Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wth_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N ASN 75.A OD1 no hydrogen 3.195 N/A ASN 8.A N ALA 72.A O no hydrogen 3.001 N/A SER 10.A N SER 70.A O no hydrogen 3.017 N/A SER 10.A OG GLU 27.A OE2 no hydrogen 2.533 N/A LYS 12.A N GLN 68.A O no hydrogen 3.189 N/A LEU 13.A N VAL 26.A O no hydrogen 3.208 N/A PHE 14.A N ILE 66.A O no hydrogen 2.804 N/A ALA 19.A N SER 16.A OG no hydrogen 2.947 N/A TRP 20.A N TYR 17.A O no hydrogen 2.976 N/A SER 21.A N TYR 17.A O no hydrogen 2.640 N/A ASN 22.A N ASP 18.A O no hydrogen 2.690 N/A ASN 23.A N TRP 20.A O no hydrogen 2.826 N/A ARG 24.A N ALA 19.A O no hydrogen 2.632 N/A VAL 26.A N LEU 13.A O no hydrogen 3.271 N/A LEU 28.A N GLU 27.A OE1 no hydrogen 2.675 N/A ALA 29.A N GLU 27.A OE1 no hydrogen 2.764 N/A ALA 30.A N LEU 28.A O no hydrogen 2.394 N/A THR 33.A N GLN 50.A O no hydrogen 2.945 N/A THR 34.A OG1 LEU 330.A O no hydrogen 3.472 N/A LEU 35.A N LEU 330.A O no hydrogen 2.848 N/A THR 36.A N MET 48.A O no hydrogen 2.662 N/A MET 37.A N HIS 328.A O no hydrogen 2.970 N/A ARG 38.A N GLU 46.A O no hydrogen 2.836 N/A ARG 38.A NH2 GLU 46.A OE2 no hydrogen 3.385 N/A ASP 39.A N VAL 326.A O no hydrogen 2.781 N/A SER 40.A N ARG 44.A O no hydrogen 2.628 N/A LEU 41.A N ASP 324.A O no hydrogen 2.830 N/A TYR 42.A N SER 40.A OG no hydrogen 2.738 N/A TYR 42.A OH ASP 324.A OD2 no hydrogen 3.190 N/A ARG 44.A NH2 GLU 325.A OE1 no hydrogen 2.934 N/A GLU 46.A N ARG 38.A O no hydrogen 3.082 N/A MET 48.A N THR 36.A O no hydrogen 2.674 N/A LEU 49.A N ILE 97.A O no hydrogen 2.866 N/A GLN 50.A N THR 34.A O no hydrogen 3.459 N/A PHE 51.A N ILE 95.A O no hydrogen 2.780 N/A TYR 52.A N THR 31.A O no hydrogen 2.378 N/A SER 54.A N ASP 53.A OD1 no hydrogen 2.366 N/A ILE 57.A N ASP 53.A OD1 no hydrogen 3.015 N/A HIS 58.A N ASP 53.A OD2 no hydrogen 2.911 N/A THR 59.A N ASN 56.A O no hydrogen 3.192 N/A LYS 60.A N ILE 57.A O no hydrogen 2.758 N/A ASP 62.A N GLU 65.A OE1 no hydrogen 3.427 N/A ASP 62.A N GLU 65.A OE2 no hydrogen 2.902 N/A GLY 63.A N GLU 65.A OE1 no hydrogen 3.146 N/A ILE 66.A N PHE 14.A O no hydrogen 2.640 N/A ILE 67.A N TYR 85.A O no hydrogen 2.966 N/A GLN 68.A N LYS 12.A O no hydrogen 2.884 N/A ILE 69.A N ARG 83.A O no hydrogen 2.998 N/A SER 70.A N SER 10.A O no hydrogen 3.003 N/A VAL 71.A N LYS 81.A O no hydrogen 2.994 N/A ASN 75.A ND2 GLN 2.A O no hydrogen 3.485 N/A ASN 79.A N ASP 76.A OD1 no hydrogen 3.473 N/A VAL 80.A N ASN 78.A O no hydrogen 3.082 N/A LYS 81.A N VAL 71.A O no hydrogen 2.845 N/A LYS 81.A NZ ASN 79.A OD1 no hydrogen 3.076 N/A ARG 83.A N ILE 69.A O no hydrogen 2.809 N/A ARG 83.A NH1 