Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m7p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 GLY 17.A O no hydrogen 3.331 N/A GLN 5.A N GLN 5.A OE1 no hydrogen 3.259 N/A CYS 12.A N TYR 20.A O no hydrogen 2.802 N/A CYS 12.A SG LEU 40.A O no hydrogen 4.041 N/A THR 14.A N VAL 18.A O no hydrogen 2.907 N/A THR 14.A OG1 SER 16.A OG no hydrogen 3.351 N/A THR 14.A OG1 VAL 18.A O no hydrogen 2.704 N/A SER 16.A OG THR 14.A OG1 no hydrogen 3.351 N/A GLY 17.A N THR 14.A O no hydrogen 2.764 N/A TYR 20.A N CYS 12.A O no hydrogen 2.937 N/A TYR 20.A OH ASN 120.A O no hydrogen 3.123 N/A VAL 22.A N GLY 10.A O no hydrogen 3.261 N/A GLY 23.A N CYS 39.A O no hydrogen 2.779 N/A MET 24.A N SER 21.A O no hydrogen 3.143 N/A TRP 26.A N CYS 37.A O no hydrogen 3.065 N/A LYS 28.A N MET 35.A O no hydrogen 3.002 N/A LYS 28.A NZ ASP 15.A OD2 no hydrogen 2.852 N/A GLN 30.A N LYS 33.A O no hydrogen 2.812 N/A LYS 33.A N GLN 30.A O no hydrogen 2.859 N/A GLN 34.A NE2 LEU 66.A O no hydrogen 3.345 N/A MET 35.A N LYS 28.A O no hydrogen 2.734 N/A LEU 36.A N GLN 47.A O no hydrogen 2.910 N/A CYS 37.A N TRP 26.A O no hydrogen 3.012 N/A THR 38.A N SER 45.A O no hydrogen 2.740 N/A THR 38.A OG1 GLN 25.A OE1 no hydrogen 3.445 N/A CYS 39.A N MET 24.A O no hydrogen 3.009 N/A CYS 39.A SG TYR 20.A O no hydrogen 3.745 N/A CYS 39.A SG LEU 40.A O no hydrogen 4.003 N/A LEU 40.A N GLY 43.A O no hydrogen 2.917 N/A GLY 43.A N LEU 40.A O no hydrogen 3.108 N/A SER 45.A N THR 38.A O no hydrogen 2.930 N/A SER 45.A OG GLN 47.A OE1 no hydrogen 3.190 N/A GLN 47.A N LEU 36.A O no hydrogen 3.049 N/A VAL 51.A N CYS 64.A O no hydrogen 2.786 N/A GLN 53.A NE2 THR 52.A OG1 no hydrogen 2.880 N/A THR 54.A OG1 GLY 61.A O no hydrogen 3.178 N/A THR 54.A OG1 GLU 62.A O no hydrogen 2.916 N/A TYR 55.A N PHE 104.A O no hydrogen 3.112 N/A ASN 58.A ND2 GLN 100.A O no hydrogen 2.764 N/A SER 59.A OG TYR 102.A O no hydrogen 3.062 N/A GLU 62.A N SER 59.A OG no hydrogen 3.350 N/A CYS 64.A N VAL 51.A O no hydrogen 2.652 N/A CYS 64.A SG VAL 51.A O no hydrogen 3.795 N/A VAL 65.A N SER 91.A O no hydrogen 2.980 N/A LEU 66.A N THR 49.A O no hydrogen 3.019 N/A PHE 68.A N PHE 75.A O no hydrogen 3.047 N/A THR 69.A N SER 94.A O no hydrogen 2.926 N/A TYR 70.A N ARG 73.A O no hydrogen 2.961 N/A ASN 71.A N GLU 97.A OE1 no hydrogen 2.751 N/A ARG 73.A N TYR 70.A O no hydrogen 2.998 N/A PHE 75.A N PHE 68.A O no hydrogen 2.822 N/A TYR 76.A OH ASN 32.A OD1 no hydrogen 3.407 N/A TYR 76.A OH PHE 235.A O no hydrogen 2.659 N/A THR 79.A N TRP 89.A O no hydrogen 2.871 N/A GLU 81.A N THR 79.A OG1 no hydrogen 2.891 N/A ARG 83.A N THR 80.A O no hydrogen 2.913 N/A ARG 83.A NE ASP 85.A OD1 no hydrogen 2.839 N/A ARG 83.A NE ASP 85.A OD2 no hydrogen 3.432 N/A ARG 83.A NH2 ASP 85.A OD2 no hydrogen 2.959 N/A HIS 87.A N ASP 85.A OD1 no hydrogen 3.435 N/A TRP 89.A N THR 79.A O no hydrogen 2.771 N/A TRP 89.A NE1 GLU 81.A O no hydrogen 3.005 