Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g6h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N ASP 1.A OD2 no hydrogen 2.853 N/A GLU 4.A N ASP 1.A O no hydrogen 3.313 N/A ILE 5.A N VAL 71.A O no hydrogen 2.944 N/A ARG 7.A NH1 GLU 74.A O no hydrogen 3.345 N/A SER 9.A OG PRO 6.A O no hydrogen 2.476 N/A LEU 10.A N ARG 7.A O no hydrogen 2.936 N/A ARG 11.A N THR 28.A O no hydrogen 2.968 N/A ARG 11.A NE THR 28.A OG1 no hydrogen 3.246 N/A GLU 13.A N MET 26.A O no hydrogen 2.978 N/A LEU 16.A N VAL 24.A O no hydrogen 2.840 N/A GLY 19.A N GLY 22.A O no hydrogen 3.134 N/A GLU 23.A N THR 39.A OG1 no hydrogen 2.907 N/A VAL 24.A N GLY 17.A O no hydrogen 3.334 N/A TRP 25.A N ILE 37.A O no hydrogen 2.902 N/A TRP 25.A NE1 GLU 23.A OE1 no hydrogen 2.713 N/A MET 26.A N VAL 14.A O no hydrogen 3.028 N/A GLY 27.A N VAL 35.A O no hydrogen 3.092 N/A THR 28.A N ARG 11.A O no hydrogen 3.167 N/A THR 28.A OG1 GLU 13.A OE2 no hydrogen 3.379 N/A TRP 29.A N THR 33.A O no hydrogen 2.671 N/A ASN 30.A N SER 9.A O no hydrogen 2.626 N/A THR 32.A N TRP 29.A O no hydrogen 3.122 N/A THR 32.A OG1 ASN 30.A O no hydrogen 2.823 N/A THR 33.A N TRP 29.A O no hydrogen 3.114 N/A THR 33.A OG1 TRP 29.A O no hydrogen 2.773 N/A VAL 35.A N GLY 27.A O no hydrogen 2.843 N/A ALA 36.A N ILE 81.A O no hydrogen 2.941 N/A ILE 37.A N TRP 25.A O no hydrogen 2.832 N/A LYS 38.A N ILE 79.A O no hydrogen 2.921 N/A THR 39.A N GLU 23.A O no hydrogen 2.789 N/A THR 39.A OG1 GLU 23.A O no hydrogen 3.451 N/A LEU 40.A N ILE 77.A O no hydrogen 3.395 N/A LYS 41.A N PHE 21.A O no hydrogen 3.188 N/A LYS 41.A NZ GLN 18.A OE1 no hydrogen 2.737 N/A THR 44.A N LYS 41.A O no hydrogen 2.750 N/A THR 44.A OG1 LYS 41.A O no hydrogen 3.371 N/A PHE 50.A N SER 46.A O no hydrogen 2.890 N/A GLN 52.A N ALA 49.A O no hydrogen 3.287 N/A GLU 53.A N PHE 50.A O no hydrogen 3.436 N/A GLN 55.A N LEU 51.A O no hydrogen 2.991 N/A MET 57.A N GLU 53.A O no hydrogen 3.103 N/A LYS 58.A N ALA 54.A O no hydrogen 2.830 N/A LYS 58.A NZ ASP 1.A OD1 no hydrogen 2.797 N/A LYS 59.A N VAL 56.A O no hydrogen 3.211 N/A LYS 59.A NZ GLN 55.A O no hydrogen 2.933 N/A LEU 60.A N MET 57.A O no hydrogen 3.419 N/A ARG 61.A N TYR 119.A OH no hydrogen 2.943 N/A LYS 64.A N HIS 62.A ND1 no hydrogen 3.059 N/A LYS 64.A NZ GLN 112.A OE1 no hydrogen 2.793 N/A LEU 65.A N HIS 62.A O no hydrogen 3.236 N/A VAL 66.A N VAL 145.A O no hydrogen 3.048 N/A GLN 67.A N GLU 82.A OE1 no hydrogen 2.788 N/A TYR 69.A N VAL 80.A O no hydrogen 2.853 N/A ALA 70.A N VAL 80.A O no hydrogen 3.482 N/A VAL 71.A N TRP 3.A O no hydrogen 3.291 N/A SER 73.A N GLU 4.A OE1 no hydrogen 3.048 N/A SER 73.A OG GLU 4.A OE1 no hydrogen 2.411 N/A TYR 78.A N VAL 72.A O no hydrogen 3.323 N/A