ASP 39.A OD1 no hydrogen 2.547 N/A ARG 83.A NH1 ASP 39.A OD2 no hydrogen 3.444 N/A ARG 83.A NH2 ASP 39.A OD1 no hydrogen 3.325 N/A ARG 83.A NH2 ASP 39.A OD2 no hydrogen 3.007 N/A TYR 85.A N ILE 67.A O no hydrogen 2.791 N/A GLY 86.A N GLY 100.A O no hydrogen 2.814 N/A LYS 88.A N GLU 98.A O no hydrogen 3.025 N/A SER 91.A N ALA 96.A O no hydrogen 3.106 N/A ILE 97.A N LEU 49.A O no hydrogen 2.472 N/A GLU 98.A N HIS 89.A O no hydrogen 2.765 N/A LEU 99.A N GLY 47.A O no hydrogen 3.066 N/A GLY 100.A N GLY 86.A O no hydrogen 3.355 N/A HIS 103.A N TYR 130.A OH no hydrogen 3.002 N/A HIS 103.A ND1 TYR 130.A OH no hydrogen 2.622 N/A SER 104.A N THR 101.A OG1 no hydrogen 3.269 N/A ILE 105.A N THR 101.A O no hydrogen 2.832 N/A GLU 106.A N ILE 102.A O no hydrogen 3.253 N/A ASN 107.A ND2 SER 104.A O no hydrogen 3.124 N/A PHE 110.A N SER 154.A O no hydrogen 2.950 N/A ARG 112.A N TRP 152.A O no hydrogen 3.401 N/A ARG 112.A NE PRO 113.A O no hydrogen 2.937 N/A ARG 112.A NH1 PRO 113.A O no hydrogen 3.239 N/A ARG 112.A NH2 GLU 124.A OE1 no hydrogen 3.559 N/A PHE 115.A N SER 121.A OG no hydrogen 3.356 N/A ALA 118.A N ALA 145.A O no hydrogen 2.834 N/A GLY 119.A N ASP 117.A OD2 no hydrogen 3.310 N/A SER 121.A N ASP 117.A O no hydrogen 3.139 N/A SER 121.A OG ASP 117.A O no hydrogen 3.416 N/A SER 121.A OG TYR 159.A OH no hydrogen 3.255 N/A ILE 122.A N ALA 118.A O no hydrogen 2.807 N/A LYS 123.A N GLY 119.A O no hydrogen 2.816 N/A GLU 124.A N GLU 120.A O no hydrogen 2.830 N/A MET 125.A N SER 121.A O no hydrogen 2.809 N/A LEU 126.A N ILE 122.A O no hydrogen 2.994 N/A GLY 127.A N LYS 123.A O no hydrogen 2.924 N/A VAL 128.A N GLU 124.A O no hydrogen 2.949 N/A ILE 129.A N MET 125.A O no hydrogen 3.031 N/A TYR 130.A N LEU 126.A O no hydrogen 2.961 N/A TYR 130.A OH HIS 103.A ND1 no hydrogen 2.622 N/A GLN 131.A N VAL 128.A O no hydrogen 3.018 N/A ARG 133.A N TYR 130.A O no hydrogen 2.729 N/A ARG 133.A NH2 ILE 129.A O no hydrogen 2.828 N/A LEU 136.A N ARG 133.A O no hydrogen 2.649 N/A THR 137.A OG1 PRO 138.A O no hydrogen 3.427 N/A ASN 141.A N VAL 185.A O no hydrogen 2.776 N/A ALA 145.A N ASP 117.A OD2 no hydrogen 3.254 N/A TYR 146.A N LEU 168.A O no hydrogen 2.715 N/A TYR 146.A OH GLU 269.A O no hydrogen 2.698 N/A VAL 147.A N PRO 116.A O no hydrogen 2.772 N/A ILE 150.A N PRO 148.A O no hydrogen 2.913 N/A TRP 152.A N ARG 112.A O no hydrogen 2.953 N/A TRP 152.A NE1 THR 155.A O no hydrogen 3.257 N/A SER 154.A OG ASN 158.A OD1 no hydrogen 3.074 N/A THR 155.A N SER 154.A OG no hydrogen 2.539 N/A ASN 158.A N THR 155.A OG1 no hydrogen 3.351 N/A TYR 159.A N THR 155.A O no hydrogen 2.886 N/A LEU 160.A N PHE 156.A O no