Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xm2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N GLU 2.A OE1 no hydrogen 3.171 N/A GLU 2.A N GLU 2.A OE1 no hydrogen 2.855 N/A SER 5.A N GLU 9.A OE1 no hydrogen 3.356 N/A GLU 9.A N THR 6.A OG1 no hydrogen 3.314 N/A ALA 10.A N THR 6.A O no hydrogen 3.170 N/A PHE 11.A N PHE 7.A O no hydrogen 2.660 N/A ASN 12.A N GLU 8.A O no hydrogen 3.069 N/A LYS 13.A N GLU 9.A O no hydrogen 2.936 N/A LEU 14.A N ALA 10.A O no hydrogen 2.892 N/A LEU 15.A N PHE 11.A O no hydrogen 3.021 N/A LYS 16.A N ASN 12.A O no hydrogen 2.844 N/A GLU 17.A N LYS 13.A O no hydrogen 2.998 N/A VAL 18.A N LYS 13.A O no hydrogen 3.133 N/A LEU 19.A N LEU 14.A O no hydrogen 2.719 N/A PHE 21.A N LEU 15.A O no hydrogen 2.989 N/A GLU 24.A N ASN 22.A OD1 no hydrogen 2.759 N/A ASN 25.A ND2 ASN 25.A O no hydrogen 2.522 N/A GLU 28.A N ASN 25.A O no hydrogen 2.950 N/A ALA 30.A N PHE 27.A O no hydrogen 3.196 N/A LYS 31.A N ASP 133.A OD2 no hydrogen 2.991 N/A LYS 32.A N ASP 133.A OD2 no hydrogen 3.104 N/A LYS 32.A NZ GLU 130.A O no hydrogen 2.710 N/A LYS 32.A NZ GLU 130.A OE1 no hydrogen 2.886 N/A VAL 33.A N GLU 60.A O no hydrogen 2.988 N/A ILE 34.A N GLY 134.A O no hydrogen 2.818 N/A CYS 35.A N ILE 62.A O no hydrogen 2.561 N/A ILE 36.A N PHE 136.A O no hydrogen 2.766 N/A GLU 37.A N ILE 64.A O no hydrogen 2.833 N/A HIS 39.A N ASP 42.A OD2 no hydrogen 3.235 N/A HIS 39.A NE2 ASP 149.A OD2 no hydrogen 2.696 N/A ASP 41.A N GLU 91.A OE2 no hydrogen 3.067 N/A ASP 42.A N HIS 39.A O no hydrogen 3.221 N/A CYS 43.A N GLU 37.A OE1 no hydrogen 2.816 N/A CYS 43.A SG CYS 35.A O no hydrogen 3.531 N/A ILE 45.A N ASP 41.A O no hydrogen 2.916 N/A GLY 46.A N ASP 42.A O no hydrogen 2.910 N/A MET 47.A N CYS 43.A O no hydrogen 2.871 N/A GLY 48.A N ALA 44.A O no hydrogen 2.847 N/A THR 50.A N GLU 247.A OE1 no hydrogen 2.692 N/A THR 50.A OG1 GLU 247.A OE1 no hydrogen 2.631 N/A ILE 51.A N MET 47.A O no hydrogen 2.976 N/A ILE 51.A N GLY 48.A O no hydrogen 2.978 N/A LYS 52.A N GLY 48.A O no hydrogen 2.979 N/A LYS 52.A NZ LEU 97.A O no hydrogen 3.171 N/A LYS 53.A N GLY 49.A O no hydrogen 3.114 N/A LYS 53.A NZ ASP 199.A O no hydrogen 2.794 N/A LEU 54.A N THR 50.A O no hydrogen 3.052 N/A SER 55.A N ILE 51.A O no hydrogen 2.723 N/A SER 55.A OG ILE 51.A O no hydrogen 3.399 N/A SER 55.A OG LEU 98.A O no hydrogen 2.366 N/A SER 55.A OG GLY 99.A O no