Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4puz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ILE 71.A O no hydrogen 3.002 N/A ASP 4.A N TYR 28.A OH no hydrogen 3.163 N/A ARG 5.A NE GLU 75.A OE2 no hydrogen 2.469 N/A ARG 5.A NH1 ARG 5.A O no hydrogen 3.524 N/A ARG 5.A NH2 GLU 75.A OE1 no hydrogen 3.351 N/A LYS 6.A N ASP 4.A OD1 no hydrogen 3.025 N/A LEU 7.A N ASP 4.A O no hydrogen 2.845 N/A LEU 8.A N ARG 5.A O no hydrogen 2.765 N/A THR 9.A N TYR 27.A O no hydrogen 3.008 N/A GLU 11.A N LYS 25.A O no hydrogen 3.014 N/A LEU 15.A N VAL 23.A O no hydrogen 2.568 N/A SER 17.A OG GLY 21.A O no hydrogen 3.134 N/A GLY 18.A N GLY 21.A O no hydrogen 3.148 N/A GLY 21.A N GLY 18.A O no hydrogen 3.249 N/A THR 22.A N ILE 41.A O no hydrogen 3.104 N/A VAL 23.A N GLY 16.A O no hydrogen 3.302 N/A LYS 24.A N VAL 39.A O no hydrogen 2.887 N/A GLY 26.A N VAL 37.A O no hydrogen 2.839 N/A TYR 27.A N THR 9.A O no hydrogen 2.827 N/A TYR 28.A N LYS 35.A O no hydrogen 2.723 N/A GLN 29.A N LEU 7.A O no hydrogen 2.931 N/A MET 30.A N VAL 33.A O no hydrogen 2.739 N/A LYS 35.A N TYR 28.A O no hydrogen 2.784 N/A VAL 37.A N GLY 26.A O no hydrogen 2.846 N/A ALA 38.A N MET 81.A O no hydrogen 2.896 N/A VAL 39.A N LYS 24.A O no hydrogen 2.766 N/A LYS 40.A N LEU 79.A O no hydrogen 2.946 N/A LYS 40.A NZ GLU 53.A OE1 no hydrogen 3.232 N/A LYS 40.A NZ GLU 53.A OE2 no hydrogen 2.823 N/A LYS 40.A NZ ASP 145.A OD1 no hydrogen 2.719 N/A ILE 41.A N THR 22.A O no hydrogen 2.562 N/A LEU 42.A N TRP 77.A O no hydrogen 2.990 N/A LYS 43.A N PHE 20.A O no hydrogen 2.857 N/A GLU 49.A N ALA 45.A O no hydrogen 3.463 N/A LEU 50.A N LEU 46.A O no hydrogen 2.925 N/A LEU 51.A N LYS 47.A O no hydrogen 2.858 N/A ALA 52.A N ASP 48.A O no hydrogen 2.735 N/A GLU 53.A N GLU 49.A O no hydrogen 2.885 N/A ALA 54.A N LEU 50.A O no hydrogen 2.932 N/A ASN 55.A N LEU 51.A O no hydrogen 2.791 N/A ASN 55.A ND2 LEU 51.A O no hydrogen 3.103 N/A VAL 56.A N ALA 52.A O no hydrogen 3.011 N/A MET 57.A N GLU 53.A O no hydrogen 2.966 N/A GLN 58.A N ALA 54.A O no hydrogen 2.686 N/A GLN 59.A N VAL 56.A O no hydrogen 2.914 N/A GLN 59.A NE2 ASN 55.A O no hydrogen 3.298 N/A LEU 60.A N MET 57.A O no hydrogen 3.292 N/A ASP 61.A N TYR 117.A OH no hydrogen 3.193 N/A TYR 64.A N ASN 62.A OD1 no hydrogen 2.865 N/A ILE 65.A N ASN 62.A O no hydrogen 3.267 N/A VAL 66.A N ILE 143.A O no hydrogen 3.018 N/A ILE 69.A N VAL 80.A O no hydrogen 2.627 N/A GLY 70.A N VAL 80.A O no hydrogen 3.296 N/A ILE 71.A N VAL 1.A O no hydrogen 3.381 N/A CYS 72.A N MET 78.A O no hydrogen 3.055 N/A CYS 72.A SG LEU 3.A O no hydrogen 3.735 N/A MET 78.A N CYS 72.A O no hydrogen 3.271 N/A LEU 79.A