Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a61_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A N ARG 1.A O no hydrogen 2.753 N/A CYS 4.A SG ARG 1.A O no hydrogen 3.269 N/A CYS 4.A SG THR 26.A OG1 no hydrogen 3.284 N/A PHE 5.A N PRO 2.A O no hydrogen 3.309 N/A LEU 8.A N GLN 21.A O no hydrogen 2.993 N/A LEU 11.A N VAL 19.A O no hydrogen 2.802 N/A GLY 12.A N VAL 19.A O no hydrogen 3.356 N/A LYS 18.A N VAL 38.A O no hydrogen 3.232 N/A VAL 19.A N GLY 12.A O no hydrogen 3.221 N/A PHE 20.A N MET 36.A O no hydrogen 3.114 N/A GLN 21.A N ARG 9.A O no hydrogen 3.123 N/A VAL 22.A N PHE 34.A O no hydrogen 2.796 N/A ARG 23.A N GLU 6.A O no hydrogen 3.088 N/A LYS 24.A N LYS 32.A O no hydrogen 3.288 N/A VAL 25.A N CYS 4.A O no hydrogen 2.748 N/A THR 30.A OG1 THR 26.A O no hydrogen 3.151 N/A THR 30.A OG1 ALA 28.A O no hydrogen 2.775 N/A PHE 34.A N VAL 22.A O no hydrogen 2.765 N/A ALA 35.A N LEU 71.A O no hydrogen 2.948 N/A MET 36.A N PHE 20.A O no hydrogen 2.709 N/A LYS 37.A NZ GLU 42.A OE1 no hydrogen 3.459 N/A VAL 38.A N LYS 18.A O no hydrogen 2.825 N/A LEU 39.A N LEU 67.A O no hydrogen 2.688 N/A ILE 45.A N ALA 41.A O no hydrogen 2.883 N/A LEU 46.A N GLU 42.A O no hydrogen 3.380 N/A GLU 47.A N ARG 43.A O no hydrogen 3.020 N/A GLU 47.A N ASN 44.A O no hydrogen 3.034 N/A VAL 49.A N ILE 45.A O no hydrogen 3.389 N/A ILE 54.A N HIS 51.A O no hydrogen 2.637 N/A VAL 55.A N LEU 133.A O no hydrogen 2.963 N/A ASP 56.A N GLU 72.A OE1 no hydrogen 2.728 N/A ILE 58.A N ILE 70.A O no hydrogen 3.003 N/A PHE 61.A N TYR 68.A O no hydrogen 3.129 N/A THR 63.A N LYS 66.A O no hydrogen 2.519 N/A THR 63.A OG1 LYS 66.A O no hydrogen 3.491 N/A GLY 65.A N THR 63.A O no hydrogen 2.519 N/A LEU 67.A N LEU 39.A O no hydrogen 3.025 N/A TYR 68.A N PHE 61.A O no hydrogen 2.498 N/A LEU 69.A N LYS 37.A O no hydrogen 2.685 N/A ILE 70.A N TYR 59.A O no hydrogen 3.041 N/A LEU 71.A N ALA 35.A O no hydrogen 2.608 N/A GLU 72.A N ASP 56.A O no hydrogen 3.247 N/A SER 75.A OG HIS 127.A ND1 no hydrogen 2.933 N/A GLY 76.A N LEU 125.A O no hydrogen 2.908 N/A LEU 79.A N ILE 123.A O no hydrogen 3.063 N/A MET 81.A N GLU 78.A O no hydrogen 3.176 N/A LEU 83.A N LEU 79.A O no hydrogen 3.251 N/A ARG 85.A N GLN 82.A O no hydrogen 2.904 N/A GLU 86.A N GLN 82.A O no hydrogen 3.017 N/A GLU 86.A N LEU 83.A O no hydrogen 3.186 N/A PHE 89.A N MET 169.A O no hydrogen 2.895 N/A ALA 94.A N MET 90.A O no hydrogen 2.934 N/A CYS 95.A N GLU 91.A O no hydrogen 2.858 N/A PHE 96.A N ASP 92.A O no hydrogen 2.873 N/A LEU 98.A N ALA 94.A O no hydrogen 3.014 N/A ALA 99.A N CYS 95.A O no hydrogen 3.266 N/A ALA 99.A N PHE 96.A O no hydrogen 2.613 N/A GLU 100.A N PHE 96.A O no hydrogen 3.429 N/A ILE 101.A N TYR 97.A O no hydrogen 3.431 N/A SER 102.A N LEU 98.A O no hydrogen 2.985 N/A SER 102.A OG ALA 99.A O no hydrogen 2.237 N/A MET 103.A N ALA 99.A O no hydrogen 3.002 N/A MET 103.A N GLU 100.A O no hydrogen 2.683 N/A ALA 104.A N GLU 100.A O no hydrogen 3.170 N/A ALA 104.A N ILE 101.A O no hydrogen 2.715 N/A LEU 105.A N ILE 101.A O no hydrogen 2.880 N/A HIS 107.A N MET 103.A O no hydrogen 3.330 N/A LEU 108.A N ALA 104.A O no hydrogen 3.063 N/A HIS 109.A N LEU 105.A O no hydrogen 3.223 N/A HIS 109.A N GLY 106.A O no hydrogen 3.216 N/A GLN 110.A N GLY 106.A O no hydrogen 3.352 N/A LYS 111.A N HIS 107.A O no hydrogen 3.304 N/A GLY 112.A N HIS 109.A O no hydrogen 2.776 N/A ILE 113.A N LEU 108.A O no hydrogen 3.063 N/A TYR 115.A N ASP 158.A OD1 no hydrogen 3.053 N/A TYR 115.A N ASP 158.A OD2 no hydrogen 2.916 N/A TYR 115.A OH ASN 122.A OD1 no hydrogen 3.165 N/A ARG 116.A N ASP 158.A OD2 no hydrogen 2.866 N/A ASP 117.A N TYR 115.A O no hydrogen 2.477 N/A MET 124.A N LYS 132.A O no hydrogen 3.139 N/A LEU 125.A N GLY 77.A O no hydrogen 2.915 N/A ASN 126.A N HIS 130.A O no hydrogen 3.222 N/A GLY 129.A N ASN 126.A O no hydrogen 2.722 N/A GLY 129.A N ASN 126.A OD1 no hydrogen 2.812 N/A HIS 130.A N ASN 126.A OD1 no hydrogen 3.080 N/A LYS 132.A N MET 124.A O no hydrogen 2.557 N/A LYS 132.A NZ GLU 72.A OE2 no hydrogen 3.373 N/A LEU 133.A N PHE 53.A O no hydrogen 2.841 N/A THR 134.A N TYR 115.A OH no hydrogen 3.421 N/A THR 134.A OG1 LYS 132.A O no hydrogen 2.711 N/A TYR 142.A N ILE 140.A O no hydrogen 2.301 N/A MET 143.A N ILE 140.A O no hydrogen 2.843 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.856 N/A ARG 155.A NH1 ALA 221.A O no hydrogen 2.545 N/A ARG 155.A NH1 ASP 225.A OD1 no hydrogen 3.435 N/A ARG 155.A NH2 ALA 221.A O no hydrogen 3.064 N/A VAL 157.A N ASN 154.A O no hydrogen 3.048 N/A TRP 159.A N ALA 156.A O no hydrogen 2.515 N/A TRP 160.A N ALA 156.A O no hydrogen 3.293 N/A SER 161.A N VAL 157.A O no hydrogen 2.994 N/A SER 161.A OG ASP 117.A O no hydrogen 3.533 N/A SER 161.A OG TYR 142.A O no hydrogen 3.000 N/A SER 161.A OG VAL 157.A O no hydrogen 3.093 N/A LEU 162.A N TRP 159.A O no hydrogen 2.707 N/A GLY 163.A N TRP 159.A O no hydrogen 3.160 N/A ALA 164.A N TRP 160.A O no hydrogen 3.374 N/A LEU 165.A N SER 161.A O no hydrogen 3.116 N/A MET 166.A N LEU 162.A O no hydrogen 3.102 N/A TYR 167.A N GLY 163.A O no hydrogen 2.685 N/A TYR 167.A OH ASN 194.A O no hydrogen 2.736 N/A ASP 168.A N ALA 164.A O no hydrogen 2.714 N/A MET 169.A N MET 166.A O no hydrogen 2.627 N/A LEU 170.A N MET 166.A O no hydrogen 2.774 N/A THR 