Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4owr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N ASP 1.A OD1 no hydrogen 3.271 N/A THR 5.A N THR 47.A OG1 no hydrogen 3.327 N/A SER 7.A OG ASN 317.A O no hydrogen 2.641 N/A SER 11.A N ASP 10.A OD1 no hydrogen 2.632 N/A SER 11.A OG TYR 302.A O no hydrogen 3.123 N/A ILE 12.A N SER 301.A OG no hydrogen 3.056 N/A GLY 13.A N GLY 30.A O no hydrogen 2.931 N/A SER 16.A N ILE 28.A O no hydrogen 3.003 N/A SER 16.A OG PHE 17.A O no hydrogen 3.539 N/A SER 18.A N PHE 26.A O no hydrogen 2.922 N/A THR 21.A OG1 ASP 66.A O no hydrogen 2.715 N/A LEU 22.A N PRO 19.A O no hydrogen 3.180 N/A LEU 27.A N TRP 39.A O no hydrogen 2.944 N/A ILE 28.A N SER 16.A O no hydrogen 2.945 N/A ALA 29.A N ARG 37.A O no hydrogen 3.191 N/A GLY 30.A N CYS 14.A O no hydrogen 3.385 N/A SER 31.A N ASP 35.A O no hydrogen 3.177 N/A SER 31.A OG ASP 35.A O no hydrogen 3.338 N/A TRP 32.A N SER 11.A O no hydrogen 2.911 N/A ASN 34.A N SER 31.A O no hydrogen 3.195 N/A ASN 34.A ND2 HIS 55.A O no hydrogen 3.694 N/A VAL 36.A N GLN 53.A O no hydrogen 2.933 N/A ARG 37.A N ALA 29.A O no hydrogen 2.979 N/A ARG 37.A NE ASP 35.A OD2 no hydrogen 2.780 N/A ARG 37.A NH1 SER 6.A O no hydrogen 2.803 N/A CYS 38.A N ALA 51.A O no hydrogen 2.927 N/A CYS 38.A SG LEU 27.A O no hydrogen 4.028 N/A CYS 38.A SG TRP 39.A O no hydrogen 3.945 N/A TRP 39.A N LEU 27.A O no hydrogen 3.059 N/A TRP 39.A NE1 THR 5.A O no hydrogen 2.840 N/A GLU 40.A N ILE 48.A O no hydrogen 2.946 N/A VAL 41.A N ASN 25.A O no hydrogen 3.123 N/A GLN 42.A N GLN 46.A O no hydrogen 3.011 N/A SER 44.A OG GLN 42.A OE1 no hydrogen 3.543 N/A GLY 45.A N GLN 42.A O no hydrogen 2.832 N/A ILE 48.A N GLU 40.A O no hydrogen 3.036 N/A LYS 50.A N CYS 38.A O no hydrogen 2.746 N/A ALA 51.A N CYS 38.A O no hydrogen 3.313 N/A GLN 52.A NE2 ASP 35.A OD2 no hydrogen 2.757 N/A GLN 53.A N VAL 36.A O no hydrogen 2.969 N/A GLN 53.A NE2 ASN 88.A O no hydrogen 3.335 N/A MET 54.A N GLN 53.A OE1 no hydrogen 3.103 N/A HIS 55.A N ASN 34.A O no hydrogen 2.868 N/A HIS 55.A ND1 ASP 77.A OD2 no hydrogen 2.811 N/A HIS 55.A NE2 THR 73.A OG1 no hydrogen 2.875 N/A THR 56.A N ASP 77.A OD2 no hydrogen 3.240 N/A THR 56.A OG1 ASP 77.A OD2 no hydrogen 3.487 N/A VAL 59.A N SER 31.A O no hydrogen 3.177 N/A LEU 60.A N ALA 74.A O no hydrogen 2.699 N/A ASP 61.A N ALA 74.A O no hydrogen 3.352 N/A