Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t7r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N PHE 1.A O no hydrogen 3.068 N/A ILE 6.A N VAL 3.A O no hydrogen 3.122 N/A CYS 7.A N VAL 3.A O no hydrogen 3.243 N/A CYS 7.A SG VAL 3.A O no hydrogen 3.795 N/A ASP 8.A N ASN 4.A O no hydrogen 2.665 N/A PHE 9.A N LEU 5.A O no hydrogen 3.216 N/A PHE 10.A N ILE 6.A O no hydrogen 3.374 N/A LEU 11.A N CYS 7.A O no hydrogen 3.238 N/A LEU 11.A N ASP 8.A O no hydrogen 3.257 N/A ASN 12.A N PHE 9.A O no hydrogen 2.850 N/A THR 13.A N PHE 10.A O no hydrogen 3.315 N/A ARG 15.A NH2 GLU 14.A OE2 no hydrogen 2.595 N/A ARG 15.A NH2 HIS 194.A O no hydrogen 3.263 N/A GLY 19.A N CYS 190.A O no hydrogen 3.094 N/A SER 20.A OG GLU 22.A OE1 no hydrogen 3.470 N/A VAL 23.A N SER 20.A OG no hydrogen 3.349 N/A THR 24.A N SER 20.A O no hydrogen 3.010 N/A THR 24.A OG1 SER 20.A O no hydrogen 3.273 N/A THR 24.A OG1 GLU 111.A OE2 no hydrogen 2.586 N/A LEU 25.A N PRO 21.A O no hydrogen 3.085 N/A LYS 26.A N GLU 22.A O no hydrogen 2.988 N/A ALA 27.A N VAL 23.A O no hydrogen 2.935 N/A LEU 28.A N THR 24.A O no hydrogen 3.072 N/A SER 29.A N LEU 25.A O no hydrogen 2.774 N/A SER 29.A N LYS 26.A O no hydrogen 3.170 N/A SER 29.A OG LYS 26.A O no hydrogen 2.481 N/A PHE 30.A N ALA 27.A O no hydrogen 3.324 N/A ILE 31.A N LEU 28.A O no hydrogen 2.891 N/A THR 35.A N SER 38.A OG no hydrogen 3.091 N/A LYS 37.A N THR 35.A OG1 no hydrogen 3.174 N/A SER 38.A N THR 35.A O no hydrogen 2.787 N/A LEU 39.A N ASP 106.A OD2 no hydrogen 3.373 N/A ILE 40.A N LYS 61.A O no hydrogen 2.843 N/A ALA 41.A N LEU 107.A O no hydrogen 2.936 N/A ASP 42.A N THR 63.A O no hydrogen 3.080 N/A LEU 43.A N TRP 109.A O no hydrogen 2.778 N/A GLY 44.A N ILE 65.A O no hydrogen 2.770 N/A CYS 45.A N ILE 65.A O no hydrogen 3.068 N/A CYS 45.A SG GLY 46.A O no hydrogen 3.503 N/A CYS 45.A SG ILE 65.A O no hydrogen 3.438 N/A GLY 46.A N ASP 66.A OD1 no hydrogen 3.070 N/A GLY 48.A N CYS 45.A O no hydrogen 2.984 N/A GLN 50.A NE2 ASP 42.A OD2 no hydrogen 2.835 N/A GLN 50.A NE2 CYS 45.A O no hydrogen 3.045 N/A THR 51.A OG1 ASP 42.A OD2 no hydrogen 2.322 N/A MET 52.A N GLY 48.A O no hydrogen 3.048 N/A LEU 54.A N GLN 50.A O no hydrogen 3.315 N/A ALA 55.A N THR 51.A O no hydrogen 3.076 N/A HIS 57.A N LEU 54.A O no hydrogen 2.634 N/A HIS 57.A ND1 ILE 53.A O no hydrogen 2.981 N/A LYS 61.A N SER 38.A O no hydrogen 3.133 N/A ILE 62.A N ARG 87.A O no hydrogen 2.702 N/A THR 63.A N ILE 40.A O no hydrogen 2.941 N/A GLY 64.A N LYS 89.A O no hydrogen 2.973 N/A ILE 65.A N ASP 42.A O no hydrogen 2.899 N/A ASP 66.A N ILE 91.A O no hydrogen 3.143 