Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pum_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE GLU 57.A OE2 no hydrogen 3.032 N/A ARG 3.A NH2 THR 67.A OG1 no hydrogen 3.282 N/A LEU 4.A N LEU 55.A O no hydrogen 2.808 N/A LEU 6.A N GLU 57.A O no hydrogen 2.842 N/A THR 8.A N THR 59.A O no hydrogen 2.722 N/A VAL 9.A N THR 12.A OG1 no hydrogen 2.671 N/A THR 12.A N VAL 9.A O no hydrogen 2.985 N/A THR 12.A OG1 ARG 7.A O no hydrogen 2.816 N/A THR 12.A OG1 VAL 9.A O no hydrogen 3.046 N/A THR 13.A N GLU 16.A OE1 no hydrogen 2.607 N/A GLY 14.A N ASN 181.A OD1 no hydrogen 2.955 N/A GLU 16.A N THR 13.A OG1 no hydrogen 3.028 N/A TYR 17.A N THR 13.A O no hydrogen 3.122 N/A TYR 17.A OH MET 162.A O no hydrogen 2.520 N/A PHE 18.A N GLY 14.A O no hydrogen 2.829 N/A SER 19.A N ALA 15.A O no hydrogen 2.682 N/A PHE 20.A N GLU 16.A O no hydrogen 3.039 N/A ILE 21.A N TYR 17.A O no hydrogen 2.916 N/A THR 22.A N PHE 18.A O no hydrogen 2.800 N/A THR 22.A OG1 PHE 18.A O no hydrogen 3.017 N/A LEU 23.A N SER 19.A O no hydrogen 2.917 N/A LEU 24.A N PHE 20.A O no hydrogen 3.070 N/A ARG 25.A N ILE 21.A O no hydrogen 2.917 N/A ARG 25.A NE ALA 167.A O no hydrogen 2.562 N/A ARG 25.A NH2 ALA 166.A O no hydrogen 2.770 N/A ASP 26.A N THR 22.A O no hydrogen 2.868 N/A PHE 27.A N LEU 23.A O no hydrogen 2.864 N/A VAL 28.A N LEU 24.A O no hydrogen 3.023 N/A SER 29.A N ASP 26.A O no hydrogen 2.999 N/A SER 29.A OG ARG 25.A O no hydrogen 2.626 N/A SER 30.A N LEU 39.A O no hydrogen 3.029 N/A SER 30.A OG LEU 39.A O no hydrogen 2.963 N/A SER 32.A N SER 30.A OG no hydrogen 2.826 N/A SER 34.A N ILE 37.A O no hydrogen 3.022 N/A SER 34.A OG ASN 35.A OD1 no hydrogen 3.389 N/A ILE 37.A N SER 34.A O no hydrogen 2.843 N/A LEU 39.A N SER 32.A O no hydrogen 3.098 N/A LEU 40.A N MET 243.A O no hydrogen 2.904 N/A ILE 45.A N GLN 42.A O no hydrogen 3.375 N/A GLU 49.A N PRO 46.A O no hydrogen 2.765 N/A GLN 51.A N GLU 49.A OE1 no hydrogen 2.589 N/A ARG 52.A N GLU 49.A O no hydrogen 3.448 N/A ARG 52.A NE ILE 45.A O no hydrogen 3.253 N/A ARG 52.A NH1 ARG 52.A O no hydrogen 3.364 N/A ARG 52.A NH1 ASP 71.A OD1 no hydrogen 2.368 N/A ARG 52.A NH2 ASP 71.A OD2 no hydrogen 3.101 N/A VAL 54.A N ILE 70.A O no hydrogen 2.977 N/A LEU 55.A N GLU 2.A O no hydrogen 2.857 N/A VAL 56.A N ALA 68.A O no hydrogen 2.852 N/A GLU 57.A N LEU 4.A O no hydrogen 2.821 N/A LEU 58.A N ILE 66.A O no hydrogen 3.010 N/A THR 59.A N LEU 6.A O no hydrogen 3.261 N/A THR 59.A OG1 SER 65.A OG no hydrogen 2.339 N/A ASN 60.A N ASP 64.A O no hydrogen 2.848 N/A GLY 63.A N ASN 60.A O no hydrogen 2.874 N/A SER 65.A OG THR 