Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yjx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N LEU 219.A O no hydrogen 2.971 N/A TYR 3.A OH LYS 175.A O no hydrogen 3.058 N/A LYS 4.A NZ TYR 49.A OH no hydrogen 3.166 N/A LEU 5.A N TYR 217.A O no hydrogen 3.035 N/A VAL 6.A N VAL 180.A O no hydrogen 3.184 N/A LEU 7.A N ILE 215.A O no hydrogen 2.844 N/A ILE 8.A N ILE 182.A O no hydrogen 2.842 N/A ARG 9.A NH1 LEU 209.A O no hydrogen 2.863 N/A HIS 10.A N ALA 184.A O no hydrogen 3.190 N/A HIS 10.A ND1 GLY 11.A O no hydrogen 2.787 N/A GLU 12.A N GLU 36.A OE1 no hydrogen 3.251 N/A ALA 14.A N ASP 28.A O no hydrogen 2.730 N/A ASN 16.A N SER 13.A O no hydrogen 2.882 N/A ASN 16.A N SER 13.A OG no hydrogen 2.979 N/A LEU 17.A N SER 13.A O no hydrogen 3.350 N/A GLU 18.A N TRP 15.A O no hydrogen 3.143 N/A ASN 19.A N ASN 16.A O no hydrogen 2.976 N/A ARG 20.A N TRP 15.A O no hydrogen 2.930 N/A ARG 20.A NE GLU 18.A OE1 no hydrogen 3.156 N/A ARG 20.A NH1 GLY 96.A O no hydrogen 2.999 N/A ARG 20.A NH2 GLU 18.A OE1 no hydrogen 3.253 N/A PHE 21.A N LEU 97.A O no hydrogen 3.100 N/A TYR 25.A N SER 22.A O no hydrogen 2.813 N/A ALA 27.A N TYR 25.A O no hydrogen 2.830 N/A LEU 29.A N ASP 28.A OD1 no hydrogen 2.535 N/A SER 30.A N GLU 12.A O no hydrogen 2.834 N/A SER 30.A OG GLU 12.A O no hydrogen 3.295 N/A SER 30.A OG GLU 12.A OE2 no hydrogen 2.675 N/A GLY 33.A N SER 30.A OG no hydrogen 3.059 N/A HIS 34.A N SER 30.A O no hydrogen 2.855 N/A GLU 35.A N PRO 31.A O no hydrogen 2.899 N/A GLU 36.A N ALA 32.A O no hydrogen 2.846 N/A ALA 37.A N GLY 33.A O no hydrogen 3.168 N/A LYS 38.A N HIS 34.A O no hydrogen 2.978 N/A ARG 39.A N GLU 35.A O no hydrogen 2.839 N/A GLY 40.A N GLU 36.A O no hydrogen 2.728 N/A GLY 41.A N ALA 37.A O no hydrogen 2.583 N/A GLN 42.A N LYS 38.A O no hydrogen 2.887 N/A ALA 43.A N ARG 39.A O no hydrogen 2.886 N/A LEU 44.A N GLY 40.A O no hydrogen 3.152 N/A ARG 45.A N GLY 41.A O no hydrogen 2.862 N/A ARG 45.A NE ASP 46.A OD1 no hydrogen 3.065 N/A ASP 46.A N GLN 42.A O no hydrogen 2.817 N/A ALA 47.A N ALA 43.A O no hydrogen 2.850 N/A GLY 48.A N ARG 45.A O no hydrogen 2.966 N/A TYR 49.A N LEU 44.A O no hydrogen 2.979 N/A ASP 52.A N ARG 179.A O no hydrogen 2.758 N/A CYS 54.A N PRO 79.A O no hydrogen 2.949 N/A PHE 55.A N LEU 181.A O no hydrogen 2.931 N/A THR 56.A N VAL 81.A O no hydrogen 2.941 N/A THR 56.A OG1 ALA 183.A O no hydrogen 2.567 N/A SER 57.A OG HIS 185.A NE2 no hydrogen 2.637 N/A VAL 58.A N ASN 87.A OD1 no hydrogen 3.176 N/A GLN 59.A N SER 57.A OG no hydrogen 2.965 N/A GLN 59.A NE2 GLY 23.A O no hydrogen 2.967 N/A GLN 59.A NE2 TYR 25.A O no hydrogen 