Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4utr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 ASP 1.A OD1 no hydrogen 2.960 N/A PHE 5.A N ASP 1.A O no hydrogen 3.014 N/A ARG 6.A N LEU 2.A O no hydrogen 2.810 N/A ARG 6.A NE ALA 260.A O no hydrogen 3.187 N/A ARG 6.A NH2 ALA 260.A O no hydrogen 3.350 N/A ARG 6.A NH2 GLU 262.A OXT no hydrogen 2.423 N/A GLU 7.A N THR 3.A O no hydrogen 3.012 N/A HIS 8.A N ALA 4.A O no hydrogen 3.395 N/A PHE 9.A N PHE 5.A O no hydrogen 2.862 N/A ALA 10.A N ARG 6.A O no hydrogen 2.910 N/A LYS 11.A N HIS 8.A O no hydrogen 3.119 N/A ALA 12.A N HIS 8.A O no hydrogen 3.027 N/A ALA 12.A N PHE 9.A O no hydrogen 3.343 N/A LYS 13.A N ASP 205.A OD2 no hydrogen 2.792 N/A HIS 14.A N ASP 205.A OD1 no hydrogen 2.976 N/A HIS 14.A ND1 SER 96.A OG no hydrogen 3.050 N/A ILE 15.A N SER 96.A O no hydrogen 2.812 N/A ALA 16.A N LEU 206.A O no hydrogen 3.038 N/A ILE 17.A N VAL 98.A O no hydrogen 2.793 N/A ILE 18.A N LEU 208.A O no hydrogen 2.819 N/A THR 19.A N ILE 100.A O no hydrogen 2.928 N/A THR 19.A OG1 THR 101.A OG1 no hydrogen 2.748 N/A THR 19.A OG1 HIS 108.A NE2 no hydrogen 2.907 N/A GLY 20.A N VAL 210.A O no hydrogen 2.925 N/A GLY 22.A N GLY 211.A O no hydrogen 2.802 N/A VAL 23.A N GLY 20.A O no hydrogen 3.079 N/A SER 24.A N ALA 21.A O no hydrogen 3.022 N/A SER 24.A OG ASP 105.A OD1 no hydrogen 3.380 N/A SER 24.A OG ASP 105.A OD2 no hydrogen 2.617 N/A ALA 25.A N ALA 21.A O no hydrogen 2.935 N/A GLU 26.A N GLY 22.A O no hydrogen 3.398 N/A SER 27.A N SER 24.A O no hydrogen 2.981 N/A SER 27.A OG MET 75.A O no hydrogen 2.828 N/A GLY 28.A N ALA 25.A O no hydrogen 2.949 N/A THR 31.A OG1 ARG 33.A O no hydrogen 3.365 N/A GLY 37.A N GLY 34.A O no hydrogen 3.025 N/A PHE 38.A N GLY 36.A O no hydrogen 2.834 N/A TRP 39.A N TRP 42.A O no hydrogen 2.777 N/A TRP 39.A NE1 GLY 150.A O no hydrogen 3.091 N/A ARG 40.A N PRO 152.A O no hydrogen 2.759 N/A ARG 40.A NE ALA 151.A O no hydrogen 2.631 N/A ARG 40.A NH1 GLU 62.A OE1 no hydrogen 3.170 N/A ARG 40.A NH1 GLU 62.A OE2 no hydrogen 3.291 N/A ARG 40.A NH2 GLU 62.A OE1 no hydrogen 2.562 N/A ARG 40.A NH2 ALA 151.A O no hydrogen 3.165 N/A TRP 42.A N TRP 39.A O no hydrogen 2.961 N/A GLN 43.A N ASP 46.A OD2 no hydrogen 2.946 N/A ALA 44.A N PHE 32.A O no hydrogen 3.033 N/A ASP 46.A N GLN 43.A O no hydrogen 3.116 N/A LEU 47.A N ALA 44.A O no hydrogen 2.990 N/A ALA 48.A N ALA 44.A O no hydrogen 2.966 N/A THR 49.A N LEU 