Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q31_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH2 THR 155.A O no hydrogen 3.353 N/A ASN 9.A N ASP 7.A OD1 no hydrogen 2.831 N/A SER 12.A N TYR 8.A O no hydrogen 2.910 N/A SER 12.A OG TYR 8.A O no hydrogen 3.328 N/A SER 12.A OG ASN 9.A O no hydrogen 3.507 N/A SER 12.A OG SER 120.A OG no hydrogen 2.807 N/A SER 13.A N ASN 9.A O no hydrogen 2.882 N/A SER 13.A OG ASN 9.A O no hydrogen 3.181 N/A SER 13.A OG PRO 10.A O no hydrogen 3.043 N/A THR 14.A N ILE 11.A O no hydrogen 3.371 N/A THR 14.A OG1 ILE 11.A O no hydrogen 2.762 N/A ILE 15.A N SER 12.A O no hydrogen 2.600 N/A CYS 16.A N GLY 31.A O no hydrogen 3.001 N/A CYS 16.A SG THR 14.A O no hydrogen 3.361 N/A HIS 17.A N GLN 55.A O no hydrogen 3.248 N/A LEU 18.A N LEU 29.A O no hydrogen 2.601 N/A THR 19.A N LEU 53.A O no hydrogen 3.136 N/A ASN 20.A N THR 27.A O no hydrogen 2.615 N/A GLU 21.A N THR 51.A O no hydrogen 2.899 N/A SER 22.A OG ASN 20.A OD1 no hydrogen 2.962 N/A THR 27.A N ASN 20.A O no hydrogen 2.966 N/A LEU 29.A N LEU 18.A O no hydrogen 2.893 N/A TYR 30.A N ALA 148.A O no hydrogen 2.993 N/A GLY 31.A N CYS 16.A O no hydrogen 3.122 N/A ILE 32.A N ILE 39.A O no hydrogen 2.787 N/A GLY 33.A N THR 14.A O no hydrogen 2.838 N/A PHE 34.A N PHE 37.A O no hydrogen 2.725 N/A GLY 35.A N PRO 92.A O no hydrogen 2.880 N/A PHE 37.A N PHE 34.A O no hydrogen 2.880 N/A ILE 38.A N ILE 82.A O no hydrogen 3.026 N/A ILE 39.A N ILE 32.A O no hydrogen 2.591 N/A THR 40.A N ILE 80.A O no hydrogen 3.236 N/A THR 40.A OG1 TYR 30.A O no hydrogen 2.572 N/A ASN 41.A N THR 40.A OG1 no hydrogen 2.432 N/A ASN 41.A ND2 HIS 43.A ND1 no hydrogen 2.951 N/A LYS 42.A N ASP 78.A O no hydrogen 3.181 N/A LYS 42.A NZ ILE 74.A O no hydrogen 2.705 N/A LYS 42.A NZ ARG 77.A O no hydrogen 3.137 N/A HIS 43.A ND1 ASP 78.A OD2 no hydrogen 2.653 N/A HIS 43.A NE2 GLN 227.A OXT no hydrogen 3.008 N/A LEU 44.A N ASN 41.A O no hydrogen 2.564 N/A ARG 46.A NE LEU 201.A O no hydrogen 3.064 N/A ASN 48.A ND2 TRP 199.A O no hydrogen 2.642 N/A ASN 49.A N SER 22.A OG no hydrogen 2.800 N/A ASN 49.A ND2 ASP 23.A OD1 no hydrogen 2.989 N/A ASN 49.A ND2 ASP 23.A OD2 no hydrogen 2.997 N/A GLY 50.A N THR 66.A OG1 no hydrogen 3.123 N/A THR 51.A N GLU 21.A O no hydrogen 3.299 N/A LEU 52.A N VAL 63.A O no hydrogen 2.971 N/A LEU 53.A N THR 19.A O no hydrogen 2.788 N/A VAL 54.A N PHE 61.A O no hydrogen 3.080 N/A GLY 59.A N SER 56.A O no hydrogen 3.043 N/A PHE 61.A N VAL 54.A O no hydrogen 3.079 N/A VAL 63.A N LEU 52.A O no hydrogen 2.665 N/A THR 66.A N GLY 50.A O no hydrogen 2.852 N/A THR 66.A OG1 ASN 48.A OD1 no hydrogen 2.448 N/A THR 67.A OG1 ASN 65.A OD1 no hydrogen 2.618 N/A THR 68.A N ASN 65.A O no hydrogen 3.067 N/A THR 68.A OG1 ASN 65.A O no hydrogen 2.697 N/A LEU 69.A N THR 66.A O no hydrogen 2.656 N/A GLN 71.A N VAL 196.A O no hydrogen 2.675 N/A HIS 72.A N ILE 81.A O no hydrogen 2.894 N/A ARG 77.A N ILE 74.A O no hydrogen 3.261 N/A ARG 77.A NE SER 178.A O no hydrogen 3.154 N/A ILE 