N/A CYS 90.A N SER 103.A O no hydrogen 3.077 N/A CYS 90.A SG SER 103.A O no hydrogen 3.778 N/A SER 91.A OG THR 93.A O no hydrogen 2.552 N/A SER 91.A OG LYS 101.A O no hydrogen 3.569 N/A THR 92.A N LYS 101.A O no hydrogen 2.937 N/A THR 93.A N SER 91.A OG no hydrogen 3.364 N/A THR 93.A OG1 ASN 95.A O no hydrogen 3.107 N/A THR 93.A OG1 ASP 99.A OD2 no hydrogen 2.847 N/A SER 94.A OG GLU 48.A OE2 no hydrogen 2.680 N/A TYR 96.A N THR 69.A O no hydrogen 3.162 N/A ASP 99.A N ASN 95.A O no hydrogen 3.070 N/A GLN 100.A N TYR 96.A O no hydrogen 2.669 N/A GLN 100.A NE2 TYR 96.A O no hydrogen 2.880 N/A GLN 100.A NE2 GLU 97.A O no hydrogen 3.386 N/A GLN 100.A NE2 GLU 97.A OE2 no hydrogen 3.316 N/A TYR 102.A N ASN 58.A OD1 no hydrogen 2.850 N/A SER 103.A N CYS 90.A O no hydrogen 3.062 N/A SER 103.A OG SER 59.A OG no hydrogen 3.071 N/A SER 103.A OG GLU 62.A O no hydrogen 2.622 N/A PHE 104.A N TYR 55.A O no hydrogen 2.755 N/A CYS 105.A N LEU 88.A O no hydrogen 2.878 N/A THR 106.A N THR 109.A OG1 no hydrogen 2.941 N/A THR 106.A OG1 GLN 53.A O no hydrogen 2.701 N/A HIS 108.A N THR 106.A OG1 no hydrogen 3.274 N/A THR 109.A N THR 106.A O no hydrogen 3.059 N/A THR 109.A OG1 GLN 53.A O no hydrogen 2.896 N/A THR 109.A OG1 THR 106.A O no hydrogen 3.192 N/A VAL 110.A N HIS 108.A O no hydrogen 2.865 N/A THR 114.A N ALA 122.A O no hydrogen 3.054 N/A THR 114.A OG1 ALA 122.A O no hydrogen 2.806 N/A ARG 115.A N PHE 164.A O no hydrogen 2.860 N/A ASN 118.A N PHE 162.A O no hydrogen 3.056 N/A SER 119.A N PHE 162.A O no hydrogen 3.299 N/A SER 119.A OG THR 152.A OG1 no hydrogen 2.504 N/A SER 119.A OG PHE 162.A O no hydrogen 3.084 N/A ALA 122.A N SER 119.A O no hydrogen 3.052 N/A LEU 123.A N GLN 25.A O no hydrogen 2.809 N/A CYS 124.A N VAL 112.A O no hydrogen 2.971 N/A CYS 124.A SG VAL 112.A O no hydrogen 3.708 N/A HIS 125.A N GLY 151.A O no hydrogen 2.944 N/A HIS 125.A ND1 PRO 127.A O no hydrogen 3.190 N/A PHE 128.A N TYR 135.A O no hydrogen 3.110 N/A LEU 129.A N GLN 154.A O no hydrogen 2.770 N/A TYR 130.A N HIS 133.A O no hydrogen 2.793 N/A ASN 131.A N ASP 157.A OD2 no hydrogen 3.008 N/A ASN 132.A N ASP 157.A OD1 no hydrogen 3.040 N/A HIS 133.A N TYR 130.A O no hydrogen 2.960 N/A TYR 135.A N PHE 128.A O no hydrogen 2.908 N/A CYS 138.A N ASP 137.A OD1 no hydrogen 2.857 N/A THR 139.A N TRP 149.A O no hydrogen 2.894 N/A SER 140.A OG ASN 146.A O no hydrogen 2.546 N/A SER 140.A OG ASN 146.A OD1 no hydrogen 3.274 N/A GLU 141.A N THR 139.A OG1 no hydrogen 3.185 N/A ARG 143.A NE ASP 145.A OD2 no hydrogen 2.888 N/A ARG 143.A NH1 ASP 145.A OD1 no hydrogen 2.866 N/A ASN 146.A ND2 ARG 144.A O no hydrogen 3.461 N/A MET 147.A N ASP 145.A OD2 no hydrogen 3.303 N/A LYS 148.A NZ CYS 138.A O no hydrogen 3.507 N/A TRP 149.A N THR 139.A O no hydrogen 3.015 N/A TRP 149.A NE1 GLU 141.A O no hydrogen 2.887 N/A CYS 150.A N GLY 163.A O no hydrogen 3.146 N/A CYS 150.A SG GLY 163.A O no hydrogen 