Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5emj_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG GLU 45.A OE2 no hydrogen 3.885 N/A MET 2.A N GLU 45.A OE2 no hydrogen 2.683 N/A GLN 5.A N SER 22.A O no hydrogen 3.202 N/A GLU 7.A N GLY 20.A O no hydrogen 2.733 N/A ALA 8.A N GLY 20.A O no hydrogen 3.119 N/A ALA 9.A N ASP 277.A OD2 no hydrogen 2.834 N/A ARG 10.A N LEU 18.A O no hydrogen 2.983 N/A ARG 10.A NE ASP 277.A OD2 no hydrogen 2.935 N/A ARG 10.A NH2 ASP 60.A OD1 no hydrogen 3.345 N/A ARG 10.A NH2 ASP 277.A OD2 no hydrogen 3.371 N/A TYR 11.A N THR 279.A OG1 no hydrogen 2.974 N/A TYR 11.A OH THR 289.A OG1 no hydrogen 2.742 N/A ARG 12.A N ALA 16.A O no hydrogen 2.948 N/A ARG 12.A NE ASP 14.A OD1 no hydrogen 2.781 N/A ARG 12.A NH1 GLU 66.A O no hydrogen 2.970 N/A ARG 12.A NH1 GLU 87.A OE1 no hydrogen 3.381 N/A ARG 12.A NH1 GLU 87.A OE2 no hydrogen 3.163 N/A ARG 12.A NH2 ASP 14.A OD1 no hydrogen 3.556 N/A ARG 12.A NH2 ASP 14.A OD2 no hydrogen 2.736 N/A ARG 12.A NH2 GLU 87.A OE1 no hydrogen 3.165 N/A SER 13.A OG GLU 66.A OE2 no hydrogen 2.627 N/A GLY 15.A N ARG 12.A O no hydrogen 2.954 N/A ALA 16.A N ASP 14.A OD1 no hydrogen 3.188 N/A LEU 17.A N PHE 36.A O no hydrogen 3.009 N/A LEU 18.A N ARG 10.A O no hydrogen 3.017 N/A LEU 19.A N TRP 34.A O no hydrogen 2.828 N/A GLY 20.A N ALA 8.A O no hydrogen 2.847 N/A ALA 21.A N SER 32.A O no hydrogen 3.321 N/A SER 22.A N GLN 5.A O no hydrogen 2.786 N/A SER 22.A OG VAL 58.A O no hydrogen 3.136 N/A SER 23.A N ALA 30.A O no hydrogen 2.651 N/A SER 23.A OG SER 25.A O no hydrogen 3.003 N/A SER 23.A OG CYS 28.A O no hydrogen 2.620 N/A LEU 24.A N GLN 5.A OE1 no hydrogen 2.778 N/A SER 32.A N ALA 21.A O no hydrogen 2.895 N/A SER 32.A OG GLU 3.A OE1 no hydrogen 2.792 N/A LEU 33.A N VAL 52.A O no hydrogen 2.908 N/A TRP 34.A N LEU 19.A O no hydrogen 2.911 N/A TRP 34.A NE1 SER 32.A OG no hydrogen 2.777 N/A LEU 35.A N ALA 50.A O no hydrogen 3.184 N/A PHE 36.A N LEU 17.A O no hydrogen 2.811 N/A LYS 37.A N SER 49.A OG no hydrogen 2.872 N/A LYS 37.A NZ GLU 87.A O no hydrogen 3.486 N/A LYS 37.A NZ GLU 87.A OE1 no hydrogen 3.385 N/A CYS 40.A N ASP 38.A OD1 no hydrogen 3.384 N/A ALA 41.A N ASP 38.A O no hydrogen 3.104 N/A ASN 44.A N ALA 41.A O no hydrogen 3.256 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.541 N/A GLY 46.A N ASN 44.A OD1 no hydrogen 2.798 N/A PHE 47.A N ASN 44.A O no hydrogen 3.303 N/A CYS 48.A SG GLU 45.A O no hydrogen 3.292 N/A CYS 48.A SG ALA 50.A O no hydrogen 3.152 N/A SER 49.A N LEU 35.A O no hydrogen 2.806 N/A ALA 50.A N LEU 35.A O no hydrogen 3.247 N/A VAL 52.A N LEU 33.A O no hydrogen 2.843 N/A THR 54.A N GLY 31.A O no hydrogen 2.805 N/A THR 54.A OG1 ALA 56.A O no hydrogen 2.880 N/A VAL 58.A N SER 22.A OG no hydrogen 2.585 N/A ALA 59.A N ALA 72.A O no hydrogen 