47.A O no hydrogen 2.896 N/A ALA 52.A N THR 49.A OG1 no hydrogen 3.052 N/A PHE 53.A N THR 49.A O no hydrogen 3.151 N/A SER 54.A N PRO 50.A O no hydrogen 2.847 N/A ARG 55.A N GLU 51.A O no hydrogen 3.133 N/A ASP 56.A N ALA 52.A O no hydrogen 2.783 N/A LEU 59.A N ASP 56.A OD1 no hydrogen 3.062 N/A VAL 60.A N ASP 56.A O no hydrogen 3.221 N/A TRP 61.A N PRO 57.A O no hydrogen 2.878 N/A TRP 61.A NE1 LEU 178.A O no hydrogen 3.013 N/A GLU 62.A N SER 58.A O no hydrogen 2.852 N/A PHE 63.A N LEU 59.A O no hydrogen 3.111 N/A TYR 64.A N VAL 60.A O no hydrogen 2.985 N/A HIS 65.A N TRP 61.A O no hydrogen 2.766 N/A TYR 66.A N GLU 62.A O no hydrogen 2.932 N/A ARG 67.A N PHE 63.A O no hydrogen 3.091 N/A ARG 68.A N TYR 64.A O no hydrogen 2.839 N/A ARG 68.A NH1 LEU 123.A O no hydrogen 3.006 N/A ARG 68.A NH1 ASN 137.A O no hydrogen 2.847 N/A ARG 68.A NH2 ASN 137.A O no hydrogen 3.177 N/A ARG 68.A NH2 ASN 137.A OD1 no hydrogen 3.076 N/A ARG 68.A NH2 LYS 139.A O no hydrogen 3.063 N/A GLU 69.A N HIS 65.A O no hydrogen 2.866 N/A VAL 70.A N TYR 66.A O no hydrogen 2.932 N/A MET 71.A N ARG 67.A O no hydrogen 3.235 N/A MET 71.A N ARG 68.A O no hydrogen 3.240 N/A ARG 72.A N GLU 69.A O no hydrogen 3.186 N/A ARG 72.A NH1 GLU 69.A OE1 no hydrogen 2.406 N/A SER 73.A N VAL 70.A O no hydrogen 3.276 N/A SER 73.A OG VAL 70.A O no hydrogen 3.357 N/A LYS 74.A N MET 71.A O no hydrogen 3.051 N/A ASN 77.A N HIS 80.A ND1 no hydrogen 3.068 N/A ASN 77.A ND2 VAL 23.A O no hydrogen 2.828 N/A HIS 80.A N ASN 77.A OD1 no hydrogen 3.216 N/A LEU 81.A N ASN 77.A O no hydrogen 2.947 N/A ALA 82.A N PRO 78.A O no hydrogen 2.909 N/A ILE 83.A N ALA 79.A O no hydrogen 3.056 N/A ALA 84.A N HIS 80.A O no hydrogen 2.994 N/A GLU 85.A N LEU 81.A O no hydrogen 2.838 N/A CYS 86.A N ALA 82.A O no hydrogen 2.876 N/A GLU 87.A N ILE 83.A O no hydrogen 3.122 N/A ALA 88.A N ALA 84.A O no hydrogen 3.037 N/A ARG 89.A N GLU 85.A O no hydrogen 2.895 N/A ARG 89.A NH2 LEU 261.A O no hydrogen 2.762 N/A LEU 90.A N CYS 86.A O no hydrogen 2.870 N/A GLY 91.A N GLU 87.A O no hydrogen 2.877 N/A GLN 92.A N ALA 88.A O no hydrogen 3.284 N/A GLN 92.A NE2 ALA 88.A O no hydrogen 3.543 N/A GLN 93.A N LEU 90.A O no hydrogen 2.923 N/A GLN 93.A NE2 ARG 89.A O no hydrogen 3.449 N/A GLY 94.A N GLY 91.A O no hydrogen 2.985 N/A ARG 95.A N LEU 90.A O no hydrogen 2.908 N/A ARG 95.A NE ALA 12.A O no hydrogen 2.904 N/A ARG 95.A NH1 GLN 93.A OE1 no hydrogen 3.000 N/A