hydrogen 3.099 N/A SER 161.A N GLU 157.A O no hydrogen 3.359 N/A SER 161.A OG GLU 157.A O no hydrogen 3.376 N/A TYR 162.A N ASN 158.A O no hydrogen 3.007 N/A VAL 163.A N TYR 159.A O no hydrogen 2.907 N/A ARG 164.A N LEU 160.A O no hydrogen 2.761 N/A GLU 165.A N TYR 162.A O no hydrogen 2.971 N/A VAL 166.A N TYR 162.A O no hydrogen 2.687 N/A ALA 167.A N VAL 163.A O no hydrogen 2.871 N/A LEU 168.A N TYR 146.A O no hydrogen 2.937 N/A ALA 169.A N LYS 174.A O no hydrogen 2.826 N/A VAL 170.A N ASN 144.A O no hydrogen 2.719 N/A SER 172.A OG ASP 189.A OD1 no hydrogen 2.605 N/A ASP 173.A N ALA 169.A O no hydrogen 2.835 N/A LYS 174.A N SER 172.A OG no hydrogen 3.131 N/A LYS 174.A NZ ASP 191.A OD1 no hydrogen 3.014 N/A LYS 174.A NZ ASP 191.A OD2 no hydrogen 3.067 N/A PHE 177.A N MET 188.A O no hydrogen 2.822 N/A TRP 179.A N ASN 186.A O no hydrogen 3.210 N/A TRP 179.A NE1 ASP 181.A OD1 no hydrogen 3.181 N/A TRP 179.A NE1 ASP 181.A OD2 no hydrogen 2.590 N/A GLN 180.A NE2 HIS 103.A NE2 no hydrogen 3.540 N/A GLN 180.A NE2 GLU 157.A OE2 no hydrogen 3.247 N/A ASP 181.A N GLY 184.A O no hydrogen 2.838 N/A VAL 185.A N ALA 139.A O no hydrogen 2.703 N/A ASN 186.A N TRP 179.A O no hydrogen 2.824 N/A MET 188.A N PHE 177.A O no hydrogen 3.116 N/A TYR 190.A N PHE 175.A O no hydrogen 3.147 N/A TYR 190.A OH TYR 288.A OH no hydrogen 2.458 N/A MET 192.A N ASP 189.A OD2 no hydrogen 2.831 N/A MET 193.A N ASP 189.A O no hydrogen 3.226 N/A ILE 194.A N TYR 190.A O no hydrogen 3.056 N/A ASN 195.A N ASP 191.A O no hydrogen 2.815 N/A GLN 196.A N MET 193.A O no hydrogen 3.268 N/A GLN 196.A NE2 MET 193.A O no hydrogen 3.111 N/A GLN 196.A NE2 GLY 305.A O no hydrogen 2.678 N/A TYR 199.A N LYS 307.A O no hydrogen 2.942 N/A MET 201.A N ILE 309.A O no hydrogen 3.146 N/A ILE 202.A N PRO 213.A O no hydrogen 3.197 N/A VAL 203.A N ASN 311.A O no hydrogen 3.128 N/A ALA 215.A N ILE 202.A O no hydrogen 2.820 N/A TYR 216.A N SER 295.A O no hydrogen 2.937 N/A VAL 219.A N LYS 293.A O no hydrogen 2.687 N/A THR 222.A N TYR 291.A O no hydrogen 2.989 N/A SER 224.A OG LYS 223.A O no hydrogen 2.666 N/A SER 224.A OG ASP 289.A OD2 no hydrogen 3.084 N/A ARG 229.A N PRO 226.A O no hydrogen 3.194 N/A ARG 229.A NH1 ASP 289.A OD2 no hydrogen 2.783 N/A ASP 230.A N PRO 226.A O no hydrogen 3.403 N/A LYS 233.A N ASP 230.A O no hydrogen 2.565 N/A ASN 234.A N PRO 231.A O no hydrogen 2.950 N/A ASN 234.A ND2 GLU 256.A OE1 no hydrogen 2.682 N/A ALA 235.A N THR 252.A O no hydrogen 2.927 N/A THR 236.A N ASN 257.A O no hydrogen 2.624 N/A THR 236.A OG1 THR 251.A OG1 no hydrogen 2.978 N/A THR 236.A OG1 GLY 255.A O no hydrogen 3.058 N/A ILE 237.A N ILE 250.A