VAL 80.A N ALA 70.A O no hydrogen 2.990 N/A ILE 81.A N ALA 36.A O no hydrogen 2.800 N/A GLU 82.A N GLN 67.A O no hydrogen 2.990 N/A SER 85.A OG GLU 139.A OE1 no hydrogen 2.667 N/A LYS 86.A N VAL 137.A O no hydrogen 2.873 N/A GLY 87.A N MET 84.A O no hydrogen 3.267 N/A LEU 89.A N ILE 135.A O no hydrogen 2.727 N/A LEU 90.A N ALA 132.A O no hydrogen 3.284 N/A ASP 91.A N SER 88.A OG no hydrogen 3.416 N/A PHE 92.A N SER 88.A O no hydrogen 2.916 N/A LEU 93.A N LEU 89.A O no hydrogen 2.811 N/A LYS 94.A N LEU 90.A O no hydrogen 3.314 N/A GLY 95.A N ASP 91.A O no hydrogen 2.743 N/A LYS 99.A NZ TYR 100.A OH no hydrogen 3.327 N/A TYR 100.A N MET 97.A O no hydrogen 3.281 N/A LEU 101.A N GLY 98.A O no hydrogen 3.143 N/A ARG 102.A N GLN 105.A OE1 no hydrogen 2.750 N/A ARG 102.A NH1 LYS 99.A O no hydrogen 2.907 N/A ARG 102.A NH1 LEU 101.A O no hydrogen 2.727 N/A LEU 103.A N LEU 266.A OXT no hydrogen 3.316 N/A GLN 105.A N ARG 102.A O no hydrogen 2.918 N/A LEU 106.A N ARG 102.A O no hydrogen 2.988 N/A VAL 107.A N LEU 103.A O no hydrogen 2.566 N/A ASP 108.A N PRO 104.A O no hydrogen 3.178 N/A MET 109.A N GLN 105.A O no hydrogen 2.934 N/A ALA 110.A N LEU 106.A O no hydrogen 3.054 N/A ALA 111.A N VAL 107.A O no hydrogen 2.916 N/A GLN 112.A N ASP 108.A O no hydrogen 3.366 N/A GLN 112.A NE2 ASP 108.A O no hydrogen 3.379 N/A GLN 112.A NE2 ASP 108.A OD2 no hydrogen 2.774 N/A GLN 112.A NE2 LEU 141.A O no hydrogen 3.294 N/A ILE 113.A N MET 109.A O no hydrogen 3.235 N/A ALA 114.A N ALA 110.A O no hydrogen 2.782 N/A SER 115.A N ALA 111.A O no hydrogen 2.878 N/A GLY 116.A N GLN 112.A O no hydrogen 2.856 N/A MET 117.A N ILE 113.A O no hydrogen 2.727 N/A ALA 118.A N ALA 114.A O no hydrogen 2.732 N/A VAL 120.A N GLY 116.A O no hydrogen 3.267 N/A GLU 121.A N MET 117.A O no hydrogen 2.746 N/A ARG 122.A N ALA 118.A O no hydrogen 3.005 N/A MET 123.A N TYR 119.A O no hydrogen 2.909 N/A ASN 124.A N GLU 121.A O no hydrogen 3.161 N/A TYR 125.A N VAL 120.A O no hydrogen 3.035 N/A VAL 126.A N ARG 152.A O no hydrogen 2.866 N/A HIS 127.A N ASP 177.A OD2 no hydrogen 2.532 N/A HIS 127.A NE2 ALA 146.A O no hydrogen 2.947 N/A ARG 128.A N ASP 177.A OD1 no hydrogen 2.955 N/A ASP 129.A N HIS 127.A ND1 no hydrogen 3.084 N/A ALA 132.A N GLU 187.A OE2 no hydrogen 2.804 N/A ASN 134.A N ARG 131.A O no hydrogen 2.912 N/A ASN 134.A ND2 ASP 129.A O no hydrogen 2.378 N/A ILE 135.A N ALA 132.A O no hydrogen 3.199 N/A LEU 136.A N LYS 144.A O no hydrogen 2.957 N/A VAL 137.A N GLY 87.A O no hydrogen 2.742 N/A GLY 138.A N VAL 142.A O no hydrogen 2.913 N/A CYS 143.A N GLN 112.A OE1 no hydrogen 2.818 N/A CYS 143.A SG LEU 141.A O no hydrogen 3.684 N/A LYS 144.A N LEU 136.A O no hydrogen 2.919 N/A LYS 