Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jw9_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASP 30.A OD1 no hydrogen 3.417 N/A ALA 1.A N ASP 30.A OD2 no hydrogen 2.824 N/A SER 4.A N GLU 7.A OE1 no hydrogen 2.834 N/A SER 4.A OG GLN 6.A OE1 no hydrogen 3.344 N/A SER 4.A OG GLU 7.A OE1 no hydrogen 3.419 N/A GLU 7.A N SER 4.A OG no hydrogen 2.948 N/A MET 8.A N SER 4.A O no hydrogen 2.832 N/A LEU 9.A N ASP 5.A O no hydrogen 3.169 N/A ARG 10.A N GLN 6.A O no hydrogen 2.987 N/A ARG 10.A NH2 ILE 96.A O no hydrogen 3.020 N/A TYR 11.A N GLU 7.A O no hydrogen 2.809 N/A ASN 12.A N LEU 9.A O no hydrogen 3.306 N/A GLN 14.A N TYR 11.A O no hydrogen 2.945 N/A GLN 14.A NE2 GLN 25.A OE1 no hydrogen 2.931 N/A GLN 14.A NE2 ALA 52.A O no hydrogen 2.946 N/A ILE 15.A N TYR 11.A O no hydrogen 2.935 N/A ILE 16.A N ASN 12.A O no hydrogen 3.066 N/A LEU 17.A N GLN 14.A O no hydrogen 3.029 N/A PHE 20.A N LEU 17.A O no hydrogen 2.943 N/A ASP 21.A N LEU 17.A O no hydrogen 3.186 N/A GLY 24.A N PHE 20.A O no hydrogen 2.927 N/A GLN 25.A N ASP 21.A O no hydrogen 3.144 N/A GLN 25.A NE2 ALA 52.A O no hydrogen 2.926 N/A GLU 26.A N PHE 22.A O no hydrogen 2.809 N/A ALA 27.A N ASP 23.A O no hydrogen 2.891 N/A LEU 28.A N GLY 24.A O no hydrogen 3.045 N/A LYS 29.A N GLN 25.A O no hydrogen 3.015 N/A LYS 29.A NZ GLU 2.A O no hydrogen 2.653 N/A LYS 29.A NZ GLU 7.A OE1 no hydrogen 2.651 N/A LYS 29.A NZ GLU 7.A OE2 no hydrogen 3.276 N/A ASP 30.A N GLU 26.A O no hydrogen 3.025 N/A SER 31.A N LEU 28.A O no hydrogen 2.973 N/A SER 31.A OG ALA 27.A O no hydrogen 2.638 N/A ARG 32.A N ASP 122.A OD2 no hydrogen 2.832 N/A VAL 33.A N ASN 56.A O no hydrogen 2.930 N/A LEU 34.A N LEU 123.A O no hydrogen 3.076 N/A ILE 35.A N THR 58.A O no hydrogen 2.888 N/A VAL 36.A N LEU 125.A O no hydrogen 2.939 N/A GLY 37.A N LEU 60.A O no hydrogen 2.910 N/A LEU 38.A N ASP 61.A OD2 no hydrogen 2.796 N/A CYS 43.A N GLY 39.A O no hydrogen 2.860 N/A CYS 43.A SG LEU 38.A O no hydrogen 3.757 N/A CYS 43.A SG GLY 39.A O no hydrogen 3.256 N/A CYS 43.A SG HIS 76.A NE2 no hydrogen 3.530 N/A ALA 44.A N GLY 40.A O no hydrogen 3.030 N/A ALA 45.A N LEU 41.A O no hydrogen 2.875 N/A SER 46.A N GLY 42.A O no hydrogen 2.885 N/A SER 46.A OG GLY 42.A O no hydrogen 2.783 N/A SER 46.A OG CYS 43.A O no hydrogen 3.417 N/A GLN 47.A N CYS 43.A O no hydrogen 3.138 N/A LEU 49.A N ALA 45.A O no hydrogen 2.959 N/A ALA 50.A N SER 46.A O no hydrogen 2.856 N/A SER 51.A N GLN 47.A O no hydrogen 2.990 N/A SER 51.A OG GLN 47.A O no hydrogen 3.566 N/A SER 51.A OG TYR 48.A O no hydrogen 3.402 N/A ALA 52.A N TYR 48.A O no hydrogen 2.831 N/A GLY 53.A N ALA 50.A O no