Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qcj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 248.A O no hydrogen 2.754 N/A VAL 6.A N SER 246.A O no hydrogen 2.875 N/A GLN 8.A N PRO 5.A O no hydrogen 2.988 N/A PHE 9.A N PRO 5.A O no hydrogen 3.222 N/A HIS 12.A N GLN 8.A O no hydrogen 2.887 N/A ILE 13.A N PHE 9.A O no hydrogen 2.922 N/A GLY 14.A N VAL 10.A O no hydrogen 3.347 N/A GLU 15.A N LYS 11.A O no hydrogen 3.119 N/A LEU 16.A N HIS 12.A O no hydrogen 2.848 N/A TYR 17.A N ILE 13.A O no hydrogen 2.958 N/A TYR 17.A OH ASP 276.A OD1 no hydrogen 2.658 N/A SER 18.A N GLU 15.A O no hydrogen 3.315 N/A SER 18.A OG GLU 15.A O no hydrogen 2.793 N/A GLN 21.A N TYR 17.A O no hydrogen 2.827 N/A GLN 21.A NE2 TYR 17.A O no hydrogen 2.771 N/A HIS 22.A N ASN 19.A O no hydrogen 3.231 N/A PHE 24.A N LEU 16.A O no hydrogen 3.227 N/A SER 25.A N GLN 21.A O no hydrogen 3.006 N/A SER 25.A OG GLN 21.A O no hydrogen 3.521 N/A SER 25.A OG GLU 268.A OE1 no hydrogen 3.335 N/A SER 25.A OG GLU 268.A OE2 no hydrogen 2.760 N/A GLU 26.A N HIS 22.A O no hydrogen 2.994 N/A ASP 27.A N GLY 23.A O no hydrogen 3.029 N/A PHE 28.A N PHE 24.A O no hydrogen 2.977 N/A GLU 29.A N SER 25.A O no hydrogen 2.915 N/A GLU 30.A N GLU 26.A O no hydrogen 2.904 N/A VAL 31.A N ASP 27.A O no hydrogen 2.893 N/A GLN 32.A N PHE 28.A O no hydrogen 2.870 N/A ARG 33.A N GLU 29.A O no hydrogen 2.984 N/A CYS 34.A N VAL 31.A O no hydrogen 2.946 N/A CYS 34.A SG VAL 31.A O no hydrogen 2.926 N/A CYS 34.A SG LYS 255.A O no hydrogen 4.005 N/A ALA 36.A N ARG 33.A O no hydrogen 2.733 N/A MET 38.A N THR 35.A O no hydrogen 2.764 N/A THR 41.A OG1 ASP 63.A OD2 no hydrogen 2.698 N/A GLU 43.A N ASP 63.A OD1 no hydrogen 3.146 N/A GLU 43.A N ASP 63.A OD2 no hydrogen 2.814 N/A HIS 44.A N ASP 63.A OD1 no hydrogen 3.370 N/A SER 45.A OG ALA 61.A O no hydrogen 3.444 N/A SER 45.A OG TYR 80.A OH no hydrogen 2.644 N/A ASN 46.A N GLU 43.A O no hydrogen 3.166 N/A HIS 47.A N HIS 44.A O no hydrogen 3.117 N/A GLU 49.A N HIS 47.A ND1 no hydrogen 3.014 N/A ASN 50.A N HIS 47.A O no hydrogen 2.746 N/A ASN 50.A ND2 HIS 44.A O no hydrogen 3.007 N/A LYS 51.A NZ ASN 46.A O no hydrogen 3.369 N/A LYS 53.A N ASN 50.A O no hydrogen 2.872 N/A LYS 53.A NZ ASN 50.A OD1 no hydrogen 2.893 N/A ASN 54.A N LYS 51.A O no hydrogen 3.000 N/A ASN 54.A ND2 SER 45.A O no hydrogen 2.895 N/A ARG 55.A N GLN 99.A OE1 no hydrogen 2.868 N/A ARG 55.A NE GLY 100.A O no hydrogen 2.915 N/A ARG 55.A NH2 GLY 100.A O no hydrogen 3.111 N/A ARG 55.A NH2 PRO 101.A O no hydrogen 2.714 N/A TYR 56.A OH SER 223.A OG no hydrogen 