hydrogen 2.927 N/A ASP 56.A N LYS 52.A O no hydrogen 2.752 N/A GLU 57.A N LYS 53.A O no hydrogen 3.107 N/A GLY 58.A N SER 55.A O no hydrogen 2.689 N/A VAL 59.A N LEU 54.A O no hydrogen 2.983 N/A GLU 60.A N LYS 31.A O no hydrogen 3.021 N/A ILE 62.A N VAL 33.A O no hydrogen 2.762 N/A TYR 63.A N LYS 102.A O no hydrogen 2.916 N/A ILE 64.A N CYS 35.A O no hydrogen 3.125 N/A CYS 65.A N TYR 104.A O no hydrogen 2.703 N/A CYS 65.A SG GLU 37.A O no hydrogen 4.027 N/A CYS 65.A SG GLU 37.A OE2 no hydrogen 3.533 N/A CYS 65.A SG THR 67.A O no hydrogen 3.365 N/A MET 66.A N GLU 37.A O no hydrogen 2.754 N/A THR 67.A N PRO 38.A O no hydrogen 3.054 N/A THR 67.A OG1 PRO 38.A O no hydrogen 2.421 N/A ASP 68.A N TYR 108.A O no hydrogen 3.138 N/A TYR 70.A N ASP 68.A OD1 no hydrogen 2.966 N/A MET 71.A N ASP 110.A OD2 no hydrogen 2.703 N/A GLY 72.A N GLY 69.A O no hydrogen 3.258 N/A THR 73.A N MET 71.A O no hydrogen 2.750 N/A ASP 75.A N THR 73.A OG1 no hydrogen 2.890 N/A LYS 77.A N ASP 75.A OD2 no hydrogen 2.679 N/A LYS 77.A NZ ASP 75.A OD2 no hydrogen 3.248 N/A LEU 78.A N ASP 75.A O no hydrogen 2.741 N/A GLU 82.A N SER 79.A OG no hydrogen 3.203 N/A LEU 83.A N SER 79.A O no hydrogen 3.116 N/A ALA 84.A N GLY 80.A O no hydrogen 3.143 N/A LEU 85.A N HIS 81.A O no hydrogen 3.143 N/A ILE 86.A N GLU 82.A O no hydrogen 2.778 N/A ARG 87.A N LEU 83.A O no hydrogen 2.553 N/A ARG 87.A NH1 GLY 69.A O no hydrogen 3.195 N/A ARG 87.A NH2 PRO 40.A O no hydrogen 2.812 N/A ARG 88.A N ALA 84.A O no hydrogen 3.088 N/A ARG 89.A N LEU 85.A O no hydrogen 3.391 N/A GLU 90.A N ILE 86.A O no hydrogen 3.025 N/A GLU 91.A N ARG 87.A O no hydrogen 2.980 N/A GLU 92.A N ARG 88.A O no hydrogen 2.871 N/A GLU 93.A N ARG 89.A O no hydrogen 3.038 N/A SER 94.A N GLU 90.A O no hydrogen 3.253 N/A SER 94.A OG ALA 210.A O no hydrogen 2.423 N/A ALA 95.A N GLU 91.A O no hydrogen 2.965 N/A LYS 96.A N GLU 92.A O no hydrogen 3.166 N/A LEU 97.A N GLU 93.A O no hydrogen 3.238 N/A LEU 98.A N ALA 95.A O no hydrogen 2.749 N/A GLY 99.A N LYS 96.A O no hydrogen 3.267 N/A VAL 100.A N ALA 95.A O no hydrogen 3.112 N/A LYS 102.A NZ GLU 130.A OE2 no hydrogen 2.950 N/A TYR 104.A N TYR 63.A O no hydrogen 2.849 N/A TYR 104.A OH GLU 130.A OE2 no hydrogen 2.561 N/A LEU 106.A N CYS 65.A O no hydrogen 2.968 N/A TYR 108.A N MET 66.A O no hydrogen 3.418 N/A TYR 108.A OH ASP 122.A OD2 no hydrogen 2.611 N/A ASP 110.A N ASP 68.A