hydrogen 3.108 N/A VAL 54.A N LEU 49.A O no hydrogen 3.065 N/A GLY 55.A N LEU 28.A O no hydrogen 2.905 N/A ASN 56.A ND2 SER 31.A O no hydrogen 2.985 N/A LEU 57.A N ALA 101.A O no hydrogen 2.804 N/A THR 58.A N VAL 33.A O no hydrogen 2.919 N/A THR 58.A OG1 HIS 121.A NE2 no hydrogen 2.725 N/A LEU 59.A N THR 103.A O no hydrogen 2.792 N/A LEU 60.A N ILE 35.A O no hydrogen 2.916 N/A ASP 61.A N VAL 105.A O no hydrogen 3.277 N/A ASP 63.A N ASP 61.A OD1 no hydrogen 3.205 N/A VAL 65.A N GLN 83.A O no hydrogen 2.848 N/A SER 66.A N ASN 69.A OD1 no hydrogen 2.861 N/A ASN 69.A N SER 66.A O no hydrogen 3.132 N/A LEU 70.A N LEU 67.A O no hydrogen 3.306 N/A GLN 71.A NE2 VAL 184.A O no hydrogen 2.843 N/A ARG 72.A N ASN 69.A O no hydrogen 3.048 N/A ARG 72.A NH1 GLN 71.A OE1 no hydrogen 3.026 N/A GLN 73.A N ASN 69.A O no hydrogen 2.875 N/A HIS 76.A N GLN 73.A O no hydrogen 3.053 N/A HIS 76.A ND1 SER 88.A OG no hydrogen 2.795 N/A HIS 76.A NE2 LEU 38.A O no hydrogen 2.900 N/A SER 77.A N THR 80.A OG1 no hydrogen 3.140 N/A THR 80.A N SER 77.A O no hydrogen 2.828 N/A THR 80.A OG1 SER 77.A O no hydrogen 3.166 N/A THR 80.A OG1 SER 88.A OG no hydrogen 2.870 N/A VAL 81.A N ASP 78.A O no hydrogen 3.315 N/A GLY 82.A N VAL 65.A O no hydrogen 2.852 N/A GLN 83.A N THR 80.A O no hydrogen 2.860 N/A LYS 85.A N ASP 63.A O no hydrogen 2.868 N/A LYS 85.A NZ ASP 63.A OD2 no hydrogen 3.538 N/A SER 88.A N PRO 84.A O no hydrogen 3.080 N/A SER 88.A OG HIS 76.A ND1 no hydrogen 2.795 N/A SER 88.A OG THR 80.A OG1 no hydrogen 2.870 N/A ALA 89.A N LYS 85.A O no hydrogen 2.847 N/A ARG 90.A N VAL 86.A O no hydrogen 3.008 N/A ARG 90.A NE ASP 91.A OD1 no hydrogen 3.001 N/A ASP 91.A N GLU 87.A O no hydrogen 3.010 N/A ALA 92.A N SER 88.A O no hydrogen 3.238 N/A LEU 93.A N ALA 89.A O no hydrogen 2.813 N/A THR 94.A N ARG 90.A O no hydrogen 2.907 N/A ILE 96.A N ALA 92.A O no hydrogen 3.186 N/A ASN 97.A N LEU 93.A O no hydrogen 3.077 N/A ASN 97.A ND2 TYR 11.A OH no hydrogen 2.916 N/A ASN 97.A ND2 ALA 50.A O no hydrogen 2.873 N/A HIS 99.A N ASN 97.A OD1 no hydrogen 2.978 N/A ALA 101.A N GLY 55.A O no hydrogen 2.858 N/A THR 103.A N LEU 57.A O no hydrogen 2.756 N/A VAL 105.A N LEU 59.A O no hydrogen 2.653 N/A ASP 110.A N GLU 113.A OE1 no hydrogen 2.927 N/A GLU 113.A N ASP 110.A OD1 no hydrogen 2.861 N/A LEU 114.A N ASP 110.A O no hydrogen 2.850 N/A ALA 115.A N ASP 111.A O no hydrogen 2.969 N/A ALA 116.A N ALA 112.A O no hydrogen 3.433 N/A LEU 117.A N GLU 113.A O no hydrogen 2.974 N/A ILE 118.A N LEU 114.A O no hydrogen 2.782 N/A ALA 119.A N ALA 115.A O no hydrogen 3.122 N/A GLU 120.A N ALA 116.A O no hydrogen 3.147 N/A GLU 120.A N