3.895 N/A THR 152.A N LYS 161.A O no hydrogen 2.861 N/A THR 152.A OG1 SER 119.A OG no hydrogen 2.504 N/A THR 153.A OG1 ASP 159.A OD1 no hydrogen 2.780 N/A TYR 156.A N LEU 129.A O no hydrogen 2.921 N/A ASP 157.A N LEU 129.A O no hydrogen 3.184 N/A ASP 159.A N ASN 155.A O no hydrogen 2.898 N/A GLN 160.A N TYR 156.A O no hydrogen 2.796 N/A LYS 161.A NZ GLN 5.A O no hydrogen 2.818 N/A LYS 161.A NZ PRO 7.A O no hydrogen 3.384 N/A LYS 161.A NZ ASP 159.A O no hydrogen 2.807 N/A GLY 163.A N CYS 150.A O no hydrogen 3.208 N/A PHE 164.A N ARG 115.A O no hydrogen 2.787 N/A CYS 165.A N LYS 148.A O no hydrogen 3.118 N/A CYS 174.A N TYR 182.A O no hydrogen 2.808 N/A CYS 174.A SG GLY 208.A O no hydrogen 3.118 N/A CYS 174.A SG GLU 209.A O no hydrogen 3.274 N/A THR 176.A N VAL 180.A O no hydrogen 2.814 N/A THR 176.A OG1 VAL 180.A O no hydrogen 3.128 N/A GLY 179.A N THR 176.A O no hydrogen 2.810 N/A TYR 182.A N CYS 174.A O no hydrogen 2.804 N/A ARG 183.A N ASP 186.A OD2 no hydrogen 3.018 N/A GLY 185.A N CYS 202.A O no hydrogen 2.707 N/A ASP 186.A N ARG 183.A O no hydrogen 2.910 N/A TRP 188.A N CYS 200.A O no hydrogen 3.136 N/A LYS 190.A N MET 198.A O no hydrogen 2.910 N/A LYS 190.A NZ TYR 229.A OH no hydrogen 2.733 N/A ARG 199.A N ILE 213.A O no hydrogen 2.935 N/A CYS 200.A N TRP 188.A O no hydrogen 2.784 N/A THR 201.A N THR 211.A O no hydrogen 2.842 N/A THR 201.A OG1 GLN 187.A OE1 no hydrogen 2.910 N/A CYS 202.A N ASP 186.A O no hydrogen 2.982 N/A CYS 202.A SG TYR 182.A O no hydrogen 3.926 N/A VAL 203.A N GLU 209.A O no hydrogen 2.931 N/A GLY 204.A N GLU 209.A O no hydrogen 2.791 N/A ASN 205.A ND2 GLU 209.A OE2 no hydrogen 2.938 N/A ARG 207.A N GLY 204.A O no hydrogen 3.228 N/A ARG 207.A NH1 THR 74.A O no hydrogen 2.698 N/A GLU 209.A N GLY 204.A O no hydrogen 2.695 N/A TRP 210.A N TYR 229.A O no hydrogen 2.928 N/A THR 211.A N THR 201.A O no hydrogen 2.946 N/A THR 211.A OG1 THR 228.A OG1 no hydrogen 2.695 N/A CYS 212.A N ILE 227.A O no hydrogen 2.778 N/A ILE 213.A N ARG 199.A O no hydrogen 2.807 N/A ALA 214.A N ASP 225.A O no hydrogen 2.927 N/A SER 216.A N ILE 223.A O no hydrogen 2.793 N/A LEU 218.A N GLN 221.A O no hydrogen 3.149 N/A GLN 221.A N ASP 220.A OD1 no hydrogen 2.849 N/A CYS 222.A N CYS 247.A O no hydrogen 2.779 N/A CYS 222.A SG SER 216.A O no hydrogen 3.717 N/A ILE 223.A N SER 216.A O no hydrogen 3.101 N/A VAL 224.A N LEU 245.A O no hydrogen 2.880 N/A ASP 225.A N ALA 214.A O no hydrogen 3.118 N/A ASP 226.A N HIS 243.A O no hydrogen 3.122 N/A ILE 227.A N CYS 212.A O no hydrogen 2.935 N/A THR 228.A N GLU 241.A O no hydrogen 2.743 N/A THR 228.A OG1 THR 211.A OG1 no hydrogen 2.695 N/A TYR 229.A N TRP 210.A O no hydrogen 2.891 N/A TYR 229.A OH GLU 262.A OE2 no hydrogen 3.142 N/A ASN 230.A ND2 VAL 231.A O no hydrogen 3.296 N/A ASN 230.A ND2 LYS 237.A O no hydrogen 2.777 N/A ASP 233.A N HIS 236.A O no hydrogen 2.932 N/A PHE 235.A N ASP 233.A OD2 no