Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mgi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N LEU 3.A O no hydrogen 2.426 N/A THR 6.A N LEU 3.A O no hydrogen 3.023 N/A LYS 8.A N ILE 5.A O no hydrogen 3.227 N/A LEU 9.A N ILE 5.A O no hydrogen 3.327 N/A GLU 10.A N THR 6.A O no hydrogen 2.546 N/A ALA 13.A N LEU 9.A O no hydrogen 2.883 N/A LYS 14.A N GLU 10.A O no hydrogen 2.948 N/A LYS 14.A NZ GLU 85.A OE1 no hydrogen 2.954 N/A LYS 14.A NZ GLU 85.A OE2 no hydrogen 3.332 N/A ALA 15.A N VAL 11.A O no hydrogen 3.039 N/A TYR 16.A N LEU 12.A O no hydrogen 2.904 N/A SER 17.A N ALA 13.A O no hydrogen 2.919 N/A VAL 18.A N LYS 14.A O no hydrogen 3.128 N/A GLN 19.A N ALA 15.A O no hydrogen 3.127 N/A GLY 20.A N SER 17.A O no hydrogen 2.907 N/A ASP 21.A N TYR 16.A O no hydrogen 2.865 N/A LYS 22.A N GLY 20.A O no hydrogen 2.679 N/A ARG 24.A N ASP 21.A OD1 no hydrogen 3.366 N/A ARG 24.A NE ASP 21.A OD2 no hydrogen 2.902 N/A ALA 25.A N ASP 21.A O no hydrogen 3.015 N/A LEU 26.A N LYS 22.A O no hydrogen 3.062 N/A GLY 27.A N TRP 23.A O no hydrogen 2.994 N/A TYR 28.A N ARG 24.A O no hydrogen 3.292 N/A ALA 29.A N ALA 25.A O no hydrogen 3.050 N/A LYS 30.A N LEU 26.A O no hydrogen 3.009 N/A ALA 31.A N GLY 27.A O no hydrogen 3.200 N/A ILE 32.A N TYR 28.A O no hydrogen 2.663 N/A ASN 33.A N ALA 29.A O no hydrogen 3.048 N/A ASN 33.A N LYS 30.A O no hydrogen 3.132 N/A ALA 34.A N LYS 30.A O no hydrogen 2.886 N/A LEU 35.A N ALA 31.A O no hydrogen 2.928 N/A LYS 36.A N ASN 33.A O no hydrogen 2.873 N/A LYS 36.A NZ GLU 10.A OE1 no hydrogen 3.332 N/A SER 37.A N ALA 34.A O no hydrogen 2.890 N/A SER 37.A OG ASN 33.A O no hydrogen 3.338 N/A PHE 38.A N LEU 35.A O no hydrogen 3.462 N/A LYS 40.A NZ PRO 41.A O no hydrogen 2.934 N/A LYS 40.A NZ THR 43.A OG1 no hydrogen 2.590 N/A LYS 40.A NZ GLU 47.A OE1 no hydrogen 3.321 N/A LYS 40.A NZ GLU 47.A OE2 no hydrogen 3.385 N/A THR 43.A N GLU 47.A OE1 no hydrogen 2.826 N/A SER 44.A N GLU 47.A OE1 no hydrogen 3.436 N/A ALA 48.A N SER 44.A O no hydrogen 3.143 N/A ALA 48.A N TYR 45.A O no hydrogen 3.085 N/A CYS 49.A N TYR 45.A O no hydrogen 3.264 N/A CYS 49.A SG TYR 45.A O no hydrogen 3.605 N/A SER 50.A N GLN 46.A O no hydrogen 3.150 N/A SER 50.A OG GLU 47.A O no hydrogen 2.620 N/A ILE 51.A N ALA 48.A O no hydrogen 2.887 N/A ILE 54.A N ILE 51.A O no hydrogen 3.190 N/A ALA 59.A N GLY 55.A O no hydrogen 2.864 N/A GLU 60.A N LYS 56.A O no hydrogen 2.845 N/A LYS 61.A NZ ARG 57.A O no hydrogen 3.393 N/A ILE 62.A N MET 58.A O no hydrogen 2.953 N/A ILE 63.A N ALA 59.A O no hydrogen 2.820 N/A GLU 64.A N GLU 60.A O no hydrogen 3.027 N/A ILE 65.A N LYS 61.A O no hydrogen 3.177 N/A LEU 66.A N ILE 63.A O no hydrogen 3.093 N/A GLU 67.A N ILE 63.A O no hydrogen 2.965 N/A SER 