Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6u2o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N GLN 1.A O no hydrogen 3.215 N/A ASN 5.A ND2 HIS 44.A O no hydrogen 2.663 N/A THR 9.A N ASN 5.A O no hydrogen 3.069 N/A THR 9.A OG1 GLY 6.A O no hydrogen 3.318 N/A ASP 10.A N GLY 6.A O no hydrogen 2.758 N/A MET 11.A N GLY 7.A O no hydrogen 2.995 N/A LEU 12.A N ILE 8.A O no hydrogen 2.870 N/A THR 13.A N THR 9.A O no hydrogen 2.920 N/A THR 13.A OG1 THR 9.A O no hydrogen 2.653 N/A GLU 14.A N ASP 10.A O no hydrogen 2.994 N/A LEU 15.A N MET 11.A O no hydrogen 2.963 N/A ALA 16.A N LEU 12.A O no hydrogen 2.707 N/A ASN 17.A N THR 13.A O no hydrogen 2.967 N/A PHE 18.A N GLU 14.A O no hydrogen 3.125 N/A GLU 19.A N LEU 15.A O no hydrogen 2.986 N/A LYS 20.A N ALA 16.A O no hydrogen 3.019 N/A LYS 20.A NZ ASN 21.A OD1 no hydrogen 3.215 N/A ASN 21.A N ASN 17.A O no hydrogen 2.780 N/A ASN 21.A ND2 ASN 91.A OD1 no hydrogen 2.796 N/A VAL 22.A N PHE 18.A O no hydrogen 2.944 N/A SER 23.A N PHE 18.A O no hydrogen 3.019 N/A GLN 24.A NE2 PRO 101.A O no hydrogen 3.516 N/A ALA 25.A N GLU 19.A O no hydrogen 2.962 N/A TYR 29.A N ALA 25.A O no hydrogen 2.993 N/A ASN 30.A N ILE 26.A O no hydrogen 2.868 N/A ALA 31.A N HIS 27.A O no hydrogen 2.965 N/A TYR 32.A N LYS 28.A O no hydrogen 2.958 N/A ARG 33.A N TYR 29.A O no hydrogen 3.039 N/A LYS 34.A N ASN 30.A O no hydrogen 2.778 N/A ALA 35.A N ALA 31.A O no hydrogen 3.050 N/A ALA 36.A N TYR 32.A O no hydrogen 2.897 N/A SER 37.A N ARG 33.A O no hydrogen 2.918 N/A SER 37.A OG ARG 33.A O no hydrogen 3.227 N/A VAL 38.A N LYS 34.A O no hydrogen 3.047 N/A ILE 39.A N ALA 35.A O no hydrogen 3.093 N/A ALA 40.A N ALA 36.A O no hydrogen 2.848 N/A LYS 41.A N SER 37.A O no hydrogen 3.088 N/A LYS 41.A N VAL 38.A O no hydrogen 3.270 N/A TYR 42.A N ILE 39.A O no hydrogen 2.993 N/A TYR 42.A OH GLU 51.A OE2 no hydrogen 2.796 N/A ILE 46.A N ASN 5.A OD1 no hydrogen 2.783 N/A LYS 47.A N GLU 51.A OE1 no hydrogen 3.190 N/A GLY 49.A N ASP 67.A OD1 no hydrogen 2.650 N/A GLU 51.A N SER 48.A OG no hydrogen 2.973 N/A ALA 52.A N SER 48.A O no hydrogen 3.312 N/A LYS 53.A N GLY 49.A O no hydrogen 2.900 N/A LYS 53.A N ALA 50.A O no hydrogen 3.193 N/A LEU 55.A N ALA 52.A O no hydrogen 3.049 N/A VAL 58.A N LEU 55.A O no hydrogen 3.262 N/A ALA 63.A N GLY 59.A O no hydrogen 3.108 N/A GLU 64.A N THR 60.A O no hydrogen 2.891 N/A