N/A PHE 68.A N ASP 66.A OD2 no hydrogen 3.095 N/A PHE 71.A N PHE 68.A O no hydrogen 2.934 N/A ILE 72.A N PHE 68.A O no hydrogen 3.211 N/A GLU 73.A N PRO 69.A O no hydrogen 2.789 N/A ARG 74.A N GLY 70.A O no hydrogen 3.432 N/A ARG 74.A NH1 LEU 11.A O no hydrogen 3.015 N/A PHE 75.A N PHE 71.A O no hydrogen 2.795 N/A ASN 76.A N ILE 72.A O no hydrogen 3.094 N/A ASN 76.A ND2 GLY 90.A O no hydrogen 3.406 N/A LYS 77.A N GLU 73.A O no hydrogen 2.941 N/A ASN 78.A N ARG 74.A O no hydrogen 2.741 N/A ALA 79.A N PHE 75.A O no hydrogen 2.925 N/A GLU 80.A N ASN 76.A O no hydrogen 2.879 N/A GLU 80.A N LYS 77.A O no hydrogen 3.075 N/A LYS 81.A N LYS 77.A O no hydrogen 3.110 N/A LEU 82.A N ASN 78.A O no hydrogen 3.205 N/A ASN 83.A N GLU 80.A O no hydrogen 2.914 N/A LEU 84.A N ALA 79.A O no hydrogen 2.811 N/A ARG 87.A N LEU 84.A O no hydrogen 2.742 N/A ARG 87.A NE GLY 60.A O no hydrogen 3.266 N/A ARG 87.A NH1 ALA 55.A O no hydrogen 3.378 N/A ARG 87.A NH1 VAL 58.A O no hydrogen 2.721 N/A ARG 87.A NH1 GLY 60.A O no hydrogen 3.034 N/A ARG 87.A NH2 ALA 55.A O no hydrogen 2.877 N/A VAL 88.A N LEU 84.A O no hydrogen 2.769 N/A LYS 89.A N ILE 62.A O no hydrogen 3.051 N/A GLY 90.A N ASN 76.A OD1 no hydrogen 2.749 N/A ILE 91.A N GLY 64.A O no hydrogen 2.861 N/A GLY 93.A N ASP 66.A O no hydrogen 3.098 N/A ASP 103.A N ASN 128.A O no hydrogen 2.810 N/A SER 104.A N TYR 129.A O no hydrogen 3.145 N/A SER 104.A OG GLU 101.A O no hydrogen 2.744 N/A LEU 105.A N TYR 129.A O no hydrogen 2.776 N/A ASP 106.A N LEU 39.A O no hydrogen 2.922 N/A ILE 108.A N TYR 135.A O no hydrogen 2.748 N/A TRP 109.A N ALA 41.A O no hydrogen 2.587 N/A TRP 109.A NE1 GLU 111.A OE2 no hydrogen 3.259 N/A SER 110.A N ALA 137.A O no hydrogen 3.049 N/A SER 110.A OG LEU 43.A O no hydrogen 2.749 N/A GLY 112.A N SER 139.A OG no hydrogen 2.840 N/A ASN 116.A N ALA 113.A O no hydrogen 3.127 N/A ASN 116.A ND2 ALA 113.A O no hydrogen 2.876 N/A GLY 118.A N ILE 114.A O no hydrogen 2.781 N/A PHE 119.A N TYR 160.A OH no hydrogen 3.066 N/A GLU 120.A N GLU 162.A OE2 no hydrogen 3.291 N/A ARG 121.A NE GLU 125.A OE2 no hydrogen 2.633 N/A ARG 121.A NH2 GLU 125.A OE2 no hydrogen 3.427 N/A GLY 122.A N GLY 118.A O no hydrogen 2.837 N/A LEU 123.A N PHE 119.A O no hydrogen 3.121 N/A LYS 124.A N GLU 120.A O no hydrogen 2.991 N/A GLU 125.A N ARG 121.A O no hydrogen 2.806 N/A TRP 126.A N GLY 122.A O no hydrogen 2.625 N/A TRP 126.A NE1 MET 95.A O no hydrogen 3.272 N/A ARG 127.A N LEU 123.A O no hydrogen 3.233 N/A ARG 127.A NE GLY 177.A O no hydrogen 3.302 N/A ARG 127.A NH2 GLY 177.A O no hydrogen 3.484 N/A ASN 128.A N GLU 125.A O no hydrogen 