Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hwp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH VAL 50.A O no hydrogen 2.804 N/A VAL 6.A N LEU 56.A O no hydrogen 3.006 N/A PHE 8.A N ARG 58.A O no hydrogen 2.921 N/A LEU 10.A N THR 60.A O no hydrogen 2.897 N/A ALA 11.A N ASN 9.A OD1 no hydrogen 2.775 N/A ALA 13.A N LEU 10.A O no hydrogen 3.059 N/A LYS 14.A NZ GLY 12.A O no hydrogen 2.884 N/A TYR 18.A N LYS 14.A O no hydrogen 3.274 N/A TYR 18.A OH MET 160.A O no hydrogen 2.707 N/A ARG 19.A N SER 15.A O no hydrogen 3.053 N/A ARG 19.A NH1 ASP 20.A OD1 no hydrogen 2.876 N/A ASP 20.A N THR 16.A O no hydrogen 2.876 N/A PHE 21.A N THR 17.A O no hydrogen 2.914 N/A LEU 22.A N TYR 18.A O no hydrogen 2.958 N/A LYS 23.A N ARG 19.A O no hydrogen 3.184 N/A ASN 24.A N ASP 20.A O no hydrogen 3.107 N/A LEU 25.A N PHE 21.A O no hydrogen 3.184 N/A ARG 26.A N LEU 22.A O no hydrogen 2.956 N/A ARG 26.A NE ALA 165.A O no hydrogen 2.891 N/A ASP 27.A N LYS 23.A O no hydrogen 2.878 N/A ARG 28.A N ASN 24.A O no hydrogen 3.125 N/A ARG 28.A N LEU 25.A O no hydrogen 3.305 N/A VAL 29.A N LEU 25.A O no hydrogen 3.253 N/A ALA 30.A N ARG 26.A O no hydrogen 2.802 N/A TYR 34.A OH CYS 249.A O no hydrogen 2.715 N/A ASN 37.A N ASP 209.A OD1 no hydrogen 3.043 N/A LEU 39.A N VAL 36.A O no hydrogen 2.983 N/A VAL 41.A N TYR 34.A O no hydrogen 3.102 N/A LEU 42.A N LEU 245.A O no hydrogen 3.006 N/A ARG 43.A NE THR 31.A O no hydrogen 3.450 N/A ARG 43.A NH2 ARG 28.A O no hydrogen 3.095 N/A ASN 52.A N GLN 49.A O no hydrogen 3.035 N/A ARG 53.A N VAL 50.A O no hydrogen 3.329 N/A ARG 53.A NE ASP 72.A OD1 no hydrogen 2.740 N/A ARG 53.A NH2 ASP 72.A OD1 no hydrogen 2.831 N/A ARG 53.A NH2 ASP 72.A OD2 no hydrogen 2.683 N/A VAL 55.A N VAL 71.A O no hydrogen 2.973 N/A LEU 56.A N PRO 4.A O no hydrogen 2.922 N/A VAL 57.A N SER 69.A O no hydrogen 2.807 N/A ARG 58.A N VAL 6.A O no hydrogen 2.755 N/A ARG 58.A NE SER 7.A OG no hydrogen 3.319 N/A LEU 59.A N VAL 67.A O no hydrogen 2.819 N/A THR 60.A N PHE 8.A O no hydrogen 3.095 N/A ASN 61.A N ASP 65.A O no hydrogen 3.063 N/A ASN 61.A ND2 ASP 138.A OD1 no hydrogen 2.703 N/A TYR 62.A N ASP 138.A OD1 no hydrogen 2.819 N/A GLY 64.A N ASN 61.A O no hydrogen 2.753 N/A THR 66.A OG1 LEU 59.A O no hydrogen 3.137 N/A VAL 67.A N LEU 59.A O no hydrogen 2.730 N/A SER 69.A N VAL 57.A O no hydrogen 2.957 N/A ALA 70.A N ALA 80.A O no hydrogen 2.668 N/A VAL 71.A N VAL 55.A O no hydrogen 2.626 N/A ASP 72.A N TYR 77.A O no hydrogen 2.629 N/A VAL 73.A N ARG 53.A O no hydrogen 3.208 