A ARG 339.A NH1 PRO 201.A O no hydrogen 3.505 N/A ARG 339.A NH1 SER 330.A OG no hydrogen 3.096 N/A ARG 339.A NH2 PRO 201.A O no hydrogen 3.257 N/A CYS 340.A N PHE 329.A O no hydrogen 2.752 N/A PHE 341.A N PHE 365.A O no hydrogen 2.682 N/A TYR 342.A N GLY 327.A O no hydrogen 3.140 N/A TYR 342.A OH PRO 39.A O no hydrogen 2.723 N/A TYR 342.A OH GLU 146.A O no hydrogen 3.051 N/A VAL 343.A N VAL 363.A O no hydrogen 2.738 N/A GLU 344.A N TYR 325.A O no hydrogen 2.784 N/A LEU 345.A N SER 361.A O no hydrogen 2.475 N/A ARG 347.A N SER 359.A O no hydrogen 3.235 N/A ARG 347.A NE GLU 352.A OE2 no hydrogen 3.507 N/A ARG 347.A NH1 ALA 381.A O no hydrogen 2.779 N/A ARG 347.A NH2 GLU 352.A OE1 no hydrogen 2.607 N/A ARG 347.A NH2 GLU 352.A OE2 no hydrogen 3.193 N/A ARG 347.A NH2 ALA 381.A O no hydrogen 3.261 N/A ARG 349.A N TRP 357.A O no hydrogen 2.967 N/A ARG 349.A NE VAL 355.A O no hydrogen 3.050 N/A GLU 352.A N GLY 348.A O no hydrogen 3.028 N/A TRP 357.A NE1 PRO 387.A O no hydrogen 2.537 N/A THR 358.A OG1 ARG 349.A O no hydrogen 3.161 N/A SER 359.A N ARG 347.A O no hydrogen 3.244 N/A SER 359.A OG ASN 360.A O no hydrogen 3.462 N/A SER 361.A N LEU 345.A O no hydrogen 3.007 N/A VAL 363.A N VAL 343.A O no hydrogen 2.948 N/A VAL 364.A N SER 20.A O no hydrogen 2.922 N/A PHE 365.A N PHE 341.A O no hydrogen 2.874 N/A CYS 366.A N ALA 17.A O no hydrogen 3.032 N/A GLY 367.A N ARG 339.A O no hydrogen 3.155 N/A THR 368.A N GLY 15.A O no hydrogen 2.818 N/A GLY 370.A N THR 368.A OG1 no hydrogen 3.413 N/A TYR 372.A OH THR 14.A O no hydrogen 2.735 N/A TRP 377.A N ILE 316.A O no hydrogen 2.832 N/A LEU 385.A N ASP 382.A O no hydrogen 2.933 N/A