59.A OG1 no hydrogen 2.339 N/A ILE 66.A N LEU 58.A O no hydrogen 3.113 N/A THR 67.A N ARG 81.A O no hydrogen 2.919 N/A ALA 68.A N VAL 56.A O no hydrogen 2.745 N/A ALA 69.A N ALA 79.A O no hydrogen 2.595 N/A ILE 70.A N VAL 54.A O no hydrogen 2.868 N/A ASP 71.A N TYR 76.A O no hydrogen 2.846 N/A VAL 72.A N ARG 52.A O no hydrogen 3.150 N/A THR 73.A N ASP 71.A OD1 no hydrogen 2.887 N/A THR 73.A OG1 ASP 71.A OD1 no hydrogen 2.771 N/A ASN 74.A N ASP 71.A O no hydrogen 3.168 N/A ASN 74.A ND2 ASP 71.A O no hydrogen 2.973 N/A LEU 75.A N ASP 71.A O no hydrogen 2.732 N/A VAL 78.A N ALA 69.A O no hydrogen 2.777 N/A TYR 80.A N TYR 87.A O no hydrogen 3.042 N/A TYR 80.A OH GLN 152.A OE1 no hydrogen 3.167 N/A ARG 81.A N THR 67.A O no hydrogen 2.638 N/A ALA 82.A N GLN 85.A O no hydrogen 2.951 N/A GLN 85.A N ALA 82.A O no hydrogen 2.990 N/A GLN 85.A NE2 ASP 84.A OD1 no hydrogen 2.697 N/A SER 86.A N THR 105.A O no hydrogen 2.909 N/A SER 86.A OG THR 104.A OG1 no hydrogen 3.022 N/A TYR 87.A N TYR 80.A O no hydrogen 2.867 N/A PHE 88.A N SER 107.A O no hydrogen 2.860 N/A LEU 89.A N VAL 78.A O no hydrogen 2.965 N/A LYS 90.A N PHE 111.A O no hydrogen 2.974 N/A ALA 96.A N PRO 93.A O no hydrogen 2.850 N/A THR 98.A N GLY 95.A O no hydrogen 3.172 N/A THR 98.A OG1 GLY 95.A O no hydrogen 3.040 N/A GLN 99.A N ALA 96.A O no hydrogen 3.097 N/A GLN 99.A NE2 GLY 95.A O no hydrogen 3.590 N/A ASP 100.A N ALA 96.A O no hydrogen 2.911 N/A THR 104.A OG1 SER 86.A OG no hydrogen 3.022 N/A THR 104.A OG1 PHE 101.A O no hydrogen 3.122 N/A THR 105.A N ASP 84.A O no hydrogen 2.841 N/A ARG 106.A NE PHE 101.A O no hydrogen 3.587 N/A SER 107.A N SER 86.A O no hydrogen 2.934 N/A LEU 109.A N PHE 88.A O no hydrogen 2.761 N/A ASN 112.A N ASP 117.A OD2 no hydrogen 2.700 N/A ASN 112.A ND2 ASP 91.A OD2 no hydrogen 2.707 N/A SER 114.A N ASN 112.A OD1 no hydrogen 3.262 N/A SER 114.A OG ASN 112.A OD1 no hydrogen 2.911 N/A TYR 115.A OH GLU 165.A OE2 no hydrogen 2.514 N/A ASP 117.A N SER 114.A OG no hydrogen 3.290 N/A LEU 118.A N SER 114.A O no hydrogen 2.788 N/A GLU 119.A N TYR 115.A O no hydrogen 2.624 N/A ARG 120.A N PRO 116.A O no hydrogen 3.082 N/A ARG 120.A N ASP 117.A O no hydrogen 3.224 N/A TYR 121.A N LEU 118.A O no hydrogen 3.043 N/A ALA 122.A N LEU 118.A O no hydrogen 2.888 N/A GLY 123.A N GLU 119.A O no hydrogen 2.648 N/A ARG 125.A N GLU 119.A OE2 no hydrogen 2.778 N/A ARG 125.A NE GLU 119.A OE2 no hydrogen 3.023 N/A ARG 125.A NH1 GLU 196.A OE2 no hydrogen 2.380 N/A GLN 127.A N HIS 124.A O no hydrogen 3.109 N/A GLN 127.A NE2 ASP 126.A OD2 no hydrogen 3.456 N/A ILE 128.A N ARG 125.A