68.A N GLU 64.A O no hydrogen 2.857 N/A ARG 72.A N GLU 64.A OE2 no hydrogen 3.117 N/A LYS 73.A NZ TYR 16.A OH no hydrogen 3.112 N/A LEU 74.A N LEU 71.A O no hydrogen 2.925 N/A ASP 75.A N ARG 72.A O no hydrogen 2.934 N/A HIS 76.A N LYS 73.A O no hydrogen 3.027 N/A SER 78.A OG SER 80.A OG no hydrogen 3.103 N/A SER 80.A N SER 78.A OG no hydrogen 3.250 N/A SER 80.A OG SER 78.A OG no hydrogen 3.103 N/A VAL 81.A N SER 78.A O no hydrogen 3.184 N/A LEU 84.A N SER 80.A O no hydrogen 2.747 N/A GLU 85.A N VAL 81.A O no hydrogen 2.747 N/A LEU 86.A N PRO 82.A O no hydrogen 2.927 N/A PHE 87.A N VAL 83.A O no hydrogen 3.006 N/A SER 88.A N LEU 84.A O no hydrogen 2.899 N/A SER 88.A OG LEU 84.A O no hydrogen 3.169 N/A SER 88.A OG GLU 85.A O no hydrogen 3.570 N/A ASN 89.A N LEU 86.A O no hydrogen 3.407 N/A ILE 90.A N PHE 87.A O no hydrogen 2.932 N/A ALA 93.A N ILE 90.A O no hydrogen 2.817 N/A THR 95.A OG1 VAL 18.A O no hydrogen 2.705 N/A ALA 98.A N GLY 94.A O no hydrogen 2.905 N/A GLN 99.A N THR 95.A O no hydrogen 2.917 N/A GLN 99.A NE2 GLN 19.A O no hydrogen 3.126 N/A MET 100.A N LYS 96.A O no hydrogen 3.166 N/A TRP 101.A N THR 97.A O no hydrogen 3.057 N/A TYR 102.A N ALA 98.A O no hydrogen 3.039 N/A GLN 103.A N GLN 99.A O no hydrogen 2.901 N/A GLN 104.A N MET 100.A O no hydrogen 2.912 N/A GLN 104.A N TRP 101.A O no hydrogen 3.203 N/A GLY 105.A N TYR 102.A O no hydrogen 3.010 N/A PHE 106.A N TRP 101.A O no hydrogen 3.014 N/A ARG 107.A N ASP 111.A OD2 no hydrogen 2.799 N/A ARG 107.A NH1 TYR 102.A O no hydrogen 2.989 N/A ARG 107.A NH1 PHE 106.A O no hydrogen 2.838 N/A SER 108.A N ASP 111.A OD2 no hydrogen 3.134 N/A ASP 111.A N SER 108.A OG no hydrogen 3.049 N/A ILE 112.A N SER 108.A O no hydrogen 2.943 N/A ARG 113.A N LEU 109.A O no hydrogen 2.782 N/A ARG 113.A NE GLU 110.A OE1 no hydrogen 3.243 N/A ARG 113.A NH2 GLU 110.A OE1 no hydrogen 3.421 N/A ARG 113.A NH2 GLU 110.A OE2 no hydrogen 2.678 N/A SER 114.A N GLU 110.A O no hydrogen 3.092 N/A SER 114.A OG GLU 110.A O no hydrogen 3.201 N/A GLN 115.A N ASP 111.A O no hydrogen 2.950 N/A ALA 116.A N ILE 112.A O no hydrogen 2.962 N/A THR 119.A N GLN 122.A OE1 no hydrogen 2.873 N/A GLN 121.A NE2 LEU 210.A O no hydrogen 2.893 N/A GLN 122.A N THR 119.A OG1 no hydrogen 3.055 N/A GLN 122.A NE2 GLY 92.A O no hydrogen 3.067 N/A ALA 123.A N THR 119.A O no hydrogen 2.881 N/A ILE 124.A N THR 120.A O no hydrogen 3.216 N/A GLY 125.A N GLN 121.A O no hydrogen 2.951 N/A LEU 126.A N GLN 122.A O no hydrogen 2.824 N/A LYS 127.A N ALA 123.A O no hydrogen 3.121 N/A LYS 127.A NZ ASP 208.A OD2 no hydrogen 3.283 N/A HIS 128.A N GLY 125.A O no hydrogen 2.992 N/A HIS 128.A NE2 ASP 208.A OD1 no hydrogen 3.222 N/A TYR 129.A N LEU 126.A O no hydrogen 3.057 N/A TYR 129.A OH