2.645 N/A ILE 59.A N TYR 56.A O no hydrogen 3.199 N/A LEU 60.A N ASN 262.A OD1 no hydrogen 3.042 N/A ALA 61.A N SER 45.A OG no hydrogen 2.910 N/A ASP 63.A N THR 41.A O no hydrogen 2.810 N/A HIS 64.A NE2 THR 259.A O no hydrogen 2.828 N/A SER 65.A OG GLN 260.A O no hydrogen 2.624 N/A ARG 66.A N ASP 63.A O no hydrogen 3.227 N/A ARG 66.A NH2 ASP 79.A OD2 no hydrogen 2.879 N/A VAL 67.A N ALA 83.A O no hydrogen 2.916 N/A LEU 69.A N ASP 79.A O no hydrogen 2.806 N/A ARG 70.A N GLU 115.A OE1 no hydrogen 2.961 N/A LEU 72.A N SER 78.A OG no hydrogen 2.811 N/A SER 78.A N SER 75.A O no hydrogen 3.243 N/A SER 78.A OG SER 75.A O no hydrogen 2.801 N/A TYR 80.A N HIS 77.A O no hydrogen 3.269 N/A TYR 80.A OH SER 45.A OG no hydrogen 2.644 N/A TYR 80.A OH ASN 54.A OD1 no hydrogen 2.596 N/A ASN 82.A ND2 ASN 54.A OD1 no hydrogen 3.131 N/A ASN 82.A ND2 ILE 59.A O no hydrogen 2.774 N/A ASN 84.A N ALA 97.A O no hydrogen 2.938 N/A ASN 84.A ND2 TYR 62.A O no hydrogen 2.984 N/A ASN 84.A ND2 SER 65.A OG no hydrogen 2.702 N/A TYR 85.A N SER 65.A O no hydrogen 2.958 N/A TYR 85.A OH GLN 116.A OE1 no hydrogen 2.794 N/A VAL 86.A N TYR 95.A O no hydrogen 2.835 N/A ASP 87.A N GLN 260.A OE1 no hydrogen 2.805 N/A GLY 88.A N LYS 91.A O no hydrogen 3.061 N/A TYR 89.A OH ASP 244.A OD2 no hydrogen 2.499 N/A LYS 93.A N ASP 87.A OD1 no hydrogen 3.060 N/A TYR 95.A N VAL 86.A O no hydrogen 3.059 N/A TYR 95.A OH ASP 236.A OD2 no hydrogen 2.542 N/A ILE 96.A N VAL 218.A O no hydrogen 2.863 N/A ALA 97.A N ASN 84.A O no hydrogen 2.868 N/A THR 98.A N VAL 220.A O no hydrogen 3.041 N/A THR 98.A OG1 ASN 82.A O no hydrogen 2.551 N/A GLN 99.A NE2 LYS 53.A O no hydrogen 2.817 N/A GLY 100.A N SER 223.A O no hydrogen 2.815 N/A LEU 102.A N THR 105.A OG1 no hydrogen 3.037 N/A LYS 103.A N ASP 136.A OD2 no hydrogen 3.104 N/A THR 105.A N LEU 102.A O no hydrogen 2.916 N/A THR 105.A OG1 LEU 102.A O no hydrogen 3.268 N/A PHE 106.A N LYS 103.A O no hydrogen 3.406 N/A PHE 109.A N THR 105.A O no hydrogen 2.894 N/A TRP 110.A N PHE 106.A O no hydrogen 3.056 N/A TRP 110.A NE1 TYR 138.A O no hydrogen 2.814 N/A ARG 111.A N GLU 107.A O no hydrogen 2.765 N/A ARG 111.A NH1 ARG 70.A O no hydrogen 2.551 N/A ARG 111.A NH1 GLU 115.A OE2 no hydrogen 2.734 N/A ARG 111.A NH2 ARG 70.A O no hydrogen 3.316 N/A ARG 111.A NH2 SER 78.A O no hydrogen 3.042 N/A MET 112.A N ASP 108.A O no hydrogen 2.777 N/A ILE 113.A N PHE 109.A O no hydrogen 3.189 N/A TRP 114.A N TRP 110.A O no hydrogen 2.981 N/A GLU 115.A N ARG 111.A O no hydrogen 2.793 N/A GLN 116.A N MET 112.A O no hydrogen 2.814 N/A ASN 117.A N TRP 114.A