171.A N TYR 167.A O no hydrogen 2.829 N/A THR 184.A N ASN 180.A O no hydrogen 3.116 N/A THR 184.A OG1 GLY 178.A O no hydrogen 2.831 N/A THR 184.A OG1 ASN 180.A O no hydrogen 2.936 N/A ILE 185.A N ARG 181.A O no hydrogen 3.165 N/A ASP 186.A N LYS 182.A O no hydrogen 2.844 N/A LYS 187.A N LYS 183.A O no hydrogen 2.676 N/A LYS 187.A NZ THR 177.A O no hydrogen 2.576 N/A ILE 188.A N THR 184.A O no hydrogen 3.081 N/A LEU 189.A N ILE 185.A O no hydrogen 3.128 N/A LYS 190.A N ASP 186.A O no hydrogen 2.991 N/A LYS 192.A N LYS 190.A O no hydrogen 3.037 N/A THR 200.A N GLU 91.A OE2 no hydrogen 2.949 N/A THR 200.A OG1 GLU 91.A OE1 no hydrogen 3.554 N/A THR 200.A OG1 GLU 91.A OE2 no hydrogen 3.139 N/A ALA 203.A N THR 200.A OG1 no hydrogen 3.044 N/A ARG 204.A N THR 200.A O no hydrogen 3.343 N/A ASP 205.A N GLN 201.A O no hydrogen 2.750 N/A LEU 206.A N GLU 202.A O no hydrogen 2.780 N/A LEU 207.A N ALA 203.A O no hydrogen 3.101 N/A LYS 208.A N ARG 204.A O no hydrogen 2.904 N/A LYS 209.A N ASP 205.A O no hydrogen 3.005 N/A LYS 209.A N LEU 206.A O no hydrogen 2.668 N/A LYS 209.A NZ ASP 205.A OD1 no hydrogen 2.884 N/A LEU 210.A N LEU 206.A O no hydrogen 2.558 N/A LEU 211.A N LEU 207.A O no hydrogen 2.679 N/A SER 217.A OG ASN 214.A OD1 no hydrogen 2.728 N/A ARG 218.A N ALA 215.A O no hydrogen 2.441 N/A ARG 218.A NE LYS 212.A O no hydrogen 2.940 N/A ARG 218.A NH1 GLU 146.A OE2 no hydrogen 2.584 N/A ARG 218.A NH2 GLU 146.A OE1 no hydrogen 3.041 N/A ARG 218.A NH2 GLU 146.A OE2 no hydrogen 3.200 N/A ARG 218.A NH2 LYS 212.A O no hydrogen 2.887 N/A ARG 218.A NH2 ARG 213.A O no hydrogen 3.412 N/A LEU 219.A N LYS 209.A O no hydrogen 2.848 N/A ALA 221.A N ARG 218.A O no hydrogen 3.075 N/A ASP 225.A N GLY 222.A O no hydrogen 3.141 N/A GLY 227.A N GLY 224.A O no hydrogen 2.681 N/A GLN 230.A N ALA 226.A O no hydrogen 2.977 N/A GLN 230.A NE2 SER 102.A OG no hydrogen 3.291 N/A ALA 231.A N GLY 227.A O no hydrogen 2.942 N/A ALA 231.A N GLU 228.A O no hydrogen 2.771 N/A HIS 232.A N GLU 228.A O no hydrogen 3.305 N/A HIS 232.A N VAL 229.A O no hydrogen 2.943 N/A PHE 234.A N HIS 232.A ND1 no hydrogen 2.693 N/A PHE 235.A N HIS 232.A O no hydrogen 3.047 N/A ARG 236.A NH1 PRO 233.A O no hydrogen 3.026 N/A ARG 236.A NH2 HIS 237.A NE2 no hydrogen 3.378 N/A ILE 238.A N PHE 235.A O no hydrogen 3.052 N/A GLU 242.A N ASN 239.A OD1 no hydrogen 2.366 N/A LEU 243.A N ASN 239.A O no hydrogen 3.068 N/A LEU 244.A N TRP 240.A O no hydrogen 3.411 N/A ALA 245.A N GLU 242.A O no hydrogen 3.086 N/A ARG 246.A N LEU 243.A O no hydrogen 2.828 N/A ARG 246.A NH1 PRO 52.A O no hydrogen 3.498 N/A LYS 247.A N GLU 242.A O no hydrogen 3.463 N/A