OD1 no hydrogen 3.023 N/A THR 111.A N ASP 149.A OD2 no hydrogen 2.734 N/A THR 111.A OG1 ASP 110.A O no hydrogen 2.397 N/A GLU 112.A N ARG 109.A O no hydrogen 2.733 N/A LEU 113.A N ASP 149.A OD1 no hydrogen 3.428 N/A TYR 115.A OH GLU 159.A OE2 no hydrogen 2.593 N/A ARG 120.A N SER 116.A O no hydrogen 3.335 N/A ARG 120.A NE GLU 159.A OE1 no hydrogen 2.767 N/A ARG 120.A NH2 GLU 159.A OE1 no hydrogen 2.795 N/A LYS 121.A N ARG 117.A O no hydrogen 2.929 N/A ASP 122.A N GLU 118.A O no hydrogen 3.341 N/A LEU 123.A N VAL 119.A O no hydrogen 3.055 N/A VAL 124.A N ARG 120.A O no hydrogen 2.792 N/A LYS 125.A N LYS 121.A O no hydrogen 2.923 N/A ILE 126.A N ASP 122.A O no hydrogen 3.191 N/A ILE 127.A N LEU 123.A O no hydrogen 2.863 N/A ARG 128.A N VAL 124.A O no hydrogen 2.936 N/A ARG 128.A NE SER 164.A O no hydrogen 2.895 N/A ARG 128.A NH1 PHE 169.A O no hydrogen 3.035 N/A ARG 128.A NH1 SER 170.A O no hydrogen 3.304 N/A ARG 128.A NH1 ASP 173.A OD2 no hydrogen 3.132 N/A ARG 128.A NH2 SER 164.A O no hydrogen 3.364 N/A ARG 128.A NH2 PHE 169.A O no hydrogen 2.881 N/A LYS 129.A N LYS 125.A O no hydrogen 3.295 N/A GLU 130.A N ILE 126.A O no hydrogen 2.927 N/A LYS 131.A N ILE 127.A O no hydrogen 2.896 N/A LYS 131.A NZ HIS 181.A ND1 no hydrogen 3.540 N/A ASP 133.A N LYS 32.A O no hydrogen 2.537 N/A GLY 134.A N LYS 32.A O no hydrogen 3.449 N/A VAL 135.A N PHE 185.A O no hydrogen 3.188 N/A PHE 136.A N ILE 34.A O no hydrogen 2.623 N/A ALA 137.A N ALA 187.A O no hydrogen 3.141 N/A ASP 139.A N TYR 189.A O no hydrogen 2.873 N/A TRP 141.A N ASP 139.A OD1 no hydrogen 3.050 N/A GLU 145.A N LEU 142.A O no hydrogen 3.227 N/A SER 146.A OG TYR 144.A O no hydrogen 3.084 N/A HIS 147.A N GLU 145.A OE1 no hydrogen 2.940 N/A HIS 150.A N HIS 147.A O no hydrogen 2.759 N/A ARG 151.A N HIS 147.A O no hydrogen 3.269 N/A ARG 151.A NH1 GLU 145.A O no hydrogen 3.033 N/A ARG 152.A N PRO 148.A O no hydrogen 2.997 N/A ARG 152.A NH1 LEU 113.A O no hydrogen 2.748 N/A THR 153.A N ASP 149.A O no hydrogen 3.050 N/A THR 153.A OG1 ASP 149.A O no hydrogen 2.563 N/A GLY 154.A N HIS 150.A O no hydrogen 3.108 N/A PHE 155.A N ARG 151.A O no hydrogen 2.999 N/A LEU 156.A N ARG 152.A O no hydrogen 2.967 N/A ALA 157.A N THR 153.A O no hydrogen 2.871 N/A ILE 158.A N GLY 154.A O no hydrogen 3.158 N/A GLU 159.A N PHE 155.A O no hydrogen 2.965 N/A SER 160.A N LEU 156.A O no hydrogen 2.720 N/A