O no hydrogen 2.945 N/A THR 118.A N ILE 113.A O no hydrogen 3.103 N/A THR 118.A OG1 PRO 217.A O no hydrogen 3.103 N/A ILE 121.A N ILE 181.A O no hydrogen 2.816 N/A VAL 122.A N LEU 219.A O no hydrogen 2.654 N/A MET 123.A N TYR 183.A O no hydrogen 2.688 N/A ILE 124.A N HIS 221.A O no hydrogen 2.831 N/A THR 125.A OG1 ASN 126.A O no hydrogen 2.868 N/A THR 125.A OG1 GLU 129.A OE1 no hydrogen 3.018 N/A ASN 126.A N GLU 129.A OE1 no hydrogen 2.828 N/A ASN 126.A ND2 THR 186.A O no hydrogen 2.975 N/A GLU 129.A N ARG 132.A O no hydrogen 2.870 N/A LYS 130.A NZ GLY 192.A O no hydrogen 2.922 N/A ARG 132.A N GLU 129.A O no hydrogen 2.778 N/A ARG 133.A NH2 LEU 127.A O no hydrogen 3.468 N/A ARG 133.A NH2 CYS 135.A O no hydrogen 2.852 N/A LYS 134.A N LEU 127.A O no hydrogen 2.820 N/A CYS 135.A N LEU 127.A O no hydrogen 3.101 N/A CYS 135.A SG ASP 136.A O no hydrogen 3.451 N/A TYR 138.A OH HIS 221.A NE2 no hydrogen 2.833 N/A THR 141.A OG1 GLN 137.A OE1 no hydrogen 3.047 N/A SER 144.A OG THR 153.A OG1 no hydrogen 2.536 N/A GLU 145.A N VAL 152.A O no hydrogen 2.904 N/A GLU 146.A N GLU 145.A OE1 no hydrogen 3.077 N/A TYR 147.A N ILE 150.A O no hydrogen 2.735 N/A ILE 150.A N TYR 147.A O no hydrogen 2.894 N/A ILE 151.A N ARG 171.A O no hydrogen 2.778 N/A VAL 152.A N GLU 145.A O no hydrogen 2.765 N/A THR 153.A N SER 169.A O no hydrogen 2.841 N/A THR 153.A OG1 SER 144.A OG no hydrogen 2.536 N/A LEU 154.A N ASN 143.A O no hydrogen 2.957 N/A LYS 155.A N ARG 167.A O no hydrogen 2.735 N/A SER 156.A N ARG 167.A O no hydrogen 3.348 N/A LYS 158.A N VAL 165.A O no hydrogen 2.874 N/A HIS 160.A N TYR 163.A O no hydrogen 2.786 N/A THR 164.A N HIS 184.A O no hydrogen 2.689 N/A VAL 165.A N LYS 158.A O no hydrogen 2.887 N/A ARG 166.A N GLN 182.A O no hydrogen 2.961 N/A ARG 166.A NH1 GLN 182.A OE1 no hydrogen 2.663 N/A ARG 167.A N SER 156.A O no hydrogen 2.888 N/A PHE 168.A N VAL 180.A O no hydrogen 2.808 N/A SER 169.A N THR 153.A O no hydrogen 2.800 N/A ILE 170.A N ARG 178.A O no hydrogen 2.889 N/A ARG 171.A N ILE 151.A O no hydrogen 2.910 N/A ASN 172.A N ASN 176.A O no hydrogen 3.259 N/A THR 173.A N ASN 149.A O no hydrogen 2.793 N/A THR 173.A OG1 ASN 149.A O no hydrogen 3.398 N/A ARG 178.A N ILE 170.A O no hydrogen 2.988 N/A ARG 178.A NH1 TRP 114.A O no hydrogen 2.656 N/A VAL 180.A N PHE 168.A O no hydrogen 3.019 N/A ILE 181.A N GLY 119.A O no hydrogen 3.064 N/A GLN 182.A N ARG 166.A O no hydrogen 2.832 N/A GLN 182.A NE2 TYR 138.A OH no hydrogen 2.994 N/A TYR 183.A N ILE 121.A O no hydrogen 2.677 N/A HIS 184.A N THR 164.A O no hydrogen 2.832 N/A TYR 