Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1x3w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 ASN 2.A O no hydrogen 2.683 N/A SER 7.A N ASP 4.A OD1 no hydrogen 3.323 N/A ALA 9.A N PHE 5.A O no hydrogen 2.576 N/A LYS 10.A N ASP 6.A O no hydrogen 3.103 N/A LEU 12.A N ALA 9.A O no hydrogen 3.034 N/A ILE 13.A N LYS 10.A O no hydrogen 3.325 N/A TYR 15.A N LEU 11.A O no hydrogen 2.762 N/A LYS 16.A N LEU 12.A O no hydrogen 2.917 N/A ASP 17.A N ILE 13.A O no hydrogen 2.996 N/A PHE 18.A N LYS 14.A O no hydrogen 3.292 N/A ILE 19.A N TYR 15.A O no hydrogen 2.846 N/A SER 21.A N PHE 18.A O no hydrogen 2.996 N/A SER 21.A OG ASP 17.A O no hydrogen 2.936 N/A LYS 22.A N PHE 18.A O no hydrogen 3.106 N/A PHE 23.A N ILE 19.A O no hydrogen 3.306 N/A LYS 24.A NZ ASP 296.A OD1 no hydrogen 3.268 N/A ASN 31.A N ALA 27.A O no hydrogen 3.222 N/A ARG 33.A NH2 ASP 278.A OD1 no hydrogen 3.064 N/A PHE 34.A N GLU 30.A O no hydrogen 2.811 N/A GLN 35.A N ASN 31.A O no hydrogen 2.969 N/A ASN 36.A N ILE 32.A O no hydrogen 3.054 N/A ASN 36.A ND2 ARG 33.A O no hydrogen 3.303 N/A LEU 37.A N ARG 33.A O no hydrogen 2.863 N/A VAL 38.A N PHE 34.A O no hydrogen 2.979 N/A HIS 39.A N ASN 36.A O no hydrogen 2.916 N/A THR 40.A N ASN 36.A O no hydrogen 2.788 N/A THR 40.A OG1 ASN 36.A O no hydrogen 2.839 N/A ASN 41.A N LEU 37.A O no hydrogen 2.945 N/A GLY 46.A N GLN 42.A O no hydrogen 2.474 N/A VAL 47.A N PHE 43.A O no hydrogen 3.214 N/A LEU 48.A N ALA 44.A O no hydrogen 2.937 N/A GLY 49.A N GLN 45.A O no hydrogen 2.753 N/A GLN 50.A N GLY 46.A O no hydrogen 2.944 N/A SER 51.A N VAL 47.A O no hydrogen 2.684 N/A SER 51.A OG LEU 48.A O no hydrogen 2.554 N/A GLN 52.A N LEU 48.A O no hydrogen 2.864 N/A HIS 53.A N GLY 49.A O no hydrogen 2.936 N/A LEU 54.A N GLN 50.A O no hydrogen 2.810 N/A CYS 55.A N SER 51.A O no hydrogen 2.950 N/A CYS 55.A SG GLY 252.A O no hydrogen 3.304 N/A THR 56.A N HIS 53.A O no hydrogen 3.152 N/A THR 56.A OG1 HIS 53.A O no hydrogen 3.350 N/A TYR 58.A OH ASN 187.A OD1 no hydrogen 2.397 N/A HIS 64.A N ASN 60.A O no hydrogen 2.879 N/A SER 65.A N PRO 61.A O no hydrogen 2.870 N/A ILE 66.A N SER 62.A O no hydrogen 3.319 N/A VAL 67.A N TRP 63.A O no hydrogen 3.061 N/A LEU 68.A N HIS 64.A O no hydrogen 3.094 N/A GLU 69.A N SER 65.A O no hydrogen 2.762 N/A THR 70.A N ILE 66.A O no hydrogen 2.913 N/A THR 70.A OG1 VAL 67.A O no hydrogen 3.452 N/A LEU 71.A N VAL 67.A O no hydrogen 2.862 N/A ASP 72.A N TYR 107.A OH no hydrogen 3.262 N/A LEU 75.A N ASP 72.A OD2 no hydrogen 2.857 N/A ILE 76.A N ASP 72.A O no hydrogen 2.961 N/A TYR 77.A N LEU 73.A O no hydrogen 2.831 N/A LYS 78.A N ASP 