Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1iqn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ARG 132.A O no hydrogen 2.908 N/A ILE 1.A N ASP 184.A OD1 no hydrogen 2.557 N/A VAL 2.A N ASP 179.A O no hydrogen 2.749 N/A GLY 4.A N GLU 178.A OE2 no hydrogen 2.811 N/A CYS 7.A N LEU 143.A O no hydrogen 2.992 N/A LYS 8.A N GLU 11.A OE1 no hydrogen 2.621 N/A LYS 8.A NZ GLU 6.A OE1 no hydrogen 2.983 N/A GLU 11.A N LYS 8.A O no hydrogen 2.784 N/A GLN 15.A N CYS 12.A O no hydrogen 3.335 N/A ALA 16.A N GLY 29.A O no hydrogen 2.980 N/A LEU 17.A N ARG 53.A O no hydrogen 2.776 N/A LEU 18.A N CYS 27.A O no hydrogen 2.939 N/A ILE 19.A N LYS 51.A O no hydrogen 2.714 N/A ASN 20.A N GLU 24.A O no hydrogen 3.104 N/A ASN 20.A ND2 GLU 24.A OE2 no hydrogen 2.852 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.430 N/A ASN 23.A N ASN 20.A O no hydrogen 2.803 N/A GLU 24.A N ASN 20.A OD1 no hydrogen 2.824 N/A PHE 26.A N LEU 18.A O no hydrogen 3.015 N/A CYS 27.A SG PHE 26.A O no hydrogen 3.226 N/A CYS 27.A SG SER 185.A O no hydrogen 3.627 N/A GLY 28.A N SER 185.A O no hydrogen 2.616 N/A THR 30.A N LEU 38.A O no hydrogen 2.871 N/A ILE 31.A N TRP 14.A O no hydrogen 2.854 N/A LEU 32.A N TYR 36.A O no hydrogen 2.849 N/A PHE 35.A N SER 33.A OG no hydrogen 3.397 N/A TYR 36.A N SER 33.A OG no hydrogen 3.205 N/A TYR 36.A OH MET 232.A O no hydrogen 2.468 N/A TYR 36.A OH THR 234.A OG1 no hydrogen 3.092 N/A ILE 37.A N LEU 92.A O no hydrogen 2.947 N/A LEU 38.A N THR 30.A O no hydrogen 2.862 N/A THR 39.A N ALA 90.A O no hydrogen 2.879 N/A THR 39.A OG1 GLY 28.A O no hydrogen 2.973 N/A HIS 42.A N ASP 88.A OD1 no hydrogen 2.906 N/A HIS 42.A ND1 ASP 88.A OD1 no hydrogen 3.127 N/A HIS 42.A ND1 ASP 88.A OD2 no hydrogen 2.683 N/A CYS 43.A N ALA 40.A O no hydrogen 3.079 N/A LEU 44.A N ALA 41.A O no hydrogen 2.892 N/A GLN 46.A N CYS 43.A O no hydrogen 3.462 N/A LYS 51.A N ILE 19.A O no hydrogen 2.895 N/A VAL 52.A N HIS 69.A O no hydrogen 3.032 N/A ARG 53.A N LEU 17.A O no hydrogen 2.602 N/A VAL 54.A N ALA 67.A O no hydrogen 3.071 N/A ARG 57.A N GLU 63.A OE1 no hydrogen 2.701 N/A ARG 57.A NH1 CYS 7.A O no hydrogen 3.032 N/A ASN 58.A N ASP 56.A OD1 no hydrogen 3.071 N/A THR 59.A N THR 141.A O no hydrogen 2.790 N/A THR 59.A OG1 THR 141.A O no hydrogen 3.217 N/A GLU 60.A N ASN 58.A O no hydrogen 2.744 N/A GLN 61.A N ASN 58.A O no hydrogen 3.320 N/A GLU 63.A N GLU 66.A OE1 no