3.433 N/A ASN 128.A ND2 LYS 124.A O no hydrogen 3.657 N/A TYR 129.A N TRP 126.A O no hydrogen 3.095 N/A LEU 130.A N ARG 127.A O no hydrogen 3.253 N/A LYS 131.A N LEU 105.A O no hydrogen 2.697 N/A LYS 131.A NZ SER 104.A O no hydrogen 3.471 N/A TYR 135.A N ASP 106.A O no hydrogen 3.110 N/A TYR 135.A OH ASP 32.A OD1 no hydrogen 3.007 N/A LEU 136.A N CYS 244.A O no hydrogen 2.796 N/A ALA 137.A N ILE 108.A O no hydrogen 2.724 N/A VAL 138.A N PHE 242.A O no hydrogen 3.025 N/A SER 139.A N SER 110.A O no hydrogen 3.326 N/A GLU 140.A N ALA 240.A O no hydrogen 2.893 N/A SER 141.A N GLU 140.A OE1 no hydrogen 2.895 N/A SER 141.A OG GLU 140.A OE1 no hydrogen 2.916 N/A VAL 142.A N GLY 238.A O no hydrogen 2.901 N/A TRP 143.A N ASP 164.A O no hydrogen 2.630 N/A PHE 144.A N TYR 236.A O no hydrogen 3.039 N/A THR 145.A OG1 GLN 147.A O no hydrogen 2.807 N/A ARG 148.A NE THR 145.A O no hydrogen 3.471 N/A ARG 148.A NH1 THR 145.A O no hydrogen 3.433 N/A HIS 153.A N PRO 149.A O no hydrogen 3.340 N/A ASP 154.A N ALA 150.A O no hydrogen 2.938 N/A PHE 155.A N GLU 151.A O no hydrogen 3.129 N/A TRP 156.A N ILE 152.A O no hydrogen 3.374 N/A MET 157.A N HIS 153.A O no hydrogen 3.050 N/A SER 158.A N PHE 155.A O no hydrogen 3.186 N/A SER 158.A OG PHE 155.A O no hydrogen 2.680 N/A ALA 159.A N TRP 156.A O no hydrogen 3.089 N/A TYR 160.A OH GLU 140.A OE2 no hydrogen 2.757 N/A ILE 163.A N TYR 160.A O no hydrogen 3.423 N/A THR 165.A N ASP 164.A OD1 no hydrogen 2.690 N/A THR 165.A OG1 ASN 168.A OD1 no hydrogen 2.730 N/A LYS 169.A N THR 165.A O no hydrogen 3.028 N/A LYS 169.A NZ GLU 140.A OE2 no hydrogen 3.343 N/A LYS 169.A NZ GLU 162.A O no hydrogen 2.834 N/A VAL 170.A N VAL 166.A O no hydrogen 2.857 N/A ALA 171.A N PRO 167.A O no hydrogen 2.918 N/A GLN 172.A N ASN 168.A O no hydrogen 3.005 N/A ILE 173.A N LYS 169.A O no hydrogen 3.007 N/A GLN 174.A N VAL 170.A O no hydrogen 3.248 N/A LYS 175.A N ALA 171.A O no hydrogen 2.981 N/A ALA 176.A N GLN 172.A O no hydrogen 2.774 N/A GLY 177.A N GLN 174.A O no hydrogen 2.961 N/A TYR 178.A N ILE 173.A O no hydrogen 3.216 N/A TYR 178.A OH LEU 123.A O no hydrogen 2.597 N/A ILE 179.A N LYS 245.A O no hydrogen 2.811 N/A VAL 181.A N ILE 179.A O no hydrogen 2.686 N/A ALA 182.A N ILE 243.A O no hydrogen 3.094 N/A PHE 184.A N PHE 241.A O no hydrogen 2.958 N/A LEU 186.A N TYR 239.A O no hydrogen 2.539 N/A CYS 190.A N PRO 187.A O no hydrogen 3.278 N/A CYS 190.A SG SER 20.A OG no hydrogen 3.605 N/A TRP 191.A N GLU 188.A O no hydrogen 2.717 N/A ILE 192.A N GLU 188.A O no hydrogen 3.039 N/A HIS 194.A N ASN 189.A O no hydrogen 2.989 N/A HIS 194.A ND1 