3.600 N/A LYS 60.A N ASP 26.A OD1 no hydrogen 2.649 N/A ARG 61.A NH1 HIS 10.A NE2 no hydrogen 3.519 N/A ARG 61.A NH2 GLY 23.A O no hydrogen 2.779 N/A ARG 61.A NH2 TYR 25.A O no hydrogen 2.889 N/A ALA 62.A N GLN 59.A O no hydrogen 2.947 N/A ILE 63.A N GLN 59.A O no hydrogen 2.994 N/A ARG 64.A N LYS 60.A O no hydrogen 2.574 N/A ARG 64.A NH1 ASP 28.A OD1 no hydrogen 2.446 N/A THR 65.A N ARG 61.A O no hydrogen 3.279 N/A THR 65.A OG1 ARG 61.A O no hydrogen 2.671 N/A LEU 66.A N ALA 62.A O no hydrogen 2.859 N/A TRP 67.A N ILE 63.A O no hydrogen 2.848 N/A THR 68.A N ARG 64.A O no hydrogen 2.921 N/A THR 68.A OG1 ARG 64.A O no hydrogen 3.027 N/A VAL 69.A N THR 65.A O no hydrogen 2.937 N/A LEU 70.A N LEU 66.A O no hydrogen 2.812 N/A ASP 71.A N TRP 67.A O no hydrogen 2.858 N/A ALA 72.A N THR 68.A O no hydrogen 2.911 N/A ILE 73.A N VAL 69.A O no hydrogen 2.908 N/A ASP 74.A N ASP 71.A O no hydrogen 3.135 N/A GLN 75.A N LEU 70.A O no hydrogen 2.842 N/A GLN 75.A NE2 PHE 51.A O no hydrogen 3.463 N/A LEU 78.A N GLN 75.A O no hydrogen 3.056 N/A VAL 81.A N CYS 54.A O no hydrogen 2.738 N/A THR 83.A N THR 56.A O no hydrogen 2.917 N/A ARG 85.A N THR 83.A OG1 no hydrogen 3.052 N/A ARG 85.A NH1 ARG 161.A O no hydrogen 3.054 N/A LEU 86.A N THR 83.A O no hydrogen 3.100 N/A ASN 87.A N TRP 84.A O no hydrogen 2.839 N/A ASN 87.A ND2 TYR 141.A OH no hydrogen 3.036 N/A GLU 88.A N GLN 59.A OE1 no hydrogen 2.735 N/A ARG 89.A N GLU 88.A OE1 no hydrogen 2.803 N/A ARG 89.A NE GLU 153.A O no hydrogen 2.944 N/A ARG 89.A NH2 TRP 114.A O no hydrogen 2.715 N/A HIS 90.A N GLU 153.A OE1 no hydrogen 2.861 N/A GLY 93.A N PRO 123.A O no hydrogen 2.618 N/A LEU 94.A N TYR 91.A O no hydrogen 3.060 N/A THR 95.A N GLY 92.A O no hydrogen 2.873 N/A THR 95.A OG1 GLY 92.A O no hydrogen 2.576 N/A GLY 96.A N PHE 21.A O no hydrogen 2.764 N/A LEU 97.A N LEU 94.A O no hydrogen 2.919 N/A LYS 99.A N ASN 19.A O no hydrogen 2.990 N/A GLU 101.A N ASN 98.A OD1 no hydrogen 2.930 N/A THR 102.A N ASN 98.A O no hydrogen 2.902 N/A THR 102.A OG1 ASN 98.A O no hydrogen 2.828 N/A ALA 103.A N LYS 99.A O no hydrogen 2.987 N/A ALA 104.A N ALA 100.A O no hydrogen 3.024 N/A LYS 105.A N GLU 101.A O no hydrogen 2.683 N/A HIS 106.A N THR 102.A O no hydrogen 2.898 N/A GLY 107.A N ALA 103.A O no hydrogen 2.763 N/A VAL 111.A N GLY 107.A O no hydrogen 3.087 N/A LYS 112.A N GLU 108.A O no hydrogen 2.807 N/A ILE 113.A N ALA 109.A O no hydrogen 3.047 N/A TRP 114.A N GLN 110.A O no hydrogen 3.146 N/A ARG 115.A N VAL 111.A O no hydrogen 2.592 N/A ARG 116.A N LYS 112.A O no hydrogen 2.720 N/A SER 117.A N ILE 113.A O no hydrogen 2.898 N/A SER 117.A OG