Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4j1i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N ASP 173.A OD1 no hydrogen 3.205 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.588 N/A MET 7.A N PHE 4.A O no hydrogen 2.956 N/A ASP 9.A N SER 166.A OG no hydrogen 2.894 N/A ASN 10.A N MET 7.A O no hydrogen 3.208 N/A ASN 10.A ND2 HIS 94.A O no hydrogen 2.829 N/A ASN 10.A ND2 MET 167.A O no hydrogen 2.962 N/A LEU 11.A N GLY 165.A O no hydrogen 2.974 N/A ARG 12.A N TYR 20.A O no hydrogen 3.132 N/A LYS 14.A NZ GLN 17.A OE1 no hydrogen 3.517 N/A GLN 17.A N LYS 14.A O no hydrogen 2.736 N/A TYR 19.A OH GLU 325.A OE1 no hydrogen 2.507 N/A TYR 20.A N ARG 12.A O no hydrogen 2.906 N/A VAL 21.A N ILE 34.A O no hydrogen 2.741 N/A MET 23.A N LEU 32.A O no hydrogen 2.853 N/A THR 24.A N SER 91.A O no hydrogen 2.936 N/A VAL 25.A N GLN 30.A O no hydrogen 2.971 N/A GLY 26.A N LEU 89.A O no hydrogen 2.867 N/A SER 27.A N SER 62.A OG no hydrogen 3.110 N/A SER 27.A OG THR 64.A OG1 no hydrogen 2.637 N/A GLN 30.A N VAL 25.A O no hydrogen 2.862 N/A GLN 30.A NE2 GLN 58.A O no hydrogen 2.894 N/A LEU 32.A N MET 23.A O no hydrogen 2.814 N/A ASN 33.A N GLU 121.A OE1 no hydrogen 2.702 N/A ASN 33.A ND2 ASN 119.A O no hydrogen 3.048 N/A ILE 34.A N VAL 21.A O no hydrogen 2.888 N/A LEU 35.A N GLY 122.A O no hydrogen 2.877 N/A VAL 36.A N TYR 19.A O no hydrogen 2.851 N/A ASP 37.A N LEU 124.A O no hydrogen 3.049 N/A THR 38.A N SER 222.A OG no hydrogen 2.975 N/A THR 38.A OG1 VAL 220.A O no hydrogen 2.922 N/A GLY 39.A N ASP 37.A OD1 no hydrogen 2.985 N/A SER 40.A OG ASP 37.A OD2 no hydrogen 2.587 N/A SER 41.A OG TYR 128.A O no hydrogen 2.615 N/A ASN 42.A ND2 ARG 133.A O no hydrogen 2.946 N/A ALA 44.A N ILE 123.A O no hydrogen 3.040 N/A VAL 45.A N ALA 105.A O no hydrogen 2.944 N/A GLY 46.A N GLU 121.A O no hydrogen 2.722 N/A ALA 47.A N ILE 107.A O no hydrogen 2.962 N/A HIS 50.A N ALA 48.A O no hydrogen 2.829 N/A PHE 52.A N HIS 50.A ND1 no hydrogen 3.013 N/A LEU 53.A N HIS 50.A O no hydrogen 3.029 N/A ARG 55.A NE GLU 121.A OE1 no hydrogen 2.779 N/A ARG 55.A NH2 ASN 119.A OD1 no hydrogen 3.030 N/A ARG 55.A NH2 GLU 121.A OE1 no hydrogen 3.468 N/A TYR 57.A N GLY 46.A O no hydrogen 2.819 N/A TYR 57.A OH ASP 88.A OD2 no hydrogen 2.687 N/A GLN 58.A N GLN 30.A OE1 no hydrogen 2.835 N/A ARG 59.A NH1 TYR 65.A OH no hydrogen 3.432 N/A ARG 59.A NH1 GLU 84.A OE2 no hydrogen 2.734 N/A ARG 59.A NH2 GLU 84.A OE2 no hydrogen 2.780 N/A GLN 60.A N GLN 60.A OE1 no hydrogen 2.848 N/A GLN 60.A NE2 GLN 58.A OE1 no hydrogen 3.443 N/A LEU 61.A N