Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f3t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 2.A OD2 no hydrogen 2.819 N/A ILE 6.A N VAL 72.A O no hydrogen 3.399 N/A ARG 8.A NE PRO 77.A O no hydrogen 2.998 N/A ARG 8.A NH2 GLU 75.A O no hydrogen 2.418 N/A ARG 8.A NH2 PRO 77.A O no hydrogen 3.193 N/A SER 10.A N PRO 7.A O no hydrogen 3.153 N/A SER 10.A OG PRO 7.A O no hydrogen 2.782 N/A LEU 11.A N ARG 8.A O no hydrogen 3.117 N/A ARG 12.A N THR 29.A O no hydrogen 2.896 N/A ARG 12.A NH2 GLU 14.A OE1 no hydrogen 2.974 N/A GLU 14.A N MET 27.A O no hydrogen 3.122 N/A VAL 15.A N MET 27.A O no hydrogen 3.347 N/A LEU 17.A N VAL 25.A O no hydrogen 2.807 N/A GLY 18.A N VAL 25.A O no hydrogen 3.268 N/A GLN 19.A NE2 GLY 20.A O no hydrogen 3.188 N/A GLY 20.A N GLY 23.A O no hydrogen 3.066 N/A VAL 25.A N GLY 18.A O no hydrogen 3.022 N/A TRP 26.A N ILE 38.A O no hydrogen 2.777 N/A TRP 26.A NE1 GLU 24.A OE2 no hydrogen 2.981 N/A MET 27.A N VAL 15.A O no hydrogen 2.888 N/A GLY 28.A N VAL 36.A O no hydrogen 2.556 N/A THR 29.A N ARG 12.A O no hydrogen 2.943 N/A THR 29.A OG1 GLU 14.A OE1 no hydrogen 2.945 N/A TRP 30.A N THR 34.A O no hydrogen 2.916 N/A ASN 31.A N SER 10.A O no hydrogen 2.843 N/A THR 34.A OG1 GLY 32.A O no hydrogen 3.137 N/A ARG 35.A NH1 GLU 14.A OE1 no hydrogen 3.438 N/A ARG 35.A NH1 GLY 28.A O no hydrogen 3.089 N/A ARG 35.A NH2 GLU 14.A OE1 no hydrogen 3.298 N/A VAL 36.A N GLY 28.A O no hydrogen 2.678 N/A ALA 37.A N THR 82.A O no hydrogen 3.066 N/A ILE 38.A N TRP 26.A O no hydrogen 2.733 N/A LYS 39.A N ILE 80.A O no hydrogen 2.748 N/A LYS 39.A NZ GLU 54.A OE1 no hydrogen 3.065 N/A THR 40.A N GLU 24.A O no hydrogen 2.796 N/A LYS 42.A N PHE 22.A O no hydrogen 2.915 N/A THR 45.A N LYS 42.A O no hydrogen 3.192 N/A THR 45.A OG1 LYS 42.A O no hydrogen 2.672 N/A PHE 51.A N SER 47.A O no hydrogen 2.804 N/A LEU 52.A N PRO 48.A O no hydrogen 3.166 N/A GLN 53.A NE2 GLU 49.A O no hydrogen 3.640 N/A GLU 54.A N PHE 51.A O no hydrogen 3.360 N/A GLN 56.A N LEU 52.A O no hydrogen 3.391 N/A VAL 57.A N GLU 54.A O no hydrogen 3.140 N/A MET 58.A N GLU 54.A O no hydrogen 3.077 N/A LYS 59.A N ALA 55.A O no hydrogen 2.962 N/A LYS 60.A N VAL 57.A O no hydrogen 3.332 N/A ARG 62.A N TYR 120.A OH no hydrogen 2.996 N/A LYS 65.A NZ GLN 113.A OE1 no hydrogen 3.021 N/A LEU 66.A N HIS 63.A O no hydrogen 3.294 N/A VAL 67.A N VAL 146.A O no hydrogen 3.093 N/A GLN 68.A N GLU 83.A OE1 no hydrogen 3.136 N/A TYR 70.A N VAL 81.A O no hydrogen 2.675 N/A ALA 71.A N VAL 81.A O no hydrogen 3.164 N/A VAL 72.A N TRP 4.A O no hydrogen 3.260 N/A VAL 73.A N TYR 79.A O no hydrogen 2.980 N/A SER 74.A OG GLU 5.A OE1 no hydrogen 2.605 N/A TYR 79.A N VAL 73.A O no hydrogen 3.127 N/A ILE 80.A N LYS 39.A O no hydrogen 3.083 N/A VAL 81.A N ALA 71.A O no hydrogen 3.171 N/A THR 82.A N ALA 37.A O no hydrogen 