hydrogen 2.378 N/A GLU 66.A N GLU 66.A OE2 no hydrogen 2.312 N/A ALA 67.A N VAL 54.A O no hydrogen 3.140 N/A HIS 69.A N VAL 52.A O no hydrogen 2.858 N/A HIS 69.A ND1 THR 96.A O no hydrogen 2.813 N/A GLU 72.A N ARG 93.A O no hydrogen 2.937 N/A VAL 73.A N ARG 93.A O no hydrogen 3.397 N/A ILE 75.A N VAL 91.A O no hydrogen 2.708 N/A LYS 76.A NZ HIS 77.A O no hydrogen 2.994 N/A ARG 79.A N HIS 77.A ND1 no hydrogen 3.219 N/A PHE 80.A N HIS 77.A O no hydrogen 3.062 N/A THR 81.A OG1 THR 84.A OG1 no hydrogen 2.789 N/A LYS 82.A NZ TYR 45.A OH no hydrogen 2.749 N/A THR 84.A N THR 81.A O no hydrogen 3.456 N/A THR 84.A OG1 THR 81.A O no hydrogen 3.553 N/A THR 84.A OG1 THR 81.A OG1 no hydrogen 2.789 N/A TYR 85.A N THR 81.A O no hydrogen 2.768 N/A ASP 86.A N THR 84.A OG1 no hydrogen 3.202 N/A ILE 89.A N PHE 87.A O no hydrogen 2.782 N/A ALA 90.A N THR 39.A O no hydrogen 2.846 N/A VAL 91.A N ILE 75.A O no hydrogen 2.906 N/A LEU 92.A N ILE 37.A O no hydrogen 2.761 N/A ARG 93.A N VAL 73.A O no hydrogen 2.865 N/A ARG 93.A NH1 TYR 36.A OH no hydrogen 3.177 N/A LEU 94.A N PHE 35.A O no hydrogen 2.708 N/A LYS 95.A N GLU 70.A O no hydrogen 3.049 N/A THR 96.A OG1 HIS 69.A ND1 no hydrogen 3.120 N/A ILE 98.A N GLU 34.A O no hydrogen 2.561 N/A ARG 101.A N VAL 104.A O no hydrogen 2.958 N/A ARG 101.A NH1 THR 99.A O no hydrogen 3.395 N/A ASN 103.A ND2 ASP 9.A OD2 no hydrogen 3.149 N/A VAL 104.A N ARG 101.A O no hydrogen 2.812 N/A ALA 105.A N PRO 13.A O no hydrogen 2.894 N/A ALA 107.A N ILE 31.A O no hydrogen 2.982 N/A CYS 108.A N TYR 197.A O no hydrogen 3.238 N/A ARG 112.A NE ASP 113.A OD2 no hydrogen 3.217 N/A ARG 112.A NH2 ASP 113.A OD2 no hydrogen 3.377 N/A ALA 115.A N GLU 111A.A O no hydrogen 2.893 N/A GLU 116.A N ARG 112.A O no hydrogen 2.916 N/A SER 117.A N ASP 113.A O no hydrogen 2.904 N/A THR 118.A N TRP 114.A O no hydrogen 2.577 N/A THR 121.A OG1 SER 117.A O no hydrogen 2.542 N/A THR 121.A OG1 THR 118.A O no hydrogen 3.258 N/A GLN 122.A N LEU 119A.A O no hydrogen 3.398 N/A GLN 122.A NE2 THR 118.A O no hydrogen 2.753 N/A THR 124.A OG1 GLU 147.A OE2 no hydrogen 2.918 N/A GLY 125.A N VAL 148.A O no hydrogen 3.023 N/A ILE 126.A N VAL 190.A O no hydrogen 2.663 N/A VAL 127.A N LEU 146.A O no hydrogen 3.083 N/A GLY 129.A N LYS 144.A O no hydrogen 2.974 N/A GLY 131.A N ASP 184.A OD2 no hydrogen 2.620 N/A ARG 132.A N GLN 182.A O no hydrogen 2.921 N/A ARG 132.A NH1 GLU 135.A