185.A N MET 123.A O no hydrogen 2.881 N/A THR 186.A N CYS 162.A O no hydrogen 2.977 N/A TRP 188.A NE1 TYR 185.A O no hydrogen 2.893 N/A LEU 201.A N ALA 197.A O no hydrogen 2.910 N/A THR 202.A N LEU 198.A O no hydrogen 3.094 N/A THR 202.A OG1 LEU 198.A O no hydrogen 3.311 N/A PHE 203.A N PRO 199.A O no hydrogen 3.042 N/A VAL 204.A N VAL 200.A O no hydrogen 2.768 N/A ARG 205.A N LEU 201.A O no hydrogen 2.896 N/A ARG 206.A N THR 202.A O no hydrogen 3.051 N/A ARG 206.A NH2 TYR 163.A OH no hydrogen 2.879 N/A SER 207.A N PHE 203.A O no hydrogen 3.038 N/A SER 207.A OG PHE 203.A O no hydrogen 2.732 N/A SER 207.A OG VAL 204.A O no hydrogen 3.118 N/A SER 207.A OG TYR 232.A OH no hydrogen 2.596 N/A SER 208.A N VAL 204.A O no hydrogen 2.842 N/A SER 208.A OG.A ASP 236.A OD1 no hydrogen 2.785 N/A SER 208.A OG.B ASP 236.A OD1 no hydrogen 3.028 N/A ALA 209.A N ARG 205.A O no hydrogen 2.906 N/A ALA 210.A N ARG 206.A O no hydrogen 3.252 N/A ALA 210.A N SER 207.A O no hydrogen 3.341 N/A ARG 211.A N SER 208.A O no hydrogen 3.112 N/A ARG 211.A NH1 ALA 94.A O no hydrogen 3.075 N/A ARG 211.A NH2 ALA 94.A O no hydrogen 3.123 N/A THR 215.A OG1 MET 212.A O no hydrogen 2.635 N/A THR 215.A OG1 GLY 216.A O no hydrogen 3.397 N/A GLY 216.A N ASN 117.A O no hydrogen 2.861 N/A VAL 218.A N ALA 94.A O no hydrogen 3.157 N/A LEU 219.A N ILE 120.A O no hydrogen 3.043 N/A VAL 220.A N ILE 96.A O no hydrogen 2.867 N/A HIS 221.A N VAL 122.A O no hydrogen 2.952 N/A HIS 221.A ND1 CYS 222.A O no hydrogen 2.957 N/A HIS 221.A NE2 TYR 138.A OH no hydrogen 2.833 N/A CYS 222.A SG THR 229.A OG1 no hydrogen 3.157 N/A SER 223.A OG TYR 56.A OH no hydrogen 2.645 N/A SER 223.A OG LYS 134.A O no hydrogen 2.925 N/A ARG 228.A NH1 ILE 124.A O no hydrogen 3.407 N/A ARG 228.A NH1 GLU 129.A OE1 no hydrogen 2.849 N/A ARG 228.A NH1 GLU 129.A OE2 no hydrogen 3.192 N/A ARG 228.A NH2 GLU 129.A OE2 no hydrogen 2.993 N/A GLY 230.A N VAL 226.A O no hydrogen 2.947 N/A THR 231.A N GLY 227.A O no hydrogen 3.059 N/A THR 231.A OG1 GLY 227.A O no hydrogen 2.921 N/A TYR 232.A N ARG 228.A O no hydrogen 3.012 N/A TYR 232.A OH SER 207.A OG no hydrogen 2.596 N/A ILE 233.A N THR 229.A O no hydrogen 3.076 N/A VAL 234.A N GLY 230.A O no hydrogen 2.927 N/A ILE 235.A N THR 231.A O no hydrogen 3.042 N/A ASP 236.A N TYR 232.A O no hydrogen 2.846 N/A SER 237.A N ILE 233.A O no hydrogen 2.937 N/A SER 237.A OG ILE 233.A O no hydrogen 2.865 N/A MET 238.A N VAL 234.A O no hydrogen 2.891 N/A LEU 239.A N ILE 235.A O no hydrogen 3.067 N/A GLN 240.A N ASP 236.A O no hydrogen 3.108 N/A GLN 241.A N SER 237.A O