Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f3u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLU 5.A OE1 no hydrogen 2.935 N/A ARG 8.A NE PRO 77.A O no hydrogen 3.405 N/A ARG 8.A NH2 PRO 77.A O no hydrogen 3.265 N/A SER 10.A N PRO 7.A O no hydrogen 3.306 N/A SER 10.A OG PRO 7.A O no hydrogen 2.820 N/A LEU 11.A N ARG 8.A O no hydrogen 2.846 N/A ARG 12.A N THR 29.A O no hydrogen 2.963 N/A GLU 14.A N MET 27.A O no hydrogen 2.900 N/A VAL 15.A N MET 27.A O no hydrogen 3.453 N/A LYS 16.A NZ GLN 19.A OE1 no hydrogen 2.630 N/A LYS 16.A NZ GLU 24.A OE2 no hydrogen 3.100 N/A LEU 17.A N VAL 25.A O no hydrogen 2.816 N/A GLY 18.A N VAL 25.A O no hydrogen 3.327 N/A GLY 20.A N GLY 23.A O no hydrogen 2.880 N/A VAL 25.A N GLY 18.A O no hydrogen 3.048 N/A TRP 26.A N ILE 38.A O no hydrogen 2.901 N/A TRP 26.A NE1 GLU 24.A OE1 no hydrogen 2.879 N/A MET 27.A N VAL 15.A O no hydrogen 2.818 N/A GLY 28.A N VAL 36.A O no hydrogen 2.961 N/A THR 29.A N ARG 12.A O no hydrogen 3.107 N/A THR 29.A OG1 GLU 14.A OE1 no hydrogen 2.909 N/A TRP 30.A N THR 34.A O no hydrogen 2.817 N/A ASN 31.A N SER 10.A O no hydrogen 2.835 N/A THR 33.A N TRP 30.A O no hydrogen 3.253 N/A THR 33.A OG1 ASN 31.A O no hydrogen 3.364 N/A THR 34.A N TRP 30.A O no hydrogen 2.896 N/A ARG 35.A NH1 GLU 14.A OE2 no hydrogen 3.284 N/A ARG 35.A NH1 GLY 28.A O no hydrogen 3.150 N/A VAL 36.A N GLY 28.A O no hydrogen 3.112 N/A ALA 37.A N THR 82.A O no hydrogen 3.060 N/A ILE 38.A N TRP 26.A O no hydrogen 2.758 N/A LYS 39.A N ILE 80.A O no hydrogen 2.776 N/A LYS 39.A NZ GLU 54.A OE2 no hydrogen 3.230 N/A LYS 42.A N PHE 22.A O no hydrogen 2.700 N/A THR 45.A N LYS 42.A O no hydrogen 3.134 N/A THR 45.A OG1 LYS 42.A O no hydrogen 2.595 N/A ALA 50.A N SER 47.A OG no hydrogen 3.353 N/A PHE 51.A N SER 47.A O no hydrogen 3.324 N/A PHE 51.A N PRO 48.A O no hydrogen 3.302 N/A LEU 52.A N PRO 48.A O no hydrogen 3.125 N/A GLN 53.A NE2 GLU 49.A O no hydrogen 3.621 N/A GLN 56.A N LEU 52.A O no hydrogen 3.278 N/A VAL 57.A N GLN 53.A O no hydrogen 3.214 N/A MET 58.A N GLU 54.A O no hydrogen 2.960 N/A LYS 60.A N VAL 57.A O no hydrogen 3.438 N/A LEU 61.A N MET 58.A O no hydrogen 3.483 N/A ARG 62.A N TYR 120.A OH no hydrogen 3.300 N/A LYS 65.A NZ GLN 113.A OE1 no hydrogen 3.009 N/A LEU 66.A N HIS 63.A O no hydrogen 3.111 N/A VAL 67.A N VAL 146.A O no hydrogen 2.991 N/A GLN 68.A N GLU 83.A OE1 no hydrogen 2.999 N/A TYR 70.A N VAL 81.A O no hydrogen 2.610 N/A ALA 71.A N VAL 81.A O no hydrogen 2.952 N/A VAL 72.A N TRP 4.A O no hydrogen 2.958 N/A VAL 73.A N TYR 79.A O no hydrogen 2.882 N/A SER 74.A N GLU 5.A OE2 no hydrogen 2.976 N/A TYR 79.A N VAL 73.A O no hydrogen 3.187 N/A ILE 80.A N LYS 39.A O no hydrogen 3.055 N/A VAL 81.A N ALA 71.A O no hydrogen 2.664 N/A THR 82.A N ALA 37.A O no hydrogen 2.827 N/A THR 82.A OG1 GLU 83.A O no hydrogen 