LEU 86.A O no hydrogen 2.816 N/A PHE 132.A N HIS 128.A O no hydrogen 2.888 N/A LEU 133.A N SER 130.A O no hydrogen 3.342 N/A GLU 134.A N ASP 131.A O no hydrogen 3.012 N/A ARG 135.A NE THR 173.A OG1 no hydrogen 3.009 N/A ARG 135.A NH2 THR 173.A O no hydrogen 3.077 N/A MET 136.A N CYS 174.A O no hydrogen 2.853 N/A ARG 138.A N ALA 172.A O no hydrogen 2.825 N/A ARG 138.A NH1 TYR 167.A O no hydrogen 2.765 N/A ARG 138.A NH1 LYS 171.A O no hydrogen 3.096 N/A ARG 138.A NH2 TYR 167.A O no hydrogen 2.970 N/A GLU 140.A N PRO 137.A O no hydrogen 2.798 N/A ALA 141.A N PRO 137.A O no hydrogen 3.390 N/A THR 142.A N ARG 138.A O no hydrogen 3.201 N/A THR 142.A OG1 TYR 167.A OH no hydrogen 2.873 N/A GLU 143.A N GLU 139.A O no hydrogen 3.487 N/A ILE 144.A N GLU 140.A O no hydrogen 3.091 N/A GLU 145.A N ALA 141.A O no hydrogen 2.986 N/A GLN 146.A N THR 142.A O no hydrogen 2.845 N/A THR 147.A N GLU 143.A O no hydrogen 2.796 N/A THR 147.A OG1 GLU 143.A O no hydrogen 2.709 N/A VAL 148.A N ILE 144.A O no hydrogen 3.090 N/A GLN 149.A N GLU 145.A O no hydrogen 2.766 N/A GLN 149.A NE2 GLN 153.A OE1 no hydrogen 3.569 N/A LYS 150.A N GLN 146.A O no hydrogen 2.863 N/A ALA 151.A N THR 147.A O no hydrogen 3.232 N/A ALA 152.A N VAL 148.A O no hydrogen 2.795 N/A GLN 153.A N GLN 149.A O no hydrogen 2.777 N/A GLN 153.A NE2 LEU 159.A O no hydrogen 3.668 N/A ASN 156.A N GLN 153.A O no hydrogen 3.378 N/A GLY 158.A N ASN 156.A OD1 no hydrogen 2.954 N/A LEU 159.A N ASN 156.A O no hydrogen 3.034 N/A LEU 160.A N THR 182.A O no hydrogen 3.065 N/A VAL 162.A N LEU 180.A O no hydrogen 2.898 N/A CYS 164.A N ASP 178.A O no hydrogen 2.646 N/A CYS 164.A SG VAL 162.A O no hydrogen 3.774 N/A GLY 165.A N PHE 250.A O no hydrogen 2.854 N/A TYR 167.A OH THR 142.A OG1 no hydrogen 2.873 N/A ARG 168.A N CYS 164.A O no hydrogen 3.107 N/A ARG 168.A NH1 THR 251.A OG1 no hydrogen 2.813 N/A ARG 168.A NH1 GLU 300.A OE2 no hydrogen 3.012 N/A ARG 168.A NH2 GLU 300.A OE1 no hydrogen 2.842 N/A ARG 168.A NH2 GLU 300.A OE2 no hydrogen 3.467 N/A ARG 169.A N GLY 165.A O no hydrogen 3.217 N/A ARG 169.A NH1 THR 251.A O no hydrogen 2.888 N/A ARG 169.A NH2 ASP 318.A OD1 no hydrogen 3.434 N/A GLY 170.A N TYR 167.A O no hydrogen 2.746 N/A LYS 171.A N SER 166.A O no hydrogen 2.991 N/A CYS 174.A N MET 136.A O no hydrogen 2.860 N/A CYS 174.A SG SER 166.A OG no hydrogen 3.639 N/A VAL 177.A N ARG 232.A O no hydrogen 3.174 N/A VAL 179.A N ASP 234.A O no hydrogen 2.773 N/A LEU 180.A N VAL 162.A O no hydrogen 2.752 N/A ILE 181.A N ILE 236.A O no hydrogen 2.911 N/A THR 182.A N LEU 160.A O no hydrogen 3.136 N/A THR 182.A OG1 VAL 238.A O no hydrogen 2.845 N/A HIS 183.A N THR 182.A OG1 no hydrogen 2.628 N/A HIS 183.A NE2 ASN 156.A OD1 no hydrogen 3.212 N/A ASP 185.A