CYS 63.A N PHE 72.A O no hydrogen 3.088 N/A CYS 63.A SG ILE 103.A O no hydrogen 3.511 N/A TRP 64.A NE1 SER 16.A O no hydrogen 2.998 N/A SER 65.A N LYS 70.A O no hydrogen 2.957 N/A GLY 68.A N SER 65.A O no hydrogen 3.304 N/A SER 69.A N ASP 67.A OD2 no hydrogen 3.073 N/A SER 69.A OG ASP 67.A OD2 no hydrogen 2.846 N/A LYS 70.A NZ SER 69.A OG no hydrogen 3.371 N/A LYS 70.A NZ ASP 84.A OD1 no hydrogen 3.147 N/A VAL 71.A N TRP 83.A O no hydrogen 3.074 N/A PHE 72.A N CYS 63.A O no hydrogen 2.683 N/A THR 73.A N LYS 81.A O no hydrogen 2.950 N/A THR 73.A OG1 HIS 55.A NE2 no hydrogen 2.875 N/A THR 73.A OG1 LYS 81.A O no hydrogen 3.239 N/A ALA 74.A N ASP 61.A O no hydrogen 2.731 N/A SER 75.A N THR 79.A O no hydrogen 3.217 N/A SER 75.A OG GLY 57.A O no hydrogen 3.080 N/A SER 75.A OG PRO 58.A O no hydrogen 2.920 N/A CYS 76.A N PRO 58.A O no hydrogen 2.752 N/A CYS 76.A SG PRO 58.A O no hydrogen 3.622 N/A ASP 77.A N SER 75.A OG no hydrogen 3.009 N/A THR 79.A N ASP 77.A OD1 no hydrogen 2.995 N/A THR 79.A OG1 ASP 77.A OD1 no hydrogen 3.044 N/A ALA 80.A N ALA 94.A O no hydrogen 3.498 N/A LYS 81.A N THR 73.A O no hydrogen 3.024 N/A LYS 81.A N THR 73.A OG1 no hydrogen 3.184 N/A MET 82.A N ILE 91.A O no hydrogen 2.689 N/A TRP 83.A N VAL 71.A O no hydrogen 2.804 N/A ASP 84.A N GLN 89.A O no hydrogen 2.894 N/A LEU 85.A N SER 69.A O no hydrogen 3.424 N/A SER 86.A OG ASP 84.A OD2 no hydrogen 3.321 N/A SER 87.A N ASP 84.A OD2 no hydrogen 3.331 N/A SER 87.A OG ASP 84.A OD2 no hydrogen 2.753 N/A ASN 88.A N LEU 85.A O no hydrogen 3.366 N/A ASN 88.A ND2 GLN 52.A O no hydrogen 3.573 N/A ASN 88.A ND2 ASN 88.A O no hydrogen 2.590 N/A ILE 91.A N MET 82.A O no hydrogen 2.900 N/A ILE 93.A N ALA 80.A O no hydrogen 3.000 N/A ALA 94.A N ALA 80.A O no hydrogen 3.349 N/A HIS 96.A N LYS 78.A O no hydrogen 2.977 N/A HIS 96.A ND1 ASP 120.A OD1 no hydrogen 2.984 N/A HIS 96.A ND1 ASP 120.A OD2 no hydrogen 2.906 N/A HIS 96.A NE2 THR 116.A OG1 no hydrogen 2.950 N/A ASP 97.A N ASP 120.A OD2 no hydrogen 2.946 N/A VAL 100.A N SER 75.A O no hydrogen 3.000 N/A LYS 101.A N GLY 117.A O no hydrogen 2.786 N/A LYS 101.A NZ TYR 144.A O no hydrogen 2.949 N/A THR 102.A N GLY 117.A O no hydrogen 2.964 N/A ILE 103.A N ASP 61.A OD2 no hydrogen 3.336 N/A HIS 104.A N MET 115.A O no hydrogen 3.107 N/A TRP 105.A NE1 ASP 66.A OD1 no hydrogen 3.049 N/A ILE 106.A N CYS 113.A