GLN 58.A O no hydrogen 2.952 N/A SER 62.A N ARG 59.A O no hydrogen 2.882 N/A SER 62.A OG ASP 88.A OD1 no hydrogen 3.301 N/A SER 62.A OG ASP 88.A OD2 no hydrogen 2.693 N/A SER 63.A N SER 27.A O no hydrogen 3.075 N/A SER 63.A OG SER 27.A O no hydrogen 3.450 N/A THR 64.A N SER 62.A OG no hydrogen 3.392 N/A THR 64.A OG1 SER 27.A OG no hydrogen 2.637 N/A THR 64.A OG1 SER 62.A OG no hydrogen 3.277 N/A THR 64.A OG1 ASP 88.A OD1 no hydrogen 2.612 N/A ARG 66.A N THR 87.A O no hydrogen 2.867 N/A LEU 68.A N LEU 85.A O no hydrogen 2.976 N/A ARG 69.A N ASP 67.A OD1 no hydrogen 2.788 N/A VAL 72.A N GLY 83.A O no hydrogen 2.987 N/A VAL 74.A N TRP 81.A O no hydrogen 2.669 N/A TYR 76.A N GLY 79.A O no hydrogen 2.835 N/A LYS 80.A N ASP 111.A O no hydrogen 2.973 N/A LYS 80.A NZ GLU 82.A OE2 no hydrogen 3.474 N/A TRP 81.A N VAL 74.A O no hydrogen 2.958 N/A TRP 81.A NE1 TYR 76.A OH no hydrogen 2.870 N/A GLU 82.A N GLU 109.A O no hydrogen 2.988 N/A GLY 83.A N VAL 72.A O no hydrogen 2.842 N/A GLU 84.A N ALA 106.A O no hydrogen 2.802 N/A LEU 85.A N LYS 70.A O no hydrogen 2.846 N/A GLY 86.A N ILE 104.A O no hydrogen 3.112 N/A THR 87.A N ARG 66.A O no hydrogen 2.781 N/A ASP 88.A N ALA 102.A O no hydrogen 3.128 N/A LEU 89.A N ASP 88.A OD1 no hydrogen 2.757 N/A VAL 90.A N VAL 100.A O no hydrogen 2.821 N/A SER 91.A N THR 24.A O no hydrogen 2.979 N/A SER 91.A OG THR 99.A OG1 no hydrogen 3.263 N/A GLY 95.A N ILE 92.A O no hydrogen 2.922 N/A VAL 98.A N PRO 96.A O no hydrogen 2.818 N/A THR 99.A OG1 SER 91.A OG no hydrogen 3.263 N/A VAL 100.A N VAL 90.A O no hydrogen 3.057 N/A ARG 101.A N GLN 148.A OE1 no hydrogen 2.891 N/A ARG 101.A NH1 THR 64.A O no hydrogen 2.855 N/A ARG 101.A NH1 THR 87.A OG1 no hydrogen 2.949 N/A ARG 101.A NH2 THR 64.A O no hydrogen 2.828 N/A ALA 102.A N ASP 88.A O no hydrogen 2.970 N/A ASN 103.A ND2 GLU 139.A O no hydrogen 2.915 N/A ILE 104.A N GLY 86.A O no hydrogen 2.836 N/A ALA 105.A N PHE 43.A O no hydrogen 2.908 N/A ALA 106.A N GLU 84.A O no hydrogen 2.811 N/A ILE 107.A N VAL 45.A O no hydrogen 2.832 N/A THR 108.A N GLU 82.A O no hydrogen 2.985 N/A THR 108.A OG1 GLU 82.A O no hydrogen 3.483 N/A GLU 109.A N GLU 82.A O no hydrogen 3.344 N/A ASP 111.A N LYS 80.A O no hydrogen 2.848 N/A SER 118.A N ILE 115.A O no hydrogen 3.024 N/A SER 118.A OG ILE 115.A O no hydrogen 3.255 N/A ASN 119.A ND2 TYR 20.A OH no hydrogen 2.909 N/A TRP 120.A NE1 GLN 17.A O no hydrogen 2.843 N/A GLU 121.A N ASN 33.A O no hydrogen 2.893 N/A ILE 123.A N ALA 44.A O no hydrogen 2.832 N/A LEU 124.A N LEU 35.A O no hydrogen 2.701 N/A GLY 