2.898 N/A THR 82.A OG1 GLU 83.A O no hydrogen 3.059 N/A GLU 83.A N GLN 68.A O no hydrogen 3.071 N/A SER 86.A OG GLU 140.A OE1 no hydrogen 3.066 N/A LYS 87.A N VAL 138.A O no hydrogen 3.071 N/A GLY 88.A N MET 85.A O no hydrogen 3.173 N/A CYS 89.A SG ASP 92.A OD2 no hydrogen 3.371 N/A LEU 90.A N ILE 136.A O no hydrogen 2.532 N/A LEU 91.A N ALA 133.A O no hydrogen 2.968 N/A PHE 93.A N CYS 89.A O no hydrogen 2.996 N/A LEU 94.A N LEU 90.A O no hydrogen 2.857 N/A LYS 95.A N LEU 91.A O no hydrogen 3.219 N/A GLY 96.A N ASP 92.A O no hydrogen 3.137 N/A GLY 99.A N GLY 96.A O no hydrogen 2.649 N/A ARG 103.A N GLN 106.A OE1 no hydrogen 2.977 N/A ARG 103.A NH1 LYS 100.A O no hydrogen 3.344 N/A ARG 103.A NH1 LEU 102.A O no hydrogen 2.614 N/A ARG 103.A NH2 LYS 100.A O no hydrogen 2.868 N/A LEU 104.A N LEU 261.A OXT no hydrogen 3.166 N/A LEU 107.A N ARG 103.A O no hydrogen 3.067 N/A VAL 108.A N LEU 104.A O no hydrogen 2.808 N/A ASP 109.A N PRO 105.A O no hydrogen 3.337 N/A MET 110.A N GLN 106.A O no hydrogen 2.958 N/A ALA 111.A N LEU 107.A O no hydrogen 2.940 N/A ALA 112.A N VAL 108.A O no hydrogen 2.850 N/A GLN 113.A N ASP 109.A O no hydrogen 3.015 N/A GLN 113.A NE2 ASP 109.A O no hydrogen 3.647 N/A GLN 113.A NE2 ASP 109.A OD2 no hydrogen 2.699 N/A GLN 113.A NE2 LEU 142.A O no hydrogen 3.015 N/A ILE 114.A N MET 110.A O no hydrogen 3.270 N/A ALA 115.A N ALA 111.A O no hydrogen 2.906 N/A SER 116.A N ALA 112.A O no hydrogen 2.979 N/A GLY 117.A N GLN 113.A O no hydrogen 2.868 N/A MET 118.A N ILE 114.A O no hydrogen 2.748 N/A ALA 119.A N ALA 115.A O no hydrogen 2.530 N/A TYR 120.A N SER 116.A O no hydrogen 3.167 N/A TYR 120.A N GLY 117.A O no hydrogen 3.189 N/A VAL 121.A N GLY 117.A O no hydrogen 3.160 N/A GLU 122.A N MET 118.A O no hydrogen 2.924 N/A ARG 123.A N ALA 119.A O no hydrogen 2.880 N/A MET 124.A N TYR 120.A O no hydrogen 2.844 N/A MET 124.A N VAL 121.A O no hydrogen 2.999 N/A ASN 125.A N GLU 122.A O no hydrogen 3.169 N/A TYR 126.A N VAL 121.A O no hydrogen 3.112 N/A HIS 128.A N ASP 172.A OD2 no hydrogen 2.431 N/A HIS 128.A NE2 ALA 147.A O no hydrogen 2.820 N/A ARG 129.A N ASP 172.A OD1 no hydrogen 2.688 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.064 N/A ARG 132.A NE ASP 130.A OD1 no hydrogen 2.347 N/A ARG 132.A NH2 ASP 130.A OD2 no hydrogen 2.883 N/A ALA 133.A N GLU 182.A OE2 no hydrogen 2.728 N/A ASN 135.A N ARG 132.A O no hydrogen 2.875 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.943 N/A ILE 136.A N ALA 133.A O no hydrogen 3.372 N/A LEU 137.A N LYS 145.A O no hydrogen 2.979 N/A VAL 138.A N GLY 88.A O no hydrogen 2.877 N/A GLY 139.A N VAL 143.A O no hydrogen 2.891 N/A VAL 143.A N GLU 140.A O no hydrogen 3.131 N/A CYS 144.A N GLN 113.A OE1 no hydrogen 2.812 N/A CYS 144.A SG LEU 142.A O no hydrogen 3.832 N/A LYS 145.A N LEU 137.A O no hydrogen 