144.A NZ GLU 63.A O no hydrogen 3.073 N/A LYS 144.A NZ GLU 82.A OE2 no hydrogen 2.425 N/A VAL 145.A N LYS 64.A O no hydrogen 3.019 N/A ALA 146.A N ASN 134.A O no hydrogen 2.928 N/A ALA 151.A N PHE 148.A O no hydrogen 2.977 N/A ARG 152.A N VAL 126.A O no hydrogen 3.168 N/A ILE 154.A N ASN 124.A O no hydrogen 3.150 N/A LYS 160.A NZ MET 199.A O no hydrogen 2.782 N/A TRP 161.A N PRO 158.A O no hydrogen 3.110 N/A TRP 161.A NE1 GLU 187.A OE2 no hydrogen 2.895 N/A THR 162.A N ILE 159.A O no hydrogen 3.285 N/A THR 162.A OG1 PRO 158.A O no hydrogen 3.270 N/A GLU 165.A N GLU 165.A OE1 no hydrogen 2.761 N/A ALA 166.A N ALA 163.A O no hydrogen 2.981 N/A ALA 167.A N ALA 163.A O no hydrogen 2.913 N/A LEU 168.A N PRO 164.A O no hydrogen 2.834 N/A TYR 169.A N GLU 165.A O no hydrogen 3.103 N/A ARG 171.A N GLU 165.A O no hydrogen 3.213 N/A THR 173.A N SER 176.A OG no hydrogen 2.604 N/A LYS 175.A N THR 173.A OG1 no hydrogen 3.139 N/A LYS 175.A NZ ARG 239.A O no hydrogen 2.710 N/A LYS 175.A NZ PRO 240.A O no hydrogen 3.219 N/A SER 176.A N THR 173.A O no hydrogen 2.797 N/A SER 176.A OG THR 173.A O no hydrogen 2.668 N/A ASP 177.A N THR 173.A O no hydrogen 3.090 N/A VAL 178.A N ILE 174.A O no hydrogen 2.926 N/A SER 180.A N SER 176.A O no hydrogen 3.158 N/A SER 180.A OG TRP 161.A O no hydrogen 2.838 N/A SER 180.A OG SER 176.A O no hydrogen 3.542 N/A PHE 181.A N ASP 177.A O no hydrogen 2.983 N/A GLY 182.A N VAL 178.A O no hydrogen 3.034 N/A ILE 183.A N TRP 179.A O no hydrogen 3.279 N/A LEU 184.A N SER 180.A O no hydrogen 2.664 N/A LEU 185.A N PHE 181.A O no hydrogen 2.774 N/A THR 186.A N GLY 182.A O no hydrogen 3.379 N/A THR 186.A OG1 ILE 183.A O no hydrogen 2.659 N/A GLU 187.A N ILE 183.A O no hydrogen 3.114 N/A LEU 188.A N LEU 184.A O no hydrogen 3.092 N/A THR 189.A N LEU 185.A O no hydrogen 3.104 N/A THR 189.A OG1 LEU 185.A O no hydrogen 3.079 N/A THR 189.A OG1 THR 186.A O no hydrogen 3.265 N/A THR 190.A N THR 186.A O no hydrogen 3.007 N/A THR 190.A OG1 THR 186.A O no hydrogen 2.810 N/A THR 190.A OG1 GLU 187.A O no hydrogen 3.525 N/A LYS 191.A N LEU 188.A O no hydrogen 3.432 N/A LYS 191.A NZ LEU 101.A O no hydrogen 3.106 N/A LYS 191.A NZ ASN 265.A O no hydrogen 3.073 N/A GLY 192.A N GLU 187.A O no hydrogen 2.525 N/A ARG 193.A N THR 190.A OG1 no hydrogen 3.186 N/A MET 199.A N TYR 196.A O no hydrogen 2.987 N/A VAL 200.A N GLU 203.A OE1 no hydrogen 3.254 N/A VAL 204.A N VAL 200.A O no hydrogen 2.804 N/A LEU 205.A N ASN 201.A O no hydrogen 2.942 N/A ASP 206.A N ARG 202.A O no hydrogen 3.043 N/A GLN 207.A N GLU 203.A O no hydrogen 3.043 N/A VAL 208.A N VAL 204.A O no hydrogen 2.949 N/A GLU 209.A N LEU 205.A O no hydrogen 3.171 N/A ARG 210.A N ASP 206.A O no hydrogen 