ILE 113.A O no hydrogen 2.859 N/A SER 117.A OG VAL 120.A O no hydrogen 3.411 N/A VAL 120.A N SER 117.A OG no hydrogen 3.064 N/A MET 125.A N SER 151.A O no hydrogen 2.924 N/A HIS 129.A N GLU 126.A O no hydrogen 2.709 N/A HIS 129.A NE2 GLY 93.A O no hydrogen 3.103 N/A PHE 131.A N HIS 129.A ND1 no hydrogen 2.866 N/A TYR 132.A N HIS 129.A O no hydrogen 3.013 N/A ILE 135.A N PHE 131.A O no hydrogen 2.941 N/A SER 136.A OG TYR 132.A O no hydrogen 2.502 N/A LYS 137.A N SER 133.A O no hydrogen 3.071 N/A ASP 138.A N ILE 135.A O no hydrogen 3.047 N/A ARG 140.A N ASP 138.A OD2 no hydrogen 2.898 N/A ARG 140.A NE ASP 138.A OD2 no hydrogen 3.141 N/A ARG 140.A NH1 ASP 26.A OD2 no hydrogen 3.054 N/A ARG 140.A NH1 VAL 58.A O no hydrogen 3.009 N/A TYR 141.A N ASP 138.A O no hydrogen 2.886 N/A ALA 142.A N ARG 139.A O no hydrogen 2.842 N/A LEU 144.A N TYR 141.A O no hydrogen 3.025 N/A THR 145.A N GLN 148.A OE1 no hydrogen 2.856 N/A GLN 148.A N THR 145.A OG1 no hydrogen 3.150 N/A LEU 149.A N THR 145.A O no hydrogen 3.255 N/A CYS 152.A SG PRO 122.A O no hydrogen 3.611 N/A CYS 152.A SG SER 151.A OG no hydrogen 3.714 N/A GLU 153.A N HIS 90.A O no hydrogen 2.896 N/A SER 154.A N ASP 157.A OD2 no hydrogen 2.851 N/A SER 154.A OG ASP 157.A OD2 no hydrogen 2.992 N/A LYS 156.A N TYR 118.A O no hydrogen 2.947 N/A ASP 157.A N SER 154.A OG no hydrogen 3.096 N/A THR 158.A N SER 154.A O no hydrogen 3.075 N/A THR 158.A OG1 SER 154.A O no hydrogen 3.185 N/A ILE 159.A N LEU 155.A O no hydrogen 3.016 N/A ALA 160.A N LYS 156.A O no hydrogen 3.041 N/A ARG 161.A N ASP 157.A O no hydrogen 3.052 N/A ARG 161.A N THR 158.A O no hydrogen 2.975 N/A ARG 161.A NE GLU 153.A OE1 no hydrogen 3.420 N/A ARG 161.A NE GLU 153.A OE2 no hydrogen 2.897 N/A ARG 161.A NH1 ARG 85.A O no hydrogen 2.888 N/A ARG 161.A NH1 ASN 87.A O no hydrogen 2.817 N/A ARG 161.A NH2 ASN 87.A O no hydrogen 3.221 N/A ARG 161.A NH2 GLU 88.A O no hydrogen 2.841 N/A ARG 161.A NH2 GLU 153.A OE1 no hydrogen 2.762 N/A ALA 162.A N ILE 159.A O no hydrogen 3.058 N/A LEU 163.A N ILE 159.A O no hydrogen 2.976 N/A PHE 165.A N ALA 162.A O no hydrogen 2.976 N/A TRP 166.A N ALA 162.A O no hydrogen 3.031 N/A ASN 167.A N LEU 163.A O no hydrogen 2.698 N/A GLU 168.A N PRO 164.A O no hydrogen 2.984 N/A GLU 169.A N PHE 165.A O no hydrogen 2.712 N/A ILE 170.A N PHE 165.A O no hydrogen 3.390 N/A VAL 171.A N TRP 166.A O no hydrogen 2.791 N/A ILE 174.A N ILE 170.A O no hydrogen 3.107 N/A LYS 175.A N VAL 171.A O no hydrogen 2.894 N/A GLU 176.A N PRO 172.A O no hydrogen 3.025 N/A GLU 176.A N GLN 173.A O no hydrogen 3.057 N/A GLY 177.A N ILE 174.A O no hydrogen 3.037 