Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1p7q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N VAL 103.A O no hydrogen 3.141 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 3.177 N/A MET 5.A N CYS 101.A O no hydrogen 3.363 N/A ARG 6.A N TYR 27.A O no hydrogen 2.943 N/A ARG 6.A NE ASP 29.A O no hydrogen 3.501 N/A TYR 7.A N TYR 99.A O no hydrogen 2.485 N/A PHE 8.A N VAL 25.A O no hydrogen 3.011 N/A PHE 9.A N ARG 97.A O no hydrogen 2.902 N/A THR 10.A N ILE 23.A O no hydrogen 2.770 N/A SER 11.A N VAL 95.A O no hydrogen 3.124 N/A SER 11.A OG ARG 21.A O no hydrogen 3.522 N/A VAL 12.A N ARG 21.A O no hydrogen 2.782 N/A SER 13.A N HIS 93.A O no hydrogen 3.064 N/A SER 13.A OG HIS 93.A O no hydrogen 3.503 N/A ARG 14.A NE GLU 19.A O no hydrogen 2.565 N/A ARG 14.A NH1 ASP 39.A OD2 no hydrogen 2.903 N/A ARG 14.A NH2 GLU 19.A O no hydrogen 3.350 N/A ARG 14.A NH2 ASP 39.A OD1 no hydrogen 2.643 N/A ARG 14.A NH2 ASP 39.A OD2 no hydrogen 3.422 N/A ARG 17.A N PRO 15.A O no hydrogen 2.615 N/A GLY 18.A N GLY 16.A O no hydrogen 2.565 N/A ARG 21.A N VAL 12.A O no hydrogen 3.173 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 2.863 N/A ARG 21.A NH2 ASP 37.A OD1 no hydrogen 3.242 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.861 N/A PHE 22.A N SER 38.A OG no hydrogen 2.836 N/A ILE 23.A N THR 10.A O no hydrogen 3.030 N/A ALA 24.A N PHE 36.A O no hydrogen 3.165 N/A VAL 25.A N PHE 8.A O no hydrogen 2.906 N/A GLY 26.A N VAL 34.A O no hydrogen 2.952 N/A TYR 27.A N ARG 6.A O no hydrogen 3.203 N/A VAL 28.A N THR 31.A O no hydrogen 3.061 N/A ASP 29.A N SER 4.A O no hydrogen 2.506 N/A THR 31.A N VAL 28.A O no hydrogen 3.129 N/A THR 31.A OG1 TYR 209.A OH no hydrogen 3.143 N/A PHE 33.A N GLY 26.A O no hydrogen 2.904 N/A ARG 35.A N GLU 46.A O no hydrogen 2.998 N/A ARG 35.A NE GLU 46.A OE2 no hydrogen 3.078 N/A PHE 36.A N ALA 24.A O no hydrogen 2.701 N/A SER 38.A N PHE 22.A O no hydrogen 3.134 N/A SER 38.A OG PHE 22.A O no hydrogen 3.473 N/A ALA 40.A N ASP 37.A O no hydrogen 2.529 N/A SER 42.A OG ARG 44.A O no hydrogen 3.297 N/A SER 42.A OG GLU 46.A OE2 no hydrogen 2.763 N/A MET 45.A N THR 64.A OG1 no hydrogen 3.314 N/A GLU 46.A N ARG 35.A O no hydrogen 2.823 N/A ARG 48.A N PHE 33.A O no hydrogen 2.966 N/A ARG 48.A NE GLN 32.A OE1 no hydrogen 3.415 N/A ILE 52.A N ALA 49.A O no hydrogen 3.098 N/A GLU 53.A N ALA 49.A O no hydrogen 3.090 N/A GLU 53.A N PRO 50.A O no hydrogen 3.049 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.884 N/A TYR 59.A N GLY 56.A O no hydrogen 2.973 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.972 N/A ASP 61.A N PRO 57.A O no hydrogen 2.687 N/A GLY 62.A N GLU 58.A O no hydrogen 3.154 N/A GLU 63.A N TYR 59.A O no hydrogen 2.850 N/A THR 64.A N ASP 61.A O no hydrogen 2.971 