N/A THR 74.A N ASP 72.A OD1 no hydrogen 3.147 N/A THR 74.A OG1 ASP 72.A OD1 no hydrogen 2.725 N/A ASN 75.A N ASP 72.A O no hydrogen 2.874 N/A LEU 76.A N ASP 72.A O no hydrogen 2.648 N/A TYR 77.A N ASN 75.A OD1 no hydrogen 2.840 N/A VAL 79.A N TYR 77.A O no hydrogen 2.932 N/A ALA 80.A N ALA 70.A O no hydrogen 3.340 N/A SER 82.A N THR 68.A O no hydrogen 2.848 N/A SER 82.A OG ASN 86.A O no hydrogen 3.005 N/A ALA 83.A N ASN 86.A O no hydrogen 2.790 N/A ASN 84.A ND2 ASN 84.A O no hydrogen 2.966 N/A ASN 86.A ND2 ALA 83.A O no hydrogen 3.153 N/A SER 87.A N THR 106.A O no hydrogen 3.037 N/A SER 87.A OG THR 106.A O no hydrogen 3.033 N/A TYR 88.A N PHE 81.A O no hydrogen 3.039 N/A LYS 91.A NZ SER 111.A O no hydrogen 2.672 N/A THR 94.A N GLN 97.A OE1 no hydrogen 2.931 N/A LEU 96.A N THR 94.A OG1 no hydrogen 2.903 N/A LYS 98.A N THR 94.A O no hydrogen 2.894 N/A SER 99.A OG GLU 95.A OE1 no hydrogen 2.965 N/A ASN 100.A N GLN 97.A O no hydrogen 3.008 N/A ASN 100.A ND2 LEU 96.A O no hydrogen 3.609 N/A LEU 101.A N GLN 97.A O no hydrogen 2.886 N/A THR 105.A N PHE 102.A O no hydrogen 3.392 N/A THR 105.A OG1 PHE 102.A O no hydrogen 3.150 N/A THR 106.A N GLY 85.A O no hydrogen 3.184 N/A THR 106.A OG1 GLY 85.A O no hydrogen 2.998 N/A THR 106.A OG1 ASN 86.A OD1 no hydrogen 2.578 N/A THR 106.A OG1 HIS 108.A NE2 no hydrogen 2.997 N/A HIS 108.A N THR 106.A O no hydrogen 3.114 N/A HIS 108.A ND1 HIS 108.A O no hydrogen 3.019 N/A HIS 108.A NE2 ASN 86.A OD1 no hydrogen 3.335 N/A LEU 110.A N PHE 89.A O no hydrogen 2.614 N/A ASN 115.A N THR 113.A OG1 no hydrogen 2.831 N/A TYR 116.A OH GLU 194.A OE1 no hydrogen 2.961 N/A ASN 118.A ND2 ASN 115.A OD1 no hydrogen 3.175 N/A LEU 119.A N ASN 115.A O no hydrogen 2.960 N/A GLU 120.A N TYR 116.A O no hydrogen 2.891 N/A THR 121.A N ASP 117.A O no hydrogen 2.871 N/A ALA 122.A N ASN 118.A O no hydrogen 3.146 N/A ALA 122.A N LEU 119.A O no hydrogen 2.758 N/A ALA 123.A N LEU 119.A O no hydrogen 2.676 N/A THR 125.A N GLU 120.A O no hydrogen 3.185 N/A ARG 126.A NE GLU 120.A OE1 no hydrogen 3.471 N/A ARG 127.A N GLU 120.A OE2 no hydrogen 2.826 N/A ARG 127.A NH1 GLU 194.A OE1 no hydrogen 3.056 N/A ARG 127.A NH1 ASN 195.A OD1 no hydrogen 3.160 N/A ARG 127.A NH2 ASN 195.A OD1 no hydrogen 3.259 N/A GLU 128.A N GLU 128.A OE2 no hydrogen 2.962 N/A SER 129.A N ARG 126.A O no hydrogen 2.792 N/A SER 129.A OG ARG 126.A O no hydrogen 3.242 N/A ILE 130.A N ARG 127.A O no hydrogen 3.284 N/A LEU 132.A N PHE 184.A O no hydrogen 2.618 N/A LEU 137.A N GLY 133.A O no hydrogen 2.973 