80.A N THR 40.A O no hydrogen 3.305 N/A ILE 81.A N HIS 72.A O no hydrogen 2.845 N/A ILE 82.A N ILE 38.A O no hydrogen 3.091 N/A ARG 83.A N GLN 70.A O no hydrogen 2.909 N/A MET 84.A N PRO 36.A O no hydrogen 3.104 N/A PHE 91.A N GLY 35.A O no hydrogen 2.816 N/A ARG 98.A N ILE 160.A O no hydrogen 3.287 N/A ARG 98.A NE ASP 157.A OD1 no hydrogen 3.451 N/A ARG 98.A NE ASP 157.A OD2 no hydrogen 2.716 N/A ARG 98.A NH1 GLU 99.A O no hydrogen 2.613 N/A ARG 98.A NH1 GLU 104.A OE1 no hydrogen 3.270 N/A ARG 98.A NH2 GLU 104.A OE1 no hydrogen 3.271 N/A ARG 98.A NH2 GLU 104.A OE2 no hydrogen 2.705 N/A ARG 98.A NH2 ASP 157.A OD1 no hydrogen 2.999 N/A GLN 101.A N GLU 104.A OE1 no hydrogen 3.165 N/A GLU 103.A N THR 128.A O no hydrogen 3.192 N/A GLU 104.A N GLN 101.A O no hydrogen 3.234 N/A ILE 106.A N SER 126.A O no hydrogen 3.113 N/A CYS 107.A N VAL 153.A O no hydrogen 2.982 N/A CYS 107.A SG TYR 8.A OH no hydrogen 3.382 N/A CYS 107.A SG VAL 153.A O no hydrogen 3.811 N/A LEU 108.A N SER 123.A OG no hydrogen 2.725 N/A VAL 109.A N PRO 151.A O no hydrogen 3.156 N/A THR 110.A N MET 121.A O no hydrogen 2.867 N/A THR 111.A OG1 SER 12.A O no hydrogen 3.093 N/A ASN 112.A N SER 119.A O no hydrogen 2.899 N/A SER 120.A OG ASN 9.A OD1 no hydrogen 2.265 N/A SER 120.A OG SER 12.A OG no hydrogen 2.807 N/A SER 123.A N LEU 108.A O no hydrogen 2.844 N/A SER 123.A OG LEU 108.A O no hydrogen 3.331 N/A SER 123.A OG ASP 124.A O no hydrogen 3.011 N/A THR 125.A N ASP 124.A OD2 no hydrogen 2.916 N/A SER 126.A N ILE 106.A O no hydrogen 2.953 N/A SER 126.A OG CYS 127.A O no hydrogen 2.994 N/A THR 128.A OG1 LYS 138.A O no hydrogen 2.439 N/A SER 131.A OG HIS 211.A NE2 no hydrogen 2.528 N/A SER 132.A OG ASN 221.A OD1 no hydrogen 3.426 N/A TRP 137.A N PHE 176.A O no hydrogen 3.032 N/A TRP 137.A NE1 GLY 134.A O no hydrogen 2.816 N/A LYS 138.A N PHE 129.A O no hydrogen 2.832 N/A HIS 139.A N ASN 174.A O no hydrogen 2.965 N/A TRP 140.A N SER 126.A OG no hydrogen 3.188 N/A TRP 140.A NE1 ASN 173.A OD1 no hydrogen 3.108 N/A THR 143.A OG1 GLN 227.A OE1 no hydrogen 2.625 N/A LYS 144.A N GLN 147.A OE1 no hydrogen 2.807 N/A GLY 146.A N GLN 227.A O no hydrogen 2.774 N/A GLN 147.A N LYS 144.A O no hydrogen 2.868 N/A ALA 148.A N GLN 227.A O no hydrogen 3.044 N/A GLY 149.A N HIS 164.A O no hydrogen 2.701 N/A SER 150.A OG GLN 147.A O no hydrogen 2.629 N/A LEU 152.A N GLY 162.A O no hydrogen 2.982 N/A VAL 153.A N CYS 107.A O no hydrogen 2.915 N/A SER 154.A N PHE 159.A O no hydrogen 2.850 N/A SER 154.A OG GLU 104.A OE2 no hydrogen 3.402 N/A SER 154.A OG ASP 157.A OD1 no hydrogen 2.371 N/A THR 155.A N ARG 105.A O no hydrogen 2.982 N/A ARG 156.A NE GLN 101.A OE1 no hydrogen 3.118 N/A ARG 156.A NH2 GLN 101.A OE1 no hydrogen 2.605 N/A ASP 157.A N SER 154.A OG no hydrogen 3.140 N/A GLY 158.A N SER 154.A O no hydrogen 2.692 N/A ILE 160.A N LYS 96.A O no hydrogen 3.087 N/A VAL 161.A N LEU 152.A O no hydrogen 2.821 N/A ILE 163.A N THR 177.A O no hydrogen 2.818 N/A HIS 164.A N SER 150.A O no hydrogen 2.844 