O no hydrogen 2.844 N/A ALA 108.A N TYR 111.A O no hydrogen 2.908 N/A TYR 111.A N ALA 108.A O no hydrogen 2.604 N/A TYR 111.A OH LEU 167.A O no hydrogen 2.977 N/A SER 112.A OG ILE 106.A O no hydrogen 3.335 N/A SER 112.A OG TYR 111.A O no hydrogen 3.414 N/A CYS 113.A N ILE 106.A O no hydrogen 2.993 N/A VAL 114.A N TRP 126.A O no hydrogen 2.799 N/A MET 115.A N HIS 104.A O no hydrogen 2.970 N/A THR 116.A N LYS 124.A O no hydrogen 2.860 N/A THR 116.A OG1 HIS 96.A NE2 no hydrogen 2.950 N/A THR 116.A OG1 LYS 124.A O no hydrogen 3.307 N/A GLY 117.A N THR 102.A O no hydrogen 2.837 N/A SER 118.A N THR 122.A O no hydrogen 3.207 N/A SER 118.A OG ALA 98.A O no hydrogen 3.310 N/A SER 118.A OG PRO 99.A O no hydrogen 2.885 N/A SER 118.A OG ASP 120.A OD1 no hydrogen 3.022 N/A TRP 119.A N PRO 99.A O no hydrogen 3.149 N/A ASP 120.A N SER 118.A OG no hydrogen 2.919 N/A LYS 121.A N SER 118.A O no hydrogen 3.261 N/A THR 122.A OG1 ASP 120.A OD1 no hydrogen 2.796 N/A LEU 123.A N LEU 137.A O no hydrogen 2.770 N/A LYS 124.A N THR 116.A O no hydrogen 2.923 N/A LYS 124.A NZ GLN 95.A O no hydrogen 3.324 N/A PHE 125.A N MET 135.A O no hydrogen 2.900 N/A TRP 126.A N VAL 114.A O no hydrogen 2.893 N/A TRP 126.A NE1 THR 116.A OG1 no hydrogen 2.751 N/A THR 128.A OG1 ASP 127.A O no hydrogen 2.521 N/A ARG 129.A N ASP 127.A OD1 no hydrogen 2.676 N/A SER 130.A N ASP 127.A OD1 no hydrogen 2.745 N/A ASN 132.A N SER 130.A OG no hydrogen 3.368 N/A ASN 132.A ND2 SER 130.A OG no hydrogen 3.404 N/A MET 134.A N PHE 125.A O no hydrogen 2.810 N/A LEU 137.A N LEU 123.A O no hydrogen 2.756 N/A LEU 139.A N LYS 121.A O no hydrogen 2.912 N/A ARG 142.A N GLU 141.A OE2 no hydrogen 2.900 N/A ARG 142.A NE GLU 141.A OE2 no hydrogen 2.886 N/A ARG 142.A NH1 GLU 141.A OE2 no hydrogen 3.372 N/A CYS 143.A N SER 118.A O no hydrogen 3.230 N/A TYR 144.A N ALA 156.A O no hydrogen 2.901 N/A CYS 145.A N ALA 156.A O no hydrogen 3.364 N/A ASP 147.A N VAL 154.A O no hydrogen 2.959 N/A VAL 148.A N ASP 147.A OD1 no hydrogen 2.770 N/A ILE 149.A N MET 152.A O no hydrogen 3.068 N/A MET 152.A N ILE 149.A O no hydrogen 2.853 N/A ALA 153.A N TYR 165.A O no hydrogen 3.066 N/A VAL 154.A N ASP 147.A O no hydrogen 3.111 N/A VAL 155.A N ILE 163.A O no hydrogen 2.823 N/A ALA 156.A N CYS 145.A O no hydrogen 2.809 N/A THR 157.A N GLY 161.A O no hydrogen 2.962 N/A THR 157.A OG1 ALA 158.A O