3.080 N/A GLU 83.A N GLN 68.A O no hydrogen 2.950 N/A SER 86.A OG GLU 140.A OE1 no hydrogen 2.700 N/A LYS 87.A N VAL 138.A O no hydrogen 3.015 N/A LYS 87.A NZ GLU 140.A OE1 no hydrogen 3.525 N/A LYS 87.A NZ GLU 140.A OE2 no hydrogen 3.337 N/A GLY 88.A N MET 85.A O no hydrogen 3.094 N/A CYS 89.A SG ALA 134.A O no hydrogen 3.370 N/A LEU 90.A N ILE 136.A O no hydrogen 2.583 N/A LEU 91.A N ALA 133.A O no hydrogen 3.403 N/A PHE 93.A N CYS 89.A O no hydrogen 3.067 N/A LEU 94.A N LEU 90.A O no hydrogen 2.818 N/A LYS 95.A N LEU 91.A O no hydrogen 3.351 N/A GLY 96.A N ASP 92.A O no hydrogen 3.122 N/A GLY 99.A N GLY 96.A O no hydrogen 2.823 N/A LEU 102.A N MET 98.A O no hydrogen 3.469 N/A ARG 103.A N GLN 106.A OE1 no hydrogen 2.949 N/A ARG 103.A NH1 LYS 100.A O no hydrogen 2.809 N/A ARG 103.A NH1 LEU 102.A O no hydrogen 2.397 N/A ARG 103.A NH2 LYS 100.A O no hydrogen 3.125 N/A LEU 104.A N LEU 261.A OXT no hydrogen 3.096 N/A LEU 107.A N ARG 103.A O no hydrogen 2.904 N/A VAL 108.A N LEU 104.A O no hydrogen 2.879 N/A MET 110.A N GLN 106.A O no hydrogen 2.855 N/A ALA 111.A N LEU 107.A O no hydrogen 3.070 N/A ALA 112.A N VAL 108.A O no hydrogen 2.784 N/A GLN 113.A N ASP 109.A O no hydrogen 3.324 N/A GLN 113.A N MET 110.A O no hydrogen 3.076 N/A GLN 113.A NE2 ASP 109.A O no hydrogen 3.531 N/A GLN 113.A NE2 ASP 109.A OD2 no hydrogen 2.852 N/A GLN 113.A NE2 LEU 142.A O no hydrogen 3.317 N/A ILE 114.A N MET 110.A O no hydrogen 3.162 N/A ALA 115.A N ALA 111.A O no hydrogen 2.930 N/A SER 116.A N GLN 113.A O no hydrogen 3.016 N/A GLY 117.A N GLN 113.A O no hydrogen 2.906 N/A MET 118.A N ILE 114.A O no hydrogen 2.759 N/A ALA 119.A N ALA 115.A O no hydrogen 2.783 N/A ALA 119.A N SER 116.A O no hydrogen 3.199 N/A TYR 120.A N SER 116.A O no hydrogen 3.142 N/A VAL 121.A N GLY 117.A O no hydrogen 3.092 N/A GLU 122.A N MET 118.A O no hydrogen 2.834 N/A ARG 123.A N ALA 119.A O no hydrogen 3.060 N/A MET 124.A N TYR 120.A O no hydrogen 2.948 N/A ASN 125.A N GLU 122.A O no hydrogen 3.191 N/A TYR 126.A N VAL 121.A O no hydrogen 3.131 N/A HIS 128.A N ASP 172.A OD2 no hydrogen 2.323 N/A HIS 128.A NE2 ALA 147.A O no hydrogen 2.926 N/A ARG 129.A N ASP 172.A OD1 no hydrogen 2.941 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 2.904 N/A ARG 132.A NE ASP 130.A OD1 no hydrogen 2.727 N/A ARG 132.A NH2 ASP 130.A OD2 no hydrogen 3.057 N/A ALA 133.A N GLU 182.A OE2 no hydrogen 2.688 N/A ASN 135.A N ARG 132.A O no hydrogen 2.768 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.873 N/A ASN 135.A ND2 ASP 130.A OD2 no hydrogen 3.173 N/A ILE 136.A N ALA 133.A O no hydrogen 3.042 N/A LEU 137.A N LYS 145.A O no hydrogen 2.930 N/A VAL 138.A N GLY 88.A O no hydrogen 2.876 N/A GLY 139.A N VAL 143.A O no hydrogen 2.752 N/A VAL 143.A N GLU 140.A O no hydrogen 3.072 N/A CYS 144.A N GLN 113.A OE1 no