O no hydrogen 3.098 N/A TYR 238.A N ILE 259.A O no hydrogen 2.659 N/A ALA 239.A N PRO 248.A O no hydrogen 3.075 N/A HIS 240.A N VAL 261.A O no hydrogen 3.095 N/A SER 241.A OG ARG 263.A O no hydrogen 3.046 N/A LEU 243.A N SER 241.A OG no hydrogen 3.063 N/A SER 246.A N ASP 244.A OD1 no hydrogen 2.993 N/A ILE 250.A N ILE 237.A O no hydrogen 3.178 N/A THR 251.A OG1 THR 236.A OG1 no hydrogen 2.978 N/A THR 252.A N ALA 235.A O no hydrogen 2.768 N/A THR 252.A OG1 THR 251.A O no hydrogen 3.454 N/A GLY 255.A N THR 252.A O no hydrogen 3.388 N/A GLU 256.A N ASN 234.A OD1 no hydrogen 3.013 N/A ASN 257.A N ASN 234.A O no hydrogen 3.044 N/A ILE 259.A N THR 236.A O no hydrogen 3.019 N/A VAL 261.A N TYR 238.A O no hydrogen 2.818 N/A SER 262.A OG SER 264.A OG no hydrogen 2.563 N/A ARG 263.A N HIS 240.A O no hydrogen 2.741 N/A ARG 263.A NE TYR 272.A O no hydrogen 2.743 N/A ARG 263.A NH1 SER 262.A O no hydrogen 2.785 N/A ARG 263.A NH1 GLU 278.A OE1 no hydrogen 3.487 N/A ARG 263.A NH1 GLU 278.A OE2 no hydrogen 3.110 N/A ARG 263.A NH2 TYR 272.A O no hydrogen 3.544 N/A ARG 263.A NH2 GLU 278.A OE1 no hydrogen 2.710 N/A SER 264.A N SER 262.A OG no hydrogen 3.240 N/A SER 264.A OG SER 262.A OG no hydrogen 2.563 N/A TYR 267.A N SER 264.A O no hydrogen 3.148 N/A SER 268.A N GLY 265.A O no hydrogen 2.752 N/A SER 268.A OG GLY 265.A O no hydrogen 3.151 N/A GLU 269.A N ALA 266.A O no hydrogen 3.286 N/A MET 270.A N TYR 267.A O no hydrogen 3.104 N/A TYR 272.A OH ASP 173.A OD1 no hydrogen 3.266 N/A TYR 272.A OH ASP 173.A OD2 no hydrogen 2.378 N/A ARG 273.A N VAL 356.A O no hydrogen 2.882 N/A ARG 273.A NE ARG 273.A O no hydrogen 2.875 N/A ARG 273.A NH1 ALA 239.A O no hydrogen 2.762 N/A ARG 273.A NH1 ARG 273.A O no hydrogen 3.316 N/A ARG 273.A NH2 ASP 244.A OD2 no hydrogen 2.730 N/A ARG 273.A NH2 SER 246.A O no hydrogen 3.384 N/A ASN 274.A ND2 VAL 354.A O no hydrogen 2.858 N/A GLU 277.A N GLU 277.A OE1 no hydrogen 2.569 N/A GLU 278.A N GLY 275.A O no hydrogen 3.102 N/A ALA 279.A N GLY 275.A O no hydrogen 2.795 N/A ILE 280.A N TYR 276.A O no hydrogen 2.743 N/A LEU 282.A N GLU 278.A O no hydrogen 2.838 N/A GLN 283.A N ALA 279.A O no hydrogen 2.900 N/A THR 284.A OG1 ILE 280.A O no hydrogen 2.468 N/A THR 284.A OG1 THR 350.A OG1 no hydrogen 3.247 N/A MET 285.A N ARG 281.A O no hydrogen 3.039 N/A ALA 286.A N LEU 282.A O no hydrogen 3.293 N/A GLN 287.A N THR 284.A O no hydrogen 3.202 N/A GLN 287.A NE2 THR 284.A O no hydrogen 3.566 N/A TYR 288.A N MET 285.A O no hydrogen 3.247 N/A TYR 288.A OH TYR 190.A OH no hydrogen 2.458 N/A GLY 290.A N THR 343.A O no hydrogen 3.109 N/A TYR 291.A N THR 222.A O no hydrogen 2.998 N/A TYR 