ASN 189.A O no hydrogen 2.799 N/A TYR 195.A N ILE 192.A O no hydrogen 3.458 N/A PHE 196.A N TRP 191.A O no hydrogen 2.715 N/A ALA 197.A N ILE 192.A O no hydrogen 2.874 N/A GLN 199.A N TYR 195.A O no hydrogen 2.999 N/A ALA 200.A N PHE 196.A O no hydrogen 3.011 N/A LYS 201.A N ALA 197.A O no hydrogen 3.491 N/A GLU 203.A N GLN 199.A O no hydrogen 3.024 N/A PHE 206.A N ALA 202.A O no hydrogen 2.971 N/A ARG 207.A N GLU 203.A O no hydrogen 3.149 N/A ARG 208.A N GLU 204.A O no hydrogen 3.264 N/A LYS 209.A N ILE 205.A O no hydrogen 3.213 N/A HIS 210.A N PHE 206.A O no hydrogen 3.179 N/A ALA 211.A N ARG 208.A O no hydrogen 3.173 N/A SER 213.A N HIS 210.A O no hydrogen 2.954 N/A VAL 216.A N SER 213.A OG no hydrogen 3.376 N/A GLU 217.A N SER 213.A O no hydrogen 3.292 N/A GLU 218.A N ARG 214.A O no hydrogen 2.901 N/A LEU 219.A N ILE 215.A O no hydrogen 3.168 N/A ILE 220.A N VAL 216.A O no hydrogen 3.088 N/A THR 221.A N GLU 217.A O no hydrogen 2.943 N/A THR 221.A OG1 GLU 217.A O no hydrogen 3.117 N/A SER 222.A N GLU 218.A O no hydrogen 2.875 N/A ASN 223.A N LEU 219.A O no hydrogen 2.903 N/A ASN 223.A ND2 GLU 203.A OE2 no hydrogen 3.364 N/A HIS 224.A N ILE 220.A O no hydrogen 3.171 N/A HIS 224.A NE2 GLU 203.A OE1 no hydrogen 2.923 N/A HIS 225.A N THR 221.A O no hydrogen 3.254 N/A GLU 226.A N SER 222.A O no hydrogen 2.805 N/A ALA 227.A N ASN 223.A O no hydrogen 2.888 N/A GLU 228.A N HIS 224.A O no hydrogen 2.911 N/A LEU 229.A N HIS 225.A O no hydrogen 2.880 N/A TYR 230.A N GLU 226.A O no hydrogen 2.996 N/A SER 231.A N ALA 227.A O no hydrogen 3.212 N/A SER 231.A OG ALA 227.A O no hydrogen 3.379 N/A LYS 232.A N GLU 228.A O no hydrogen 3.206 N/A LYS 232.A NZ TYR 233.A OH no hydrogen 2.738 N/A TYR 233.A N LEU 229.A O no hydrogen 2.813 N/A TYR 233.A OH GLU 151.A OE1 no hydrogen 2.863 N/A LYS 234.A NZ GLU 188.A OE2 no hydrogen 3.253 N/A TYR 236.A N TYR 233.A O no hydrogen 2.716 N/A GLY 238.A N VAL 142.A O no hydrogen 2.989 N/A ALA 240.A N GLU 140.A O no hydrogen 2.877 N/A PHE 241.A N PHE 184.A O no hydrogen 2.568 N/A PHE 242.A N VAL 138.A O no hydrogen 2.751 N/A ILE 243.A N ALA 182.A O no hydrogen 2.563 N/A CYS 244.A N LEU 136.A O no hydrogen 2.919 N/A CYS 244.A SG LEU 136.A O no hydrogen 3.767 N/A LYS 245.A N ILE 179.A O no hydrogen 3.041 N/A LYS 245.A NZ GLY 133.A O no hydrogen 3.167 N/A LYS 245.A NZ TYR 135.A OH no hydrogen 3.316 N/A LYS 246.A N GLY 134.A O no hydrogen 2.745 N/A LYS 246.A NZ ASP 103.A OD2 no hydrogen 3.523 N/A LYS 246.A NZ ARG 127.A O no hydrogen 2.887 N/A LYS 246.A NZ LEU 130.A O no hydrogen 2.594 N/A GLY 247.A N GLY 177.A O no hydrogen 2.892 N/A