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.807 N/A ARG 65.A N ASP 61.A O no hydrogen 3.038 N/A ARG 65.A NE ASP 61.A OD2 no hydrogen 3.346 N/A LYS 66.A N GLY 62.A O no hydrogen 2.861 N/A LYS 66.A NZ GLU 63.A OE1 no hydrogen 3.445 N/A LYS 66.A NZ GLU 63.A OE2 no hydrogen 3.119 N/A VAL 67.A N GLU 63.A O no hydrogen 2.925 N/A LYS 68.A N THR 64.A O no hydrogen 2.742 N/A ALA 69.A N ARG 65.A O no hydrogen 2.894 N/A HIS 70.A N LYS 66.A O no hydrogen 2.802 N/A HIS 70.A ND1 LYS 66.A O no hydrogen 2.699 N/A HIS 70.A NE2 TYR 99.A OH no hydrogen 3.105 N/A SER 71.A N VAL 67.A O no hydrogen 2.441 N/A GLN 72.A N LYS 68.A O no hydrogen 2.814 N/A GLN 72.A N ALA 69.A O no hydrogen 2.832 N/A THR 73.A N ALA 69.A O no hydrogen 2.924 N/A THR 73.A OG1 HIS 70.A O no hydrogen 3.387 N/A THR 73.A OG1 HIS 74.A ND1 no hydrogen 3.386 N/A HIS 74.A N HIS 70.A O no hydrogen 3.196 N/A HIS 74.A ND1 HIS 70.A O no hydrogen 2.655 N/A VAL 76.A N GLN 72.A O no hydrogen 3.301 N/A ASP 77.A N THR 73.A O no hydrogen 3.237 N/A LEU 78.A N HIS 74.A O no hydrogen 2.889 N/A GLY 79.A N VAL 76.A O no hydrogen 2.699 N/A THR 80.A N VAL 76.A O no hydrogen 2.856 N/A THR 80.A OG1 VAL 76.A O no hydrogen 2.900 N/A LEU 81.A N ASP 77.A O no hydrogen 2.431 N/A ARG 82.A N LEU 78.A O no hydrogen 3.344 N/A GLY 83.A N GLY 79.A O no hydrogen 2.783 N/A GLY 83.A N THR 80.A O no hydrogen 3.081 N/A TYR 84.A N THR 80.A O no hydrogen 3.090 N/A TYR 85.A N LEU 81.A O no hydrogen 3.118 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 2.536 N/A ASN 86.A N GLY 83.A O no hydrogen 2.522 N/A GLN 87.A N ARG 82.A O no hydrogen 3.143 N/A GLN 87.A NE2 TYR 118.A OH no hydrogen 2.652 N/A SER 92.A OG SER 13.A O no hydrogen 2.797 N/A HIS 93.A N SER 13.A OG no hydrogen 3.037 N/A HIS 93.A ND1 ASP 119.A OD2 no hydrogen 2.598 N/A THR 94.A N ASP 119.A OD1 no hydrogen 2.806 N/A VAL 95.A N SER 11.A O no hydrogen 3.037 N/A GLN 96.A N ALA 117.A O no hydrogen 2.870 N/A ARG 97.A N PHE 9.A O no hydrogen 3.141 N/A ARG 97.A NE HIS 114.A NE2 no hydrogen 3.485 N/A ARG 97.A NH1 HIS 74.A NE2 no hydrogen 2.865 N/A ARG 97.A NH2 HIS 114.A NE2 no hydrogen 3.409 N/A MET 98.A N GLN 115.A O no hydrogen 2.978 N/A TYR 99.A N TYR 7.A O no hydrogen 2.983 N/A TYR 99.A OH HIS 70.A NE2 no hydrogen 3.105 N/A GLY 100.A N TYR 113.A O no hydrogen 3.090 N/A CYS 101.A N MET 5.A O no hydrogen 3.057 N/A ASP 102.A N ARG 111.A O no hydrogen 2.620 N/A VAL 103.A N HIS 3.A O no hydrogen 2.927 N/A TRP 107.A N GLY 104.A O no hydrogen 2.847 N/A LEU 110.A N ASP 102.A O no hydrogen 3.174 N/A ARG 111.A NE ASP 102.A OD2 no hydrogen 3.319 N/A ARG 111.A NH1 GLU 128.A OE2 no hydrogen 3.143 N/A TYR 113.A N GLY 100.A O no hydrogen 2.904 N/A TYR 113.A OH ASP 102.A OD1 no hydrogen 2.585 N/A GLN 115.A N MET 98.A O no hydrogen 2.901 N/A TYR 116.A