Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uqg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N VAL 71.A O no hydrogen 3.193 N/A ARG 7.A NH1 PRO 76.A O no hydrogen 3.039 N/A ARG 7.A NH2 GLU 74.A O no hydrogen 2.931 N/A ARG 7.A NH2 PRO 76.A O no hydrogen 3.253 N/A GLU 8.A N GLU 8.A OE2 no hydrogen 3.026 N/A SER 9.A N PRO 6.A O no hydrogen 3.130 N/A SER 9.A OG PRO 6.A O no hydrogen 2.448 N/A LEU 10.A N ARG 7.A O no hydrogen 3.212 N/A ARG 11.A N THR 28.A O no hydrogen 3.009 N/A GLU 13.A N MET 26.A O no hydrogen 2.902 N/A VAL 14.A N MET 26.A O no hydrogen 3.207 N/A LYS 15.A NZ GLN 18.A OE1 no hydrogen 2.849 N/A LEU 16.A N VAL 24.A O no hydrogen 2.795 N/A GLN 18.A NE2 GLY 22.A O no hydrogen 3.061 N/A GLU 23.A N THR 39.A O no hydrogen 3.299 N/A VAL 24.A N GLY 17.A O no hydrogen 3.333 N/A TRP 25.A N ILE 37.A O no hydrogen 2.785 N/A TRP 25.A NE1 GLU 23.A OE1 no hydrogen 2.869 N/A MET 26.A N VAL 14.A O no hydrogen 2.792 N/A GLY 27.A N VAL 35.A O no hydrogen 2.839 N/A THR 28.A N ARG 11.A O no hydrogen 2.979 N/A THR 28.A OG1 GLU 13.A OE2 no hydrogen 2.757 N/A TRP 29.A N THR 33.A O no hydrogen 2.785 N/A ASN 30.A N SER 9.A O no hydrogen 2.821 N/A THR 32.A N TRP 29.A O no hydrogen 3.431 N/A THR 32.A OG1 THR 33.A OG1 no hydrogen 2.984 N/A THR 33.A N TRP 29.A O no hydrogen 3.155 N/A THR 33.A OG1 TRP 29.A O no hydrogen 3.446 N/A THR 33.A OG1 THR 32.A OG1 no hydrogen 2.984 N/A ARG 34.A NH1 GLU 13.A OE1 no hydrogen 3.279 N/A VAL 35.A N GLY 27.A O no hydrogen 2.873 N/A ALA 36.A N THR 81.A O no hydrogen 3.040 N/A ILE 37.A N TRP 25.A O no hydrogen 2.802 N/A LYS 38.A N ILE 79.A O no hydrogen 2.916 N/A LYS 38.A NZ GLU 53.A OE1 no hydrogen 3.440 N/A LYS 38.A NZ ASP 147.A OD1 no hydrogen 3.450 N/A THR 39.A N GLU 23.A O no hydrogen 2.816 N/A THR 44.A OG1 CYS 20.A O no hydrogen 3.328 N/A PHE 50.A N SER 46.A O no hydrogen 3.196 N/A LEU 51.A N PRO 47.A O no hydrogen 3.143 N/A GLN 55.A N LEU 51.A O no hydrogen 2.989 N/A VAL 56.A N GLN 52.A O no hydrogen 3.248 N/A MET 57.A N GLU 53.A O no hydrogen 3.203 N/A LYS 58.A N ALA 54.A O no hydrogen 3.001 N/A LYS 58.A NZ ASP 1.A OD1 no hydrogen 2.270 N/A LYS 58.A NZ GLN 55.A OE1 no hydrogen 2.972 N/A LYS 59.A N VAL 56.A O no hydrogen 3.230 N/A ARG 61.A N TYR 119.A OH no hydrogen 2.830 N/A LYS 64.A N HIS 62.A ND1 no hydrogen 3.191 N/A LYS 64.A NZ GLN 112.A OE1 no hydrogen 2.714 N/A LEU 65.A N HIS 62.A O no hydrogen 3.041 N/A VAL 66.A N VAL 145.A O no hydrogen 3.042 N/A GLN 67.A N GLU 82.A OE1 no hydrogen 2.713 N/A GLN 67.A NE2 LEU 68.A O no hydrogen 2.905 N/A TYR 69.A N VAL 80.A O no hydrogen 2.828 N/A ALA 70.A N VAL 80.A O no hydrogen 3.332 N/A VAL 71.A N TRP 3.A O no hydrogen 3.026 N/A VAL 72.A N TYR 78.A O no hydrogen 2.940 N/A SER 73.A N GLU 4.A OE2 no hydrogen 2.785 N/A SER 73.A OG GLU 4.A OE2 no hydrogen 2.774 N/A TYR 78.A N VAL 72.A O no hydrogen 3.245 N/A ILE 79.A N LYS 38.A O no hydrogen 3.009 