2.731 N/A ASP 60.A N ALA 72.A O no hydrogen 3.383 N/A LEU 61.A N ASP 60.A OD1 no hydrogen 2.963 N/A THR 62.A N LEU 70.A O no hydrogen 3.016 N/A THR 62.A OG1 TRP 63.A O no hydrogen 3.171 N/A TRP 63.A NE1 ARG 10.A O no hydrogen 3.083 N/A VAL 64.A N GLY 68.A O no hydrogen 2.608 N/A ARG 67.A NE GLU 87.A OE2 no hydrogen 2.983 N/A GLY 68.A N VAL 64.A O no hydrogen 3.024 N/A ILE 69.A N TRP 81.A O no hydrogen 2.643 N/A LEU 70.A N THR 62.A O no hydrogen 2.822 N/A VAL 71.A N GLU 79.A O no hydrogen 2.622 N/A ALA 72.A N ASP 60.A O no hydrogen 2.669 N/A SER 73.A N ALA 77.A O no hydrogen 3.118 N/A SER 73.A OG SER 75.A OG no hydrogen 2.665 N/A ASP 74.A N GLY 57.A O no hydrogen 3.331 N/A SER 75.A N SER 73.A OG no hydrogen 3.071 N/A SER 75.A OG SER 73.A OG no hydrogen 2.665 N/A GLY 76.A N SER 73.A O no hydrogen 3.130 N/A ALA 77.A N SER 75.A OG no hydrogen 3.394 N/A VAL 78.A N LYS 96.A O no hydrogen 3.104 N/A GLU 79.A N VAL 71.A O no hydrogen 2.983 N/A LEU 80.A N PHE 94.A O no hydrogen 2.956 N/A TRP 81.A N ILE 69.A O no hydrogen 2.757 N/A GLU 82.A N VAL 91.A O no hydrogen 2.611 N/A LEU 83.A N ARG 67.A O no hydrogen 2.588 N/A ASP 84.A N LEU 89.A O no hydrogen 3.099 N/A GLU 87.A N ASP 84.A O no hydrogen 3.077 N/A THR 88.A OG1 ASP 84.A OD2 no hydrogen 2.896 N/A LEU 89.A N ASP 84.A OD2 no hydrogen 3.172 N/A VAL 91.A N GLU 82.A O no hydrogen 2.966 N/A LYS 93.A N LEU 80.A O no hydrogen 2.734 N/A PHE 94.A N LEU 80.A O no hydrogen 3.058 N/A CYS 95.A SG GLU 79.A OE1 no hydrogen 3.544 N/A CYS 95.A SG TYR 97.A OH no hydrogen 3.540 N/A LYS 96.A N VAL 78.A O no hydrogen 3.065 N/A TYR 97.A OH GLU 55.A OE1 no hydrogen 2.721 N/A TYR 97.A OH GLU 55.A OE2 no hydrogen 2.999 N/A HIS 99.A N GLY 76.A O no hydrogen 3.121 N/A HIS 99.A ND1 ASP 121.A OD1 no hydrogen 3.103 N/A HIS 99.A ND1 ASP 121.A OD2 no hydrogen 3.067 N/A HIS 99.A NE2 SER 117.A OG no hydrogen 2.936 N/A ASP 100.A N ASP 121.A OD2 no hydrogen 2.798 N/A ILE 102.A N ASP 101.A OD1 no hydrogen 2.593 N/A VAL 103.A N SER 73.A O no hydrogen 3.093 N/A SER 104.A N GLY 118.A O no hydrogen 2.835 N/A SER 104.A OG GLY 118.A O no hydrogen 3.062 N/A SER 104.A OG VAL 145.A O no hydrogen 2.791 N/A THR 105.A N GLY 118.A O no hydrogen 3.251 N/A VAL 106.A N ASP 60.A OD2 no hydrogen 3.258 N/A SER 107.A N VAL 116.A O no hydrogen 2.945 N/A LEU 109.A N GLN 114.A O no hydrogen 2.995 N/A SER 110.A OG ASP 155.A OD1 no hydrogen 2.695 N/A SER 111.A N ASP 155.A OD1 no hydrogen 2.585 N/A SER 111.A OG THR 113.A OG1 no hydrogen 2.789 N/A SER 111.A OG ASP 155.A OD1 no hydrogen 3.107 N/A SER 111.A OG ASP 155.A OD2 no hydrogen 2.546 N/A GLY 112.A N LEU 109.A O no hydrogen 2.915 N/A THR 113.A OG1 SER 111.A OG no hydrogen 2.789 N/A ALA 115.A N TRP 127.A O no hydrogen 3.217 N/A VAL 116.A N SER 107.A O no hydrogen 3.047 N/A SER 117.A N LYS 