N ILE 124.A O no hydrogen 3.037 N/A ALA 117.A N GLN 96.A O no hydrogen 3.341 N/A ASP 119.A N THR 94.A O no hydrogen 2.496 N/A TYR 123.A N TYR 116.A O no hydrogen 2.760 N/A TYR 123.A OH ALA 139.A O no hydrogen 3.253 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 3.114 N/A ILE 124.A N TYR 116.A O no hydrogen 3.178 N/A ALA 125.A N THR 134.A O no hydrogen 3.070 N/A LEU 126.A N HIS 114.A O no hydrogen 2.866 N/A LYS 127.A N SER 132.A O no hydrogen 2.826 N/A LEU 130.A N LYS 127.A O no hydrogen 3.023 N/A ARG 131.A N ASP 129.A OD1 no hydrogen 2.541 N/A SER 132.A N ASP 129.A OD1 no hydrogen 3.002 N/A SER 132.A OG ASP 129.A OD1 no hydrogen 2.877 N/A SER 132.A OG ASP 129.A OD2 no hydrogen 2.640 N/A THR 134.A N ALA 125.A O no hydrogen 2.932 N/A GLN 141.A NE2 MET 138.A O no hydrogen 2.622 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 3.114 N/A LYS 144.A N ALA 140.A O no hydrogen 3.161 N/A LYS 144.A NZ TRP 133.A O no hydrogen 3.273 N/A HIS 145.A N GLN 141.A O no hydrogen 2.393 N/A TRP 147.A N THR 143.A O no hydrogen 2.815 N/A GLU 148.A N LYS 144.A O no hydrogen 2.720 N/A ALA 149.A N HIS 145.A O no hydrogen 2.895 N/A ALA 150.A N LYS 146.A O no hydrogen 3.148 N/A HIS 151.A N TRP 147.A O no hydrogen 3.051 N/A GLN 155.A NE2 HIS 151.A O no hydrogen 3.522 N/A GLN 155.A NE2 VAL 152.A O no hydrogen 3.683 N/A LEU 156.A N VAL 152.A O no hydrogen 2.665 N/A ALA 158.A N GLU 154.A O no hydrogen 3.237 N/A TYR 159.A N LEU 156.A O no hydrogen 3.158 N/A LEU 160.A N LEU 156.A O no hydrogen 3.154 N/A GLU 161.A N ARG 157.A O no hydrogen 3.477 N/A CYS 164.A N TYR 159.A O no hydrogen 2.796 N/A GLU 166.A N GLY 162.A O no hydrogen 3.240 N/A TRP 167.A N THR 163.A O no hydrogen 2.778 N/A LEU 168.A N CYS 164.A O no hydrogen 2.917 N/A ARG 169.A N VAL 165.A O no hydrogen 2.968 N/A ARG 169.A N GLU 166.A O no hydrogen 3.066 N/A ARG 170.A N GLU 166.A O no hydrogen 3.076 N/A ARG 170.A NE GLU 55.A OE2 no hydrogen 2.979 N/A ARG 170.A NH2 GLU 55.A OE1 no hydrogen 3.287 N/A TYR 171.A N TRP 167.A O no hydrogen 2.913 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.972 N/A LEU 172.A N LEU 168.A O no hydrogen 3.005 N/A GLU 173.A N ARG 169.A O no hydrogen 3.013 N/A GLU 173.A N ARG 170.A O no hydrogen 3.227 N/A ASN 174.A N ARG 170.A O no hydrogen 3.027 N/A GLY 175.A N TYR 171.A O no hydrogen 2.773 N/A LYS 176.A N GLU 173.A O no hydrogen 2.805 N/A LEU 179.A N GLY 175.A O no hydrogen 2.647 N/A GLN 180.A N LYS 176.A O no hydrogen 3.104 N/A GLN 180.A NE2 LEU 172.A O no hydrogen 2.755 N/A ASP 183.A N TYR 209.A O no hydrogen 2.928 N/A LYS 186.A N LEU 206.A O no hydrogen 3.110 N/A THR 190.A N ARG 202.A O no hydrogen 3.182 N/A HIS 191.A NE2 GLU 254.A OE2 no hydrogen 2.559 N/A VAL 194.A N GLU 198.A O no hydrogen 3.145 N/A SER 195.A N GLU 198.A O no hydrogen 