N/A ASP 138.A N PRO 134.A O no hydrogen 3.242 N/A GLY 139.A N ASN 135.A O no hydrogen 2.991 N/A ALA 140.A N PRO 136.A O no hydrogen 3.043 N/A ILE 141.A N LEU 137.A O no hydrogen 2.973 N/A THR 142.A N ASP 138.A O no hydrogen 2.881 N/A THR 142.A OG1 ASP 138.A O no hydrogen 2.648 N/A SER 143.A N GLY 139.A O no hydrogen 2.807 N/A SER 143.A OG ASP 147.A OD2 no hydrogen 2.867 N/A LEU 144.A N ALA 140.A O no hydrogen 2.904 N/A TRP 145.A N ILE 141.A O no hydrogen 2.689 N/A TYR 146.A N THR 142.A O no hydrogen 2.815 N/A GLY 149.A N SER 143.A O no hydrogen 3.255 N/A ARG 152.A NH2 GLU 131.A OE1 no hydrogen 2.882 N/A SER 153.A OG VAL 150.A O no hydrogen 3.334 N/A LEU 154.A N VAL 150.A O no hydrogen 3.451 N/A LEU 155.A N ALA 151.A O no hydrogen 2.834 N/A VAL 156.A N ARG 152.A O no hydrogen 3.047 N/A LEU 157.A N SER 153.A O no hydrogen 3.170 N/A ILE 158.A N LEU 154.A O no hydrogen 2.869 N/A GLN 159.A NE2 LEU 155.A O no hydrogen 3.237 N/A VAL 161.A N LEU 157.A O no hydrogen 2.981 N/A GLU 163.A N ILE 158.A O no hydrogen 3.153 N/A ALA 164.A N GLN 159.A O no hydrogen 3.179 N/A ALA 165.A N VAL 161.A O no hydrogen 2.663 N/A ALA 165.A N PRO 162.A O no hydrogen 2.837 N/A ARG 166.A N PRO 162.A O no hydrogen 3.099 N/A ARG 166.A N GLU 163.A O no hydrogen 3.141 N/A ARG 166.A NE GLU 163.A OE2 no hydrogen 3.224 N/A ARG 166.A NH1 GLU 163.A OE1 no hydrogen 3.376 N/A ARG 166.A NH2 LEU 76.A O no hydrogen 3.354 N/A PHE 167.A N GLU 163.A O no hydrogen 2.720 N/A ARG 168.A N GLY 241.A O no hydrogen 2.914 N/A ARG 168.A NE GLY 241.A O no hydrogen 3.189 N/A ARG 168.A NH2 ILE 242.A O no hydrogen 3.355 N/A TYR 169.A OH TYR 223.A OH no hydrogen 3.269 N/A GLU 171.A N PHE 167.A O no hydrogen 3.090 N/A GLN 172.A N ARG 168.A O no hydrogen 2.921 N/A GLU 173.A N TYR 169.A O no hydrogen 2.961 N/A VAL 174.A N ILE 170.A O no hydrogen 2.984 N/A VAL 174.A N GLU 171.A O no hydrogen 3.003 N/A ARG 175.A N GLU 171.A O no hydrogen 2.732 N/A ARG 176.A N GLN 172.A O no hydrogen 2.841 N/A SER 177.A OG THR 182.A O no hydrogen 3.491 N/A LEU 178.A N VAL 174.A O no hydrogen 2.880 N/A GLN 179.A N ARG 175.A O no hydrogen 3.041 N/A GLN 180.A N ARG 176.A O no hydrogen 2.863 N/A LEU 181.A N LEU 178.A O no hydrogen 3.172 N/A THR 182.A N SER 177.A O no hydrogen 2.815 N/A THR 182.A OG1 SER 183.A O no hydrogen 3.556 N/A PHE 184.A N LEU 132.A O no hydrogen 2.964 N/A ASN 187.A ND2 TYR 169.A OH no hydrogen 3.170 N/A MET 190.A N ASN 187.A OD1 no hydrogen 2.735 N/A LEU 191.A N ASN 187.A O no hydrogen 2.976 N/A SER 192.A N ALA 188.A O no