125.A N ASN 42.A O no hydrogen 2.922 N/A LEU 126.A N ASP 37.A O no hydrogen 2.895 N/A ALA 127.A N SER 40.A O no hydrogen 2.945 N/A TYR 128.A N TRP 190.A O no hydrogen 2.970 N/A ILE 131.A N TYR 128.A O no hydrogen 3.226 N/A ALA 132.A N ALA 129.A O no hydrogen 2.837 N/A ARG 133.A N ASN 42.A OD1 no hydrogen 2.923 N/A SER 137.A N ASP 135.A OD2 no hydrogen 2.987 N/A SER 137.A OG ASP 135.A OD2 no hydrogen 2.717 N/A LEU 138.A N ASP 135.A O no hydrogen 3.172 N/A SER 144.A N PRO 140.A O no hydrogen 3.194 N/A SER 144.A OG GLU 139.A OE2 no hydrogen 2.540 N/A SER 144.A OG PRO 140.A O no hydrogen 3.415 N/A LEU 145.A N PHE 141.A O no hydrogen 2.957 N/A VAL 146.A N PHE 142.A O no hydrogen 2.959 N/A LYS 147.A N ASP 143.A O no hydrogen 2.812 N/A GLN 148.A N SER 144.A O no hydrogen 2.881 N/A GLN 148.A NE2 ARG 101.A O no hydrogen 2.857 N/A THR 149.A N LEU 145.A O no hydrogen 3.151 N/A THR 149.A OG1 LEU 145.A O no hydrogen 2.866 N/A VAL 151.A N THR 149.A OG1 no hydrogen 2.947 N/A LEU 154.A N PRO 152.A O no hydrogen 2.964 N/A PHE 155.A N PHE 331.A O no hydrogen 3.166 N/A SER 156.A N ILE 168.A O no hydrogen 2.904 N/A SER 156.A OG GLY 171.A O no hydrogen 2.946 N/A SER 156.A OG TYR 328.A OH no hydrogen 2.507 N/A LEU 157.A N VAL 329.A O no hydrogen 2.786 N/A GLN 158.A N SER 166.A O no hydrogen 2.792 N/A GLN 158.A NE2 LEU 176.A O no hydrogen 3.189 N/A GLN 158.A NE2 SER 343.A OG no hydrogen 3.329 N/A CYS 160.A N GLY 164.A O no hydrogen 2.961 N/A CYS 160.A SG GLN 158.A OE1 no hydrogen 3.578 N/A SER 166.A N GLN 158.A O no hydrogen 2.952 N/A MET 167.A N ASN 10.A OD1 no hydrogen 2.779 N/A ILE 168.A N SER 156.A O no hydrogen 2.872 N/A GLY 170.A N LEU 154.A O no hydrogen 2.823 N/A ASP 173.A N TYR 328.A OH no hydrogen 2.844 N/A HIS 174.A N GLY 2.A O no hydrogen 3.228 N/A HIS 174.A ND1 TYR 177.A OH no hydrogen 2.865 N/A SER 175.A N ASP 173.A OD2 no hydrogen 3.084 N/A SER 175.A OG ASP 173.A OD2 no hydrogen 2.963 N/A LEU 176.A N ASP 173.A O no hydrogen 2.985 N/A TYR 177.A N HIS 174.A O no hydrogen 3.441 N/A TYR 177.A OH HIS 174.A ND1 no hydrogen 2.865 N/A THR 178.A N VAL 342.A O no hydrogen 2.933 N/A SER 180.A OG LEU 181.A O no hydrogen 3.310 N/A TRP 182.A N PHE 340.A O no hydrogen 2.956 N/A THR 184.A N ILE 338.A O no hydrogen 2.895 N/A THR 184.A OG1 MET 281.A O no hydrogen 2.588 N/A ILE 186.A N LYS 336.A O no hydrogen 2.972 N/A ARG 187.A N GLU 193.A O no hydrogen 2.876 N/A ARG 187.A NH1 GLU 193.A OE2 no hydrogen 3.024 N/A ARG 187.A NH1 TYR 370.A O no hydrogen 2.966 N/A ARG 187.A NH2 TYR 370.A O no hydrogen 3.247 N/A ARG 188.A NH2 GLU 130.A