O no hydrogen 2.890 N/A LEU 130.A N PHE 186.A O no hydrogen 2.782 N/A GLN 134.A NE2 SER 185.A OG no hydrogen 2.789 N/A LEU 135.A N GLY 131.A O no hydrogen 2.977 N/A ILE 136.A N ILE 132.A O no hydrogen 2.782 N/A ALA 137.A N ASP 133.A O no hydrogen 2.804 N/A SER 138.A N GLN 134.A O no hydrogen 2.874 N/A SER 138.A OG GLN 134.A O no hydrogen 2.912 N/A VAL 139.A N LEU 135.A O no hydrogen 3.202 N/A THR 140.A N ILE 136.A O no hydrogen 3.264 N/A ALA 141.A N ALA 137.A O no hydrogen 2.770 N/A LEU 142.A N SER 138.A O no hydrogen 3.011 N/A ARG 143.A N VAL 139.A O no hydrogen 2.751 N/A ARG 143.A NH1 ARG 143.A O no hydrogen 2.806 N/A PHE 144.A N THR 140.A O no hydrogen 3.457 N/A SER 148.A OG THR 151.A OG1 no hydrogen 2.981 N/A ARG 150.A NH1 TYR 121.A O no hydrogen 3.542 N/A THR 151.A N SER 148.A OG no hydrogen 3.088 N/A THR 151.A OG1 SER 148.A OG no hydrogen 2.981 N/A GLN 152.A N SER 148.A O no hydrogen 3.142 N/A ALA 153.A N THR 149.A O no hydrogen 2.776 N/A ARG 154.A N ARG 150.A O no hydrogen 2.870 N/A SER 155.A N THR 151.A O no hydrogen 2.987 N/A SER 155.A OG THR 151.A O no hydrogen 2.588 N/A ILE 156.A N GLN 152.A O no hydrogen 2.944 N/A LEU 157.A N ALA 153.A O no hydrogen 2.909 N/A ILE 158.A N ARG 154.A O no hydrogen 3.053 N/A LEU 159.A N SER 155.A O no hydrogen 2.987 N/A ILE 160.A N ILE 156.A O no hydrogen 2.745 N/A GLN 161.A N LEU 157.A O no hydrogen 3.184 N/A GLN 161.A NE2 LEU 157.A O no hydrogen 3.344 N/A MET 162.A N ILE 158.A O no hydrogen 3.066 N/A ILE 163.A N LEU 159.A O no hydrogen 2.830 N/A SER 164.A OG LEU 75.A O no hydrogen 2.602 N/A GLU 165.A N ILE 160.A O no hydrogen 2.895 N/A ALA 167.A N ILE 163.A O no hydrogen 2.982 N/A ARG 168.A N SER 164.A O no hydrogen 3.065 N/A ARG 168.A NH1 GLU 165.A OE1 no hydrogen 3.069 N/A ARG 168.A NH2 ASN 74.A O no hydrogen 2.645 N/A PHE 169.A N GLU 165.A O no hydrogen 2.866 N/A ASN 170.A N SER 239.A O no hydrogen 2.872 N/A ILE 172.A N PHE 169.A O no hydrogen 3.049 N/A LEU 173.A N PHE 169.A O no hydrogen 2.932 N/A TRP 174.A N ASN 170.A O no hydrogen 2.804 N/A ARG 175.A N PRO 171.A O no hydrogen 3.031 N/A ARG 175.A NH1 ASP 189.A OD1 no hydrogen 2.856 N/A ALA 176.A N ILE 172.A O no hydrogen 2.845 N/A ARG 177.A N LEU 173.A O no hydrogen 2.889 N/A GLN 178.A N TRP 174.A O no hydrogen 2.806 N/A TYR 179.A N ARG 175.A O no hydrogen 3.071 N/A ILE 180.A N ALA 176.A O no hydrogen 2.902 N/A ASN 181.A N ARG 177.A O no hydrogen 3.005 N/A SER 182.A N GLN 178.A O no hydrogen 3.094 N/A SER 182.A OG TYR 179.A O no hydrogen 3.305 N/A GLY 183.A N ILE 180.A O no hydrogen 3.126 N/A ALA 184.A N SER 182.A OG no hydrogen 3.397 