LYS 65.A N LYS 61.A O no hydrogen 3.145 N/A LYS 65.A NZ TYR 32.A OH no hydrogen 3.210 N/A ILE 66.A N ILE 62.A O no hydrogen 2.889 N/A ASP 67.A N ALA 63.A O no hydrogen 3.083 N/A GLU 68.A N GLU 64.A O no hydrogen 3.118 N/A PHE 69.A N LYS 65.A O no hydrogen 2.904 N/A LEU 70.A N ILE 66.A O no hydrogen 2.822 N/A ALA 71.A N ASP 67.A O no hydrogen 2.977 N/A THR 72.A N GLU 68.A O no hydrogen 2.976 N/A THR 72.A OG1 GLU 68.A O no hydrogen 2.516 N/A GLY 73.A N PHE 69.A O no hydrogen 2.603 N/A LYS 74.A N THR 72.A OG1 no hydrogen 3.121 N/A ARG 76.A N GLU 68.A OE2 no hydrogen 2.835 N/A LEU 78.A N LEU 75.A O no hydrogen 2.986 N/A GLU 79.A N LEU 75.A O no hydrogen 2.911 N/A LYS 80.A N ARG 76.A O no hydrogen 2.864 N/A LYS 80.A NZ GLN 83.A OE1 no hydrogen 3.010 N/A ILE 81.A N LYS 77.A O no hydrogen 2.983 N/A ARG 82.A N LEU 78.A O no hydrogen 2.860 N/A ARG 82.A NE GLU 14.A OE2 no hydrogen 2.869 N/A ARG 82.A NH2 GLU 14.A OE1 no hydrogen 3.267 N/A GLN 83.A N LYS 80.A O no hydrogen 3.196 N/A ASP 84.A N ILE 81.A O no hydrogen 3.355 N/A THR 86.A OG1 ASP 84.A OD1 no hydrogen 3.330 N/A SER 87.A N ASP 84.A OD1 no hydrogen 2.952 N/A SER 87.A OG ASP 84.A OD1 no hydrogen 3.179 N/A SER 88.A N ASP 84.A O no hydrogen 2.942 N/A SER 88.A OG ASP 84.A O no hydrogen 3.202 N/A SER 88.A OG ASP 85.A O no hydrogen 3.541 N/A SER 89.A N ASP 85.A O no hydrogen 2.962 N/A SER 89.A OG ASP 85.A O no hydrogen 2.612 N/A ILE 90.A N THR 86.A O no hydrogen 2.829 N/A ASN 91.A N SER 87.A O no hydrogen 3.058 N/A PHE 92.A N SER 88.A O no hydrogen 3.011 N/A LEU 93.A N SER 89.A O no hydrogen 3.064 N/A THR 94.A N ILE 90.A O no hydrogen 3.378 N/A THR 94.A OG1 ASN 91.A O no hydrogen 2.853 N/A ARG 95.A N PHE 92.A O no hydrogen 2.989 N/A ARG 95.A NE GLU 140.A OE2 no hydrogen 2.777 N/A ARG 95.A NH2 GLU 140.A OE1 no hydrogen 2.802 N/A ARG 95.A NH2 GLU 140.A OE2 no hydrogen 3.485 N/A VAL 96.A N LEU 93.A O no hydrogen 3.007 N/A SER 97.A OG HIS 128.A NE2 no hydrogen 2.782 N/A ILE 99.A N VAL 96.A O no hydrogen 2.988 N/A ALA 104.A N GLY 100.A O no hydrogen 2.944 N/A ARG 105.A N PRO 101.A O no hydrogen 3.145 N/A LYS 106.A N SER 102.A O no hydrogen 3.038 N/A LYS 106.A NZ GLU 110.A OE1 no hydrogen 3.013 N/A PHE 107.A N ALA 103.A O no hydrogen 2.872 N/A VAL 108.A N ALA 104.A O no hydrogen 2.984 N/A ASP 109.A N ARG 105.A O no hydrogen 2.902 N/A GLU 110.A N LYS 106.A O no hydrogen 3.188 N/A