N HIS 183.A ND1 no hydrogen 2.960 N/A SER 188.A OG ASP 185.A OD2 no hydrogen 2.545 N/A ARG 190.A N ARG 187.A O no hydrogen 3.292 N/A LEU 196.A N ILE 192.A O no hydrogen 3.140 N/A LEU 197.A N PHE 193.A O no hydrogen 3.179 N/A ASP 198.A N SER 194.A O no hydrogen 3.058 N/A SER 199.A N ARG 195.A O no hydrogen 3.174 N/A LEU 200.A N LEU 196.A O no hydrogen 3.047 N/A ARG 201.A N LEU 197.A O no hydrogen 2.951 N/A ARG 201.A NE ASP 209.A OD2 no hydrogen 3.329 N/A ARG 201.A NH2 ASP 209.A OD2 no hydrogen 3.152 N/A GLN 202.A N ASP 198.A O no hydrogen 3.072 N/A GLU 203.A N SER 199.A O no hydrogen 3.427 N/A GLY 204.A N ARG 201.A O no hydrogen 2.872 N/A PHE 205.A N LEU 200.A O no hydrogen 3.011 N/A LEU 206.A N LEU 200.A O no hydrogen 3.168 N/A THR 207.A N VAL 220.A O no hydrogen 2.631 N/A THR 207.A OG1 ASP 208.A OD1 no hydrogen 3.149 N/A THR 207.A OG1 VAL 220.A O no hydrogen 3.143 N/A ASP 208.A N VAL 220.A O no hydrogen 3.368 N/A LEU 210.A N LEU 218.A O no hydrogen 2.910 N/A VAL 211.A N LEU 218.A O no hydrogen 2.985 N/A GLY 213.A N LYS 216.A O no hydrogen 2.829 N/A TYR 217.A N ILE 235.A O no hydrogen 2.621 N/A TYR 217.A OH ASP 209.A OD1 no hydrogen 2.892 N/A LEU 218.A N VAL 211.A O no hydrogen 2.997 N/A GLY 219.A N LEU 233.A O no hydrogen 2.799 N/A VAL 220.A N ASP 208.A O no hydrogen 2.837 N/A CYS 221.A N ARG 231.A O no hydrogen 2.831 N/A CYS 221.A SG ARG 231.A O no hydrogen 3.616 N/A ARG 222.A N PHE 205.A O no hydrogen 2.944 N/A ARG 228.A NE PRO 224.A O no hydrogen 3.398 N/A ARG 228.A NH1 GLU 143.A OE1 no hydrogen 3.259 N/A ARG 228.A NH2 GLU 143.A OE1 no hydrogen 3.484 N/A ARG 228.A NH2 GLU 143.A OE2 no hydrogen 3.123 N/A ARG 229.A NE ASP 131.A OD1 no hydrogen 2.877 N/A ARG 229.A NH2 ASP 131.A OD1 no hydrogen 3.315 N/A HIS 230.A N ASP 131.A OD2 no hydrogen 3.364 N/A ARG 231.A N CYS 221.A O no hydrogen 2.828 N/A ARG 231.A NE GLU 140.A OE2 no hydrogen 3.082 N/A ARG 232.A NH1 ASP 176.A OD1 no hydrogen 3.280 N/A LEU 233.A N GLY 219.A O no hydrogen 2.753 N/A ASP 234.A N VAL 177.A O no hydrogen 2.923 N/A ILE 235.A N TYR 217.A O no hydrogen 2.776 N/A ILE 236.A N VAL 179.A O no hydrogen 3.160 N/A VAL 237.A N THR 215.A O no hydrogen 2.820 N/A VAL 238.A N ILE 181.A O no hydrogen 2.967 N/A GLU 242.A N PRO 239.A O no hydrogen 2.913 N/A PHE 243.A N TYR 240.A O no hydrogen 3.151 N/A ALA 246.A N GLU 242.A O no hydrogen 2.918 N/A LEU 247.A N PHE 243.A O no hydrogen 2.793 N/A LEU 248.A N ALA 244.A O no hydrogen 2.879 N/A TYR 249.A N CYS 245.A O no hydrogen 2.771 N/A PHE 250.A N ALA 246.A O no hydrogen 2.786 N/A THR 251.A OG1 LEU 247.A O no hydrogen 2.631 N/A GLY 252.A N LEU 248.A O no hydrogen 3.384 N/A SER 253.A N ARG 317.A O no hydrogen 3.266 N/A SER 253.A OG ARG 317.A O no hydrogen 3.287 N/A SER 253.A