no hydrogen 3.110 N/A ALA 158.A N ARG 142.A O no hydrogen 2.814 N/A ARG 160.A NH1 LEU 181.A O no hydrogen 3.159 N/A GLY 161.A N THR 157.A O no hydrogen 3.262 N/A GLY 161.A N ALA 158.A O no hydrogen 3.426 N/A ILE 163.A N VAL 155.A O no hydrogen 2.899 N/A VAL 164.A N ARG 175.A O no hydrogen 2.891 N/A TYR 165.A N ALA 153.A O no hydrogen 2.659 N/A GLN 166.A N SER 172.A O no hydrogen 3.073 N/A GLN 166.A NE2 GLU 173.A O no hydrogen 3.426 N/A LEU 167.A N PRO 151.A O no hydrogen 2.614 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.943 N/A SER 172.A N GLN 166.A O no hydrogen 3.080 N/A PHE 174.A N VAL 164.A O no hydrogen 2.784 N/A ARG 175.A N VAL 164.A O no hydrogen 3.180 N/A ARG 175.A NH1 ILE 215.A O no hydrogen 3.122 N/A ARG 176.A NH2 GLU 173.A OE1 no hydrogen 3.009 N/A ILE 177.A N LEU 162.A O no hydrogen 3.011 N/A SER 179.A OG LEU 181.A O no hydrogen 3.362 N/A SER 179.A OG HIS 185.A NE2 no hydrogen 2.578 N/A LEU 181.A N SER 179.A OG no hydrogen 3.247 N/A HIS 185.A ND1 GLY 161.A O no hydrogen 3.052 N/A HIS 185.A NE2 SER 179.A OG no hydrogen 2.578 N/A ARG 186.A N GLY 204.A O no hydrogen 2.955 N/A ARG 186.A NE ASN 243.A OD1 no hydrogen 3.324 N/A CYS 187.A N GLY 204.A O no hydrogen 3.277 N/A CYS 187.A SG VAL 242.A O no hydrogen 3.587 N/A ALA 189.A N ALA 202.A O no hydrogen 2.814 N/A ILE 190.A N ASP 147.A OD2 no hydrogen 2.728 N/A PHE 191.A N GLY 200.A O no hydrogen 3.382 N/A LYS 192.A NZ ASN 196.A OD1 no hydrogen 3.540 N/A ASP 193.A N LYS 197.A O no hydrogen 2.885 N/A ASN 196.A N ASP 193.A O no hydrogen 2.721 N/A LYS 197.A N ASP 193.A OD1 no hydrogen 2.630 N/A LYS 197.A NZ ASP 193.A OD2 no hydrogen 3.182 N/A THR 199.A N PHE 191.A O no hydrogen 3.057 N/A GLY 200.A N PHE 191.A O no hydrogen 3.245 N/A PHE 201.A N HIS 213.A O no hydrogen 3.136 N/A ALA 202.A N ALA 189.A O no hydrogen 2.690 N/A LEU 203.A N ALA 211.A O no hydrogen 2.949 N/A GLY 204.A N CYS 187.A O no hydrogen 2.656 N/A SER 205.A N ARG 209.A O no hydrogen 3.084 N/A SER 205.A OG ARG 209.A O no hydrogen 3.454 N/A ILE 206.A N GLN 184.A O no hydrogen 3.199 N/A GLU 207.A N SER 205.A OG no hydrogen 3.128 N/A ARG 209.A NE GLU 207.A OE1 no hydrogen 2.787 N/A ARG 209.A NH2 GLU 207.A OE1 no hydrogen 3.351 N/A ARG 209.A NH2 GLU 207.A OE2 no hydrogen 3.018 N/A VAL 210.A N PHE 227.A O no hydrogen 2.895 N/A ALA 211.A N LEU 203.A O no hydrogen 2.771 N/A ILE 212.A N