O no hydrogen 2.752 N/A THR 133.A OG1 HIS 134.A ND1 no hydrogen 3.044 N/A HIS 134.A ND1 THR 133.A OG1 no hydrogen 3.044 N/A GLN 139.A NE2 PHE 130.A O no hydrogen 2.866 N/A SER 140.A N GLY 131.A O no hydrogen 3.062 N/A SER 140.A OG ARG 142.A O no hydrogen 2.691 N/A ARG 142.A N SER 140.A OG no hydrogen 3.145 N/A LEU 143.A N ARG 57.A O no hydrogen 3.083 N/A LYS 144.A N GLY 129.A O no hydrogen 3.046 N/A LYS 144.A NZ ILE 1.A O no hydrogen 2.964 N/A LYS 144.A NZ GLY 3.A O no hydrogen 2.900 N/A MET 145.A N GLN 5.A O no hydrogen 2.921 N/A LEU 146.A N VAL 127.A O no hydrogen 2.886 N/A VAL 148.A N GLY 125.A O no hydrogen 2.921 N/A TYR 150.A N LYS 123.A O no hydrogen 3.128 N/A TYR 150.A OH THR 191.A OG1 no hydrogen 2.874 N/A VAL 151.A N CYS 170.A O no hydrogen 3.125 N/A ARG 153.A NH1 MET 168.A O no hydrogen 3.207 N/A ARG 153.A NH2 THR 165.A O no hydrogen 2.954 N/A SER 155.A N ASP 152.A OD2 no hydrogen 3.062 N/A SER 155.A OG ASP 152.A OD2 no hydrogen 3.271 N/A CYS 156.A N ASP 152.A O no hydrogen 3.276 N/A LYS 157.A NZ ILE 164.A O no hydrogen 3.534 N/A LEU 158.A N ASN 154.A O no hydrogen 2.915 N/A SER 159.A N SER 155.A O no hydrogen 2.708 N/A SER 159.A OG SER 155.A O no hydrogen 3.031 N/A SER 159.A OG CYS 156.A O no hydrogen 2.983 N/A SER 160.A N LYS 157.A O no hydrogen 2.855 N/A SER 160.A OG PHE 162.A O no hydrogen 2.417 N/A SER 161.A N GLU 207.A OE2 no hydrogen 2.982 N/A SER 161.A OG GLU 207.A OE1 no hydrogen 2.584 N/A SER 161.A OG GLU 207.A OE2 no hydrogen 3.321 N/A PHE 162.A N SER 160.A OG no hydrogen 3.001 N/A THR 165.A OG1 ASP 86.A OD1 no hydrogen 2.936 N/A ASN 167.A N THR 165.A OG1 no hydrogen 3.150 N/A ASN 167.A ND2 ASP 86.A OD1 no hydrogen 3.252 N/A MET 168.A N THR 165.A O no hydrogen 3.011 N/A PHE 169.A N TYR 218.A O no hydrogen 3.047 N/A ALA 171.A N GLY 216.A O no hydrogen 3.147 N/A GLY 172.A N PRO 149.A O no hydrogen 2.768 N/A TYR 173.A OH GLU 147.A O no hydrogen 3.277 N/A GLN 177.A NE2 ALA 210.A O no hydrogen 3.127 N/A GLN 177.A NE2 THR 175B.A O no hydrogen 3.185 N/A GLU 178.A N LYS 176.A O no hydrogen 2.826 N/A ASP 179.A N VAL 2.A O no hydrogen 3.330 N/A CYS 181.A N ASP 184.A OD1 no hydrogen 2.983 N/A CYS 181.A SG HIS 134.A O no hydrogen 3.354 N/A ASP 184.A N CYS 181.A O no hydrogen 3.047 N/A SER 185.A OG HIS 42.A NE2 no hydrogen 3.330 N/A SER 185.A OG SER 204.A O no hydrogen 3.561 N/A GLY 186.A N VAL 203.A O no hydrogen 2.641 N/A GLY 187.A N