GLU 110.A N PHE 107.A O no hydrogen 3.246 N/A GLY 111.A N VAL 108.A O no hydrogen 3.192 N/A ILE 112.A N PHE 107.A O no hydrogen 2.800 N/A LYS 113.A N ASP 117.A OD2 no hydrogen 2.839 N/A LYS 113.A NZ ASP 85.A OD2 no hydrogen 2.752 N/A ASP 117.A N THR 114.A OG1 no hydrogen 2.991 N/A LEU 118.A N THR 114.A O no hydrogen 3.185 N/A ARG 119.A N LEU 115.A O no hydrogen 2.753 N/A LYS 120.A N GLU 116.A O no hydrogen 3.119 N/A ASN 121.A N LEU 118.A O no hydrogen 2.902 N/A ASN 121.A ND2 ASP 117.A O no hydrogen 2.379 N/A LYS 124.A N ASN 121.A O no hydrogen 2.982 N/A LYS 124.A NZ GLU 110.A OE2 no hydrogen 2.513 N/A LEU 125.A N GLU 122.A O no hydrogen 3.043 N/A ASN 126.A N GLN 129.A OE1 no hydrogen 3.033 N/A HIS 127.A NE2 THR 218.A O no hydrogen 2.926 N/A HIS 128.A NE2 SER 97.A OG no hydrogen 2.782 N/A GLN 129.A N ASN 126.A OD1 no hydrogen 2.828 N/A GLN 129.A NE2 GLY 98.A O no hydrogen 2.926 N/A ARG 130.A N ASN 126.A O no hydrogen 3.101 N/A ARG 130.A NE GLU 122.A O no hydrogen 3.171 N/A ARG 130.A NH2 GLU 122.A O no hydrogen 2.991 N/A ILE 131.A N HIS 127.A O no hydrogen 3.175 N/A GLY 132.A N HIS 128.A O no hydrogen 2.967 N/A LEU 133.A N GLN 129.A O no hydrogen 2.912 N/A LYS 134.A N ARG 130.A O no hydrogen 2.812 N/A TYR 135.A N ILE 131.A O no hydrogen 2.910 N/A TYR 135.A OH ASP 217.A OD1 no hydrogen 2.513 N/A PHE 136.A N LEU 133.A O no hydrogen 3.117 N/A PHE 139.A N TYR 135.A O no hydrogen 2.819 N/A GLU 140.A N GLY 137.A O no hydrogen 3.294 N/A LYS 141.A N ASP 138.A O no hydrogen 3.075 N/A ARG 142.A NE SER 180.A OG no hydrogen 2.693 N/A ILE 143.A N SER 181.A O no hydrogen 2.648 N/A ARG 145.A N GLU 179.A O no hydrogen 2.928 N/A ARG 145.A NH1 PHE 174.A O no hydrogen 2.774 N/A ARG 145.A NH1 ALA 178.A O no hydrogen 3.024 N/A ARG 145.A NH2 PHE 174.A O no hydrogen 3.273 N/A MET 148.A N PRO 144.A O no hydrogen 3.128 N/A LEU 149.A N ARG 145.A O no hydrogen 2.678 N/A GLN 150.A N GLU 146.A O no hydrogen 3.073 N/A MET 151.A N GLU 147.A O no hydrogen 2.829 N/A GLN 152.A N MET 148.A O no hydrogen 2.724 N/A ASP 153.A N LEU 149.A O no hydrogen 2.995 N/A ILE 154.A N GLN 150.A O no hydrogen 3.314 N/A VAL 155.A N MET 151.A O no hydrogen 2.945 N/A LEU 156.A N GLN 152.A O no hydrogen 2.811 N/A ASN 157.A N ASP 153.A O no hydrogen 3.161 N/A ASN 157.A ND2 GLU 158.A OE2 no hydrogen 3.255 N/A GLU 158.A N ILE 154.A O no hydrogen 3.008 N/A VAL 159.A N VAL 155.A