Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jd0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASP 8.A O no hydrogen 3.016 N/A THR 3.A OG1 PHE 5.A O no hydrogen 2.693 N/A PHE 5.A N THR 3.A OG1 no hydrogen 3.389 N/A GLY 9.A N GLY 6.A O no hydrogen 2.786 N/A SER 12.A N GLY 9.A O no hydrogen 2.861 N/A SER 12.A OG PRO 7.A O no hydrogen 3.195 N/A TRP 13.A N GLU 10.A O no hydrogen 3.433 N/A TRP 13.A NE1 THR 3.A O no hydrogen 2.889 N/A LYS 15.A N SER 12.A O no hydrogen 3.032 N/A LYS 15.A NZ SER 12.A OG no hydrogen 3.390 N/A LYS 16.A N TRP 13.A O no hydrogen 3.224 N/A TYR 17.A N TRP 13.A O no hydrogen 2.804 N/A CYS 20.A N TYR 17.A O no hydrogen 2.931 N/A GLY 21.A N PRO 18.A O no hydrogen 2.970 N/A GLY 22.A N SER 19.A O no hydrogen 2.922 N/A SER 26.A N SER 194.A OG no hydrogen 2.984 N/A SER 26.A OG TYR 191.A OH no hydrogen 2.810 N/A LEU 30.A N THR 104.A O no hydrogen 2.783 N/A HIS 31.A ND1 ASP 29.A OD2 no hydrogen 2.666 N/A SER 32.A OG ASP 33.A OD1 no hydrogen 3.338 N/A ILE 34.A N HIS 31.A O no hydrogen 3.030 N/A LEU 35.A N SER 32.A O no hydrogen 3.071 N/A GLN 36.A N VAL 255.A O no hydrogen 2.965 N/A GLN 36.A NE2 TYR 37.A O no hydrogen 3.212 N/A ASP 38.A N THR 257.A O no hydrogen 2.866 N/A SER 40.A N ASP 38.A OD2 no hydrogen 2.852 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 2.882 N/A SER 40.A OG ASP 38.A OD2 no hydrogen 2.591 N/A LEU 41.A N ASP 38.A O no hydrogen 3.108 N/A GLU 45.A N GLN 77.A O no hydrogen 2.800 N/A GLN 47.A N HIS 75.A O no hydrogen 2.904 N/A TYR 49.A OH HIS 118.A NE2 no hydrogen 2.849 N/A LEU 51.A N TYR 49.A O no hydrogen 2.990 N/A LEU 51.A N PHE 175.A O no hydrogen 3.237 N/A LYS 55.A N SER 52.A O no hydrogen 3.045 N/A PHE 57.A N VAL 172.A O no hydrogen 2.795 N/A LEU 59.A N ALA 170.A O no hydrogen 2.797 N/A THR 60.A N LYS 67.A O no hydrogen 2.775 N/A ASN 61.A N GLN 168.A O no hydrogen 3.105 N/A ASN 61.A ND2 VAL 163.A O no hydrogen 3.062 N/A ASN 61.A ND2 TYR 228.A O no hydrogen 3.029 N/A ASN 62.A N SER 65.A O no hydrogen 3.286 N/A GLY 63.A N ASN 61.A OD1 no hydrogen 2.788 N/A HIS 64.A N ASN 62.A OD1 no hydrogen 2.852 N/A SER 65.A N ASN 62.A OD1 no hydrogen 2.942 N/A SER 65.A OG VAL 66.A O no hydrogen 3.357 N/A SER 65.A OG LEU 90.A O no hydrogen 2.649 N/A LYS 67.A N THR 60.A O no hydrogen 2.853 N/A LEU 68.A N LEU 88.A O no hydrogen 2.873 N/A ASN 69.A N LEU 58.A O no hydrogen 2.863 N/A LEU 70.A N THR 86.A O no hydrogen 3.022 N/A MET 74.A N PRO 71.A O no hydrogen 3.235 N/A HIS 75.A N GLN 47.A O no hydrogen 2.707 N/A HIS 75.A ND1 ASP 73.A O no hydrogen 3.009 N/A ILE 76.A N TYR 83.A O no hydrogen 2.889 N/A GLN 77.A N GLU 45.A O no hydrogen 2.866 N/A ARG 82.A N ASP 122.A OD2 no hydrogen 2.746 N/A ARG 82.A NE SER 84.A OG no hydrogen 3.183 N/A ARG 82.A NH2 SER 72.A O no hydrogen 3.176 