74.A O no hydrogen 3.033 N/A LYS 78.A NZ ASP 74.A OD2 no hydrogen 3.214 N/A ASN 79.A N LEU 75.A O no hydrogen 3.131 N/A VAL 80.A N ILE 76.A O no hydrogen 2.908 N/A ASP 81.A N TYR 77.A O no hydrogen 2.843 N/A LYS 82.A N LYS 78.A O no hydrogen 3.107 N/A GLU 83.A N ASN 79.A O no hydrogen 2.907 N/A PHE 84.A N VAL 80.A O no hydrogen 2.692 N/A ALA 85.A N ASP 81.A O no hydrogen 2.918 N/A LYS 86.A N LYS 82.A O no hydrogen 3.296 N/A HIS 89.A N TYR 99.A OH no hydrogen 3.048 N/A ASN 94.A N GLU 93.A OE1 no hydrogen 2.351 N/A TYR 96.A OH ASP 81.A OD1 no hydrogen 3.134 N/A THR 97.A N ASN 94.A O no hydrogen 2.873 N/A THR 97.A OG1 TYR 214.A OH no hydrogen 3.116 N/A TYR 99.A N ILE 95.A O no hydrogen 3.407 N/A LEU 100.A N TYR 96.A O no hydrogen 3.041 N/A VAL 101.A N THR 97.A O no hydrogen 3.039 N/A LYS 102.A N ASP 98.A O no hydrogen 2.732 N/A GLU 103.A N TYR 99.A O no hydrogen 2.729 N/A LEU 104.A N LEU 100.A O no hydrogen 2.637 N/A LEU 105.A N VAL 101.A O no hydrogen 2.672 N/A ARG 106.A N LYS 102.A O no hydrogen 3.338 N/A ARG 106.A NH1 GLU 103.A OE1 no hydrogen 2.586 N/A ARG 106.A NH1 GLU 103.A OE2 no hydrogen 3.361 N/A ARG 106.A NH2 ASP 111.A OD2 no hydrogen 2.388 N/A TYR 107.A N GLU 103.A O no hydrogen 2.876 N/A PHE 108.A N LEU 104.A O no hydrogen 2.869 N/A LYS 109.A N LEU 105.A O no hydrogen 3.166 N/A LYS 109.A NZ CYS 228.A O no hydrogen 3.506 N/A GLN 110.A N ARG 106.A O no hydrogen 2.784 N/A GLN 110.A NE2 GLN 230.A OE1 no hydrogen 2.880 N/A PHE 112.A N TYR 107.A O no hydrogen 2.717 N/A PHE 112.A N PHE 108.A O no hydrogen 3.142 N/A PHE 113.A N PHE 108.A O no hydrogen 2.785 N/A LYS 114.A N ARG 178.A O no hydrogen 2.686 N/A CYS 116.A N GLY 180.A O no hydrogen 3.284 N/A LYS 118.A NZ GLU 130.A O no hydrogen 2.982 N/A ASN 122.A N THR 163.A OG1 no hydrogen 3.214 N/A HIS 123.A N ASN 122.A OD1 no hydrogen 2.741 N/A THR 128.A OG1 THR 128.A O no hydrogen 2.308 N/A SER 129.A OG LYS 118.A O no hydrogen 2.957 N/A SER 129.A OG ASP 120.A OD1 no hydrogen 2.936 N/A ASN 131.A ND2 THR 128.A OG1 no hydrogen 2.979 N/A THR 132.A N LYS 155.A O no hydrogen 2.836 N/A LEU 134.A N ILE 153.A O no hydrogen 3.061 N/A GLN 137.A N VAL 151.A O no hydrogen 2.868 N/A ASN 140.A N GLU 143.A OE1 no hydrogen 2.698 N/A CYS 148.A SG THR 150.A O no hydrogen 3.477 N/A CYS 148.A SG ARG 167.A O no hydrogen 3.597 N/A VAL 151.A N GLN 137.A O no hydrogen 2.854 N/A GLU 152.A N PHE 165.A O no hydrogen 2.955 N/A ILE 153.A N GLY 135.A O no hydrogen 2.900 N/A TYR 154.A N THR 163.A O no hydrogen 2.909 N/A TYR 154.A OH GLU 152.A OE2 no hydrogen 2.990 N/A LYS 155.A N THR 132.A O no hydrogen 3.112 N/A LYS 155.A NZ GLY 160.A