ARG 95.A NH2 PHE 9.A O no hydrogen 2.731 N/A ARG 95.A NH2 ALA 12.A O no hydrogen 2.730 N/A SER 96.A N LYS 13.A O no hydrogen 2.857 N/A SER 96.A OG HIS 14.A ND1 no hydrogen 3.050 N/A VAL 98.A N ILE 15.A O no hydrogen 2.960 N/A ILE 99.A N HIS 115.A O.A no hydrogen 2.910 N/A ILE 99.A N HIS 115.A O.B no hydrogen 2.914 N/A ILE 100.A N ILE 17.A O no hydrogen 2.806 N/A THR 101.A N TYR 117.A O no hydrogen 2.929 N/A THR 101.A OG1 THR 19.A O no hydrogen 3.551 N/A THR 101.A OG1 THR 19.A OG1 no hydrogen 2.748 N/A GLN 102.A N THR 19.A O no hydrogen 2.860 N/A ASN 103.A N THR 101.A OG1 no hydrogen 2.857 N/A ASN 103.A ND2 GLY 20.A O no hydrogen 2.987 N/A LEU 107.A N ASP 105.A OD1 no hydrogen 3.251 N/A HIS 108.A NE2 THR 19.A OG1 no hydrogen 2.907 N/A HIS 109.A N.B GLU 106.A O no hydrogen 2.962 N/A ARG 110.A N GLU 106.A O no hydrogen 3.026 N/A ARG 110.A NH1 MET 71.A O no hydrogen 3.127 N/A ARG 110.A NH1 LYS 74.A O no hydrogen 3.430 N/A ARG 110.A NH2 LYS 74.A O no hydrogen 2.605 N/A ALA 111.A N LEU 107.A O no hydrogen 2.864 N/A GLY 112.A N HIS 109.A O.A no hydrogen 2.977 N/A GLY 112.A N HIS 109.A O.B no hydrogen 2.993 N/A SER 113.A N HIS 108.A O no hydrogen 3.066 N/A SER 113.A OG GLU 87.A OE1 no hydrogen 3.144 N/A LYS 114.A N GLU 87.A OE1 no hydrogen 3.355 N/A LYS 114.A N GLU 87.A OE2 no hydrogen 3.070 N/A HIS 115.A N.A GLU 87.A OE2 no hydrogen 2.900 N/A HIS 115.A N.B GLU 87.A OE2 no hydrogen 2.901 N/A TYR 117.A N ILE 99.A O no hydrogen 2.804 N/A TYR 117.A OH GLU 200.A OE2 no hydrogen 3.172 N/A ILE 119.A N THR 101.A O no hydrogen 3.108 N/A HIS 120.A NE2 TYR 217.A OH no hydrogen 2.811 N/A GLY 121.A N GLU 118.A O no hydrogen 3.178 N/A SER 122.A N HIS 181.A O no hydrogen 2.976 N/A SER 122.A OG GLU 106.A OE2 no hydrogen 2.922 N/A LEU 123.A N ILE 104.A O no hydrogen 2.865 N/A PHE 124.A N SER 122.A OG no hydrogen 2.936 N/A LYS 125.A N SER 122.A O no hydrogen 3.340 N/A THR 126.A N LYS 135.A O no hydrogen 2.861 N/A THR 126.A OG1 LYS 135.A O no hydrogen 3.534 N/A ARG 127.A N ARG 179.A O no hydrogen 2.856 N/A ARG 127.A NE HIS 181.A ND1 no hydrogen 3.140 N/A ARG 127.A NH2 HIS 181.A ND1 no hydrogen 3.554 N/A CYS 128.A N GLU 133.A O no hydrogen 2.966 N/A MET 129.A N LEU 177.A O no hydrogen 2.953 N/A GLY 132.A N CYS 128.A O no hydrogen 2.922 N/A LYS 135.A N THR 126.A O no hydrogen 3.065 N/A ASN 137.A N PHE 124.A O no hydrogen 2.810 N/A HIS 138.A NE2 GLU 106.A OE1 no hydrogen 2.709 N/A LYS 139.A N