O no hydrogen 2.987 N/A LYS 160.A N LEU 156.A O no hydrogen 3.155 N/A LYS 161.A N ASN 157.A O no hydrogen 3.134 N/A LYS 161.A NZ GLU 158.A OE1 no hydrogen 3.038 N/A LYS 161.A NZ GLU 158.A OE2 no hydrogen 3.310 N/A VAL 162.A N GLU 158.A O no hydrogen 3.043 N/A ASP 163.A N VAL 159.A O no hydrogen 3.295 N/A GLU 165.A N ASP 163.A OD1 no hydrogen 3.046 N/A TYR 166.A N ASP 163.A O no hydrogen 3.175 N/A TYR 166.A OH LEU 201.A O no hydrogen 2.401 N/A ILE 167.A N THR 189.A O no hydrogen 2.956 N/A THR 169.A N LEU 187.A O no hydrogen 2.955 N/A THR 169.A OG1 TYR 256.A OH no hydrogen 2.667 N/A CYS 171.A N ASP 185.A O no hydrogen 2.800 N/A CYS 171.A SG THR 169.A O no hydrogen 3.963 N/A CYS 171.A SG THR 264.A OG1 no hydrogen 3.494 N/A GLY 172.A N PHE 263.A O no hydrogen 2.795 N/A SER 173.A OG SER 181.A OG no hydrogen 2.622 N/A ARG 175.A N CYS 171.A O no hydrogen 3.392 N/A ARG 175.A NH1 THR 264.A OG1 no hydrogen 3.005 N/A ARG 175.A NH1 GLU 307.A OE1 no hydrogen 3.550 N/A ARG 175.A NH1 GLU 307.A OE2 no hydrogen 3.331 N/A ARG 175.A NH2 GLU 307.A OE2 no hydrogen 2.792 N/A ARG 176.A N SER 173.A O no hydrogen 3.090 N/A ARG 176.A NH1 THR 264.A O no hydrogen 2.887 N/A GLY 177.A N PHE 174.A O no hydrogen 2.871 N/A ALA 178.A N SER 173.A O no hydrogen 3.094 N/A SER 181.A N ILE 143.A O no hydrogen 2.788 N/A SER 181.A OG SER 173.A OG no hydrogen 2.622 N/A MET 184.A N ARG 245.A O no hydrogen 2.960 N/A VAL 186.A N ASP 247.A O no hydrogen 2.844 N/A LEU 187.A N THR 169.A O no hydrogen 2.939 N/A LEU 188.A N ARG 249.A O no hydrogen 2.733 N/A THR 189.A N ILE 167.A O no hydrogen 2.830 N/A THR 189.A OG1 ILE 251.A O no hydrogen 2.513 N/A HIS 190.A NE2 ASP 163.A OD2 no hydrogen 2.907 N/A SER 192.A N HIS 190.A ND1 no hydrogen 3.207 N/A SER 192.A OG HIS 190.A ND1 no hydrogen 2.806 N/A PHE 193.A N HIS 190.A O no hydrogen 3.205 N/A SER 195.A N ASP 254.A OD1 no hydrogen 2.903 N/A SER 195.A OG ASP 254.A OD1 no hydrogen 3.232 N/A SER 195.A OG ASP 254.A OD2 no hydrogen 2.239 N/A SER 197.A OG SER 192.A O no hydrogen 3.538 N/A GLN 204.A N LYS 200.A O no hydrogen 2.800 N/A VAL 205.A N LEU 202.A O no hydrogen 3.016 N/A VAL 206.A N LEU 202.A O no hydrogen 3.164 N/A GLU 207.A N HIS 203.A O no hydrogen 2.827 N/A GLN 208.A N GLN 204.A O no hydrogen 3.080 N/A GLN 208.A NE2 GLU 158.A OE1 no hydrogen 2.760 N/A LEU 209.A N VAL 205.A O no hydrogen 2.978 N/A GLN 210.A N VAL 206.A