LEU 117.A O no hydrogen 3.222 N/A HIS 121.A N ILE 118.A O no hydrogen 2.918 N/A HIS 121.A ND1 LEU 117.A O no hydrogen 2.743 N/A HIS 121.A NE2 THR 58.A OG1 no hydrogen 2.725 N/A ASP 122.A N ARG 32.A O no hydrogen 2.781 N/A VAL 124.A N PRO 147.A O no hydrogen 2.895 N/A LEU 125.A N LEU 34.A O no hydrogen 2.761 N/A ASP 126.A N VAL 149.A O no hydrogen 2.981 N/A CYS 127.A N VAL 36.A O no hydrogen 2.919 N/A CYS 127.A SG GLN 196.A OE1 no hydrogen 3.632 N/A THR 128.A N ASP 126.A OD2 no hydrogen 3.004 N/A THR 128.A OG1 ASP 126.A OD2 no hydrogen 2.664 N/A ASN 130.A ND2 ASP 129.A OD1 no hydrogen 2.746 N/A VAL 133.A N ASN 130.A OD1 no hydrogen 2.826 N/A ARG 134.A N ASN 130.A O no hydrogen 3.102 N/A ARG 134.A NH1 GLY 151.A O no hydrogen 3.103 N/A ARG 134.A NH2 THR 128.A O no hydrogen 2.676 N/A ARG 134.A NH2 GLY 151.A O no hydrogen 2.664 N/A ASN 135.A N VAL 131.A O no hydrogen 2.860 N/A GLN 136.A N ALA 132.A O no hydrogen 3.076 N/A GLN 136.A NE2 LEU 109.A O no hydrogen 3.646 N/A GLN 136.A NE2 ASP 111.A OD1 no hydrogen 3.101 N/A LEU 137.A N VAL 133.A O no hydrogen 2.901 N/A ASN 138.A N ARG 134.A O no hydrogen 2.985 N/A ALA 139.A N ASN 135.A O no hydrogen 2.986 N/A GLY 140.A N GLN 136.A O no hydrogen 3.030 N/A CYS 141.A N LEU 137.A O no hydrogen 2.864 N/A CYS 141.A SG LEU 137.A O no hydrogen 3.315 N/A PHE 142.A N ASN 138.A O no hydrogen 2.819 N/A ALA 143.A N ALA 139.A O no hydrogen 3.119 N/A ALA 144.A N GLY 140.A O no hydrogen 3.163 N/A LYS 145.A N PHE 142.A O no hydrogen 3.410 N/A LYS 145.A NZ PHE 142.A O no hydrogen 2.813 N/A VAL 146.A N CYS 141.A O no hydrogen 3.064 N/A LEU 148.A N PHE 163.A O no hydrogen 2.952 N/A VAL 149.A N VAL 124.A O no hydrogen 2.848 N/A SER 150.A N THR 161.A O no hydrogen 2.911 N/A SER 150.A OG ASP 126.A OD1 no hydrogen 2.739 N/A GLY 151.A N ASP 126.A O no hydrogen 3.338 N/A ALA 152.A N GLN 159.A O no hydrogen 2.949 N/A ILE 154.A N GLU 157.A O no hydrogen 3.009 N/A ARG 155.A N GLY 183.A O no hydrogen 2.765 N/A GLU 157.A N ILE 154.A O no hydrogen 2.824 N/A GLY 158.A N TYR 218.A O no hydrogen 3.024 N/A GLN 159.A N ALA 152.A O no hydrogen 2.921 N/A GLN 159.A NE2 GLU 157.A OE2 no hydrogen 3.100 N/A ILE 160.A N VAL 216.A O no hydrogen 2.943 N/A THR 161.A N SER 150.A O no hydrogen 2.972 N/A THR 161.A OG1 LYS 214.A O no hydrogen 3.022 N/A VAL 162.A N ALA 211.A O no hydrogen 2.949 N/A PHE 163.A N LEU 148.A O no hydrogen 2.872 N/A THR 164.A N GLU 169.A OE2 no hydrogen 2.835 N/A THR 164.A OG1 GLU 169.A OE1 no hydrogen 2.468 N/A THR 164.A OG1 GLU 169.A OE2 no hydrogen 3.351 N/A GLN 166.A NE2 THR 164.A O no hydrogen 3.042 N/A GLU 169.A N GLN 166.A O no hydrogen 3.064 N/A