ASN 137.A OD1 no hydrogen 2.981 N/A SER 140.A OG GLU 69.A OE1 no hydrogen 2.783 N/A SER 140.A OG GLU 69.A OE2 no hydrogen 2.783 N/A CYS 143.A SG LEU 165.A O no hydrogen 3.497 N/A LEU 146.A N CYS 143.A O no hydrogen 3.072 N/A ASP 147.A N PRO 144.A O no hydrogen 3.002 N/A LYS 149.A N LEU 146.A O no hydrogen 2.956 N/A GLY 150.A N GLU 62.A OE1 no hydrogen 3.397 N/A THR 156.A N ASP 153.A O no hydrogen 2.986 N/A THR 156.A OG1 ALA 151.A O no hydrogen 3.558 N/A THR 156.A OG1 ASP 153.A O no hydrogen 2.815 N/A ALA 159.A N GLU 62.A OE2 no hydrogen 2.986 N/A ILE 161.A N SER 58.A OG no hydrogen 3.359 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.949 N/A LEU 165.A N PRO 162.A O no hydrogen 2.787 N/A LEU 166.A N VAL 163.A O no hydrogen 3.213 N/A ARG 168.A NE ASN 175.A O no hydrogen 2.942 N/A ARG 168.A NH1 VAL 163.A O no hydrogen 3.053 N/A ARG 168.A NH2 ASN 175.A O no hydrogen 2.881 N/A CYS 169.A N GLY 176.A O no hydrogen 2.757 N/A CYS 174.A N ARG 171.A O no hydrogen 2.837 N/A ASN 175.A N ARG 171.A O no hydrogen 3.167 N/A LEU 178.A N PRO 167.A O no hydrogen 2.900 N/A ARG 179.A N ARG 127.A O no hydrogen 2.845 N/A ARG 179.A NE PRO 180.A O no hydrogen 3.126 N/A ARG 179.A NH1 GLU 187.A OE2 no hydrogen 2.883 N/A ARG 179.A NH2 VAL 182.A O no hydrogen 2.598 N/A ARG 179.A NH2 GLU 187.A OE1 no hydrogen 3.024 N/A ARG 179.A NH2 GLU 187.A OE2 no hydrogen 3.549 N/A HIS 181.A N LYS 125.A O no hydrogen 2.953 N/A VAL 183.A N HIS 120.A O no hydrogen 2.837 N/A TRP 184.A N GLU 187.A OE1 no hydrogen 3.143 N/A TRP 184.A NE1 TYR 64.A OH no hydrogen 2.959 N/A PHE 185.A N ALA 48.A O no hydrogen 2.860 N/A GLU 187.A N TRP 184.A O no hydrogen 2.860 N/A ILE 193.A N ASP 190.A OD1 no hydrogen 2.968 N/A LEU 194.A N ASP 190.A O no hydrogen 3.084 N/A THR 195.A N SER 191.A O no hydrogen 2.912 N/A THR 195.A OG1 SER 191.A O no hydrogen 2.764 N/A ALA 196.A N ASP 192.A O no hydrogen 3.080 N/A VAL 197.A N ILE 193.A O no hydrogen 2.858 N/A GLU 198.A N LEU 194.A O no hydrogen 2.890 N/A ARG 199.A N THR 195.A O no hydrogen 3.103 N/A GLU 200.A N ALA 196.A O no hydrogen 3.043 N/A LEU 201.A N VAL 197.A O no hydrogen 2.901 N/A GLU 202.A N GLU 198.A O no hydrogen 2.905 N/A LYS 203.A N ARG 199.A O no hydrogen 3.127 N/A LYS 203.A N GLU 200.A O no hydrogen 3.274 N/A CYS 204.A N GLU 200.A O no hydrogen 2.976 N/A CYS 204.A SG LEU 201.A O no hydrogen 3.621 N/A CYS 204.A SG LEU 206.A O no hydrogen 3.584 N/A ASP 205.A N HIS 14.A O