OE2 no hydrogen 3.206 N/A TRP 190.A N ARG 188.A O no hydrogen 3.075 N/A TRP 190.A N TYR 191.A O no hydrogen 3.053 N/A TRP 190.A NE1 GLU 193.A OE1 no hydrogen 2.798 N/A TYR 192.A OH LEU 126.A O no hydrogen 2.553 N/A VAL 194.A N SER 218.A O no hydrogen 2.905 N/A ILE 196.A N ASN 214.A OD1 no hydrogen 2.877 N/A VAL 197.A N TYR 279.A O no hydrogen 2.683 N/A GLU 200.A N SER 277.A O no hydrogen 2.964 N/A ILE 201.A N GLN 204.A O no hydrogen 2.786 N/A ASN 202.A N VAL 275.A O no hydrogen 2.877 N/A GLN 204.A N ILE 201.A O no hydrogen 2.927 N/A LEU 206.A N VAL 199.A O no hydrogen 2.931 N/A LYS 211.A N ASP 209.A OD1 no hydrogen 3.286 N/A LYS 211.A NZ ASP 367.A O no hydrogen 2.939 N/A GLU 212.A N ASP 209.A O no hydrogen 2.788 N/A TYR 213.A N CYS 210.A O no hydrogen 2.898 N/A ASN 214.A N LYS 211.A O no hydrogen 3.242 N/A ASN 214.A ND2 ILE 196.A O no hydrogen 2.891 N/A ASN 214.A ND2 CYS 368.A O no hydrogen 2.849 N/A LYS 217.A NZ ASP 216.A OD1 no hydrogen 3.558 N/A LYS 217.A NZ THR 315.A O no hydrogen 2.880 N/A SER 218.A OG TYR 213.A O no hydrogen 3.310 N/A SER 218.A OG ASN 214.A OD1 no hydrogen 2.660 N/A ILE 219.A N THR 317.A O no hydrogen 3.063 N/A VAL 220.A N TYR 192.A O no hydrogen 3.042 N/A ASP 221.A N MET 319.A O no hydrogen 3.048 N/A SER 222.A N THR 38.A OG1 no hydrogen 2.931 N/A SER 222.A OG VAL 36.A O no hydrogen 2.679 N/A GLY 223.A N ASP 221.A OD1 no hydrogen 2.868 N/A THR 224.A N ASP 221.A O no hydrogen 3.285 N/A THR 224.A OG1 ASP 221.A OD2 no hydrogen 2.654 N/A ASN 226.A ND2 SER 311.A OG no hydrogen 2.905 N/A LEU 227.A N ALA 309.A O no hydrogen 2.966 N/A ARG 228.A N VAL 318.A O no hydrogen 2.840 N/A LEU 229.A N SER 311.A O no hydrogen 2.833 N/A PHE 234.A N PRO 230.A O no hydrogen 2.834 N/A GLU 235.A N LYS 231.A O no hydrogen 2.756 N/A ALA 236.A N LYS 232.A O no hydrogen 3.139 N/A ALA 237.A N VAL 233.A O no hydrogen 2.735 N/A VAL 238.A N PHE 234.A O no hydrogen 2.966 N/A ALA 239.A N GLU 235.A O no hydrogen 3.353 N/A SER 240.A N ALA 236.A O no hydrogen 3.118 N/A ILE 241.A N ALA 237.A O no hydrogen 2.942 N/A LYS 242.A N VAL 238.A O no hydrogen 2.565 N/A LYS 242.A NZ ASP 252.A OD2 no hydrogen 2.687 N/A ALA 243.A N ALA 239.A O no hydrogen 3.051 N/A ALA 244.A N SER 240.A O no hydrogen 3.028 N/A SER 245.A N ILE 241.A O no hydrogen 3.060 N/A SER 245.A N LYS 242.A O no hydrogen 3.177 N/A SER 245.A OG ILE 241.A O no hydrogen 2.773 N/A SER 245.A OG LYS 242.A O no hydrogen 3.237 N/A SER 246.A OG ALA 243.A O no hydrogen 3.324 N/A GLU 248.A N SER 245.A O no hydrogen 2.814 N/A TRP 255.A N ASP 252.A O no hydrogen 3.005 