O no hydrogen 3.433 N/A CYS 156.A N ASN 161.A O no hydrogen 3.358 N/A ASN 157.A N ASN 131.A O no hydrogen 3.154 N/A ASN 157.A ND2 THR 132.A OG1 no hydrogen 3.080 N/A CYS 159.A SG HIS 123.A ND1 no hydrogen 3.868 N/A GLY 160.A N CYS 156.A O no hydrogen 2.648 N/A THR 163.A N TYR 154.A O no hydrogen 2.815 N/A PHE 165.A N GLU 152.A O no hydrogen 2.734 N/A ARG 167.A N THR 150.A O no hydrogen 2.730 N/A ARG 167.A NH1 GLU 184.A OE2 no hydrogen 3.068 N/A ARG 167.A NH2 GLU 184.A OE2 no hydrogen 2.929 N/A ASN 169.A N ASN 147.A O no hydrogen 2.320 N/A ILE 172.A N ASP 170.A OD2 no hydrogen 2.798 N/A LEU 174.A N ASP 170.A O no hydrogen 3.096 N/A LEU 175.A N ILE 172.A O no hydrogen 2.550 N/A GLU 176.A N LYS 173.A O no hydrogen 2.654 N/A THR 177.A N LYS 173.A O no hydrogen 3.193 N/A THR 177.A OG1 LYS 179.A O no hydrogen 3.434 N/A ARG 178.A NE LEU 175.A O no hydrogen 2.606 N/A ARG 178.A NH1 PHE 112.A O no hydrogen 3.498 N/A GLY 180.A N LYS 114.A O no hydrogen 3.177 N/A ARG 181.A N GLU 184.A OE2 no hydrogen 2.778 N/A ARG 181.A NE CYS 116.A O no hydrogen 2.913 N/A ARG 181.A NE ASN 117.A O no hydrogen 3.321 N/A ARG 181.A NH1 GLU 152.A OE1 no hydrogen 3.376 N/A ARG 181.A NH2 ASN 117.A O no hydrogen 3.252 N/A ARG 181.A NH2 GLU 152.A OE2 no hydrogen 2.401 N/A TRP 185.A N ARG 181.A O no hydrogen 2.960 N/A CYS 186.A N CYS 182.A O no hydrogen 2.828 N/A CYS 186.A N GLY 183.A O no hydrogen 3.245 N/A CYS 186.A SG THR 190.A OG1 no hydrogen 3.535 N/A ASN 187.A N GLY 183.A O no hydrogen 3.189 N/A ASN 187.A ND2 ASN 169.A O no hydrogen 2.901 N/A LEU 188.A N GLU 184.A O no hydrogen 3.166 N/A THR 190.A N CYS 186.A O no hydrogen 2.790 N/A THR 190.A OG1 CYS 186.A O no hydrogen 3.257 N/A LEU 191.A N ASN 187.A O no hydrogen 3.313 N/A ILE 192.A N LEU 188.A O no hydrogen 2.807 N/A LEU 193.A N PHE 189.A O no hydrogen 2.999 N/A LEU 193.A N THR 190.A O no hydrogen 3.149 N/A LYS 194.A N THR 190.A O no hydrogen 3.059 N/A LYS 194.A NZ ASP 59.A OD1 no hydrogen 3.465 N/A LYS 194.A NZ ASP 59.A OD2 no hydrogen 3.557 N/A SER 195.A N LEU 191.A O no hydrogen 2.710 N/A SER 195.A OG LEU 191.A O no hydrogen 2.472 N/A PHE 196.A N LEU 193.A O no hydrogen 3.044 N/A GLY 197.A N LYS 194.A O no hydrogen 2.585 N/A LEU 198.A N LEU 193.A O no hydrogen 3.408 N/A ARG 201.A N GLU 213.A O no hydrogen 2.792 N/A ARG 201.A NH1 GLU 213.A OE2 no hydrogen 2.753 N/A ARG 201.A NH1 GLU 309.A OE1 no hydrogen 2.939 N/A ARG 201.A NH2 GLU 309.A OE1 no hydrogen 3.297 N/A ARG 201.A NH2 GLU 309.A OE2 no hydrogen 3.108 N/A TYR 202.A N PHE 251.A O no hydrogen 2.823 N/A VAL 203.A N TRP 211.A O no hydrogen 2.813 N/A TRP 204.A N ILE 249.A O no