125.A O no hydrogen 2.973 N/A SER 117.A OG HIS 99.A NE2 no hydrogen 2.936 N/A GLY 118.A N THR 105.A O no hydrogen 2.735 N/A SER 119.A N CYS 123.A O no hydrogen 3.280 N/A SER 119.A OG ASP 101.A O no hydrogen 2.887 N/A SER 119.A OG ILE 102.A O no hydrogen 2.914 N/A LYS 120.A N ILE 102.A O no hydrogen 2.908 N/A ASP 121.A N SER 119.A OG no hydrogen 3.069 N/A ILE 122.A N SER 119.A O no hydrogen 3.151 N/A CYS 123.A N ASP 121.A OD1 no hydrogen 2.917 N/A CYS 123.A SG ASP 121.A O no hydrogen 3.913 N/A ILE 124.A N TYR 138.A O no hydrogen 2.879 N/A LYS 125.A N SER 117.A O no hydrogen 3.103 N/A LYS 125.A NZ SER 137.A OG no hydrogen 2.924 N/A VAL 126.A N SER 136.A O no hydrogen 2.897 N/A TRP 127.A N ALA 115.A O no hydrogen 2.707 N/A TRP 127.A NE1 SER 117.A OG no hydrogen 3.055 N/A ASP 128.A N VAL 133.A O no hydrogen 2.859 N/A LEU 129.A N THR 113.A O no hydrogen 3.211 N/A GLN 131.A N ASP 128.A OD1 no hydrogen 3.141 N/A VAL 133.A N ASP 128.A O no hydrogen 3.232 N/A LEU 135.A N VAL 126.A O no hydrogen 2.681 N/A SER 136.A N VAL 126.A O no hydrogen 3.329 N/A SER 136.A OG TYR 138.A OH no hydrogen 3.343 N/A TYR 138.A N ILE 124.A O no hydrogen 2.718 N/A HIS 141.A ND1 ASP 164.A OD1 no hydrogen 3.267 N/A HIS 141.A ND1 ASP 164.A OD2 no hydrogen 3.185 N/A HIS 141.A NE2 SER 160.A OG no hydrogen 2.969 N/A ALA 142.A N ASP 164.A OD2 no hydrogen 2.671 N/A VAL 145.A N SER 119.A O no hydrogen 3.013 N/A THR 146.A N CYS 161.A O no hydrogen 2.780 N/A CYS 147.A N.A CYS 161.A O no hydrogen 3.391 N/A CYS 147.A N.B CYS 161.A O no hydrogen 3.357 N/A CYS 147.A SG.B THR 191.A O no hydrogen 3.141 N/A VAL 148.A N THR 105.A OG1 no hydrogen 2.863 N/A ALA 149.A N LEU 159.A O no hydrogen 2.858 N/A ALA 150.A N SER 107.A OG no hydrogen 3.208 N/A SER 151.A N VAL 157.A O no hydrogen 2.838 N/A SER 151.A OG LYS 154.A O no hydrogen 3.030 N/A SER 151.A OG VAL 157.A O no hydrogen 3.143 N/A LYS 154.A N SER 151.A OG no hydrogen 3.185 N/A SER 156.A OG ASP 171.A OD1 no hydrogen 3.034 N/A VAL 157.A N LYS 154.A O no hydrogen 3.247 N/A LEU 159.A N ALA 149.A O no hydrogen 2.800 N/A SER 160.A N LEU 168.A O no hydrogen 2.942 N/A SER 160.A OG HIS 141.A NE2 no hydrogen 2.969 N/A CYS 161.A N CYS 147.A O.A no hydrogen 3.065 N/A CYS 161.A N CYS 147.A O.B no hydrogen 3.287 N/A CYS 161.A SG PRO 190.A O no hydrogen 3.470 N/A SER 162.A N ARG 166.A O no hydrogen 3.313 N/A SER 162.A OG ALA 143.A O no hydrogen 2.716 N/A SER 162.A OG GLN 144.A O no hydrogen 2.744 N/A GLU 163.A N GLN 144.A O no hydrogen 3.215 N/A ASP 164.A N SER 162.A OG no hydrogen 3.384 N/A ASN 165.A N SER 162.A O no hydrogen 3.216 N/A ASN 165.A ND2 GLY 187.A O no hydrogen 3.641 N/A ARG 166.A N ASP 164.A OD1 no hydrogen 2.867 N/A ARG 166.A NE GLN 180.A OE1 no hydrogen 3.123 N/A ARG 166.A NH1 ASP 164.A OD2 no hydrogen 2.898 N/A LEU 168.A