N/A TYR 83.A OH GLU 135.A O no hydrogen 2.969 N/A SER 84.A N TYR 119.A O no hydrogen 2.882 N/A SER 84.A OG SER 72.A O no hydrogen 3.320 N/A SER 84.A OG SER 121.A OG no hydrogen 2.762 N/A ALA 85.A N MET 74.A O no hydrogen 2.947 N/A THR 86.A N VAL 117.A O no hydrogen 2.950 N/A LEU 88.A N LEU 68.A O no hydrogen 3.002 N/A HIS 89.A N HIS 115.A O no hydrogen 2.987 N/A HIS 89.A ND1 GLN 87.A OE1 no hydrogen 2.902 N/A LEU 90.A N SER 65.A OG no hydrogen 3.257 N/A HIS 91.A N GLU 113.A O no hydrogen 2.973 N/A HIS 91.A ND1 ASN 243.A O no hydrogen 2.757 N/A TRP 92.A N ASN 243.A OD1 no hydrogen 2.812 N/A TRP 92.A NE1 MET 240.A O no hydrogen 2.886 N/A ASN 94.A N ASP 97.A O no hydrogen 3.289 N/A ASN 94.A ND2 ASN 242.A OD1 no hydrogen 2.879 N/A ASN 96.A N ASN 94.A OD1 no hydrogen 2.701 N/A ASP 97.A N ASN 94.A O no hydrogen 2.948 N/A HIS 99.A N ASP 97.A O no hydrogen 2.874 N/A GLY 100.A N ALA 111.A O no hydrogen 2.935 N/A SER 101.A N PHE 110.A O no hydrogen 3.009 N/A SER 101.A OG HIS 103.A O no hydrogen 2.737 N/A SER 101.A OG PHE 110.A O no hydrogen 3.483 N/A GLU 102.A N GLU 113.A OE2 no hydrogen 2.762 N/A HIS 103.A N GLU 113.A OE2 no hydrogen 2.855 N/A HIS 103.A ND1 GLU 113.A OE1 no hydrogen 2.833 N/A HIS 103.A NE2 TYR 191.A OH no hydrogen 2.686 N/A THR 104.A N ILE 28.A O no hydrogen 3.512 N/A THR 104.A OG1 ASP 29.A OD1 no hydrogen 2.601 N/A VAL 105.A N GLN 108.A O no hydrogen 2.951 N/A SER 106.A N LEU 30.A O no hydrogen 2.834 N/A GLY 107.A N ASP 29.A OD1 no hydrogen 2.729 N/A GLN 108.A N VAL 105.A O no hydrogen 2.876 N/A GLN 108.A NE2 SER 106.A O no hydrogen 3.093 N/A HIS 109.A ND1 SER 101.A O no hydrogen 2.841 N/A PHE 110.A N SER 101.A OG no hydrogen 2.802 N/A ALA 112.A N ILE 144.A O no hydrogen 3.146 N/A GLU 113.A N HIS 91.A O no hydrogen 2.991 N/A LEU 114.A N VAL 142.A O no hydrogen 2.906 N/A HIS 115.A N HIS 89.A O no hydrogen 2.910 N/A HIS 115.A NE2 GLU 113.A OE1 no hydrogen 2.737 N/A ILE 116.A N LEU 140.A O no hydrogen 2.903 N/A VAL 117.A N GLN 87.A O no hydrogen 2.746 N/A HIS 118.A N ALA 138.A O no hydrogen 2.856 N/A HIS 118.A ND1 ILE 116.A O no hydrogen 3.115 N/A HIS 118.A NE2 TYR 49.A OH no hydrogen 2.849 N/A TYR 119.A N SER 84.A O no hydrogen 2.812 N/A ASN 120.A N GLY 136.A O no hydrogen 2.801 N/A ASN 120.A ND2 GLU 135.A O no hydrogen 3.237 N/A SER 121.A N ARG 82.A O no hydrogen 3.231 N/A SER 121.A OG ARG 82.A O no hydrogen 3.400 N/A SER 121.A OG SER 84.A OG no hydrogen 2.762 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 3.102 N/A LEU 123.A N ASN 120.A OD1 no hydrogen 3.134 N/A TYR 124.A N ASN 120.A O no hydrogen 2.901 N/A TYR 124.A OH SER 134.A O no hydrogen 2.936 N/A THR 129.A N ASP 126.A OD1 no hydrogen 2.828 N/A THR 129.A OG1 ASP 126.A O no hydrogen 3.049 N/A THR 129.A OG1 ASP 126.A OD1 no hydrogen 3.266 N/A