N/A LEU 256.A N GLY 253.A O no hydrogen 2.999 N/A GLY 257.A N PHE 254.A O no hydrogen 2.782 N/A GLU 258.A N GLY 253.A O no hydrogen 2.837 N/A VAL 261.A N TYR 306.A O no hydrogen 2.981 N/A TRP 263.A N ASP 304.A O no hydrogen 3.021 N/A GLY 266.A N ASP 304.A OD1 no hydrogen 2.683 N/A THR 267.A N GLN 264.A O no hydrogen 3.128 N/A THR 267.A OG1 GLN 264.A O no hydrogen 2.343 N/A THR 268.A OG1 TYR 306.A OH no hydrogen 2.422 N/A VAL 275.A N ASN 202.A OD1 no hydrogen 3.033 N/A ILE 276.A N ILE 293.A O no hydrogen 3.164 N/A SER 277.A N GLU 200.A O no hydrogen 2.774 N/A SER 277.A OG THR 292.A OG1 no hydrogen 2.993 N/A LEU 278.A N ILE 291.A O no hydrogen 2.876 N/A TYR 279.A N ARG 198.A O no hydrogen 2.801 N/A TYR 279.A OH GLU 200.A OE1 no hydrogen 3.033 N/A TYR 279.A OH GLU 200.A OE2 no hydrogen 3.186 N/A LEU 280.A N PHE 289.A O no hydrogen 2.942 N/A MET 281.A N ILE 195.A O no hydrogen 2.913 N/A GLY 282.A N GLN 287.A O no hydrogen 2.871 N/A VAL 284.A N GLN 287.A OE1 no hydrogen 2.998 N/A GLN 287.A N VAL 284.A O no hydrogen 3.072 N/A GLN 287.A NE2 SER 288.A O no hydrogen 3.247 N/A SER 288.A N PHE 360.A O no hydrogen 2.808 N/A SER 288.A OG THR 362.A OG1 no hydrogen 2.699 N/A PHE 289.A N LEU 280.A O no hydrogen 3.225 N/A ARG 290.A N GLU 357.A O no hydrogen 2.820 N/A ARG 290.A NE GLU 357.A OE2 no hydrogen 3.006 N/A ARG 290.A NH1 TYR 279.A OH no hydrogen 2.978 N/A ARG 290.A NH2 GLU 357.A OE1 no hydrogen 3.196 N/A ILE 291.A N LEU 278.A O no hydrogen 2.846 N/A THR 292.A N ALA 355.A O no hydrogen 2.850 N/A THR 292.A OG1 SER 277.A OG no hydrogen 2.993 N/A ILE 293.A N ILE 276.A O no hydrogen 3.018 N/A LEU 294.A N GLN 297.A OE1 no hydrogen 3.012 N/A GLN 296.A N GLN 296.A OE1 no hydrogen 2.607 N/A GLN 297.A N LEU 294.A O no hydrogen 2.719 N/A GLN 297.A NE2 VAL 347.A O no hydrogen 3.391 N/A TYR 298.A N LEU 294.A O no hydrogen 3.270 N/A TYR 298.A OH PRO 274.A O no hydrogen 2.578 N/A LEU 299.A N PRO 295.A O no hydrogen 2.713 N/A ARG 300.A N LYS 307.A O no hydrogen 3.002 N/A ARG 300.A NH1 GLU 325.A OE2 no hydrogen 3.262 N/A ARG 300.A NH2 GLU 325.A OE1 no hydrogen 3.246 N/A VAL 302.A N CYS 305.A O no hydrogen 2.559 N/A TYR 306.A N VAL 261.A O no hydrogen 2.863 N/A TYR 306.A OH THR 268.A OG1 no hydrogen 2.422 N/A LYS 307.A N ARG 300.A O no hydrogen 2.809 N/A ALA 309.A N TYR 298.A O no hydrogen 2.798 N/A SER 311.A N LEU 227.A O no hydrogen 3.028 N/A SER 313.A OG THR 315.A OG1 no hydrogen 3.025 N/A SER 313.A OG GLY 316.A O no hydrogen 2.768 N/A THR 315.A N SER 313.A OG no hydrogen 2.911 N/A THR 315.A OG1 SER 313.A OG no hydrogen 