Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gu1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N LEU 50.A O no hydrogen 2.764 N/A TYR 4.A N LEU 48.A O no hydrogen 2.888 N/A TYR 4.A OH ASP 10.A OD1 no hydrogen 3.316 N/A TYR 4.A OH ASP 10.A OD2 no hydrogen 2.585 N/A TYR 4.A OH GLN 18.A OE1 no hydrogen 3.186 N/A VAL 6.A N GLU 46.A O no hydrogen 2.830 N/A LYS 7.A N ASP 10.A OD2 no hydrogen 2.849 N/A LYS 7.A NZ MET 5.A O no hydrogen 3.213 N/A ASP 10.A N LYS 7.A O no hydrogen 3.084 N/A THR 11.A OG1 SER 13.A OG no hydrogen 3.146 N/A SER 13.A OG THR 11.A OG1 no hydrogen 3.146 N/A GLY 14.A N THR 11.A OG1 no hydrogen 3.031 N/A ILE 15.A N THR 11.A O no hydrogen 2.924 N/A PHE 16.A N LEU 12.A O no hydrogen 2.994 N/A ALA 17.A N SER 13.A O no hydrogen 3.110 N/A GLN 18.A N GLY 14.A O no hydrogen 3.010 N/A LEU 19.A N ILE 15.A O no hydrogen 2.900 N/A GLY 20.A N ALA 17.A O no hydrogen 3.269 N/A VAL 21.A N PHE 16.A O no hydrogen 2.932 N/A ILE 25.A N PRO 22.A O no hydrogen 3.083 N/A LEU 26.A N PRO 22.A O no hydrogen 3.063 N/A GLN 27.A N TYR 23.A O no hydrogen 2.932 N/A LYS 28.A N SER 24.A O no hydrogen 3.292 N/A ILE 29.A N ILE 25.A O no hydrogen 3.179 N/A LEU 30.A N LEU 26.A O no hydrogen 2.948 N/A SER 31.A N GLN 27.A O no hydrogen 2.900 N/A VAL 32.A N LYS 28.A O no hydrogen 3.232 N/A ASP 33.A N ILE 29.A O no hydrogen 3.020 N/A LEU 34.A N SER 31.A O no hydrogen 3.368 N/A HIS 36.A N ASP 33.A O no hydrogen 3.046 N/A LEU 37.A N ASP 33.A O no hydrogen 2.614 N/A GLN 38.A N ASP 33.A OD1 no hydrogen 3.355 N/A GLN 38.A NE2 TYR 83.A OH no hydrogen 2.738 N/A LEU 39.A N ASP 33.A OD2 no hydrogen 2.966 N/A MET 41.A N GLN 38.A O no hydrogen 3.235 N/A GLN 43.A N GLU 46.A OE1 no hydrogen 2.737 N/A GLN 43.A NE2 MET 41.A O no hydrogen 3.377 N/A GLY 45.A N VAL 6.A O no hydrogen 2.747 N/A GLU 46.A N GLN 43.A O no hydrogen 3.081 N/A GLU 47.A N HIS 64.A O no hydrogen 3.383 N/A LEU 48.A N TYR 4.A O no hydrogen 2.793 N/A GLU 49.A N ILE 62.A O no hydrogen 2.796 N/A LEU 50.A N ILE 2.A O no hydrogen 2.862 N/A MET 51.A N ARG 60.A O no hydrogen 2.732 N/A ASP 53.A N GLN 57.A O no hydrogen 2.942 N/A MET 55.A N ASP 53.A OD1 no hydrogen 2.697 N/A GLY 56.A N ASP 53.A O no hydrogen 2.793 N/A GLN 57.A N ASP 53.A OD1 no hydrogen 2.938 N/A GLN 57.A NE2 MET 55.A O no hydrogen 3.018 N/A SER 59.A N MET 51.A O no hydrogen 2.722 N/A SER 59.A OG MET 51.A O no hydrogen 2.899 N/A ARG 60.A N MET 51.A O no hydrogen 3.306 N/A ARG 60.A NE THR 74.A OG1 no hydrogen 3.141 N/A ARG 60.A NH2 THR 74.A OG1 no hydrogen 3.188 N/A LEU 61.A N TYR 73.A O no hydrogen 2.850 N/A ILE 62.A N GLU 49.A O no hydrogen 2.833 N/A TYR 63.A N ALA 71.A O no hydrogen 2.822 N/A TYR 63.A OH GLU 46.A OE1 no hydrogen 2.556 N/A TYR 63.A OH GLU 46.A OE2 no hydrogen 3.321 N/A HIS 64.A N GLU 47.A O no hydrogen 2.818 N/A HIS 64.A NE2 GLU 49.A OE1 no hydrogen 3.000 N/A SER 66.A N GLU 69.A O no hydrogen 3.172 N/A VAL 68.A N SER 66.A OG no hydrogen 3.037 N/A GLU 69.A N SER 66.A O no hydrogen 3.332 N/A LYS 70.A N GLN 86.A O no hydrogen 3.117 N/A ALA 71.A N TYR 63.A O no hydrogen 2.945 N/A ILE 72.A N ASP 84.A O no hydrogen 2.699 N/A TYR 73.A N LEU 61.A O no hydrogen 2.752 N/A TYR 73.A OH ASP 33.A OD1 no hydrogen 2.619 N/A THR 74.A N SER 82.A O no hydrogen 2.803 