no hydrogen 2.862 N/A CYS 207.A N PRO 232.A O no hydrogen 3.069 N/A CYS 207.A SG ALA 16.A O no hydrogen 3.813 N/A CYS 207.A SG LEU 208.A O no hydrogen 3.991 N/A LEU 208.A N ALA 16.A O no hydrogen 2.830 N/A VAL 209.A N ALA 234.A O no hydrogen 2.851 N/A VAL 210.A N ILE 18.A O no hydrogen 2.728 N/A GLY 211.A N PHE 236.A O no hydrogen 2.845 N/A SER 213.A N THR 212.A OG1 no hydrogen 2.472 N/A SER 213.A OG GLU 235.A OE2 no hydrogen 3.419 N/A SER 214.A N GLU 235.A OE2 no hydrogen 2.912 N/A SER 214.A OG GLU 235.A OE2 no hydrogen 2.658 N/A ILE 215.A N SER 213.A OG no hydrogen 3.414 N/A VAL 216.A N SER 213.A O no hydrogen 3.255 N/A TYR 217.A OH HIS 120.A NE2 no hydrogen 2.811 N/A ALA 220.A N VAL 216.A O no hydrogen 2.774 N/A MET 221.A N PRO 218.A O no hydrogen 2.883 N/A PHE 222.A N ALA 219.A O no hydrogen 3.059 N/A ALA 223.A N ALA 219.A O no hydrogen 2.746 N/A VAL 226.A N PHE 222.A O no hydrogen 3.226 N/A ALA 227.A N ALA 223.A O no hydrogen 2.887 N/A SER 228.A N PRO 224.A O no hydrogen 2.898 N/A SER 228.A OG PRO 224.A O no hydrogen 3.031 N/A SER 228.A OG GLN 225.A O no hydrogen 2.769 N/A ARG 229.A N VAL 226.A O no hydrogen 3.043 N/A ARG 229.A NH1 CYS 204.A O no hydrogen 3.398 N/A ARG 229.A NH2 CYS 204.A O no hydrogen 2.553 N/A GLY 230.A N ALA 227.A O no hydrogen 2.865 N/A VAL 231.A N VAL 226.A O no hydrogen 3.369 N/A ALA 234.A N CYS 207.A O no hydrogen 2.927 N/A GLU 235.A N TYR 247.A O no hydrogen 2.872 N/A PHE 236.A N VAL 209.A O no hydrogen 2.870 N/A ASN 237.A N PHE 249.A O no hydrogen 3.364 N/A ASN 237.A ND2 THR 212.A O no hydrogen 2.838 N/A ASN 237.A ND2 GLU 235.A OE1 no hydrogen 3.290 N/A GLU 239.A N ASN 237.A OD1 no hydrogen 3.052 N/A THR 241.A OG1 PRO 242.A O no hydrogen 3.373 N/A LYS 246.A NZ VAL 231.A O no hydrogen 3.570 N/A TYR 247.A N VAL 233.A O no hydrogen 3.015 N/A HIS 248.A ND1 GLU 235.A OE1 no hydrogen 3.125 N/A HIS 248.A NE2 GLU 239.A O no hydrogen 2.979 N/A PHE 249.A N GLU 235.A O no hydrogen 2.850 N/A GLY 251.A N ASN 237.A O no hydrogen 2.866 N/A CYS 253.A N GLU 26.A OE2 no hydrogen 2.930 N/A CYS 253.A SG GLU 26.A OE2 no hydrogen 3.234 N/A GLY 254.A N GLU 26.A OE1 no hydrogen 3.063 N/A SER 255.A N PRO 252.A O no hydrogen 2.935 N/A THR 256.A N PRO 252.A O no hydrogen 3.165 N/A THR 256.A OG1 PRO 252.A O no hydrogen 3.418 N/A LEU 257.A N CYS 253.A O no hydrogen 2.918 N/A ALA 260.A N THR 256.A O no hydrogen 2.919 N/A LEU 261.A N LEU 257.A O no hydrogen 2.944 N/A