3.025 N/A THR 317.A N LYS 217.A O no hydrogen 2.739 N/A THR 317.A OG1 TYR 213.A O no hydrogen 2.669 N/A VAL 318.A N ARG 228.A O no hydrogen 2.800 N/A MET 319.A N ILE 219.A O no hydrogen 2.875 N/A ALA 321.A N THR 224.A O no hydrogen 2.847 N/A VAL 322.A N THR 225.A O no hydrogen 2.830 N/A MET 324.A N GLY 320.A O no hydrogen 3.037 N/A GLU 325.A N ALA 321.A O no hydrogen 3.043 N/A GLY 326.A N ILE 323.A O no hydrogen 3.126 N/A PHE 327.A N MET 324.A O no hydrogen 3.001 N/A TYR 328.A N ALA 341.A O no hydrogen 2.797 N/A TYR 328.A OH SER 156.A OG no hydrogen 2.507 N/A VAL 329.A N LEU 157.A O no hydrogen 2.979 N/A VAL 330.A N GLY 339.A O no hydrogen 2.870 N/A PHE 331.A N PHE 155.A O no hydrogen 2.724 N/A ASP 332.A N ARG 337.A O no hydrogen 2.869 N/A ARG 333.A NE ASN 153.A OD1 no hydrogen 2.911 N/A ARG 333.A NH1 TYR 192.A OH no hydrogen 2.946 N/A ARG 333.A NH2 ASP 143.A OD2 no hydrogen 3.067 N/A ALA 334.A N ASN 153.A O no hydrogen 2.960 N/A ARG 335.A N ASP 332.A OD1 no hydrogen 3.058 N/A ARG 335.A NE ASP 332.A OD2 no hydrogen 3.213 N/A LYS 336.A N ARG 333.A O no hydrogen 3.092 N/A ARG 337.A N ASP 332.A O no hydrogen 3.104 N/A ARG 337.A NE ASP 332.A OD2 no hydrogen 2.682 N/A ARG 337.A NH1 GLU 283.A OE2 no hydrogen 2.756 N/A ARG 337.A NH2 ASP 332.A OD2 no hydrogen 3.229 N/A ILE 338.A N THR 184.A O no hydrogen 2.852 N/A GLY 339.A N VAL 330.A O no hydrogen 2.770 N/A PHE 340.A N TRP 182.A O no hydrogen 2.828 N/A ALA 341.A N TYR 328.A O no hydrogen 2.996 N/A SER 343.A N GLY 326.A O no hydrogen 3.023 N/A ALA 344.A N LEU 176.A O no hydrogen 2.948 N/A CYS 345.A N SER 343.A OG no hydrogen 2.986 N/A CYS 345.A SG LEU 159.A O no hydrogen 4.032 N/A CYS 345.A SG SER 343.A OG no hydrogen 3.345 N/A HIS 346.A N SER 343.A O no hydrogen 3.454 N/A HIS 346.A ND1 SER 343.A O no hydrogen 3.121 N/A HIS 348.A ND1 ASP 349.A O no hydrogen 3.229 N/A ASP 349.A N ARG 352.A O no hydrogen 3.257 N/A ARG 352.A N ASP 349.A OD1 no hydrogen 2.801 N/A ARG 352.A NH1 PHE 273.A O no hydrogen 2.741 N/A ARG 352.A NH2 PHE 273.A O no hydrogen 2.818 N/A THR 353.A OG1 ALA 354.A O no hydrogen 3.345 N/A ALA 354.A N HIS 346.A NE2 no hydrogen 3.038 N/A ALA 355.A N THR 292.A O no hydrogen 3.224 N/A GLU 357.A N ARG 290.A O no hydrogen 2.935 N/A PHE 360.A N SER 288.A O no hydrogen 2.966 N/A THR 362.A N ASN 286.A O no hydrogen 2.924 N/A THR 362.A OG1 SER 288.A OG no hydrogen 2.699 N/A ASP 367.A N ASP 364.A O no hydrogen 3.068 N/A CYS 368.A N MET 365.A O no hydrogen 3.087 N/A CYS 368.A SG ASP 364.A O no hydrogen 4.016 N/A GLY 369.A N GLU 366.A O no hydrogen 3.235 N/A