N/A LYS 178.A N GLN 173.A O no hydrogen 3.148 N/A ARG 179.A N ASP 52.A OD2 no hydrogen 2.709 N/A ARG 179.A NH1 ASP 52.A OD2 no hydrogen 3.060 N/A LEU 181.A N ILE 53.A O no hydrogen 3.204 N/A ILE 182.A N VAL 6.A O no hydrogen 2.896 N/A ALA 183.A N PHE 55.A O no hydrogen 2.935 N/A ALA 184.A N ILE 8.A O no hydrogen 3.012 N/A HIS 185.A N SER 188.A OG no hydrogen 3.208 N/A HIS 185.A ND1 HIS 10.A NE2 no hydrogen 3.106 N/A HIS 185.A NE2 SER 57.A OG no hydrogen 2.637 N/A ASN 187.A N GLU 88.A OE1 no hydrogen 3.285 N/A ASN 187.A ND2 GLU 88.A OE1 no hydrogen 2.739 N/A SER 188.A OG LEU 86.A O no hydrogen 2.865 N/A SER 188.A OG HIS 185.A O no hydrogen 3.122 N/A LEU 189.A N HIS 185.A O no hydrogen 2.848 N/A ARG 190.A N GLY 186.A O no hydrogen 2.943 N/A ARG 190.A NE LEU 207.A O no hydrogen 3.096 N/A ARG 190.A NH2 LEU 207.A O no hydrogen 2.981 N/A ARG 190.A NH2 ASN 208.A OD1 no hydrogen 3.325 N/A GLY 191.A N ASN 187.A O no hydrogen 3.189 N/A ILE 192.A N SER 188.A O no hydrogen 3.386 N/A VAL 193.A N LEU 189.A O no hydrogen 2.900 N/A LYS 194.A N ARG 190.A O no hydrogen 2.693 N/A HIS 195.A N GLY 191.A O no hydrogen 3.085 N/A LEU 196.A N ILE 192.A O no hydrogen 2.849 N/A GLU 197.A N VAL 193.A O no hydrogen 2.897 N/A GLY 198.A N HIS 195.A O no hydrogen 3.403 N/A LEU 199.A N LYS 194.A O no hydrogen 3.150 N/A ALA 203.A N SER 200.A OG no hydrogen 2.824 N/A ILE 204.A N SER 200.A O no hydrogen 2.943 N/A MET 205.A N GLU 201.A O no hydrogen 3.075 N/A GLU 206.A N ALA 203.A O no hydrogen 2.961 N/A LEU 207.A N ALA 203.A O no hydrogen 3.213 N/A THR 211.A OG1 GLU 36.A OE2 no hydrogen 2.800 N/A GLY 212.A N ARG 9.A O no hydrogen 2.716 N/A ILE 215.A N LEU 7.A O no hydrogen 2.760 N/A VAL 216.A N GLN 230.A O no hydrogen 2.892 N/A TYR 217.A N LEU 5.A O no hydrogen 2.819 N/A TYR 217.A OH GLU 197.A OE2 no hydrogen 2.507 N/A LEU 219.A N TYR 3.A O no hydrogen 3.167 N/A ASP 220.A N LYS 224.A O no hydrogen 2.990 N/A ASN 222.A N ASP 220.A OD1 no hydrogen 2.526 N/A LYS 224.A N ASP 220.A OD1 no hydrogen 3.246 N/A ILE 226.A N GLU 218.A O no hydrogen 2.746 N/A GLN 230.A N VAL 216.A O no hydrogen 3.217 N/A LEU 232.A N PRO 214.A O no hydrogen 3.145 N/A THR 237.A N ASP 234.A O no hydrogen 2.848 N/A THR 237.A N ASP 234.A OD1 no hydrogen 2.937 N/A THR 237.A OG1 ASP 234.A OD1 no hydrogen 2.428 N/A VAL 238.A N ASP 234.A O no hydrogen 2.922 N/A ARG 239.A N GLU 235.A O no hydrogen 2.532 N/A LYS 240.A N GLU 236.A O no hydrogen 3.289 N/A ALA 241.A N THR 237.A O no hydrogen 3.113 N/A MET 242.A N VAL 238.A O no hydrogen 2.523 N/A GLU 243.A N ARG 239.A O no hydrogen 2.862 N/A ALA 244.A N ALA 241.A O no hydrogen 3.393 N/A