hydrogen 2.702 N/A ASN 205.A N HIS 209.A O no hydrogen 2.748 N/A ARG 206.A N TYR 247.A O no hydrogen 3.249 N/A ARG 206.A NH1 SER 246.A OG no hydrogen 2.695 N/A GLU 207.A N ASN 205.A OD1 no hydrogen 2.594 N/A HIS 209.A NE2 ASP 226.A OD2 no hydrogen 3.374 N/A TRP 211.A N VAL 203.A O no hydrogen 3.107 N/A TRP 211.A NE1 TYR 263.A OH no hydrogen 2.861 N/A CYS 212.A N VAL 225.A O no hydrogen 2.921 N/A CYS 212.A SG THR 190.A OG1 no hydrogen 3.688 N/A GLU 213.A N ARG 201.A O no hydrogen 3.061 N/A TYR 214.A N VAL 223.A O no hydrogen 2.931 N/A TYR 214.A OH THR 97.A OG1 no hydrogen 3.116 N/A TYR 214.A OH ASP 98.A OD1 no hydrogen 2.644 N/A PHE 215.A N ASP 199.A O no hydrogen 2.980 N/A SER 216.A N ARG 221.A O no hydrogen 3.103 N/A SER 216.A OG ASP 98.A OD1 no hydrogen 2.891 N/A SER 216.A OG ASP 98.A OD2 no hydrogen 3.423 N/A LEU 219.A N SER 216.A OG no hydrogen 3.145 N/A ASN 220.A ND2 ASN 217.A O no hydrogen 3.547 N/A ASN 220.A ND2 PHE 218.A O no hydrogen 3.358 N/A ARG 221.A NH1 TRP 222.A O no hydrogen 3.472 N/A ARG 221.A NH1 ASP 233.A OD2 no hydrogen 3.207 N/A ARG 221.A NH2 ASP 233.A OD2 no hydrogen 2.772 N/A VAL 223.A N TYR 214.A O no hydrogen 2.619 N/A HIS 224.A NE2 TYR 238.A OH no hydrogen 3.113 N/A VAL 225.A N CYS 212.A O no hydrogen 2.637 N/A ASP 226.A N SER 231.A O no hydrogen 3.169 N/A SER 227.A OG TRP 185.A O no hydrogen 3.209 N/A CYS 228.A N ASP 226.A OD1 no hydrogen 2.993 N/A SER 231.A N ASP 226.A O no hydrogen 3.145 N/A GLN 234.A N HIS 224.A ND1 no hydrogen 3.027 N/A TYR 238.A OH HIS 224.A NE2 no hydrogen 3.113 N/A TYR 238.A OH ASP 226.A OD2 no hydrogen 2.593 N/A SER 239.A OG GLN 266.A O no hydrogen 2.569 N/A ILE 240.A N TYR 236.A O no hydrogen 3.310 N/A TRP 242.A N ILE 237.A O no hydrogen 3.002 N/A LYS 244.A N TYR 238.A O no hydrogen 2.876 N/A LYS 244.A NZ GLU 207.A O no hydrogen 2.674 N/A SER 246.A OG GLU 207.A OE1 no hydrogen 2.727 N/A SER 246.A OG GLU 207.A OE2 no hydrogen 2.858 N/A CYS 248.A N SER 260.A OG no hydrogen 2.959 N/A CYS 248.A SG TYR 247.A O no hydrogen 3.386 N/A ILE 249.A N TRP 204.A O no hydrogen 3.093 N/A ALA 250.A N VAL 257.A O no hydrogen 3.039 N/A PHE 251.A N TYR 202.A O no hydrogen 2.984 N/A GLY 252.A N GLY 255.A O no hydrogen 2.875 N/A GLY 255.A N GLY 252.A O no hydrogen 2.854 N/A VAL 257.A N ALA 250.A O no hydrogen 3.041 N/A VAL 259.A N CYS 248.A O no hydrogen 2.785 N/A SER 260.A N ASP 258.A OD2 no hydrogen 2.647 N/A SER 260.A OG CYS 248.A O no hydrogen 3.386 N/A SER 260.A OG ASP 258.A OD1 no hydrogen 3.557 N/A SER 260.A OG ASP 258.A OD2 no hydrogen 2.699 N/A ARG 262.A N VAL 259.A O no hydrogen 2.973 N/A ARG 262.A NH1 GLU 213.A OE1 no