O no hydrogen 2.799 N/A LYS 211.A N GLU 207.A O no hydrogen 2.744 N/A LYS 211.A NZ GLU 207.A OE2 no hydrogen 3.087 N/A VAL 212.A N GLN 208.A O no hydrogen 3.189 N/A HIS 213.A N GLN 210.A O no hydrogen 2.948 N/A PHE 214.A N LEU 209.A O no hydrogen 2.979 N/A ILE 215.A N LEU 209.A O no hydrogen 3.130 N/A THR 216.A N VAL 229.A O no hydrogen 2.837 N/A THR 216.A OG1 ASP 217.A OD1 no hydrogen 2.969 N/A THR 216.A OG1 VAL 229.A O no hydrogen 3.332 N/A ASP 217.A N VAL 229.A O no hydrogen 3.417 N/A LEU 219.A N MET 227.A O no hydrogen 2.951 N/A SER 220.A N MET 227.A O no hydrogen 3.118 N/A LYS 221.A NZ GLY 222.A O no hydrogen 3.504 N/A GLY 222.A N LYS 225.A O no hydrogen 2.984 N/A PHE 226.A N ILE 248.A O no hydrogen 2.632 N/A MET 227.A N SER 220.A O no hydrogen 2.758 N/A GLY 228.A N ILE 246.A O no hydrogen 2.905 N/A VAL 229.A N ASP 217.A O no hydrogen 2.842 N/A CYS 230.A N ARG 244.A O no hydrogen 2.983 N/A CYS 230.A SG ARG 244.A O no hydrogen 3.978 N/A GLN 231.A N PHE 214.A O no hydrogen 2.972 N/A GLN 231.A NE2 GLU 240.A OE2 no hydrogen 3.159 N/A GLN 231.A NE2 TYR 241.A O no hydrogen 2.793 N/A GLU 238.A N LYS 235.A O no hydrogen 2.555 N/A HIS 243.A N ASP 138.A OD2 no hydrogen 2.843 N/A ARG 244.A N CYS 230.A O no hydrogen 2.825 N/A ARG 244.A NH2 GLU 147.A OE1 no hydrogen 2.942 N/A ARG 245.A NH1 GLY 228.A O no hydrogen 2.888 N/A ARG 245.A NH1 ILE 246.A O no hydrogen 3.191 N/A ARG 245.A NH1 ASP 247.A OD1 no hydrogen 3.033 N/A ARG 245.A NH2 ASP 247.A OD1 no hydrogen 2.914 N/A ILE 246.A N GLY 228.A O no hydrogen 3.084 N/A ASP 247.A N MET 184.A O no hydrogen 2.895 N/A ILE 248.A N PHE 226.A O no hydrogen 2.801 N/A ARG 249.A N VAL 186.A O no hydrogen 2.892 N/A LEU 250.A N THR 224.A O no hydrogen 2.756 N/A ILE 251.A N LEU 188.A O no hydrogen 2.907 N/A LYS 253.A N PHE 193.A O no hydrogen 2.916 N/A GLN 255.A N PRO 252.A O no hydrogen 2.929 N/A TYR 256.A N LYS 253.A O no hydrogen 3.116 N/A TYR 256.A OH THR 169.A OG1 no hydrogen 2.667 N/A TYR 256.A OH LEU 187.A O no hydrogen 3.229 N/A GLY 259.A N GLN 255.A O no hydrogen 3.147 N/A VAL 260.A N TYR 256.A O no hydrogen 2.783 N/A LEU 261.A N TYR 257.A O no hydrogen 2.792 N/A TYR 262.A N CYS 258.A O no hydrogen 3.028 N/A PHE 263.A N GLY 259.A O no hydrogen 2.830 N/A THR 264.A OG1 VAL 260.A O no hydrogen 2.362 N/A GLY 265.A N LEU 261.A O no hydrogen 3.255 N/A SER 266.A N ARG 324.A O no hydrogen 