2.807 N/A ALA 199.A N VAL 249.A O no hydrogen 2.955 N/A LEU 201.A N VAL 247.A O no hydrogen 2.956 N/A ARG 202.A N THR 190.A O no hydrogen 3.028 N/A CYS 203.A N ALA 245.A O no hydrogen 3.013 N/A TRP 204.A N HIS 188.A O no hydrogen 3.258 N/A TRP 204.A NE1 THR 190.A OG1 no hydrogen 2.756 N/A LEU 206.A N LYS 186.A O no hydrogen 2.706 N/A PHE 208.A N PHE 241.A O no hydrogen 2.983 N/A TYR 209.A N ASP 183.A O no hydrogen 3.146 N/A TYR 209.A OH THR 31.A OG1 no hydrogen 3.143 N/A ALA 211.A N ASP 30.A OD2 no hydrogen 3.342 N/A THR 214.A N GLN 262.A O no hydrogen 3.292 N/A THR 216.A N HIS 260.A O no hydrogen 2.885 N/A TRP 217.A NE1 ALA 245.A O no hydrogen 2.770 N/A GLN 218.A N THR 258.A O no hydrogen 2.793 N/A GLN 218.A NE2 ASP 223.A OD2 no hydrogen 3.450 N/A ASP 220.A N ARG 256.A O no hydrogen 2.928 N/A GLY 221.A N GLN 218.A O no hydrogen 3.335 N/A GLN 224.A N TRP 217.A O no hydrogen 2.981 N/A THR 225.A OG1 THR 228.A OG1 no hydrogen 3.044 N/A THR 228.A OG1 THR 225.A OG1 no hydrogen 3.044 N/A ARG 234.A N GLN 242.A O no hydrogen 2.770 N/A ARG 234.A NE GLN 242.A OE1 no hydrogen 3.032 N/A ARG 234.A NH2 GLN 242.A OE1 no hydrogen 3.483 N/A ALA 236.A N THR 240.A O no hydrogen 2.912 N/A THR 240.A N ASP 238.A OD1 no hydrogen 3.217 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.568 N/A THR 240.A OG1 ASP 238.A OD2 no hydrogen 3.470 N/A PHE 241.A N PHE 208.A O no hydrogen 2.571 N/A GLN 242.A N ARG 234.A O no hydrogen 2.765 N/A LYS 243.A N ALA 205.A O no hydrogen 2.973 N/A LYS 243.A NZ VAL 231.A O no hydrogen 2.744 N/A LYS 243.A NZ THR 233.A OG1 no hydrogen 2.788 N/A ALA 245.A N CYS 203.A O no hydrogen 3.088 N/A ALA 246.A N GLU 229.A O no hydrogen 3.267 N/A VAL 247.A N LEU 201.A O no hydrogen 2.885 N/A VAL 249.A N ALA 199.A O no hydrogen 2.965 N/A SER 251.A N HIS 197.A O no hydrogen 2.540 N/A SER 251.A OG ASP 196.A O no hydrogen 3.493 N/A GLY 252.A N GLU 254.A OE1 no hydrogen 2.878 N/A GLN 253.A N PRO 250.A O no hydrogen 2.948 N/A GLN 253.A N GLU 254.A OE1 no hydrogen 2.777 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.403 N/A GLN 255.A NE2 GLY 252.A O no hydrogen 2.849 N/A ARG 256.A N GLN 253.A O no hydrogen 2.976 N/A TYR 257.A N GLU 254.A O no hydrogen 2.764 N/A THR 258.A OG1 GLN 218.A O no hydrogen 3.055 N/A THR 258.A OG1 GLN 218.A OE1 no hydrogen 3.528 N/A CYS 259.A N LEU 272.A O no hydrogen 2.524 N/A CYS 259.A SG THR 216.A O no hydrogen 3.979 N/A HIS 260.A N THR 216.A O no hydrogen 2.614 N/A VAL 261.A N LEU 270.A O no hydrogen 2.978 N/A GLN 262.A N THR 214.A O no hydrogen 3.279 N/A HIS 263.A NE2 PRO 210.A O no hydrogen 2.936 N/A GLY 265.A N HIS 263.A ND1 no hydrogen 2.644 N/A LEU 266.A N HIS 263.A O no hydrogen 2.612 N/A ARG 273.A NE PRO 276.A O no hydrogen 3.017 N/A ARG 273.A NH2 PRO 276.A O no hydrogen 2.613 N/A