PHE 225.A O no hydrogen 2.880 N/A HIS 213.A N PHE 201.A O no hydrogen 3.135 N/A TYR 214.A N ASN 224.A OD1 no hydrogen 2.693 N/A ILE 215.A N THR 199.A O no hydrogen 3.342 N/A ASN 219.A N ASP 223.A OD2 no hydrogen 2.833 N/A LYS 222.A N ASN 219.A O no hydrogen 3.136 N/A ASP 223.A N ASN 219.A O no hydrogen 3.056 N/A ASN 224.A N PRO 220.A O no hydrogen 2.968 N/A ASN 224.A ND2 TYR 214.A O no hydrogen 3.671 N/A PHE 227.A N VAL 210.A O no hydrogen 2.844 N/A CYS 229.A N GLY 208.A O no hydrogen 3.106 N/A HIS 230.A NE2 ARG 262.A O no hydrogen 2.985 N/A ARG 231.A NE GLY 208.A O no hydrogen 2.749 N/A ARG 231.A NH2 GLU 207.A O no hydrogen 2.778 N/A ARG 231.A NH2 GLU 207.A OE2 no hydrogen 3.106 N/A ARG 231.A NH2 GLY 208.A O no hydrogen 3.369 N/A SER 232.A N ASP 238.A O no hydrogen 3.130 N/A GLN 237.A NE2 SER 232.A O no hydrogen 3.672 N/A ASP 238.A N SER 232.A O no hydrogen 3.275 N/A TYR 240.A N HIS 230.A O no hydrogen 3.257 N/A VAL 242.A N SER 205.A O no hydrogen 3.320 N/A ASN 243.A N VAL 257.A O no hydrogen 2.753 N/A ASN 243.A ND2 ILE 284.A O no hydrogen 3.085 N/A ASN 243.A ND2 ASP 303.A OD2 no hydrogen 2.969 N/A GLY 244.A N VAL 257.A O no hydrogen 3.407 N/A ALA 246.A N ALA 255.A O no hydrogen 2.940 N/A HIS 248.A N THR 253.A O no hydrogen 2.737 N/A VAL 250.A N HIS 248.A ND1 no hydrogen 3.139 N/A HIS 251.A N HIS 248.A ND1 no hydrogen 3.464 N/A GLY 252.A N HIS 248.A O no hydrogen 3.372 N/A THR 253.A OG1 LEU 328.A O no hydrogen 3.528 N/A LEU 254.A N TRP 266.A O no hydrogen 3.137 N/A ALA 255.A N ALA 246.A O no hydrogen 2.692 N/A THR 256.A N SER 264.A O no hydrogen 2.944 N/A THR 256.A OG1 SER 264.A O no hydrogen 3.506 N/A VAL 257.A N GLY 244.A O no hydrogen 3.356 N/A GLY 258.A N ARG 262.A O no hydrogen 3.249 N/A SER 259.A N ALA 241.A O no hydrogen 2.901 N/A SER 259.A OG ASP 303.A OD2 no hydrogen 2.392 N/A SER 259.A OG SER 305.A OG no hydrogen 3.408 N/A GLY 261.A N GLY 258.A O no hydrogen 3.489 N/A ARG 262.A N ASP 260.A OD1 no hydrogen 3.260 N/A ARG 262.A NH2 SER 232.A OG no hydrogen 3.069 N/A PHE 263.A N SER 277.A OG no hydrogen 2.946 N/A SER 264.A N THR 256.A O no hydrogen 2.914 N/A SER 264.A OG THR 276.A OG1 no hydrogen 3.340 N/A PHE 265.A N LYS 275.A O no hydrogen 2.874 N/A TRP 266.A N LEU 254.A O no hydrogen 2.996 N/A TRP 266.A NE1 THR 256.A OG1 no hydrogen 2.913 N/A ASP 267.A N THR 272.A O no hydrogen 2.820 N/A LYS 268.A