ASP 184.A O no hydrogen 3.035 N/A HIS 189.A ND1 THR 200.A OG1 no hydrogen 2.787 N/A VAL 190.A N ILE 126.A O no hydrogen 2.707 N/A THR 191.A N PHE 198.A O no hydrogen 2.908 N/A THR 191.A OG1 TYR 150.A OH no hydrogen 2.874 N/A THR 191.A OG1 THR 200.A OG1 no hydrogen 2.904 N/A PHE 193.A N THR 196.A O no hydrogen 2.870 N/A THR 196.A N PHE 193.A O no hydrogen 3.046 N/A PHE 198.A N THR 191.A O no hydrogen 2.993 N/A VAL 199.A N CYS 108.A O no hydrogen 2.821 N/A THR 200.A N HIS 189.A O no hydrogen 2.909 N/A THR 200.A OG1 HIS 189.A ND1 no hydrogen 2.787 N/A THR 200.A OG1 HIS 189.A O no hydrogen 3.293 N/A THR 200.A OG1 THR 191.A OG1 no hydrogen 2.904 N/A GLY 201.A N HIS 189.A O no hydrogen 3.124 N/A ILE 202.A N THR 219.A O no hydrogen 3.188 N/A VAL 203.A N GLY 187.A O no hydrogen 3.092 N/A SER 204.A N ILE 217.A O no hydrogen 3.283 N/A SER 204.A OG ASP 88.A OD2 no hydrogen 2.572 N/A TRP 205.A N ILE 217.A O no hydrogen 2.993 N/A CYS 209.A N GLU 135.A OE1 no hydrogen 3.160 N/A CYS 209.A SG ALA 180.A O no hydrogen 3.983 N/A ALA 210.A N ASP 179.A OD2 no hydrogen 3.066 N/A ARG 211.A NE GLU 135.A OE1 no hydrogen 3.463 N/A ARG 211.A NH2 GLU 135.A OE2 no hydrogen 3.269 N/A LYS 214.A N ARG 211.A O no hydrogen 2.948 N/A LYS 214.A NZ SER 159.A O no hydrogen 2.742 N/A LYS 214.A NZ SER 161.A OG no hydrogen 3.318 N/A LYS 214.A NZ GLU 207.A OE1 no hydrogen 3.113 N/A LYS 214.A NZ GLU 207.A OE2 no hydrogen 2.779 N/A GLY 216.A N ALA 171.A O no hydrogen 3.143 N/A ILE 217.A N TRP 205.A O no hydrogen 2.767 N/A TYR 218.A N PHE 169.A O no hydrogen 3.035 N/A THR 219.A N ILE 202.A O no hydrogen 2.825 N/A THR 219.A OG1 ASP 88.A O no hydrogen 2.685 N/A LYS 220.A N ASN 167.A O no hydrogen 2.948 N/A VAL 221.A N THR 200.A O no hydrogen 3.296 N/A ALA 223.A N LYS 220.A O no hydrogen 3.074 N/A PHE 224.A N VAL 221.A O no hydrogen 2.983 N/A ILE 228.A N PHE 224.A O no hydrogen 2.654 N/A ASP 229.A N LEU 225.A O no hydrogen 2.875 N/A ARG 230.A N LYS 226.A O no hydrogen 3.041 N/A SER 231.A N TRP 227.A O no hydrogen 2.976 N/A SER 231.A OG TRP 227.A O no hydrogen 3.322 N/A MET 232.A N ILE 228.A O no hydrogen 3.024 N/A LYS 233.A N ASP 229.A O no hydrogen 3.322 N/A LYS 233.A NZ ASP 229.A O no hydrogen 2.650 N/A THR 234.A N SER 231.A O no hydrogen 2.635 N/A THR 234.A OG1 TYR 36.A OH no hydrogen 3.092 N/A GLY 213A.A N ASP 174A.A O no hydrogen 2.876 N/A MET 120B.A N ALA 115.A O no hydrogen 3.022 N/A