hydrogen 2.831 N/A SER 192.A OG LEU 189.A O no hydrogen 2.844 N/A MET 193.A N LEU 189.A O no hydrogen 2.913 N/A GLU 194.A N MET 190.A O no hydrogen 3.055 N/A ASN 195.A N LEU 191.A O no hydrogen 3.129 N/A ASN 195.A N SER 192.A O no hydrogen 2.802 N/A ASN 196.A N SER 192.A O no hydrogen 2.937 N/A TRP 197.A NE1 ILE 244.A O no hydrogen 2.769 N/A MET 200.A N ASN 196.A O no hydrogen 3.136 N/A SER 201.A OG LEU 246.A O no hydrogen 2.560 N/A LEU 202.A N SER 198.A O no hydrogen 3.107 N/A GLU 203.A N SER 199.A O no hydrogen 2.987 N/A VAL 204.A N MET 200.A O no hydrogen 3.228 N/A VAL 204.A N SER 201.A O no hydrogen 3.195 N/A GLN 205.A N SER 201.A O no hydrogen 3.165 N/A LEU 206.A N LEU 202.A O no hydrogen 2.686 N/A SER 207.A N GLU 203.A O no hydrogen 3.478 N/A SER 207.A OG GLU 203.A O no hydrogen 3.024 N/A SER 207.A OG PRO 213.A O no hydrogen 2.767 N/A GLY 208.A N VAL 204.A O no hydrogen 3.107 N/A ASN 210.A N ASN 37.A OD1 no hydrogen 2.729 N/A VAL 211.A N GLY 208.A O no hydrogen 3.371 N/A SER 212.A OG GLU 234.A OE1 no hydrogen 2.821 N/A PHE 214.A N ASP 231.A O no hydrogen 2.600 N/A GLY 216.A N GLU 203.A OE1 no hydrogen 3.251 N/A VAL 218.A N VAL 230.A O no hydrogen 2.941 N/A LEU 220.A N VAL 218.A O no hydrogen 3.172 N/A LEU 220.A N ARG 228.A O no hydrogen 3.017 N/A GLN 221.A N SER 192.A OG no hydrogen 3.262 N/A ASN 222.A N THR 226.A O no hydrogen 2.879 N/A TYR 223.A OH TYR 169.A OH no hydrogen 3.269 N/A HIS 225.A N ASN 222.A O no hydrogen 2.830 N/A THR 226.A N ASP 224.A OD1 no hydrogen 2.902 N/A THR 226.A OG1 ASN 222.A OD1 no hydrogen 3.110 N/A THR 226.A OG1 ASP 224.A OD1 no hydrogen 2.595 N/A THR 226.A OG1 ASP 224.A OD2 no hydrogen 3.183 N/A ARG 228.A N LEU 220.A O no hydrogen 2.878 N/A ARG 228.A NH2 GLU 235.A OE2 no hydrogen 3.026 N/A VAL 230.A N VAL 218.A O no hydrogen 3.200 N/A ASN 232.A ND2 ASP 231.A OD2 no hydrogen 3.224 N/A PHE 233.A N SER 212.A O no hydrogen 2.830 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.800 N/A GLU 235.A N ASN 232.A OD1 no hydrogen 2.721 N/A LEU 236.A N ASN 232.A O no hydrogen 3.262 N/A TYR 237.A N PHE 233.A O no hydrogen 2.840 N/A LYS 238.A N GLU 234.A O no hydrogen 3.046 N/A THR 240.A N LEU 236.A O no hydrogen 2.846 N/A THR 240.A OG1 LEU 236.A O no hydrogen 2.632 N/A GLY 241.A N TYR 237.A O no hydrogen 2.739 N/A ILE 242.A N THR 240.A OG1 no hydrogen 3.204 N/A ALA 243.A N ARG 166.A O no hydrogen 2.789 N/A LEU 245.A N PRO 40.A O no hydrogen 2.950 N/A LEU 246.A N SER 201.A OG no hydrogen 2.700 N/A CYS 249.A SG VAL 250.A O no hydrogen 3.612 N/A