OG TRP 319.A OXT no hydrogen 3.008 N/A PHE 256.A N SER 253.A OG no hydrogen 3.414 N/A ASN 257.A N SER 253.A O no hydrogen 2.898 N/A ASN 257.A ND2 TYR 249.A O no hydrogen 2.785 N/A ARG 258.A N ALA 254.A O no hydrogen 3.030 N/A SER 259.A N HIS 255.A O no hydrogen 3.049 N/A MET 260.A N PHE 256.A O no hydrogen 2.817 N/A ARG 261.A N ASN 257.A O no hydrogen 2.787 N/A ALA 262.A N ARG 258.A O no hydrogen 2.961 N/A LEU 263.A N SER 259.A O no hydrogen 3.017 N/A ALA 264.A N MET 260.A O no hydrogen 3.056 N/A LYS 265.A N ARG 261.A O no hydrogen 3.131 N/A LYS 265.A NZ GLY 286.A O no hydrogen 3.367 N/A THR 266.A N ALA 262.A O no hydrogen 3.182 N/A THR 266.A OG1 LEU 263.A O no hydrogen 2.618 N/A LYS 267.A N LEU 263.A O no hydrogen 3.376 N/A LYS 267.A N ALA 264.A O no hydrogen 3.134 N/A GLY 268.A N LYS 265.A O no hydrogen 2.844 N/A MET 269.A N ALA 264.A O no hydrogen 2.766 N/A SER 270.A N SER 277.A O no hydrogen 2.924 N/A SER 272.A N ALA 275.A O no hydrogen 3.069 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 2.636 N/A HIS 274.A N SER 272.A OG no hydrogen 3.073 N/A HIS 274.A ND1 GLU 242.A OE1 no hydrogen 3.042 N/A ALA 275.A N SER 272.A OG no hydrogen 3.423 N/A SER 277.A N SER 270.A O no hydrogen 2.663 N/A THR 278.A N ARG 293.A O no hydrogen 2.879 N/A VAL 280.A N GLY 268.A O no hydrogen 3.222 N/A VAL 281.A N GLY 290.A O no hydrogen 3.008 N/A ARG 282.A NH1 MET 269.A O no hydrogen 3.499 N/A ARG 282.A NH2 MET 269.A O no hydrogen 2.641 N/A ASN 283.A N CYS 287.A O no hydrogen 3.093 N/A HIS 285.A N ASN 283.A OD1 no hydrogen 3.219 N/A LYS 288.A NZ SER 270.A OG no hydrogen 3.152 N/A VAL 289.A N VAL 281.A O no hydrogen 2.717 N/A GLY 290.A N VAL 281.A O no hydrogen 2.837 N/A ARG 293.A N THR 278.A O no hydrogen 2.843 N/A LEU 295.A N LEU 276.A O no hydrogen 2.763 N/A THR 299.A N ASP 302.A OD2 no hydrogen 2.780 N/A THR 299.A OG1 ASP 302.A OD2 no hydrogen 2.888 N/A ASP 302.A N THR 299.A O no hydrogen 3.043 N/A PHE 304.A N GLU 300.A O no hydrogen 3.198 N/A ARG 305.A N LYS 301.A O no hydrogen 2.754 N/A ARG 305.A NH2 ASP 302.A OD1 no hydrogen 2.934 N/A LEU 306.A N ASP 302.A O no hydrogen 2.727 N/A LEU 307.A N VAL 303.A O no hydrogen 3.022 N/A LEU 307.A N PHE 304.A O no hydrogen 2.959 N/A GLY 308.A N ARG 305.A O no hydrogen 2.644 N/A LEU 309.A N PHE 304.A O no hydrogen 2.827 N/A TYR 311.A OH GLU 300.A OE1 no hydrogen 3.424 N/A GLU 316.A N GLU 313.A O no hydrogen 2.568 N/A ARG 317.A N PRO 314.A O no hydrogen 2.889 N/A ARG 317.A NE ARG 312.A O no hydrogen 2.862 N/A ARG 317.A NH1 GLU 300.A OE1 no hydrogen 3.335 N/A ARG 317.A NH1 GLU 300.A OE2 no hydrogen 3.235 N/A ARG 317.A NH2 GLU 300.A OE1 no hydrogen 2.737 N/A ARG 317.A NH2 ARG 312.A O no hydrogen 3.051 N/A TRP 319.A N SER 253.A OG no hydrogen 3.135 N/A