SER 160.A OG ARG 120.A O no hydrogen 3.370 N/A SER 160.A OG LEU 156.A O no hydrogen 2.979 N/A VAL 161.A N ALA 157.A O no hydrogen 2.984 N/A ALA 162.A N ILE 158.A O no hydrogen 3.232 N/A PHE 163.A N GLU 159.A O no hydrogen 2.955 N/A SER 164.A N SER 160.A O no hydrogen 2.911 N/A SER 164.A OG SER 160.A O no hydrogen 2.720 N/A GLN 165.A NE2 ALA 162.A O no hydrogen 3.669 N/A LEU 166.A N PHE 163.A O no hydrogen 2.866 N/A PHE 169.A N LEU 166.A O no hydrogen 2.964 N/A ASP 173.A N SER 170.A O no hydrogen 3.267 N/A ASP 175.A N ASN 171.A O no hydrogen 3.427 N/A ILE 176.A N ASP 173.A O no hydrogen 2.960 N/A GLY 177.A N ILE 174.A O no hydrogen 3.104 N/A LEU 178.A N ASP 173.A O no hydrogen 2.905 N/A HIS 181.A N SER 164.A O no hydrogen 3.247 N/A HIS 181.A NE2 PRO 132.A O no hydrogen 2.755 N/A SER 182.A OG GLN 165.A OE1 no hydrogen 2.604 N/A SER 184.A N ASP 133.A O no hydrogen 2.880 N/A PHE 185.A N ASP 133.A O no hydrogen 3.207 N/A ALA 187.A N VAL 135.A O no hydrogen 3.075 N/A LEU 188.A N ARG 250.A O no hydrogen 2.754 N/A TYR 189.A N ALA 137.A O no hydrogen 2.968 N/A TYR 189.A OH ILE 36.A O no hydrogen 2.896 N/A TYR 190.A OH ASP 42.A OD1 no hydrogen 2.706 N/A THR 191.A OG1 ASP 139.A OD2 no hydrogen 2.771 N/A LYS 193.A N THR 191.A OG1 no hydrogen 2.763 N/A ASN 195.A N PHE 249.A O no hydrogen 2.942 N/A ASN 195.A ND2 PHE 249.A O no hydrogen 3.418 N/A TYR 196.A N PHE 249.A O no hydrogen 3.306 N/A VAL 198.A N GLU 247.A O no hydrogen 2.870 N/A ILE 200.A N TYR 245.A O no hydrogen 3.079 N/A THR 201.A N ASP 199.A OD1 no hydrogen 3.197 N/A THR 201.A OG1 ASP 199.A OD1 no hydrogen 2.725 N/A THR 201.A OG1 TYR 245.A O no hydrogen 3.111 N/A MET 204.A N THR 201.A O no hydrogen 3.455 N/A LEU 206.A N LEU 203.A O no hydrogen 3.252 N/A LYS 207.A N MET 204.A O no hydrogen 3.205 N/A LYS 207.A NZ ILE 45.A O no hydrogen 2.973 N/A LYS 207.A NZ GLU 247.A OE2 no hydrogen 2.702 N/A LEU 208.A N MET 204.A O no hydrogen 3.372 N/A ALA 210.A N LEU 206.A O no hydrogen 2.898 N/A ILE 211.A N LYS 207.A O no hydrogen 2.921 N/A ARG 212.A N LEU 208.A O no hydrogen 2.937 N/A ARG 212.A NH2 PHE 218.A O no hydrogen 3.403 N/A ARG 212.A NH2 ASP 220.A OD2 no hydrogen 3.501 N/A ALA 213.A N LYS 209.A O no hydrogen 3.083 N/A HIS 214.A N ILE 211.A O no hydrogen 2.851 N/A SER 216.A N GLU 90.A OE1 no hydrogen 3.263 N/A SER 216.A N GLU 90.A OE2 no hydrogen 2.766 N/A SER 216.A OG GLU 90.A OE1 no