N LYS 40.A O no hydrogen 2.916 N/A VAL 80.A N GLY 70.A O no hydrogen 2.860 N/A MET 81.A N ALA 38.A O no hydrogen 2.870 N/A GLU 82.A N ARG 67.A O no hydrogen 2.837 N/A MET 83.A N THR 36.A O no hydrogen 3.126 N/A LEU 89.A N VAL 133.A O no hydrogen 2.757 N/A TYR 92.A N PRO 88.A O no hydrogen 3.147 N/A TYR 92.A OH GLN 138.A OE1 no hydrogen 2.888 N/A LEU 93.A N LEU 89.A O no hydrogen 3.237 N/A GLN 94.A N ASN 90.A O no hydrogen 2.878 N/A GLN 94.A NE2 GLY 199.A O no hydrogen 3.345 N/A GLN 95.A N TYR 92.A O no hydrogen 3.088 N/A ASN 96.A N LEU 93.A O no hydrogen 3.285 N/A ILE 104.A N ASP 101.A O no hydrogen 2.909 N/A ILE 105.A N ASP 101.A O no hydrogen 3.322 N/A LEU 107.A N ASN 103.A O no hydrogen 3.175 N/A VAL 108.A N ILE 104.A O no hydrogen 2.832 N/A HIS 109.A N ILE 105.A O no hydrogen 2.851 N/A HIS 109.A NE2 GLU 253.A OE2 no hydrogen 3.264 N/A GLN 110.A N GLU 106.A O no hydrogen 3.270 N/A GLN 110.A NE2 HIS 139.A O no hydrogen 3.531 N/A VAL 111.A N LEU 107.A O no hydrogen 3.073 N/A SER 112.A N VAL 108.A O no hydrogen 2.978 N/A SER 112.A OG HIS 109.A O no hydrogen 2.688 N/A MET 113.A N HIS 109.A O no hydrogen 2.697 N/A GLY 114.A N GLN 110.A O no hydrogen 2.865 N/A MET 115.A N VAL 111.A O no hydrogen 2.758 N/A LYS 116.A N SER 112.A O no hydrogen 2.706 N/A LYS 116.A NZ GLU 120.A OE1 no hydrogen 2.288 N/A TYR 117.A N MET 113.A O no hydrogen 3.122 N/A LEU 118.A N GLY 114.A O no hydrogen 3.129 N/A GLU 119.A N MET 115.A O no hydrogen 2.849 N/A GLU 120.A N LYS 116.A O no hydrogen 2.791 N/A SER 121.A N TYR 117.A O no hydrogen 2.912 N/A SER 121.A OG TYR 117.A O no hydrogen 2.464 N/A ASN 122.A N GLU 119.A O no hydrogen 2.578 N/A PHE 123.A N LEU 118.A O no hydrogen 2.913 N/A VAL 124.A N LYS 150.A O no hydrogen 2.806 N/A HIS 125.A N ASP 184.A OD2 no hydrogen 2.857 N/A HIS 125.A NE2 SER 144.A O no hydrogen 2.965 N/A ARG 126.A N ASP 184.A OD1 no hydrogen 3.064 N/A ARG 126.A NH1 LEU 148.A O no hydrogen 2.735 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 2.919 N/A ALA 130.A N GLU 194.A OE1 no hydrogen 3.086 N/A ARG 131.A NH2 ASP 127.A OD1 no hydrogen 3.160 N/A ASN 132.A N ALA 129.A O no hydrogen 2.803 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.711 N/A VAL 133.A N ALA 130.A O no hydrogen 2.993 N/A LEU 134.A N LYS 142.A O no hydrogen 2.591 N/A LEU 135.A N GLY 87.A O no hydrogen 2.868 N/A VAL 136.A N TYR 140.A O no hydrogen 2.774 N/A HIS 139.A N THR 137.A OG1 no hydrogen 3.164 N/A TYR 140.A N THR 137.A O no hydrogen 3.178 N/A TYR 140.A OH PRO 63.A O no hydrogen 2.537 N/A ALA 141.A N GLN 110.A OE1 no hydrogen 3.290 N/A LYS 142.A N LEU 134.A O no hydrogen 2.697 N/A ILE 143.A N TYR 64.A O no