hydrogen 2.915 N/A CYS 144.A SG LEU 142.A O no hydrogen 3.761 N/A LYS 145.A N LEU 137.A O no hydrogen 2.779 N/A LYS 145.A NZ GLU 83.A OE1 no hydrogen 2.861 N/A LYS 145.A NZ GLU 83.A OE2 no hydrogen 2.743 N/A VAL 146.A N LYS 65.A O no hydrogen 2.679 N/A ALA 147.A N ASN 135.A O no hydrogen 3.023 N/A PHE 149.A N ASN 135.A OD1 no hydrogen 3.085 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 2.860 N/A LYS 155.A NZ MET 194.A O no hydrogen 2.982 N/A TRP 156.A N PRO 153.A O no hydrogen 3.289 N/A TRP 156.A NE1 GLU 182.A OE2 no hydrogen 2.917 N/A THR 157.A N ILE 154.A O no hydrogen 3.311 N/A THR 157.A OG1 PRO 153.A O no hydrogen 2.779 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.843 N/A ALA 161.A N ALA 158.A O no hydrogen 2.871 N/A ALA 162.A N ALA 158.A O no hydrogen 2.933 N/A LEU 163.A N PRO 159.A O no hydrogen 3.057 N/A GLY 165.A N ALA 161.A O no hydrogen 3.242 N/A ARG 166.A N GLU 160.A O no hydrogen 2.912 N/A THR 168.A N SER 171.A OG no hydrogen 2.686 N/A LYS 170.A N THR 168.A OG1 no hydrogen 3.179 N/A LYS 170.A NZ ARG 234.A O no hydrogen 2.684 N/A SER 171.A N THR 168.A OG1 no hydrogen 3.296 N/A SER 171.A OG THR 168.A O no hydrogen 2.821 N/A ASP 172.A N THR 168.A O no hydrogen 2.849 N/A VAL 173.A N ILE 169.A O no hydrogen 3.086 N/A TRP 174.A N LYS 170.A O no hydrogen 3.322 N/A SER 175.A N SER 171.A O no hydrogen 3.281 N/A SER 175.A OG TRP 156.A O no hydrogen 2.764 N/A SER 175.A OG SER 171.A O no hydrogen 3.148 N/A PHE 176.A N ASP 172.A O no hydrogen 3.005 N/A GLY 177.A N VAL 173.A O no hydrogen 3.093 N/A ILE 178.A N TRP 174.A O no hydrogen 3.042 N/A LEU 179.A N SER 175.A O no hydrogen 2.701 N/A LEU 180.A N PHE 176.A O no hydrogen 2.773 N/A THR 181.A N ILE 178.A O no hydrogen 2.701 N/A GLU 182.A N LEU 179.A O no hydrogen 2.761 N/A LEU 183.A N LEU 179.A O no hydrogen 2.918 N/A THR 184.A N THR 181.A O no hydrogen 3.268 N/A THR 184.A OG1 LEU 180.A O no hydrogen 2.619 N/A THR 184.A OG1 THR 181.A O no hydrogen 3.258 N/A THR 185.A N THR 181.A O no hydrogen 2.998 N/A THR 185.A OG1 THR 181.A O no hydrogen 2.933 N/A LYS 186.A NZ LEU 102.A O no hydrogen 2.490 N/A LYS 186.A NZ ASN 260.A O no hydrogen 2.633 N/A GLY 187.A N GLU 182.A O no hydrogen 2.535 N/A MET 194.A N TYR 191.A O no hydrogen 3.162 N/A VAL 195.A N GLU 198.A OE1 no hydrogen 3.187 N/A VAL 199.A N VAL 195.A O no hydrogen 3.149 N/A LEU 200.A N ASN 196.A O no hydrogen 3.027 N/A ASP 201.A N ARG 197.A O no hydrogen 3.130 N/A GLN 202.A N GLU 198.A O no hydrogen 3.191 N/A VAL 203.A N VAL 199.A O no hydrogen 2.757 N/A GLU 204.A N LEU 200.A O no hydrogen 3.226 N/A ARG 205.A N ASP 201.A O no hydrogen 3.389 N/A GLY 206.A N VAL 203.A O no hydrogen 2.835 N/A TYR 207.A N GLN 202.A O no hydrogen 3.138 N/A ARG 208.A NE TRP 227.A O no hydrogen 2.715 N/A ARG 208.A NH1 VAL 203.A O no hydrogen 2.947 N/A ARG 208.A NH1 TYR 