291.A OH ASP 324.A OD1 no hydrogen 2.929 N/A ALA 292.A N MET 341.A O no hydrogen 2.945 N/A LYS 293.A N VAL 219.A O no hydrogen 2.820 N/A CYS 294.A N LEU 339.A O no hydrogen 3.112 N/A SER 295.A N TYR 216.A O no hydrogen 2.883 N/A SER 295.A OG TYR 216.A OH no hydrogen 3.322 N/A SER 295.A OG HIS 338.A ND1 no hydrogen 3.104 N/A THR 296.A N THR 337.A O no hydrogen 2.846 N/A THR 296.A OG1 LEU 214.A O no hydrogen 2.745 N/A GLY 298.A N SER 335.A O no hydrogen 2.735 N/A ASN 299.A N THR 337.A OG1 no hydrogen 2.856 N/A LEU 302.A N ASN 299.A O no hydrogen 3.468 N/A THR 303.A OG1 PRO 304.A O no hydrogen 3.470 N/A GLY 305.A N VAL 323.A O no hydrogen 2.781 N/A VAL 306.A N THR 303.A O no hydrogen 3.245 N/A LYS 307.A NZ ILE 194.A O no hydrogen 2.673 N/A LYS 307.A NZ GLN 196.A O no hydrogen 2.501 N/A ILE 308.A N PHE 321.A O no hydrogen 2.664 N/A ILE 309.A N TYR 199.A O no hydrogen 3.345 N/A ASN 311.A N MET 201.A O no hydrogen 2.811 N/A LYS 314.A N ASP 312.A OD2 no hydrogen 2.993 N/A THR 319.A OG1 GLU 320.A O no hydrogen 3.353 N/A THR 319.A OG1 THR 343.A OG1 no hydrogen 2.820 N/A THR 319.A OG1 ASN 344.A OD1 no hydrogen 2.773 N/A PHE 321.A N ILE 308.A O no hydrogen 2.703 N/A TYR 322.A N PHE 342.A O no hydrogen 3.152 N/A VAL 323.A N VAL 306.A O no hydrogen 2.960 N/A GLU 325.A N TYR 340.A O no hydrogen 2.981 N/A VAL 326.A N ASP 39.A O no hydrogen 2.804 N/A ILE 327.A N HIS 338.A O no hydrogen 2.949 N/A HIS 328.A N MET 37.A O no hydrogen 2.553 N/A GLU 329.A N VAL 336.A O no hydrogen 2.909 N/A LEU 330.A N LEU 35.A O no hydrogen 3.281 N/A SER 331.A N ASN 334.A O no hydrogen 3.230 N/A SER 331.A OG THR 33.A O no hydrogen 2.431 N/A SER 335.A OG GLY 5.A O no hydrogen 2.929 N/A VAL 336.A N GLU 329.A O no hydrogen 2.777 N/A THR 337.A N THR 296.A O no hydrogen 2.747 N/A HIS 338.A N ILE 327.A O no hydrogen 2.923 N/A HIS 338.A NE2 GLU 329.A OE1 no hydrogen 3.074 N/A LEU 339.A N CYS 294.A O no hydrogen 2.892 N/A TYR 340.A N GLU 325.A O no hydrogen 2.965 N/A MET 341.A N ALA 292.A O no hydrogen 3.005 N/A PHE 342.A N TYR 322.A O no hydrogen 3.160 N/A THR 343.A N GLY 290.A O no hydrogen 2.774 N/A THR 343.A OG1 GLU 320.A O no hydrogen 2.714 N/A THR 343.A OG1 ASN 344.A OD1 no hydrogen 3.282 N/A ASN 344.A N THR 343.A OG1 no hydrogen 2.569 N/A ASN 344.A ND2 THR 346.A O no hydrogen 2.493 N/A ALA 345.A N ASP 289.A OD1 no hydrogen 3.169 N/A LEU 348.A N GLN 287.A OE1 no hydrogen 3.091 N/A THR 350.A OG1 THR 284.A OG1 no hydrogen 3.247 N/A LYS 355.A NZ ASP 173.A OD2 no hydrogen 3.434 N/A ASN 358.A N THR 271.A O no hydrogen 3.171 N/A ASN 358.A ND2 SER 268.A O no hydrogen 3.231 N/A ASN 358.A ND2 MET 270.A O no hydrogen 3.493 N/A