NZ TYR 214.A OH no hydrogen 3.502 N/A LYS 268.A NZ ASP 269.A OD1 no hydrogen 3.322 N/A ARG 271.A NH2 LYS 222.A O no hydrogen 2.730 N/A THR 272.A N ASP 267.A O no hydrogen 2.970 N/A LYS 273.A NZ THR 276.A OG1 no hydrogen 2.709 N/A LEU 274.A N PHE 265.A O no hydrogen 2.768 N/A LYS 275.A N PHE 265.A O no hydrogen 3.446 N/A THR 276.A OG1 SER 264.A OG no hydrogen 3.340 N/A SER 277.A N PHE 263.A O no hydrogen 3.021 N/A SER 277.A OG PHE 263.A O no hydrogen 3.373 N/A SER 277.A OG GLU 278.A O no hydrogen 3.206 N/A GLN 279.A NE2 ASP 260.A O no hydrogen 3.216 N/A LEU 280.A N GLY 261.A O no hydrogen 2.970 N/A GLN 282.A NE2 SER 300.A O no hydrogen 3.168 N/A GLN 282.A NE2 LYS 316.A O no hydrogen 2.759 N/A ILE 284.A N GLY 258.A O no hydrogen 3.052 N/A SER 285.A N ALA 299.A O no hydrogen 3.098 N/A SER 285.A OG ILE 12.A O no hydrogen 2.647 N/A CYS 288.A N ALA 297.A O no hydrogen 3.142 N/A ASN 290.A N ILE 295.A O no hydrogen 3.066 N/A ASN 292.A ND2 HIS 291.A NE2 no hydrogen 3.027 N/A ILE 295.A N ASN 290.A OD1 no hydrogen 2.702 N/A PHE 296.A N ARG 322.A O no hydrogen 3.293 N/A ALA 297.A N CYS 288.A O no hydrogen 2.814 N/A TYR 298.A N PHE 320.A O no hydrogen 3.067 N/A TYR 298.A OH ASP 1.A OD2 no hydrogen 2.987 N/A ALA 299.A N ALA 286.A O no hydrogen 2.930 N/A SER 300.A N TYR 318.A O no hydrogen 2.692 N/A SER 300.A OG GLN 282.A O no hydrogen 3.281 N/A SER 300.A OG PRO 283.A O no hydrogen 3.537 N/A SER 301.A N PRO 283.A O no hydrogen 2.986 N/A SER 301.A OG ASN 317.A OD1 no hydrogen 3.299 N/A TYR 302.A OH GLY 307.A O no hydrogen 2.769 N/A SER 305.A N ASP 303.A OD1 no hydrogen 3.145 N/A SER 305.A OG SER 259.A OG no hydrogen 3.408 N/A SER 305.A OG ASP 303.A OD1 no hydrogen 2.665 N/A SER 305.A OG ASP 303.A OD2 no hydrogen 3.270 N/A LYS 306.A N TYR 302.A OH no hydrogen 3.102 N/A GLY 307.A N TRP 304.A O no hydrogen 3.173 N/A TYR 311.A N HIS 308.A O no hydrogen 3.368 N/A TYR 311.A OH ASP 10.A OD1 no hydrogen 2.727 N/A GLN 314.A N ASN 312.A OD1 no hydrogen 3.373 N/A LYS 315.A N ASN 312.A O no hydrogen 2.996 N/A ASN 317.A ND2 ASP 9.A O no hydrogen 3.083 N/A TYR 318.A N SER 300.A O no hydrogen 3.313 N/A PHE 320.A N TYR 298.A O no hydrogen 2.873 N/A LEU 321.A N ILE 2.A O no hydrogen 2.962 N/A ARG 322.A NE GLU 327.A OE1 no hydrogen 2.756 N/A ARG 322.A NH1 ASP 1.A OD2 no hydrogen 2.807 N/A ARG 322.A NH2 GLU 327.A OE2 no hydrogen 2.860 N/A