no hydrogen 2.896 N/A ILE 242.A N MET 238.A O no hydrogen 2.836 N/A LYS 243.A N LEU 239.A O no hydrogen 2.940 N/A ASP 244.A N GLN 240.A O no hydrogen 2.935 N/A LYS 245.A N GLN 241.A O no hydrogen 2.759 N/A LYS 245.A NZ TYR 89.A OH no hydrogen 3.144 N/A LYS 245.A NZ ASP 244.A OD2 no hydrogen 3.292 N/A SER 246.A N ILE 242.A O no hydrogen 2.690 N/A SER 246.A OG ILE 242.A O no hydrogen 3.537 N/A THR 247.A OG1 GLN 241.A OE1 no hydrogen 3.065 N/A VAL 248.A N ILE 4.A O no hydrogen 2.798 N/A GLY 252.A N ASN 249.A OD1 no hydrogen 3.190 N/A PHE 253.A N ASN 249.A O no hydrogen 3.024 N/A LEU 254.A N VAL 250.A O no hydrogen 3.015 N/A LYS 255.A N LEU 251.A O no hydrogen 3.145 N/A LYS 255.A NZ GLU 30.A OE1 no hydrogen 2.578 N/A HIS 256.A N GLY 252.A O no hydrogen 3.201 N/A HIS 256.A NE2 ASP 87.A OD2 no hydrogen 2.584 N/A ILE 257.A N PHE 253.A O no hydrogen 3.051 N/A ARG 258.A N LEU 254.A O no hydrogen 3.043 N/A ARG 258.A NE LEU 264.A O no hydrogen 2.800 N/A ARG 258.A NH2 LEU 264.A O no hydrogen 3.499 N/A ARG 258.A NH2 VAL 265.A O no hydrogen 2.946 N/A THR 259.A N HIS 256.A O no hydrogen 2.989 N/A THR 259.A OG1 HIS 256.A O no hydrogen 2.708 N/A GLN 260.A N ILE 257.A O no hydrogen 2.841 N/A GLN 260.A NE2 ASP 87.A OD2 no hydrogen 2.768 N/A ARG 261.A N ILE 257.A O no hydrogen 3.230 N/A ARG 261.A NE GLY 225.A O no hydrogen 2.970 N/A ARG 261.A NH1 ASN 82.A OD1 no hydrogen 2.800 N/A ARG 261.A NH1 ASN 84.A OD1 no hydrogen 2.859 N/A ARG 261.A NH2 ASN 82.A OD1 no hydrogen 2.896 N/A ARG 261.A NH2 ALA 224.A O no hydrogen 3.018 N/A ASN 262.A ND2 LEU 60.A O no hydrogen 3.161 N/A ASN 262.A ND2 ASN 262.A O no hydrogen 2.570 N/A VAL 265.A N VAL 226.A O no hydrogen 2.881 N/A GLN 266.A N GLN 270.A OE1 no hydrogen 2.697 N/A THR 267.A N GLN 270.A OE1 no hydrogen 3.196 N/A THR 267.A OG1 GLU 269.A OE1 no hydrogen 3.510 N/A GLN 270.A N THR 267.A OG1 no hydrogen 3.119 N/A TYR 271.A N THR 267.A O no hydrogen 2.989 N/A TYR 271.A OH ASP 27.A OD2 no hydrogen 3.018 N/A ILE 272.A N GLU 268.A O no hydrogen 2.810 N/A PHE 273.A N GLU 269.A O no hydrogen 2.883 N/A ILE 274.A N GLN 270.A O no hydrogen 2.993 N/A HIS 275.A ND1 TYR 271.A O no hydrogen 2.816 N/A ASP 276.A N ILE 272.A O no hydrogen 3.118 N/A ALA 277.A N PHE 273.A O no hydrogen 2.928 N/A LEU 278.A N ILE 274.A O no hydrogen 3.122 N/A LEU 279.A N HIS 275.A O no hydrogen 2.711 N/A GLU 280.A N ASP 276.A O no hydrogen 2.868 N/A ALA 281.A N ALA 277.A O no hydrogen 3.063 N/A ILE 282.A N LEU 278.A O no hydrogen 2.933 N/A LEU 283.A N LEU 279.A O no hydrogen 2.875 N/A GLY 284.A N GLU 280.A O no hydrogen 2.983 N/A