2.925 N/A LYS 145.A NZ GLU 83.A OE1 no hydrogen 3.026 N/A LYS 145.A NZ GLU 83.A OE2 no hydrogen 2.657 N/A VAL 146.A N LYS 65.A O no hydrogen 2.798 N/A ALA 147.A N ASN 135.A O no hydrogen 2.885 N/A PHE 149.A N ASN 135.A OD1 no hydrogen 2.926 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 2.652 N/A LYS 155.A NZ PRO 190.A O no hydrogen 3.211 N/A LYS 155.A NZ TYR 191.A O no hydrogen 3.348 N/A LYS 155.A NZ MET 194.A O no hydrogen 2.671 N/A TRP 156.A N PRO 153.A O no hydrogen 3.029 N/A TRP 156.A NE1 GLU 182.A OE2 no hydrogen 2.723 N/A THR 157.A N ILE 154.A O no hydrogen 3.254 N/A THR 157.A OG1 PRO 153.A O no hydrogen 2.537 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.773 N/A ALA 161.A N ALA 158.A O no hydrogen 2.895 N/A ALA 162.A N ALA 158.A O no hydrogen 2.771 N/A LEU 163.A N PRO 159.A O no hydrogen 2.985 N/A TYR 164.A N GLU 160.A O no hydrogen 3.300 N/A GLY 165.A N ALA 161.A O no hydrogen 3.176 N/A ARG 166.A N GLU 160.A O no hydrogen 2.973 N/A PHE 167.A N GLY 165.A O no hydrogen 3.056 N/A THR 168.A N SER 171.A OG no hydrogen 2.826 N/A LYS 170.A N THR 168.A OG1 no hydrogen 3.071 N/A LYS 170.A NZ ARG 234.A O no hydrogen 2.990 N/A SER 171.A OG ARG 166.A O no hydrogen 3.456 N/A SER 171.A OG THR 168.A O no hydrogen 3.047 N/A ASP 172.A N THR 168.A O no hydrogen 3.073 N/A VAL 173.A N ILE 169.A O no hydrogen 3.040 N/A TRP 174.A N LYS 170.A O no hydrogen 3.318 N/A SER 175.A N SER 171.A O no hydrogen 3.096 N/A SER 175.A OG TRP 156.A O no hydrogen 2.276 N/A SER 175.A OG SER 171.A O no hydrogen 3.488 N/A PHE 176.A N ASP 172.A O no hydrogen 2.827 N/A GLY 177.A N VAL 173.A O no hydrogen 2.990 N/A ILE 178.A N TRP 174.A O no hydrogen 3.073 N/A LEU 179.A N SER 175.A O no hydrogen 2.678 N/A LEU 180.A N PHE 176.A O no hydrogen 2.768 N/A THR 181.A N ILE 178.A O no hydrogen 2.905 N/A THR 181.A OG1 ILE 178.A O no hydrogen 2.640 N/A GLU 182.A N ILE 178.A O no hydrogen 3.166 N/A LEU 183.A N LEU 179.A O no hydrogen 3.139 N/A THR 184.A N LEU 180.A O no hydrogen 3.176 N/A THR 184.A OG1 LEU 180.A O no hydrogen 2.745 N/A THR 184.A OG1 THR 181.A O no hydrogen 3.214 N/A THR 185.A N THR 181.A O no hydrogen 3.067 N/A THR 185.A OG1 THR 181.A O no hydrogen 3.042 N/A LYS 186.A N LEU 183.A O no hydrogen 3.320 N/A LYS 186.A NZ LEU 102.A O no hydrogen 3.246 N/A LYS 186.A NZ ASN 260.A O no hydrogen 2.772 N/A GLY 187.A N GLU 182.A O no hydrogen 2.637 N/A ARG 188.A N THR 185.A OG1 no hydrogen 3.247 N/A MET 194.A N TYR 191.A O no hydrogen 3.051 N/A VAL 195.A N GLU 198.A OE1 no hydrogen 3.017 N/A VAL 199.A N VAL 195.A O no hydrogen 2.732 N/A LEU 200.A N ASN 196.A O no hydrogen 2.878 N/A ASP 201.A N ARG 197.A O no hydrogen 3.086 N/A GLN 202.A N GLU 198.A O no hydrogen 2.868 N/A VAL 203.A N VAL 199.A O no hydrogen 3.052 N/A GLY 206.A N VAL 203.A O no hydrogen 2.971 N/A TYR 207.A N GLN 202.A O