N/A VAL 80.A N ALA 70.A O no hydrogen 2.867 N/A THR 81.A N ALA 36.A O no hydrogen 2.903 N/A THR 81.A OG1 GLU 82.A O no hydrogen 3.464 N/A GLU 82.A N GLN 67.A O no hydrogen 2.978 N/A SER 85.A OG GLU 139.A OE1 no hydrogen 2.652 N/A LYS 86.A N VAL 137.A O no hydrogen 2.884 N/A GLY 87.A N MET 84.A O no hydrogen 3.517 N/A LEU 89.A N ILE 135.A O no hydrogen 2.734 N/A LEU 90.A N ALA 132.A O no hydrogen 3.399 N/A ASP 91.A N SER 88.A OG no hydrogen 3.114 N/A PHE 92.A N SER 88.A O no hydrogen 3.059 N/A LEU 93.A N LEU 89.A O no hydrogen 2.853 N/A LYS 94.A N LEU 90.A O no hydrogen 3.079 N/A GLY 95.A N ASP 91.A O no hydrogen 2.990 N/A GLY 98.A N GLY 95.A O no hydrogen 2.919 N/A TYR 100.A N MET 97.A O no hydrogen 3.086 N/A LEU 101.A N GLY 98.A O no hydrogen 3.276 N/A ARG 102.A N GLN 105.A OE1 no hydrogen 2.912 N/A ARG 102.A NH1 LYS 99.A O no hydrogen 2.679 N/A ARG 102.A NH1 LEU 101.A O no hydrogen 3.414 N/A LEU 103.A N LEU 263.A OXT no hydrogen 3.143 N/A GLN 105.A N ARG 102.A O no hydrogen 3.233 N/A LEU 106.A N ARG 102.A O no hydrogen 3.149 N/A VAL 107.A N LEU 103.A O no hydrogen 2.855 N/A ASP 108.A N PRO 104.A O no hydrogen 3.307 N/A MET 109.A N GLN 105.A O no hydrogen 3.029 N/A ALA 110.A N LEU 106.A O no hydrogen 3.012 N/A ALA 111.A N VAL 107.A O no hydrogen 2.844 N/A GLN 112.A N ASP 108.A O no hydrogen 2.937 N/A GLN 112.A NE2 ASP 108.A O no hydrogen 3.637 N/A GLN 112.A NE2 ASP 108.A OD2 no hydrogen 2.704 N/A GLN 112.A NE2 LEU 141.A O no hydrogen 3.226 N/A ILE 113.A N MET 109.A O no hydrogen 3.123 N/A ALA 114.A N ALA 110.A O no hydrogen 2.871 N/A SER 115.A N ALA 111.A O no hydrogen 2.951 N/A GLY 116.A N GLN 112.A O no hydrogen 3.153 N/A MET 117.A N ILE 113.A O no hydrogen 3.020 N/A ALA 118.A N ALA 114.A O no hydrogen 2.852 N/A TYR 119.A N SER 115.A O no hydrogen 3.145 N/A VAL 120.A N GLY 116.A O no hydrogen 3.153 N/A GLU 121.A N MET 117.A O no hydrogen 2.809 N/A ARG 122.A N ALA 118.A O no hydrogen 2.871 N/A MET 123.A N TYR 119.A O no hydrogen 3.029 N/A ASN 124.A N GLU 121.A O no hydrogen 3.091 N/A TYR 125.A N VAL 120.A O no hydrogen 2.987 N/A VAL 126.A N ARG 152.A O no hydrogen 3.028 N/A HIS 127.A N ASP 174.A OD2 no hydrogen 2.654 N/A HIS 127.A NE2 ALA 146.A O no hydrogen 2.993 N/A ARG 128.A N ASP 174.A OD1 no hydrogen 2.790 N/A ARG 128.A NH1 LEU 150.A O no hydrogen 2.979 N/A ASP 129.A N HIS 127.A ND1 no hydrogen 3.067 N/A ALA 132.A N GLU 184.A OE2 no hydrogen 2.994 N/A ASN 134.A N ARG 131.A O no hydrogen 2.913 N/A ASN 134.A ND2 ASP 129.A O no hydrogen 2.718 N/A ILE 135.A N ALA 132.A O no hydrogen 3.264 N/A LEU 136.A N LYS 144.A O no hydrogen 2.955 N/A VAL 137.A N GLY 87.A O no hydrogen 2.979 N/A GLY 138.A N VAL 142.A O no hydrogen 2.797 N/A VAL 142.A N GLU 139.A O no hydrogen 3.273 N/A CYS 143.A N GLN 112.A OE1 no hydrogen 2.841 N/A CYS 143.A SG LEU 141.A O no hydrogen 3.634 N/A LYS 144.A N LEU 136.A O no hydrogen 2.894 N/A LYS 144.A NZ GLU 63.A O no hydrogen 3.069 N/A LYS 144.A NZ GLU 82.A OE1 no hydrogen 3.342 N/A LYS 144.A NZ GLU 82.A OE2 no hydrogen 2.710 N/A VAL 145.A N LYS 64.A O no hydrogen 2.885 N/A ALA 146.A N ASN 134.A O no hydrogen 2.988 N/A ALA 151.A N PHE 148.A O no hydrogen 3.300 N/A LYS 157.A NZ PRO 192.A O no hydrogen 3.104 N/A LYS 157.A NZ TYR 193.A O no hydrogen 3.568 N/A LYS 157.A NZ MET 196.A O no hydrogen 3.062 N/A TRP 158.A N PRO 155.A O no hydrogen 3.152 N/A TRP 158.A NE1 GLU 184.A OE2 no hydrogen 2.957 N/A THR 159.A N ILE 156.A O no hydrogen 3.395 N/A THR 159.A OG1 PRO 155.A O no hydrogen 2.619 N/A GLU 162.A N GLU 162.A OE1 no hydrogen 2.889 N/A ALA 163.A N ALA 160.A O no hydrogen 3.011 N/A ALA 164.A N ALA 160.A O no hydrogen 2.959 N/A LEU 165.A N PRO 161.A O no hydrogen 2.764 N/A TYR 166.A N GLU 162.A O no hydrogen 3.115 N/A GLY 167.A N ALA 163.A O no hydrogen 2.988 N/A ARG 168.A N GLU 162.A O no hydrogen 3.232 N/A PHE 169.A N GLY 167.A O no hydrogen 3.046 N/A THR 170.A N SER 173.A OG no hydrogen 2.726 N/A LYS 172.A N THR 170.A OG1 no hydrogen 3.151 N/A LYS 172.A NZ ARG 236.A O no hydrogen 2.584 N/A SER 173.A N THR 170.A OG1 no hydrogen 3.302 N/A SER 173.A OG THR 170.A O no hydrogen 2.696 N/A ASP 174.A N THR 170.A O no hydrogen 3.218 N/A VAL 175.A N ILE 171.A O no hydrogen 3.025 N/A TRP 176.A N LYS 172.A O no hydrogen 3.216 N/A SER 177.A N SER 173.A O no hydrogen 3.141 N/A SER 177.A OG TRP 158.A O no hydrogen 2.580 N/A SER 177.A OG SER 173.A O no hydrogen 3.249 N/A PHE 178.A N ASP 174.A O no hydrogen 2.945 N/A GLY 179.A N VAL 175.A O no hydrogen 3.075 N/A ILE 180.A N TRP 176.A O no hydrogen 3.191 N/A LEU 181.A N SER 177.A O no hydrogen 2.825 N/A LEU 182.A N PHE 178.A O no hydrogen 2.930 N/A THR 183.A N ILE 180.A O no hydrogen 2.950 N/A THR 183.A OG1 ILE 180.A O no hydrogen 2.623 N/A GLU 184.A N ILE 180.A O no hydrogen 3.213 N/A LEU 185.A N LEU 181.A O no hydrogen 3.078 N/A THR 186.A N LEU 182.A O no hydrogen 3.112 N/A THR 186.A OG1 LEU 182.A O no hydrogen 2.821 N/A THR 186.A OG1 THR 183.A O no hydrogen 3.253 N/A THR 187.A N THR 183.A O no hydrogen 2.866 N/A THR 187.A OG1 THR 183.A O no hydrogen 2.864 N/A LYS 188.A N LEU 185.A O no hydrogen 3.454 N/A LYS 188.A NZ GLY 98.A O no hydrogen 2.998 N/A LYS 188.A NZ LEU 101.A O no hydrogen 3.262 N/A LYS 188.A NZ ASN 262.A O no hydrogen 3.239 N/A GLY 189.A N GLU 184.A O no hydrogen 2.565 N/A ARG 190.A N THR 187.A OG1 no hydrogen 3.223 N/A MET 196.A N TYR 193.A O no hydrogen 3.063 N/A VAL 201.A N VAL 197.A O no hydrogen 3.172 N/A VAL 201.A N ASN 198.A O no hydrogen 3.015 N/A LEU 202.A N ASN 198.A O no hydrogen 3.277 N/A GLN 204.A N GLU 200.A O no hydrogen 3.216 N/A VAL 205.A N VAL 201.A O no hydrogen 3.029 N/A GLU 206.A N LEU 202.A O no hydrogen 3.083 N/A ARG 207.A N ASP 203.A O no hydrogen 3.112 N/A GLY 208.A N VAL 205.A O no hydrogen 3.228 N/A TYR 209.A N GLN 204.A O no hydrogen 2.996 N/A ARG 