ALA 130.A N ASP 126.A O no hydrogen 3.118 N/A SER 131.A N ALA 127.A O no hydrogen 2.827 N/A SER 131.A OG SER 128.A O no hydrogen 2.810 N/A LYS 133.A N ALA 130.A O no hydrogen 3.029 N/A LYS 133.A NZ THR 129.A O no hydrogen 2.670 N/A LYS 133.A NZ ASN 132.A OD1 no hydrogen 3.060 N/A GLY 136.A N LYS 133.A O no hydrogen 2.968 N/A LEU 137.A N THR 203.A O no hydrogen 3.041 N/A ALA 138.A N HIS 118.A O no hydrogen 2.987 N/A VAL 139.A N LEU 205.A O no hydrogen 3.185 N/A LEU 140.A N ILE 116.A O no hydrogen 2.983 N/A ALA 141.A N THR 207.A O no hydrogen 2.841 N/A VAL 142.A N LEU 114.A O no hydrogen 2.889 N/A ILE 144.A N ALA 112.A O no hydrogen 2.928 N/A GLU 145.A N VAL 213.A O no hydrogen 2.939 N/A GLY 147.A N ILE 215.A O no hydrogen 2.715 N/A SER 148.A N GLN 214.A OE1 no hydrogen 2.980 N/A SER 148.A OG GLN 214.A OE1 no hydrogen 3.536 N/A ASN 150.A N GLN 219.A OE1 no hydrogen 2.884 N/A ASN 150.A ND2 GLN 214.A O no hydrogen 3.015 N/A SER 152.A OG GLU 179.A OE1 no hydrogen 2.637 N/A TYR 153.A N ASN 150.A OD1 no hydrogen 3.002 N/A TYR 153.A OH LEU 180.A O no hydrogen 2.722 N/A ASP 154.A N ASN 150.A O no hydrogen 3.070 N/A LYS 155.A N SER 152.A O no hydrogen 3.087 N/A LYS 155.A NZ GLU 179.A OE1 no hydrogen 2.887 N/A ILE 156.A N TYR 153.A O no hydrogen 2.985 N/A PHE 157.A N TYR 153.A O no hydrogen 2.984 N/A SER 158.A N ASP 154.A O no hydrogen 2.886 N/A SER 158.A OG ASP 154.A O no hydrogen 3.033 N/A HIS 159.A N ILE 156.A O no hydrogen 3.059 N/A LEU 160.A N PHE 157.A O no hydrogen 3.091 N/A HIS 162.A N HIS 159.A O no hydrogen 2.930 N/A VAL 163.A N LEU 160.A O no hydrogen 3.112 N/A LYS 164.A NZ GLN 161.A OE1 no hydrogen 2.887 N/A LYS 164.A NZ ALA 226.A O no hydrogen 2.815 N/A TYR 165.A N GLN 168.A OE1 no hydrogen 2.908 N/A LYS 166.A N THR 230.A O no hydrogen 3.190 N/A GLY 167.A N ASN 61.A O no hydrogen 2.747 N/A GLN 168.A N TYR 165.A O no hydrogen 3.063 N/A ALA 170.A N LEU 59.A O no hydrogen 2.891 N/A VAL 172.A N PHE 57.A O no hydrogen 2.808 N/A GLY 174.A N LYS 55.A O no hydrogen 2.900 N/A ILE 177.A N TYR 49.A O no hydrogen 2.925 N/A GLU 178.A N ASN 176.A OD1 no hydrogen 3.161 N/A GLU 179.A N ASN 176.A O no hydrogen 2.915 N/A LEU 180.A N ILE 177.A O no hydrogen 2.879 N/A LEU 181.A N GLU 178.A O no hydrogen 3.030 N/A GLU 187.A N ARG 184A.A O no hydrogen 2.951 N/A TYR 188.A N SER 258.A OG no hydrogen 2.811 N/A TYR 188.A OH THR 42.A O no hydrogen 2.683 N/A TYR 189.A N VAL 208.A O no hydrogen 2.729 N/A ARG 190.A N TYR 256.A O no hydrogen 2.742 N/A ARG 190.A NE TRP 206.A O no hydrogen 3.301 N/A ARG 190.A NE THR 207.A OG1 no hydrogen 3.019 N/A ARG 190.A NH1 THR 207.A OG1 no hydrogen 2.960 N/A TYR 191.A N TRP 206.A O no hydrogen 3.250 N/A TYR 191.A OH SER 26.A OG no hydrogen 2.810 N/A TYR 191.A OH HIS 103.A NE2 no hydrogen 2.686 N/A GLY 