CYS 171.A SG ASN 138.A OD1 no hydrogen 3.453 N/A ARG 173.A NE GLU 237.A OE1 no hydrogen 3.096 N/A ARG 173.A NE GLU 237.A OE2 no hydrogen 3.381 N/A ARG 173.A NH2 GLU 237.A OE2 no hydrogen 2.953 N/A CYS 174.A N CYS 171.A O no hydrogen 3.175 N/A LEU 175.A N TYR 172.A O no hydrogen 2.923 N/A SER 176.A N TYR 172.A O no hydrogen 2.852 N/A ARG 177.A N ARG 173.A O no hydrogen 3.013 N/A LEU 178.A N LEU 175.A O no hydrogen 2.883 N/A PHE 179.A N SER 176.A O no hydrogen 3.373 N/A MET 185.A N ARG 155.A O no hydrogen 3.141 N/A LEU 188.A N MET 185.A O no hydrogen 3.044 N/A ILE 189.A N ALA 186.A O no hydrogen 3.203 N/A VAL 191.A N PRO 187.A O no hydrogen 3.036 N/A ILE 192.A N LEU 188.A O no hydrogen 3.107 N/A GLY 193.A N ILE 189.A O no hydrogen 2.827 N/A SER 194.A N GLY 190.A O no hydrogen 2.979 N/A SER 194.A OG GLY 190.A O no hydrogen 2.644 N/A LEU 195.A N VAL 191.A O no hydrogen 3.035 N/A GLN 196.A N ILE 192.A O no hydrogen 2.930 N/A GLN 196.A NE2 ASP 126.A O no hydrogen 3.213 N/A GLN 196.A NE2 VAL 149.A O no hydrogen 3.231 N/A ALA 197.A N GLY 193.A O no hydrogen 2.969 N/A MET 198.A N SER 194.A O no hydrogen 2.890 N/A GLU 199.A N LEU 195.A O no hydrogen 2.888 N/A ALA 200.A N GLN 196.A O no hydrogen 2.924 N/A ILE 201.A N ALA 197.A O no hydrogen 2.938 N/A LYS 202.A N MET 198.A O no hydrogen 2.962 N/A LYS 202.A NZ GLU 199.A OE1 no hydrogen 2.791 N/A LYS 202.A NZ GLU 199.A OE2 no hydrogen 3.488 N/A LYS 202.A NZ LYS 209.A O no hydrogen 2.811 N/A MET 203.A N GLU 199.A O no hydrogen 3.000 N/A LEU 204.A N ALA 200.A O no hydrogen 2.912 N/A ALA 205.A N ILE 201.A O no hydrogen 2.989 N/A GLY 206.A N MET 203.A O no hydrogen 3.365 N/A TYR 207.A N LYS 202.A O no hydrogen 2.927 N/A ALA 211.A N GLU 199.A OE2 no hydrogen 2.830 N/A LYS 214.A NZ GLU 227.A OE1 no hydrogen 2.872 N/A ILE 215.A N MET 228.A O no hydrogen 2.823 N/A VAL 216.A N ILE 160.A O no hydrogen 2.907 N/A MET 217.A N ARG 226.A O no hydrogen 2.818 N/A TYR 218.A N GLY 158.A O no hydrogen 2.850 N/A ASP 219.A N GLN 224.A O no hydrogen 2.761 N/A ALA 220.A N MET 156.A O no hydrogen 2.898 N/A THR 222.A OG1 GLN 224.A OE1 no hydrogen 2.623 N/A CYS 223.A N ALA 220.A O no hydrogen 3.450 N/A GLN 224.A N ASP 219.A O no hydrogen 3.144 N/A ARG 226.A N MET 217.A O no hydrogen 2.903 N/A ARG 226.A NH1 PHE 225.A O no hydrogen 3.016 N/A MET 228.A N ILE 215.A O no hydrogen 3.055 N/A LEU 230.A N GLY 213.A O no hydrogen 2.859 N/A ARG 232.A NH1 GLN 166.A O no hydrogen 3.199 N/A ARG 232.A NH2 CYS 239.A O no hydrogen 3.344 N/A CYS 236.A N ASN 233.A O no hydrogen 3.056 N/A GLU 237.A N GLU 237.A OE1 no hydrogen 2.752 N/A GLY 240.A N CYS 236.A O no hydrogen 2.865 N/A