N SER 160.A O no hydrogen 2.867 N/A LEU 169.A N SER 179.A O no hydrogen 3.040 N/A TRP 170.A N PHE 158.A O no hydrogen 2.933 N/A TRP 170.A NE1 SER 160.A OG no hydrogen 3.000 N/A ASP 171.A N PRO 177.A O no hydrogen 2.781 N/A THR 172.A N SER 156.A O no hydrogen 2.896 N/A ARG 173.A N ASP 171.A OD1 no hydrogen 3.074 N/A ARG 173.A NE ASP 171.A OD1 no hydrogen 3.000 N/A ARG 173.A NH2 ASP 171.A OD2 no hydrogen 2.830 N/A CYS 174.A N ASP 171.A O no hydrogen 3.038 N/A CYS 174.A SG ASP 171.A O no hydrogen 3.856 N/A SER 179.A N LEU 169.A O no hydrogen 2.870 N/A ILE 181.A N ILE 167.A O no hydrogen 2.895 N/A LEU 189.A N GLU 208.A OE2 no hydrogen 2.831 N/A THR 191.A N GLY 206.A O no hydrogen 2.698 N/A THR 191.A OG1 GLY 206.A O no hydrogen 3.278 N/A THR 191.A OG1 VAL 233.A O no hydrogen 2.646 N/A SER 192.A N GLY 206.A O no hydrogen 3.336 N/A SER 192.A OG VAL 233.A O no hydrogen 3.023 N/A ALA 194.A N VAL 204.A O no hydrogen 3.164 N/A TRP 195.A NE1 ALA 149.A O no hydrogen 2.896 N/A HIS 196.A N VAL 202.A O no hydrogen 2.787 N/A GLN 198.A N HIS 196.A ND1 no hydrogen 3.116 N/A GLN 199.A N HIS 196.A ND1 no hydrogen 3.234 N/A VAL 202.A N GLN 199.A O no hydrogen 3.144 N/A PHE 203.A N VAL 215.A O no hydrogen 3.084 N/A VAL 204.A N ALA 194.A O no hydrogen 3.016 N/A PHE 205.A N SER 213.A O no hydrogen 2.938 N/A GLY 206.A N SER 192.A O no hydrogen 2.899 N/A ASP 207.A N THR 211.A O no hydrogen 3.022 N/A GLU 208.A N LEU 189.A O no hydrogen 2.881 N/A ASN 209.A N ASP 207.A OD1 no hydrogen 2.740 N/A GLY 210.A N ASP 207.A O no hydrogen 3.443 N/A THR 211.A N ASP 207.A OD1 no hydrogen 3.040 N/A VAL 212.A N SER 226.A O no hydrogen 2.881 N/A SER 213.A N PHE 205.A O no hydrogen 2.929 N/A LEU 214.A N LEU 224.A O no hydrogen 2.809 N/A VAL 215.A N PHE 203.A O no hydrogen 2.781 N/A THR 217.A N GLU 201.A O no hydrogen 3.265 N/A THR 217.A OG1 GLU 201.A O no hydrogen 2.850 N/A LYS 218.A NZ THR 217.A OG1 no hydrogen 3.422 N/A VAL 223.A N LEU 214.A O no hydrogen 2.901 N/A SER 226.A N VAL 212.A O no hydrogen 2.902 N/A HIS 229.A N GLY 210.A O no hydrogen 2.853 N/A HIS 229.A ND1 ASP 252.A OD2 no hydrogen 2.971 N/A HIS 229.A NE2 SER 248.A OG no hydrogen 3.158 N/A SER 230.A N ASP 252.A OD2 no hydrogen 3.348 N/A GLN 231.A NE2 GLU 251.A O no hydrogen 3.331 N/A VAL 233.A N ASP 207.A O no hydrogen 3.060 N/A THR 234.A N LEU 249.A O no hydrogen 3.091 N/A THR 234.A OG1 VAL 275.A O no hydrogen 3.489 N/A VAL 237.A N ALA 247.A O no hydrogen 2.966 N/A SER 239.A N PHE 245.A O no hydrogen 2.605 N/A SER 239.A OG PHE 245.A O no hydrogen 3.156 N/A HIS 241.A NE2 HIS 285.A O no hydrogen 2.531 N/A PHE 245.A N SER 239.A OG no hydrogen 2.528 N/A LEU 246.A N LEU 258.A O no hydrogen 2.830 N/A ALA 247.A N VAL 237.A O no hydrogen 2.742 N/A SER 248.A N ALA 256.A O no hydrogen 2.684 N/A SER 248.A OG HIS 