hydrogen 2.977 N/A SER 144.A N ASN 132.A O no hydrogen 2.837 N/A SER 144.A OG ASN 132.A O no hydrogen 3.303 N/A SER 144.A OG ASP 145.A OD2 no hydrogen 2.970 N/A PHE 146.A N GLU 53.A OE2 no hydrogen 3.261 N/A SER 149.A N PHE 146.A O no hydrogen 3.304 N/A SER 149.A OG HIS 125.A O no hydrogen 3.097 N/A LYS 150.A N VAL 124.A O no hydrogen 2.928 N/A LEU 152.A N ASN 122.A O no hydrogen 2.724 N/A ARG 153.A NE ASP 155.A OD1 no hydrogen 2.884 N/A ARG 153.A NH1 ASP 155.A OD1 no hydrogen 3.239 N/A ARG 153.A NH1 ASP 155.A OD2 no hydrogen 2.286 N/A GLU 156.A N ARG 153.A O no hydrogen 3.232 N/A TYR 159.A N PHE 179.A O no hydrogen 2.727 N/A LYS 160.A NZ ALA 161.A O no hydrogen 3.043 N/A ALA 161.A N TYR 177.A O no hydrogen 3.123 N/A LYS 167.A NZ MET 206.A O no hydrogen 2.784 N/A TRP 168.A N PRO 165.A O no hydrogen 2.627 N/A TRP 168.A NE1 GLU 194.A OE1 no hydrogen 2.882 N/A TYR 169.A N VAL 166.A O no hydrogen 3.070 N/A TYR 169.A OH ARG 126.A O no hydrogen 2.804 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.631 N/A CYS 173.A N ALA 170.A O no hydrogen 3.084 N/A CYS 173.A SG LYS 178.A O no hydrogen 3.530 N/A ILE 174.A N ALA 170.A O no hydrogen 3.320 N/A ASN 175.A N PRO 171.A O no hydrogen 2.736 N/A ASN 175.A ND2 TYR 241.A OH no hydrogen 3.366 N/A TYR 176.A N GLU 172.A O no hydrogen 2.764 N/A LYS 178.A N GLU 172.A O no hydrogen 3.487 N/A PHE 179.A N TYR 159.A O no hydrogen 2.875 N/A SER 180.A N SER 183.A OG no hydrogen 3.046 N/A LYS 182.A NZ VAL 243.A O no hydrogen 3.105 N/A SER 183.A N SER 180.A OG no hydrogen 3.248 N/A SER 183.A OG GLU 172.A OE2 no hydrogen 3.158 N/A SER 183.A OG LYS 178.A O no hydrogen 3.412 N/A ASP 184.A N SER 180.A O no hydrogen 3.093 N/A VAL 185.A N SER 181.A O no hydrogen 2.753 N/A TRP 186.A N LYS 182.A O no hydrogen 2.962 N/A SER 187.A N SER 183.A O no hydrogen 3.076 N/A SER 187.A OG TRP 168.A O no hydrogen 2.560 N/A SER 187.A OG SER 183.A O no hydrogen 3.268 N/A PHE 188.A N ASP 184.A O no hydrogen 2.771 N/A GLY 189.A N VAL 185.A O no hydrogen 3.097 N/A GLY 189.A N TRP 186.A O no hydrogen 2.834 N/A VAL 190.A N TRP 186.A O no hydrogen 3.204 N/A LEU 191.A N SER 187.A O no hydrogen 2.749 N/A MET 192.A N PHE 188.A O no hydrogen 2.898 N/A TRP 193.A N GLY 189.A O no hydrogen 2.833 N/A TRP 193.A NE1 GLY 222.A O no hydrogen 3.104 N/A GLU 194.A N VAL 190.A O no hydrogen 2.989 N/A ALA 195.A N LEU 191.A O no hydrogen 2.858 N/A PHE 196.A N MET 192.A O no hydrogen 3.005 N/A SER 197.A N GLU 194.A O no hydrogen 2.722 N/A SER 197.A OG TRP 193.A O no hydrogen 3.198 N/A TYR 198.A N ALA 195.A O no hydrogen 2.733 N/A TYR 198.A OH VAL 99.A O no hydrogen 2.717 N/A GLY 199.A N GLU 194.A O no hydrogen 