210.A NE TRP 229.A O no hydrogen 2.879 N/A ARG 210.A NH1 VAL 205.A O no hydrogen 2.968 N/A ARG 210.A NH1 TYR 209.A O no hydrogen 2.853 N/A ARG 210.A NH2 TRP 229.A O no hydrogen 2.732 N/A CYS 213.A SG PRO 214.A O no hydrogen 3.849 N/A CYS 213.A SG CYS 217.A O no hydrogen 3.055 N/A CYS 213.A SG GLU 219.A OE1 no hydrogen 3.560 N/A CYS 217.A N PRO 214.A O no hydrogen 2.966 N/A CYS 217.A SG PRO 218.A O no hydrogen 3.382 N/A SER 220.A OG GLU 254.A OE1 no hydrogen 2.687 N/A LEU 221.A N PRO 218.A O no hydrogen 3.032 N/A HIS 222.A N PRO 218.A O no hydrogen 3.245 N/A HIS 222.A ND1 GLU 219.A OE2 no hydrogen 2.975 N/A HIS 222.A NE2 MET 211.A O no hydrogen 2.829 N/A ASP 223.A N GLU 219.A O no hydrogen 2.803 N/A LEU 224.A N SER 220.A O no hydrogen 3.342 N/A MET 225.A N LEU 221.A O no hydrogen 3.152 N/A CYS 226.A N HIS 222.A O no hydrogen 2.942 N/A CYS 226.A SG HIS 222.A O no hydrogen 3.600 N/A GLN 227.A N ASP 223.A O no hydrogen 3.029 N/A GLN 227.A NE2 ASP 223.A O no hydrogen 3.425 N/A GLN 227.A NE2 ASP 223.A OD1 no hydrogen 2.850 N/A CYS 228.A N LEU 224.A O no hydrogen 3.139 N/A CYS 228.A SG LEU 224.A O no hydrogen 3.305 N/A TRP 229.A N MET 225.A O no hydrogen 3.040 N/A TRP 229.A N CYS 226.A O no hydrogen 3.241 N/A ARG 230.A N GLN 227.A O no hydrogen 3.445 N/A ARG 230.A NH1 GLU 235.A O no hydrogen 2.998 N/A GLU 234.A N ASP 232.A OD1 no hydrogen 3.223 N/A GLU 235.A N ASP 232.A O no hydrogen 3.012 N/A ARG 236.A N PRO 233.A O no hydrogen 3.193 N/A ARG 236.A NE LYS 172.A O no hydrogen 3.428 N/A ARG 236.A NH1 GLU 162.A OE1 no hydrogen 3.503 N/A ARG 236.A NH1 ARG 230.A O no hydrogen 2.699 N/A ARG 236.A NH2 GLU 162.A OE1 no hydrogen 3.429 N/A ARG 236.A NH2 GLU 162.A OE2 no hydrogen 2.583 N/A ARG 236.A NH2 LYS 172.A O no hydrogen 3.163 N/A PHE 239.A N GLU 121.A OE2 no hydrogen 2.789 N/A GLU 240.A N GLU 121.A OE1 no hydrogen 3.222 N/A TYR 241.A N THR 238.A OG1 no hydrogen 2.947 N/A LEU 242.A N THR 238.A O no hydrogen 2.973 N/A GLN 243.A N PHE 239.A O no hydrogen 2.796 N/A GLN 243.A NE2 GLU 247.A OE2 no hydrogen 3.140 N/A ALA 244.A N GLU 240.A O no hydrogen 3.347 N/A PHE 245.A N TYR 241.A O no hydrogen 3.089 N/A LEU 246.A N LEU 242.A O no hydrogen 2.991 N/A GLU 247.A N GLN 243.A O no hydrogen 2.845 N/A ASP 248.A N ALA 244.A O no hydrogen 2.985 N/A TYR 249.A N LEU 246.A O no hydrogen 3.229 N/A TYR 249.A OH SER 220.A OG no hydrogen 2.677 N/A THR 251.A N ASP 248.A O no hydrogen 3.034 N/A SER 252.A N ASP 248.A O no hydrogen 3.018 N/A SER 252.A OG ASP 248.A O no hydrogen 3.557 N/A THR 253.A N TYR 249.A O no hydrogen 3.025 N/A GLU 254.A N TYR 249.A O no hydrogen 2.950 N/A TYR 257.A N GLU 254.A O no hydrogen 3.404 N/A TYR 257.A OH LEU 263.A OXT no hydrogen 2.711 N/A GLY 260.A N LEU 263.A O no hydrogen 2.863 N/A ASN 262.A N GLU 216.A OE2 no hydrogen 2.835 N/A ASN 262.A ND2 GLU 216.A OE1 no hydrogen 3.179 N/A LEU 263.A N GLU 216.A OE2 no hydrogen 3.002 N/A