N/A HIS 164.A NE2 GLN 227.A OE1 no hydrogen 2.718 N/A SER 165.A N TYR 175.A O no hydrogen 3.057 N/A SER 165.A OG ILE 163.A O no hydrogen 3.063 N/A SER 165.A OG THR 177.A OG1 no hydrogen 2.753 N/A ALA 166.A N TYR 175.A O no hydrogen 2.934 N/A SER 167.A N TYR 225.A O no hydrogen 2.868 N/A SER 167.A OG ASN 168.A O no hydrogen 3.263 N/A SER 167.A OG ASN 173.A O no hydrogen 3.242 N/A SER 167.A OG ASN 174.A OD1 no hydrogen 2.732 N/A ASN 168.A N ASN 173.A O no hydrogen 3.052 N/A ASN 168.A ND2 THR 172.A OG1 no hydrogen 3.347 N/A THR 170.A OG1 ASN 168.A OD1 no hydrogen 3.319 N/A ASN 171.A N ASN 168.A OD1 no hydrogen 2.623 N/A ASN 171.A ND2 SER 167.A OG no hydrogen 3.099 N/A ASN 171.A ND2 TYR 225.A OH no hydrogen 2.823 N/A THR 172.A N ASN 168.A OD1 no hydrogen 3.411 N/A THR 172.A OG1 THR 170.A OG1 no hydrogen 2.982 N/A ASN 174.A ND2 ILE 141.A O no hydrogen 3.209 N/A TYR 175.A N ALA 166.A O no hydrogen 2.851 N/A TYR 175.A OH GLU 222.A OE1 no hydrogen 2.683 N/A PHE 176.A N TRP 137.A O no hydrogen 2.932 N/A THR 177.A N ILE 163.A O no hydrogen 2.890 N/A THR 177.A N SER 165.A OG no hydrogen 3.148 N/A THR 177.A OG1 SER 165.A OG no hydrogen 2.753 N/A SER 178.A N ILE 135.A O no hydrogen 2.977 N/A SER 178.A OG GLY 134.A O no hydrogen 2.743 N/A SER 178.A OG ILE 135.A O no hydrogen 2.782 N/A VAL 179.A N VAL 161.A O no hydrogen 3.312 N/A PHE 183.A N PRO 180.A O no hydrogen 3.167 N/A LEU 186.A N ASN 182.A O no hydrogen 3.191 N/A LEU 187.A N PHE 183.A O no hydrogen 3.196 N/A LEU 187.A N MET 184.A O no hydrogen 2.817 N/A THR 188.A N GLU 185.A O no hydrogen 3.207 N/A THR 188.A OG1 GLU 185.A O no hydrogen 3.303 N/A ASN 189.A N GLU 185.A O no hydrogen 3.011 N/A GLU 191.A N ASN 189.A O no hydrogen 2.467 N/A ALA 192.A N ASN 189.A O no hydrogen 3.359 N/A GLN 193.A NE2 LEU 186.A O no hydrogen 3.350 N/A GLN 194.A N HIS 72.A ND1 no hydrogen 3.230 N/A TRP 195.A NE1 GLN 193.A OE1 no hydrogen 3.011 N/A VAL 196.A N GLN 71.A O no hydrogen 2.990 N/A SER 197.A OG THR 67.A O no hydrogen 3.224 N/A TRP 199.A N GLN 71.A OE1 no hydrogen 2.347 N/A LEU 201.A N PHE 45.A O no hydrogen 3.001 N/A SER 205.A OG VAL 213.A O no hydrogen 2.991 N/A VAL 206.A N VAL 213.A O no hydrogen 2.843 N/A TRP 208.A N HIS 211.A O no hydrogen 2.996 N/A HIS 211.A N TRP 208.A O no hydrogen 2.644 N/A HIS 211.A ND1 GLU 222.A O no hydrogen 3.276 N/A HIS 211.A NE2 SER 131.A OG no hydrogen 2.528 N/A VAL 213.A N VAL 206.A O no hydrogen 2.856 N/A PHE 214.A N VAL 224.A O no hydrogen 3.124 N/A LYS 217.A NZ ASN 171.A OD1 no hydrogen 3.025 N/A LYS 217.A NZ TYR 225.A OH no hydrogen 3.262 N/A ASN 221.A ND2 SER 132.A OG no hydrogen 3.193 N/A VAL 224.A N LYS 212.A O no hydrogen 3.212 N/A TYR 225.A N SER 167.A O no hydrogen 2.801 N/A TYR 225.A OH ASP 145.A OD1 no hydrogen 2.646 N/A SER 226.A N PHE 214.A O no hydrogen 3.061 N/A SER 226.A OG HIS 43.A ND1 no hydrogen 3.142 N/A GLN 227.A N SER 165.A O no hydrogen 2.986 N/A GLN 227.A NE2 THR 143.A O no hydrogen 2.911 N/A GLN 227.A NE2 ASP 145.A OD1 no hydrogen 3.107 N/A