3.078 N/A GLN 200.A N SER 197.A O no hydrogen 3.128 N/A GLN 200.A NE2 SER 197.A O no hydrogen 3.690 N/A MET 206.A N TYR 203.A O no hydrogen 2.995 N/A LYS 207.A N GLU 210.A OE1 no hydrogen 2.838 N/A GLU 210.A N LYS 207.A O no hydrogen 2.854 N/A VAL 211.A N LYS 207.A O no hydrogen 2.917 N/A VAL 211.A N GLY 208.A O no hydrogen 2.785 N/A THR 212.A N GLY 208.A O no hydrogen 2.808 N/A ALA 213.A N SER 209.A O no hydrogen 3.221 N/A MET 214.A N GLU 210.A O no hydrogen 3.140 N/A LEU 215.A N VAL 211.A O no hydrogen 3.104 N/A GLU 216.A N THR 212.A O no hydrogen 3.312 N/A LYS 217.A N ALA 213.A O no hydrogen 2.974 N/A LYS 217.A NZ GLU 219.A OE1 no hydrogen 3.533 N/A GLY 218.A N LEU 215.A O no hydrogen 2.785 N/A GLU 219.A N MET 214.A O no hydrogen 3.085 N/A ARG 220.A NE TRP 239.A O no hydrogen 3.071 N/A ARG 220.A NH1 LEU 215.A O no hydrogen 3.062 N/A ARG 220.A NH1 GLU 219.A O no hydrogen 2.931 N/A ARG 220.A NH2 TRP 239.A O no hydrogen 2.988 N/A CYS 223.A SG PRO 224.A O no hydrogen 3.789 N/A CYS 227.A N PRO 224.A O no hydrogen 2.825 N/A CYS 227.A SG PRO 228.A O no hydrogen 3.285 N/A TYR 232.A OH MET 221.A O no hydrogen 2.449 N/A ASP 233.A N ARG 229.A O no hydrogen 2.885 N/A LEU 234.A N GLU 230.A O no hydrogen 2.456 N/A MET 235.A N MET 231.A O no hydrogen 3.179 N/A ASN 236.A N TYR 232.A O no hydrogen 3.135 N/A ASN 236.A ND2 TYR 232.A O no hydrogen 3.169 N/A LEU 237.A N ASP 233.A O no hydrogen 3.309 N/A CYS 238.A N LEU 234.A O no hydrogen 2.869 N/A CYS 238.A SG LEU 234.A O no hydrogen 3.315 N/A TRP 239.A N MET 235.A O no hydrogen 2.914 N/A THR 240.A N LEU 237.A O no hydrogen 3.051 N/A THR 240.A OG1 LEU 237.A O no hydrogen 2.586 N/A GLU 244.A N ASP 242.A OD2 no hydrogen 3.446 N/A ASN 245.A N ASP 242.A O no hydrogen 2.988 N/A ARG 246.A N ASP 242.A O no hydrogen 3.070 N/A ARG 246.A N VAL 243.A O no hydrogen 2.832 N/A ARG 246.A NE THR 240.A O no hydrogen 2.873 N/A ARG 246.A NH1 GLU 172.A OE2 no hydrogen 2.736 N/A ARG 246.A NH1 LYS 182.A O no hydrogen 3.090 N/A ARG 246.A NH2 GLU 172.A OE1 no hydrogen 2.996 N/A ARG 246.A NH2 GLU 172.A OE2 no hydrogen 3.456 N/A ARG 246.A NH2 THR 240.A O no hydrogen 3.112 N/A ARG 246.A NH2 TYR 241.A O no hydrogen 3.379 N/A ALA 250.A N GLU 119.A OE1 no hydrogen 3.193 N/A VAL 252.A N GLY 248.A O no hydrogen 2.853 N/A GLU 253.A N PHE 249.A O no hydrogen 2.855 N/A LEU 254.A N ALA 250.A O no hydrogen 3.330 N/A ARG 255.A N ALA 251.A O no hydrogen 3.202 N/A LEU 256.A N VAL 252.A O no hydrogen 3.151 N/A ARG 257.A N GLU 253.A O no hydrogen 2.474 N/A TYR 259.A N ARG 255.A O no hydrogen 3.174 N/A ASP 262.A N TYR 259.A O no hydrogen 3.201 N/A VAL 263.A N TYR 260.A O no hydrogen 2.397 N/A