hydrogen 2.759 N/A HIS 236.A N ASP 233.A OD2 no hydrogen 2.720 N/A LYS 237.A NZ GLY 72.A O no hydrogen 3.170 N/A ARG 238.A NE ASN 232.A OD1 no hydrogen 2.734 N/A GLU 240.A N CYS 296.A O no hydrogen 3.143 N/A GLU 241.A N THR 228.A O no hydrogen 2.986 N/A GLY 242.A N TRP 294.A O no hydrogen 2.912 N/A HIS 243.A N ASP 226.A O no hydrogen 2.830 N/A HIS 243.A NE2 GLU 241.A OE2 no hydrogen 2.853 N/A MET 244.A N ILE 291.A O no hydrogen 2.740 N/A LEU 245.A N VAL 224.A O no hydrogen 2.706 N/A CYS 247.A N CYS 222.A O no hydrogen 3.066 N/A THR 248.A N LYS 251.A O no hydrogen 2.905 N/A THR 248.A OG1 LYS 251.A O no hydrogen 2.636 N/A CYS 249.A N ASP 220.A O no hydrogen 3.185 N/A LYS 251.A N THR 248.A O no hydrogen 3.416 N/A LYS 251.A NZ ASP 253.A OD2 no hydrogen 3.149 N/A ASP 253.A N ASN 246.A O no hydrogen 2.951 N/A VAL 255.A N GLY 290.A O no hydrogen 2.888 N/A CYS 258.A N TYR 267.A O no hydrogen 2.789 N/A CYS 258.A SG GLY 292.A O no hydrogen 3.536 N/A CYS 258.A SG GLU 293.A O no hydrogen 3.554 N/A ASP 260.A N THR 265.A O no hydrogen 3.005 N/A SER 261.A OG GLU 262.A OE2 no hydrogen 3.347 N/A GLU 262.A N ASP 260.A OD2 no hydrogen 3.224 N/A THR 263.A OG1 THR 265.A OG1 no hydrogen 3.180 N/A GLY 264.A N ASP 260.A O no hydrogen 2.825 N/A THR 265.A N THR 263.A OG1 no hydrogen 3.350 N/A THR 265.A OG1 THR 263.A OG1 no hydrogen 3.180 N/A TYR 267.A N CYS 258.A O no hydrogen 2.740 N/A GLN 268.A N ASP 271.A OD2 no hydrogen 3.005 N/A GLN 268.A NE2 GLN 257.A OE1 no hydrogen 3.043 N/A GLY 270.A N CYS 286.A O no hydrogen 2.977 N/A ASP 271.A N GLN 268.A O no hydrogen 3.132 N/A TRP 273.A N CYS 284.A O no hydrogen 3.244 N/A TRP 273.A NE1 ASP 260.A OD1 no hydrogen 2.782 N/A LYS 275.A N TYR 282.A O no hydrogen 3.095 N/A LYS 275.A NZ GLU 240.A OE2 no hydrogen 2.627 N/A LYS 275.A NZ ASP 260.A OD1 no hydrogen 2.930 N/A LYS 275.A NZ ASP 260.A OD2 no hydrogen 3.018 N/A VAL 277.A N VAL 280.A O no hydrogen 2.991 N/A VAL 280.A N VAL 277.A O no hydrogen 3.179 N/A ARG 281.A NH1 LEU 299.A O no hydrogen 3.271 N/A TYR 282.A N LYS 275.A O no hydrogen 2.729 N/A GLN 283.A N GLN 297.A O no hydrogen 2.842 N/A CYS 284.A N TRP 273.A O no hydrogen 2.877 N/A TYR 285.A N HIS 295.A O no hydrogen 2.844 N/A CYS 286.A N ASP 271.A O no hydrogen 3.014 N/A CYS 286.A SG TYR 267.A O no hydrogen 3.713 N/A TYR 287.A N GLU 293.A O no hydrogen 2.819 N/A GLY 288.A N GLU 293.A O no hydrogen 3.010 N/A ARG 289.A NE GLU 293.A OE1 no hydrogen 3.326 N/A ARG 289.A NH1 GLU 293.A OE2 no hydrogen 3.026 N/A ILE 291.A N GLY 288.A O no hydrogen 3.011 N/A GLY 292.A N VAL 255.A O no hydrogen 3.021 N/A GLU 293.A N GLY 288.A O no hydrogen 2.896 N/A TRP 294.A N GLY 242.A O no hydrogen 3.050 N/A HIS 295.A N TYR 285.A O no hydrogen 3.107 N/A HIS 295.A NE2 GLU 293.A OE2 no hydrogen 2.508 N/A CYS 296.A N GLU 240.A O no hydrogen 3.003 N/A GLN 297.A N GLN 283.A O no hydrogen 2.910 N/A LEU 299.A N ARG 281.A O no hydrogen 2.784 N/A