207.A O no hydrogen 2.862 N/A ARG 208.A NH2 TRP 227.A O no hydrogen 2.691 N/A CYS 211.A SG PRO 212.A O no hydrogen 3.716 N/A CYS 211.A SG CYS 215.A O no hydrogen 2.720 N/A CYS 215.A N PRO 212.A O no hydrogen 3.266 N/A CYS 215.A SG PRO 216.A O no hydrogen 3.689 N/A SER 218.A OG TYR 247.A OH no hydrogen 2.568 N/A SER 218.A OG GLU 252.A OE1 no hydrogen 2.519 N/A LEU 219.A N PRO 216.A O no hydrogen 3.180 N/A HIS 220.A N PRO 216.A O no hydrogen 3.317 N/A HIS 220.A NE2 MET 209.A O no hydrogen 2.818 N/A ASP 221.A N GLU 217.A O no hydrogen 2.720 N/A LEU 222.A N SER 218.A O no hydrogen 3.340 N/A MET 223.A N LEU 219.A O no hydrogen 2.958 N/A CYS 224.A N HIS 220.A O no hydrogen 2.896 N/A CYS 224.A SG HIS 220.A O no hydrogen 3.398 N/A GLN 225.A N ASP 221.A O no hydrogen 2.981 N/A GLN 225.A NE2 ASP 221.A O no hydrogen 3.584 N/A GLN 225.A NE2 ASP 221.A OD2 no hydrogen 3.246 N/A CYS 226.A N LEU 222.A O no hydrogen 3.155 N/A CYS 226.A SG LEU 222.A O no hydrogen 3.353 N/A TRP 227.A N MET 223.A O no hydrogen 3.026 N/A TRP 227.A N CYS 224.A O no hydrogen 3.086 N/A ARG 228.A N GLN 225.A O no hydrogen 3.398 N/A ARG 228.A NH1 GLU 233.A O no hydrogen 2.627 N/A LYS 229.A NZ GLU 204.A OE1 no hydrogen 3.012 N/A GLU 232.A N ASP 230.A OD1 no hydrogen 2.799 N/A GLU 233.A N ASP 230.A O no hydrogen 3.034 N/A GLU 233.A N ASP 230.A OD1 no hydrogen 3.375 N/A ARG 234.A N PRO 231.A O no hydrogen 3.293 N/A ARG 234.A NE ARG 228.A O no hydrogen 2.947 N/A ARG 234.A NH1 GLU 160.A OE2 no hydrogen 3.109 N/A ARG 234.A NH1 LYS 170.A O no hydrogen 2.860 N/A ARG 234.A NH2 GLU 160.A OE1 no hydrogen 3.222 N/A ARG 234.A NH2 ARG 228.A O no hydrogen 3.039 N/A PHE 237.A N GLU 122.A OE1 no hydrogen 3.120 N/A PHE 237.A N GLU 122.A OE2 no hydrogen 2.561 N/A GLU 238.A N GLU 122.A OE1 no hydrogen 3.333 N/A TYR 239.A N THR 236.A OG1 no hydrogen 2.898 N/A LEU 240.A N THR 236.A O no hydrogen 2.982 N/A GLN 241.A N PHE 237.A O no hydrogen 2.479 N/A GLN 241.A NE2 GLU 245.A OE2 no hydrogen 2.613 N/A ALA 242.A N GLU 238.A O no hydrogen 3.135 N/A PHE 243.A N TYR 239.A O no hydrogen 2.760 N/A LEU 244.A N LEU 240.A O no hydrogen 3.023 N/A LEU 244.A N GLN 241.A O no hydrogen 3.181 N/A GLU 245.A N GLN 241.A O no hydrogen 3.101 N/A ASP 246.A N ALA 242.A O no hydrogen 3.255 N/A TYR 247.A N LEU 244.A O no hydrogen 3.312 N/A TYR 247.A OH SER 218.A OG no hydrogen 2.568 N/A THR 249.A N ASP 246.A O no hydrogen 3.052 N/A SER 250.A N ASP 246.A O no hydrogen 3.242 N/A THR 251.A N TYR 247.A O no hydrogen 3.081 N/A GLU 252.A N TYR 247.A O no hydrogen 3.068 N/A TYR 255.A N GLU 252.A O no hydrogen 3.299 N/A TYR 255.A OH LEU 261.A OXT no hydrogen 2.981 N/A GLY 258.A N LEU 261.A O no hydrogen 2.844 N/A ASN 260.A N GLU 214.A OE2 no hydrogen 2.817 N/A ASN 260.A ND2 GLU 214.A OE1 no hydrogen 2.896 N/A LEU 261.A N GLU 214.A OE2 no hydrogen 3.012 N/A