229.A NE2 no hydrogen 3.158 N/A LEU 249.A N GLY 235.A O no hydrogen 3.146 N/A SER 250.A OG GLN 231.A O no hydrogen 3.081 N/A SER 250.A OG CYS 232.A O no hydrogen 2.690 N/A GLU 251.A N CYS 232.A O no hydrogen 3.324 N/A ASP 252.A N SER 250.A OG no hydrogen 3.026 N/A CYS 253.A N SER 250.A O no hydrogen 3.133 N/A CYS 253.A SG GLU 251.A O no hydrogen 3.736 N/A SER 254.A N ASP 252.A OD1 no hydrogen 2.874 N/A SER 254.A OG ASP 252.A OD1 no hydrogen 2.957 N/A LEU 255.A N SER 268.A O no hydrogen 3.040 N/A ALA 256.A N SER 248.A O no hydrogen 2.819 N/A VAL 257.A N PHE 266.A O no hydrogen 3.099 N/A LEU 258.A N LEU 246.A O no hydrogen 2.811 N/A ASP 259.A N SER 263.A O no hydrogen 3.087 N/A SER 261.A N ASP 259.A OD1 no hydrogen 3.049 N/A SER 261.A OG ASP 259.A OD1 no hydrogen 3.262 N/A LEU 262.A N ASP 259.A O no hydrogen 2.898 N/A SER 263.A N ASP 259.A OD1 no hydrogen 2.936 N/A LEU 265.A N VAL 257.A O no hydrogen 2.845 N/A PHE 266.A N VAL 257.A O no hydrogen 3.400 N/A ARG 267.A NH1 VAL 228.A O no hydrogen 2.735 N/A SER 268.A N LEU 255.A O no hydrogen 2.662 N/A ALA 270.A N SER 268.A OG no hydrogen 3.137 N/A HIS 271.A ND1 ASP 294.A OD1 no hydrogen 2.749 N/A HIS 271.A ND1 ASP 294.A OD2 no hydrogen 2.909 N/A HIS 271.A NE2 THR 290.A OG1 no hydrogen 3.094 N/A ARG 272.A N ASP 294.A OD2 no hydrogen 2.993 N/A PHE 274.A N ASP 273.A OD1 no hydrogen 2.833 N/A VAL 275.A N SER 250.A O no hydrogen 3.376 N/A ARG 276.A N VAL 291.A O no hydrogen 2.916 N/A ARG 276.A NH1 GLU 7.A OE2 no hydrogen 2.907 N/A THR 279.A N THR 289.A O no hydrogen 2.859 N/A TRP 280.A NE1 VAL 237.A O no hydrogen 3.206 N/A SER 281.A N LEU 287.A O no hydrogen 3.030 N/A ASN 284.A N SER 281.A OG no hydrogen 2.823 N/A SER 286.A N ASN 284.A OD1 no hydrogen 3.484 N/A SER 286.A OG VAL 302.A O no hydrogen 3.237 N/A LEU 287.A N ASN 284.A O no hydrogen 2.746 N/A LEU 288.A N HIS 300.A O no hydrogen 3.077 N/A THR 289.A N THR 279.A O no hydrogen 2.907 N/A THR 289.A OG1 TYR 11.A OH no hydrogen 2.742 N/A THR 289.A OG1 HIS 299.A ND1 no hydrogen 2.826 N/A THR 290.A N VAL 298.A O no hydrogen 2.934 N/A THR 290.A OG1 HIS 271.A NE2 no hydrogen 3.094 N/A THR 290.A OG1 HIS 300.A NE2 no hydrogen 2.774 N/A VAL 291.A N ASP 277.A O no hydrogen 3.266 N/A TRP 293.A N PHE 274.A O no hydrogen 3.031 N/A TRP 293.A NE1 GLU 7.A OE1 no hydrogen 3.004 N/A HIS 295.A N GLY 292.A O no hydrogen 3.023 N/A HIS 295.A ND1 ARG 4.A O no hydrogen 3.145 N/A GLN 296.A N ASP 294.A OD1 no hydrogen 3.228 N/A GLN 296.A NE2 ALA 270.A O no hydrogen 3.000 N/A GLN 296.A NE2 ASP 294.A OD2 no hydrogen 2.939 N/A VAL 298.A N THR 290.A O no hydrogen 2.993 N/A HIS 299.A ND1 THR 289.A OG1 no hydrogen 2.826 N/A HIS 300.A N LEU 288.A O no hydrogen 2.616 N/A HIS 300.A NE2 THR 290.A OG1 no hydrogen 2.774 N/A VAL 302.A N SER 286.A O no hydrogen 2.867 N/A