hydrogen 2.607 N/A SER 216.A OG GLU 90.A OE2 no hydrogen 3.539 N/A SER 216.A OG GLN 217.A OE1 no hydrogen 3.143 N/A GLN 217.A N HIS 214.A O no hydrogen 3.272 N/A PHE 218.A N ARG 215.A O no hydrogen 3.260 N/A ILE 222.A N THR 219.A OG1 no hydrogen 3.242 N/A TRP 223.A N THR 219.A O no hydrogen 2.992 N/A TRP 223.A NE1 GLU 227.A OE2 no hydrogen 2.812 N/A GLU 224.A N ASP 220.A O no hydrogen 3.126 N/A GLU 224.A N ASP 221.A O no hydrogen 2.883 N/A THR 225.A N ILE 222.A O no hydrogen 2.967 N/A TRP 226.A N ILE 222.A O no hydrogen 2.977 N/A GLU 227.A N TRP 223.A O no hydrogen 3.059 N/A PHE 229.A N THR 225.A O no hydrogen 3.284 N/A LEU 230.A N TRP 226.A O no hydrogen 2.776 N/A ARG 231.A N GLU 227.A O no hydrogen 2.940 N/A ARG 231.A NE GLU 227.A OE1 no hydrogen 3.220 N/A ARG 231.A NH1 GLU 205.A OE2 no hydrogen 3.422 N/A ARG 231.A NH1 TYR 245.A OH no hydrogen 2.892 N/A ARG 231.A NH2 GLU 205.A OE1 no hydrogen 3.562 N/A ARG 231.A NH2 GLU 205.A OE2 no hydrogen 2.815 N/A ARG 231.A NH2 GLU 227.A OE1 no hydrogen 3.375 N/A THR 232.A N PRO 228.A O no hydrogen 2.763 N/A THR 232.A OG1 PRO 228.A O no hydrogen 2.588 N/A VAL 233.A N PHE 229.A O no hydrogen 2.774 N/A THR 234.A N LEU 230.A O no hydrogen 2.989 N/A THR 234.A OG1 LEU 230.A O no hydrogen 3.269 N/A THR 234.A OG1 ARG 231.A O no hydrogen 3.025 N/A MET 235.A N ARG 231.A O no hydrogen 3.116 N/A PHE 236.A N THR 232.A O no hydrogen 3.271 N/A TYR 237.A N VAL 233.A O no hydrogen 3.465 N/A TYR 237.A OH THR 191.A O no hydrogen 2.888 N/A GLY 238.A N THR 234.A O no hydrogen 2.798 N/A GLU 239.A N MET 235.A O no hydrogen 2.652 N/A LYS 240.A N TYR 237.A O no hydrogen 3.352 N/A ILE 241.A N GLY 238.A O no hydrogen 3.141 N/A VAL 243.A N GLY 238.A O no hydrogen 2.852 N/A TYR 245.A N THR 201.A OG1 no hydrogen 2.841 N/A GLY 246.A N THR 234.A O no hydrogen 2.713 N/A GLU 247.A N VAL 198.A O no hydrogen 3.070 N/A PHE 249.A N TYR 196.A O no hydrogen 2.994 N/A ARG 250.A N LEU 188.A O no hydrogen 2.725 N/A ARG 250.A NH1 LYS 193.A O no hydrogen 2.852 N/A ARG 250.A NH1 ILE 266.A OXT no hydrogen 3.478 N/A ARG 250.A NH2 ILE 266.A OXT no hydrogen 3.036 N/A PHE 256.A N PRO 253.A O no hydrogen 2.808 N/A TYR 257.A N GLY 254.A O no hydrogen 3.247 N/A THR 260.A OG1 LEU 255.A O no hydrogen 2.894 N/A THR 260.A OG1 HIS 258.A O no hydrogen 2.656 N/A ALA 263.A N THR 260.A O no hydrogen 3.352 N/A LEU 265.A N PHE 262.A O no hydrogen 3.103 N/A