3.171 N/A ASN 270.A N SER 266.A O no hydrogen 2.836 N/A ASN 270.A ND2 TYR 262.A O no hydrogen 2.870 N/A ASN 270.A ND2 GLY 265.A O no hydrogen 3.246 N/A LYS 271.A N ASP 267.A O no hydrogen 2.846 N/A ASN 272.A N ILE 268.A O no hydrogen 2.964 N/A MET 273.A N PHE 269.A O no hydrogen 2.886 N/A ARG 274.A N ASN 270.A O no hydrogen 2.958 N/A ALA 275.A N LYS 271.A O no hydrogen 2.828 N/A HIS 276.A N ASN 272.A O no hydrogen 2.933 N/A HIS 276.A NE2 ILE 314.A O no hydrogen 3.142 N/A ALA 277.A N MET 273.A O no hydrogen 2.881 N/A LEU 278.A N ARG 274.A O no hydrogen 3.066 N/A GLU 279.A N ALA 275.A O no hydrogen 3.341 N/A LYS 280.A N HIS 276.A O no hydrogen 3.208 N/A LYS 280.A N ALA 277.A O no hydrogen 3.254 N/A GLY 281.A N LEU 278.A O no hydrogen 2.868 N/A PHE 282.A N ALA 277.A O no hydrogen 2.739 N/A THR 283.A N ARG 290.A O no hydrogen 2.712 N/A ASN 285.A N THR 288.A O no hydrogen 3.033 N/A TYR 287.A N ASN 285.A OD1 no hydrogen 3.017 N/A THR 288.A N ASN 285.A OD1 no hydrogen 2.667 N/A THR 288.A OG1 ASN 285.A OD1 no hydrogen 2.924 N/A ARG 290.A N THR 283.A O no hydrogen 2.779 N/A LEU 292.A N GLY 281.A O no hydrogen 2.659 N/A GLY 293.A N VAL 297.A O no hydrogen 2.699 N/A GLY 296.A N GLY 293.A O no hydrogen 3.068 N/A GLY 299.A N PRO 291.A O no hydrogen 2.759 N/A LEU 302.A N ILE 289.A O no hydrogen 3.053 N/A ASP 305.A N ASP 309.A OD2 no hydrogen 3.085 N/A LYS 308.A NZ ASP 312.A OD1 no hydrogen 2.964 N/A LYS 308.A NZ ASP 312.A OD2 no hydrogen 3.187 N/A ASP 309.A N SER 306.A OG no hydrogen 3.361 N/A ILE 310.A N GLU 307.A O no hydrogen 2.938 N/A ASP 312.A N LYS 308.A O no hydrogen 2.789 N/A TYR 313.A N ASP 309.A O no hydrogen 2.970 N/A TYR 313.A OH PRO 303.A O no hydrogen 2.624 N/A ILE 314.A N ILE 310.A O no hydrogen 3.305 N/A GLN 315.A N ASP 312.A O no hydrogen 2.764 N/A TRP 316.A N PHE 311.A O no hydrogen 2.884 N/A TYR 318.A OH GLU 307.A OE2 no hydrogen 3.402 N/A ARG 319.A NE ASP 323.A O no hydrogen 2.974 N/A ARG 319.A NH1 GLU 326.A OXT no hydrogen 3.108 N/A ARG 319.A NH2 ASP 323.A O no hydrogen 2.770 N/A ARG 319.A NH2 GLU 326.A OXT no hydrogen 2.742 N/A ASP 323.A N GLU 320.A O no hydrogen 2.920 N/A ARG 324.A NE ARG 319.A O no hydrogen 2.899 N/A ARG 324.A NH1 GLU 307.A OE1 no hydrogen 3.035 N/A ARG 324.A NH1 GLU 307.A OE2 no hydrogen 3.485 N/A ARG 324.A NH2 GLU 307.A OE2 no hydrogen 3.207 N/A ARG 324.A NH2 ARG 319.A O no hydrogen 2.947 N/A