193.A N VAL 204.A O no hydrogen 2.707 N/A SER 194.A N SER 26.A OG no hydrogen 3.019 N/A SER 194.A OG LEU 195.A O no hydrogen 2.854 N/A LEU 195.A N ASN 201.A O no hydrogen 3.045 N/A THR 196.A OG1 GLU 102.A OE1 no hydrogen 2.597 N/A THR 196.A OG1 GLU 102.A OE2 no hydrogen 3.490 N/A CYS 200.A N THR 197.A O no hydrogen 2.807 N/A THR 203.A OG1 SER 131.A O no hydrogen 2.616 N/A VAL 204.A N GLY 193.A O no hydrogen 3.109 N/A LEU 205.A N LEU 137.A O no hydrogen 2.937 N/A TRP 206.A N TYR 191.A O no hydrogen 2.879 N/A TRP 206.A NE1 SER 194.A O no hydrogen 2.948 N/A THR 207.A N VAL 139.A O no hydrogen 3.144 N/A VAL 208.A N TYR 189.A O no hydrogen 2.933 N/A PHE 209.A N ALA 141.A O no hydrogen 3.066 N/A ARG 210.A N GLU 187.A O no hydrogen 2.972 N/A ARG 210.A NH1 GLU 187.A OE1 no hydrogen 2.747 N/A ASN 211.A ND2 GLU 183.A O no hydrogen 2.978 N/A VAL 213.A N LEU 143.A O no hydrogen 2.935 N/A ILE 215.A N GLU 145.A O no hydrogen 3.044 N/A SER 216.A N GLN 219.A OE1 no hydrogen 2.973 N/A GLN 219.A N SER 216.A OG no hydrogen 3.121 N/A GLN 219.A NE2 ASN 150.A O no hydrogen 2.930 N/A GLN 219.A NE2 ASP 154.A OD2 no hydrogen 2.917 N/A LEU 220.A N SER 216.A O no hydrogen 2.922 N/A LEU 221.A N GLN 217.A O no hydrogen 2.870 N/A ALA 222.A N GLU 218.A O no hydrogen 2.926 N/A LEU 223.A N GLN 219.A O no hydrogen 3.059 N/A GLU 224.A N LEU 220.A O no hydrogen 2.992 N/A THR 225.A N ALA 222.A O no hydrogen 3.222 N/A THR 225.A OG1 LEU 221.A O no hydrogen 2.720 N/A ALA 226.A N ALA 222.A O no hydrogen 2.862 N/A TYR 228.A N LYS 164.A O no hydrogen 2.739 N/A CYS 229.A N ARG 238A.A O no hydrogen 2.882 N/A CYS 229.A SG ARG 238A.A O no hydrogen 3.571 N/A HIS 231.A ND1 LYS 166.A O no hydrogen 3.196 N/A ASP 234.A N HIS 231.A O no hydrogen 3.239 N/A SER 236.A N ASP 234.A OD1 no hydrogen 2.638 N/A MET 240.A N LEU 227.A O no hydrogen 2.849 N/A ASN 242.A N GLY 93.A O no hydrogen 2.878 N/A ASN 243.A N TRP 92.A O no hydrogen 3.128 N/A ASN 243.A ND2 HIS 64.A O no hydrogen 3.002 N/A ASN 243.A ND2 LEU 90.A O no hydrogen 3.587 N/A ARG 245.A N GLU 102.A OE2 no hydrogen 2.856 N/A ARG 245.A NH1 SER 26.A O no hydrogen 2.914 N/A ARG 245.A NH2 CYS 20.A O no hydrogen 3.034 N/A GLN 246.A N GLU 10.A OE1 no hydrogen 2.814 N/A GLN 248.A N PRO 27.A O no hydrogen 2.797 N/A GLN 248.A NE2 GLN 246.A O no hydrogen 2.905 N/A ARG 253.A NH2 ARG 192.A O no hydrogen 2.809 N/A VAL 255.A N ILE 34.A O no hydrogen 2.826 N/A TYR 256.A N ARG 190.A O no hydrogen 3.086 N/A THR 257.A N GLN 36.A O no hydrogen 2.851 N/A THR 257.A OG1 PHE 259.A O no hydrogen 2.798 N/A SER 258.A N TYR 188.A O no hydrogen 3.046 N/A SER 258.A OG ALA 186.A O no hydrogen 2.587 N/A SER 258.A OG TYR 188.A O no hydrogen 3.537 N/A ARG 238A.A N THR 230.A OG1 no hydrogen 3.086 N/A ASN 54B.A N SER 52.A OG no hydrogen 3.127 N/A