hydrogen 2.774 N/A ARG 262.A NH1 GLU 309.A OE1 no hydrogen 3.186 N/A ARG 262.A NH2 GLU 309.A OE1 no hydrogen 3.239 N/A ARG 262.A NH2 GLU 312.A OE1 no hydrogen 3.099 N/A TYR 263.A N SER 260.A O no hydrogen 2.744 N/A TYR 263.A OH GLU 213.A OE1 no hydrogen 2.515 N/A ILE 264.A N SER 260.A O no hydrogen 2.902 N/A GLN 266.A NE2 SER 239.A O no hydrogen 3.443 N/A GLN 266.A NE2 ASN 267.A OD1 no hydrogen 3.212 N/A ASN 267.A ND2 ASN 243.A OD1 no hydrogen 3.521 N/A GLN 273.A N TYR 247.A OH no hydrogen 3.300 N/A GLU 277.A N GLU 277.A OE1 no hydrogen 2.685 N/A ASP 278.A N LYS 275.A O no hydrogen 2.592 N/A LEU 279.A N LYS 275.A O no hydrogen 3.214 N/A LYS 280.A NZ GLN 310.A OE1 no hydrogen 3.265 N/A PHE 281.A N GLU 277.A O no hydrogen 3.209 N/A LEU 282.A N ASP 278.A O no hydrogen 2.909 N/A CYS 283.A N LEU 279.A O no hydrogen 3.075 N/A CYS 283.A SG LEU 279.A O no hydrogen 3.555 N/A GLN 284.A N LYS 280.A O no hydrogen 3.190 N/A GLN 284.A NE2 LYS 280.A O no hydrogen 3.154 N/A PHE 285.A N PHE 281.A O no hydrogen 2.821 N/A ILE 286.A N LEU 282.A O no hydrogen 2.984 N/A THR 287.A N CYS 283.A O no hydrogen 2.854 N/A THR 287.A OG1 CYS 283.A O no hydrogen 2.982 N/A THR 287.A OG1 GLN 284.A O no hydrogen 2.680 N/A LYS 288.A N GLN 284.A O no hydrogen 2.908 N/A LYS 288.A NZ LYS 25.A O no hydrogen 2.916 N/A ARG 289.A N PHE 285.A O no hydrogen 2.853 N/A LEU 290.A N ILE 286.A O no hydrogen 2.656 N/A ARG 291.A N LYS 288.A O no hydrogen 2.649 N/A ARG 291.A NH1 ASP 254.A O no hydrogen 2.832 N/A ARG 291.A NH1 ASP 306.A OD2 no hydrogen 3.461 N/A ARG 291.A NH2 ASP 306.A OD2 no hydrogen 3.444 N/A LEU 294.A N ARG 291.A O no hydrogen 2.991 N/A ASN 295.A N GLU 298.A OE1 no hydrogen 2.851 N/A ASP 297.A N ASN 295.A OD1 no hydrogen 2.835 N/A GLU 298.A N ASN 295.A OD1 no hydrogen 3.130 N/A ILE 299.A N ASN 295.A O no hydrogen 3.110 N/A GLN 301.A N ASP 297.A O no hydrogen 2.584 N/A LEU 302.A N GLU 298.A O no hydrogen 2.972 N/A ALA 303.A N ILE 299.A O no hydrogen 3.233 N/A CYS 304.A N TYR 300.A O no hydrogen 2.874 N/A CYS 304.A SG TYR 300.A O no hydrogen 3.810 N/A ARG 305.A N GLN 301.A O no hydrogen 3.370 N/A ASP 306.A N LEU 302.A O no hydrogen 2.778 N/A GLU 307.A N ALA 303.A O no hydrogen 3.293 N/A GLN 308.A N CYS 304.A O no hydrogen 2.804 N/A GLU 309.A N ARG 305.A O no hydrogen 3.217 N/A GLU 309.A N ASP 306.A O no hydrogen 2.939 N/A GLN 310.A N ASP 306.A O no hydrogen 2.857 N/A ILE 311.A N GLU 307.A O no hydrogen 2.901 N/A GLU 312.A N GLU 309.A O no hydrogen 2.502 N/A LEU 313.A N GLU 309.A O no hydrogen 2.847 N/A ILE 314.A N GLN 310.A O no hydrogen 3.098 N/A GLY 316.A N GLU 312.A O no hydrogen 2.896 N/A