N/A PHE 186.A N LEU 130.A O no hydrogen 2.874 N/A MET 192.A N ASP 189.A OD1 no hydrogen 2.865 N/A LEU 193.A N ASP 189.A O no hydrogen 2.939 N/A GLU 194.A N VAL 190.A O no hydrogen 2.845 N/A LEU 195.A N TYR 191.A O no hydrogen 2.785 N/A GLU 196.A N MET 192.A O no hydrogen 3.092 N/A THR 197.A N LEU 193.A O no hydrogen 3.180 N/A THR 197.A OG1 LEU 193.A O no hydrogen 3.151 N/A THR 197.A OG1 GLU 194.A O no hydrogen 3.403 N/A SER 198.A N LEU 195.A O no hydrogen 2.881 N/A SER 198.A OG GLU 194.A O no hydrogen 2.939 N/A SER 198.A OG LEU 195.A O no hydrogen 2.934 N/A TRP 199.A NE1 ILE 242.A O no hydrogen 2.951 N/A GLN 202.A N SER 198.A O no hydrogen 2.851 N/A GLN 202.A NE2 SER 198.A OG no hydrogen 2.626 N/A SER 203.A N TRP 199.A O no hydrogen 3.010 N/A SER 203.A OG TRP 199.A O no hydrogen 3.011 N/A THR 204.A N GLY 200.A O no hydrogen 2.911 N/A THR 204.A OG1 GLY 200.A O no hydrogen 2.983 N/A GLN 205.A N GLN 201.A O no hydrogen 2.644 N/A VAL 206.A N GLN 202.A O no hydrogen 3.030 N/A GLN 207.A N SER 203.A O no hydrogen 3.192 N/A GLN 207.A NE2 SER 203.A O no hydrogen 2.880 N/A GLN 207.A NE2 LEU 244.A O no hydrogen 2.819 N/A HIS 208.A N THR 204.A O no hydrogen 3.011 N/A SER 209.A N VAL 206.A O no hydrogen 3.240 N/A SER 209.A OG VAL 206.A O no hydrogen 2.533 N/A THR 210.A N VAL 213.A O no hydrogen 3.097 N/A VAL 213.A N THR 210.A O no hydrogen 3.076 N/A PHE 214.A N THR 231.A O no hydrogen 2.887 N/A ASN 216.A N GLN 205.A OE1 no hydrogen 2.771 N/A ILE 218.A N LEU 230.A O no hydrogen 2.977 N/A LEU 220.A N VAL 228.A O no hydrogen 2.741 N/A ALA 221.A N GLU 194.A OE1 no hydrogen 3.009 N/A LEU 222.A N SER 226.A O no hydrogen 2.734 N/A SER 226.A OG PRO 224.A O no hydrogen 2.992 N/A VAL 228.A N LEU 220.A O no hydrogen 2.663 N/A LEU 230.A N ILE 218.A O no hydrogen 2.650 N/A THR 231.A N ASP 235.A OD2 no hydrogen 2.532 N/A THR 231.A OG1 ASP 235.A OD2 no hydrogen 2.781 N/A ASN 232.A N ASP 235.A OD2 no hydrogen 2.935 N/A VAL 233.A N GLY 212.A O no hydrogen 2.988 N/A ARG 234.A N ASN 232.A OD1 no hydrogen 3.089 N/A ASP 235.A N ASN 232.A O no hydrogen 2.682 N/A VAL 236.A N VAL 233.A O no hydrogen 2.986 N/A ILE 237.A N VAL 233.A O no hydrogen 2.647 N/A SER 239.A N VAL 236.A O no hydrogen 3.030 N/A LEU 240.A N VAL 236.A O no hydrogen 2.927 N/A ALA 241.A N ARG 168.A O no hydrogen 2.794 N/A MET 243.A N PRO 38.A O no hydrogen 2.867 N/A LEU 244.A N SER 203.A OG no hydrogen 2.967 N/A VAL 246.A N GLN 207.A OE1 no hydrogen 2.640 N/A CYS 247.A N GLN 207.A OE1 no hydrogen 3.110 N/A CYS 247.A SG GLN 207.A O no hydrogen 3.987 N/A CYS 247.A SG GLN 207.A OE1 no hydrogen 3.876 N/A