3.316 N/A GLY 211.A N VAL 208.A O no hydrogen 2.922 N/A TYR 212.A N GLN 207.A O no hydrogen 2.961 N/A ARG 213.A NE TRP 232.A O no hydrogen 2.963 N/A ARG 213.A NH1 VAL 208.A O no hydrogen 3.006 N/A ARG 213.A NH1 TYR 212.A O no hydrogen 3.129 N/A ARG 213.A NH2 TRP 232.A O no hydrogen 2.718 N/A CYS 216.A SG PRO 217.A O no hydrogen 3.798 N/A CYS 216.A SG CYS 220.A O no hydrogen 2.817 N/A CYS 220.A N PRO 217.A O no hydrogen 3.034 N/A CYS 220.A SG PRO 221.A O no hydrogen 3.680 N/A SER 223.A OG TYR 252.A OH no hydrogen 2.516 N/A SER 223.A OG GLU 257.A OE2 no hydrogen 2.497 N/A LEU 224.A N PRO 221.A O no hydrogen 2.973 N/A HIS 225.A N PRO 221.A O no hydrogen 3.294 N/A HIS 225.A NE2 MET 214.A O no hydrogen 2.776 N/A ASP 226.A N GLU 222.A O no hydrogen 2.680 N/A LEU 227.A N SER 223.A O no hydrogen 3.399 N/A MET 228.A N LEU 224.A O no hydrogen 3.093 N/A CYS 229.A N HIS 225.A O no hydrogen 2.840 N/A CYS 229.A SG HIS 225.A O no hydrogen 3.518 N/A GLN 230.A N ASP 226.A O no hydrogen 2.931 N/A CYS 231.A N LEU 227.A O no hydrogen 3.150 N/A CYS 231.A SG LEU 227.A O no hydrogen 3.378 N/A TRP 232.A N MET 228.A O no hydrogen 3.142 N/A TRP 232.A N CYS 229.A O no hydrogen 3.050 N/A ARG 233.A N GLN 230.A O no hydrogen 3.227 N/A ARG 233.A NH1 GLU 238.A O no hydrogen 2.588 N/A LYS 234.A NZ GLU 209.A OE1 no hydrogen 2.954 N/A GLU 238.A N ASP 235.A O no hydrogen 2.878 N/A ARG 239.A NE LYS 175.A O no hydrogen 2.984 N/A ARG 239.A NH1 ARG 233.A O no hydrogen 2.607 N/A ARG 239.A NH2 GLU 165.A OE2 no hydrogen 2.606 N/A ARG 239.A NH2 LYS 175.A O no hydrogen 2.802 N/A PHE 242.A N GLU 121.A OE2 no hydrogen 2.940 N/A TYR 244.A N THR 241.A OG1 no hydrogen 3.152 N/A LEU 245.A N THR 241.A O no hydrogen 3.067 N/A GLN 246.A N PHE 242.A O no hydrogen 2.626 N/A GLN 246.A NE2 GLU 250.A OE2 no hydrogen 2.879 N/A ALA 247.A N GLU 243.A O no hydrogen 3.161 N/A PHE 248.A N TYR 244.A O no hydrogen 2.856 N/A LEU 249.A N LEU 245.A O no hydrogen 2.925 N/A LEU 249.A N GLN 246.A O no hydrogen 3.202 N/A GLU 250.A N GLN 246.A O no hydrogen 2.924 N/A ASP 251.A N ALA 247.A O no hydrogen 3.166 N/A TYR 252.A N LEU 249.A O no hydrogen 3.156 N/A TYR 252.A OH SER 223.A OG no hydrogen 2.516 N/A THR 254.A N ASP 251.A O no hydrogen 3.208 N/A SER 255.A N ASP 251.A O no hydrogen 3.051 N/A THR 256.A N TYR 252.A O no hydrogen 3.082 N/A GLU 257.A N TYR 252.A O no hydrogen 2.940 N/A TYR 260.A N GLU 257.A O no hydrogen 3.164 N/A TYR 260.A OH LEU 266.A OXT no hydrogen 2.589 N/A GLY 263.A N LEU 266.A O no hydrogen 2.814 N/A GLU 264.A N GLU 219.A OE1 no hydrogen 3.146 N/A ASN 265.A N GLU 219.A OE1 no hydrogen 3.484 N/A ASN 265.A N GLU 219.A OE2 no hydrogen 3.330 N/A ASN 265.A ND2 GLU 219.A OE2 no hydrogen 3.460 N/A