no hydrogen 3.154 N/A ARG 208.A NE TRP 227.A O no hydrogen 2.562 N/A ARG 208.A NH1 VAL 203.A O no hydrogen 3.068 N/A ARG 208.A NH1 TYR 207.A O no hydrogen 3.256 N/A ARG 208.A NH2 TRP 227.A O no hydrogen 2.690 N/A CYS 211.A SG PRO 212.A O no hydrogen 3.626 N/A CYS 211.A SG CYS 215.A O no hydrogen 2.947 N/A CYS 215.A N PRO 212.A O no hydrogen 3.138 N/A CYS 215.A SG PRO 216.A O no hydrogen 3.803 N/A SER 218.A OG GLU 252.A OE1 no hydrogen 2.756 N/A LEU 219.A N PRO 216.A O no hydrogen 2.768 N/A HIS 220.A N PRO 216.A O no hydrogen 3.223 N/A HIS 220.A ND1 GLU 217.A OE1 no hydrogen 2.986 N/A HIS 220.A NE2 MET 209.A O no hydrogen 2.719 N/A ASP 221.A N GLU 217.A O no hydrogen 2.775 N/A LEU 222.A N LEU 219.A O no hydrogen 3.130 N/A MET 223.A N LEU 219.A O no hydrogen 3.186 N/A CYS 224.A N HIS 220.A O no hydrogen 2.839 N/A CYS 224.A SG HIS 220.A NE2 no hydrogen 3.425 N/A CYS 224.A SG HIS 220.A O no hydrogen 3.475 N/A GLN 225.A N ASP 221.A O no hydrogen 3.119 N/A GLN 225.A N LEU 222.A O no hydrogen 3.168 N/A CYS 226.A N LEU 222.A O no hydrogen 3.014 N/A CYS 226.A SG LEU 222.A O no hydrogen 3.345 N/A TRP 227.A N MET 223.A O no hydrogen 2.931 N/A ARG 228.A NH1 GLU 233.A O no hydrogen 2.791 N/A LYS 229.A NZ GLU 204.A OE2 no hydrogen 2.313 N/A ASP 230.A N GLU 233.A OE1 no hydrogen 3.037 N/A GLU 232.A N ASP 230.A OD2 no hydrogen 3.083 N/A GLU 233.A N ASP 230.A O no hydrogen 2.911 N/A ARG 234.A N PRO 231.A O no hydrogen 3.068 N/A ARG 234.A NE ARG 228.A O no hydrogen 2.684 N/A ARG 234.A NH1 GLU 160.A OE1 no hydrogen 3.358 N/A ARG 234.A NH1 GLU 160.A OE2 no hydrogen 2.569 N/A ARG 234.A NH1 LYS 170.A O no hydrogen 3.179 N/A ARG 234.A NH2 GLU 160.A OE1 no hydrogen 2.866 N/A ARG 234.A NH2 ARG 228.A O no hydrogen 2.889 N/A PHE 237.A N GLU 122.A OE2 no hydrogen 2.789 N/A GLU 238.A N GLU 122.A OE1 no hydrogen 3.333 N/A LEU 240.A N THR 236.A O no hydrogen 2.822 N/A GLN 241.A N PHE 237.A O no hydrogen 2.870 N/A GLN 241.A NE2 GLU 245.A OE2 no hydrogen 2.979 N/A ALA 242.A N GLU 238.A O no hydrogen 3.271 N/A PHE 243.A N TYR 239.A O no hydrogen 2.920 N/A LEU 244.A N LEU 240.A O no hydrogen 2.986 N/A GLU 245.A N GLN 241.A O no hydrogen 2.716 N/A ASP 246.A N ALA 242.A O no hydrogen 3.000 N/A TYR 247.A N LEU 244.A O no hydrogen 3.369 N/A TYR 247.A OH SER 218.A OG no hydrogen 2.784 N/A THR 249.A N ASP 246.A O no hydrogen 3.036 N/A SER 250.A N ASP 246.A O no hydrogen 3.099 N/A THR 251.A N TYR 247.A O no hydrogen 3.019 N/A GLU 252.A N TYR 247.A O no hydrogen 2.962 N/A GLN 254.A NE2 GLU 252.A OE2 no hydrogen 3.007 N/A TYR 255.A N GLU 252.A O no hydrogen 3.231 N/A TYR 255.A OH LEU 261.A OXT no hydrogen 2.597 N/A GLY 258.A N LEU 261.A O no hydrogen 2.620 N/A ASN 260.A N GLU 214.A OE1 no hydrogen 3.193 N/A ASN 260.A N GLU 214.A OE2 no hydrogen 3.060 N/A LEU 261.A N GLU 214.A OE2 no hydrogen 3.000 N/A