N/A ARG 75.A N SER 59.A O no hydrogen 2.956 N/A ARG 75.A NE LEU 58.A O no hydrogen 3.035 N/A GLU 76.A N SER 80.A O no hydrogen 2.623 N/A GLY 79.A N GLU 76.A O no hydrogen 2.841 N/A SER 80.A N ASP 78.A OD2 no hydrogen 2.970 N/A SER 80.A OG ASP 78.A OD1 no hydrogen 3.310 N/A SER 80.A OG ASP 78.A OD2 no hydrogen 2.697 N/A SER 82.A N THR 74.A O no hydrogen 2.644 N/A SER 82.A OG THR 74.A O no hydrogen 3.307 N/A SER 82.A OG GLU 76.A OE2 no hydrogen 2.590 N/A ASP 84.A N ILE 72.A O no hydrogen 2.944 N/A GLN 86.A N LYS 70.A O no hydrogen 3.012 N/A GLN 86.A NE2 ASP 84.A OD2 no hydrogen 3.075 N/A ILE 88.A N VAL 68.A O no hydrogen 2.834 N/A GLU 91.A N TYR 149.A O no hydrogen 2.889 N/A ARG 93.A N GLN 147.A O no hydrogen 2.771 N/A ILE 95.A N VAL 145.A O no hydrogen 2.804 N/A PHE 97.A N ILE 143.A O no hydrogen 2.841 N/A SER 98.A OG ASP 142.A OD1 no hydrogen 2.522 N/A GLY 99.A N PHE 141.A O no hydrogen 3.171 N/A ILE 101.A N ASP 139.A O no hydrogen 2.695 N/A SER 108.A N SER 104.A O no hydrogen 2.920 N/A SER 108.A OG GLU 100.A O no hydrogen 2.815 N/A ALA 109.A N PHE 105.A O no hydrogen 2.737 N/A ARG 110.A N SER 106.A O no hydrogen 2.991 N/A ARG 110.A NE LEU 114.A O no hydrogen 3.158 N/A ARG 111.A N VAL 107.A O no hydrogen 2.923 N/A VAL 112.A N SER 108.A O no hydrogen 3.208 N/A GLY 113.A N ARG 110.A O no hydrogen 3.142 N/A LEU 114.A N ALA 109.A O no hydrogen 3.071 N/A THR 115.A N GLN 118.A OE1 no hydrogen 2.876 N/A THR 115.A OG1 SER 117.A OG no hydrogen 2.947 N/A SER 117.A OG THR 115.A OG1 no hydrogen 2.947 N/A GLN 118.A N THR 115.A OG1 no hydrogen 3.155 N/A VAL 119.A N THR 115.A O no hydrogen 2.938 N/A ALA 120.A N SER 116.A O no hydrogen 2.837 N/A ASN 121.A N SER 117.A O no hydrogen 2.851 N/A ILE 122.A N GLN 118.A O no hydrogen 2.908 N/A THR 123.A N VAL 119.A O no hydrogen 2.870 N/A THR 123.A OG1 VAL 119.A O no hydrogen 3.119 N/A THR 123.A OG1 ALA 120.A O no hydrogen 2.969 N/A GLN 124.A N ALA 120.A O no hydrogen 2.857 N/A VAL 125.A N ASN 121.A O no hydrogen 2.941 N/A MET 126.A N ILE 122.A O no hydrogen 3.003 N/A LYS 127.A N GLN 124.A O no hydrogen 3.428 N/A LYS 129.A N MET 126.A O no hydrogen 3.012 N/A ILE 130.A N MET 126.A O no hydrogen 2.766 N/A SER 133.A N ASP 131.A OD1 no hydrogen 2.846 N/A ARG 134.A N ASP 131.A O no hydrogen 3.113 N/A ARG 134.A N ASP 131.A OD1 no hydrogen 2.996 N/A SER 135.A N ASP 131.A O no hydrogen 3.100 N/A SER 135.A OG ASP 131.A O no hydrogen 3.269 N/A LEU 136.A N ARG 134.A O no hydrogen 2.922 N/A ARG 140.A N LYS 166.A O no hydrogen 3.095 N/A PHE 141.A N GLY 99.A O no hydrogen 3.086 N/A ASP 142.A N SER 164.A O no hydrogen 2.876 N/A ILE 143.A N PHE 97.A O no hydrogen 2.858 N/A LEU 144.A N ALA 162.A O no hydrogen 2.953 N/A VAL 145.A N ILE 95.A O no hydrogen 2.847 N/A LYS 146.A N GLU 159.A O no hydrogen 2.834 N/A LYS 146.A NZ GLU 94.A OE1 no hydrogen 3.212 N/A GLN 147.A N ARG 93.A O no hydrogen 2.751 N/A GLN 148.A N ASN 157.A O no hydrogen 2.960 N/A TYR 149.A N GLU 91.A O no hydrogen 2.659 N/A LEU 150.A N HIS 153.A O no hydrogen 2.677 N/A GLY 151.A N GLU 91.A OE2 no hydrogen 3.234 N/A HIS 153.A N LEU 150.A O no hydrogen 2.834 N/A THR 155.A N GLN 148.A O no hydrogen 3.077 N/A THR 155.A OG1 GLN 148.A O no hydrogen 2.978 N/A THR 155.A OG1 GLN 148.A OE1 no hydrogen 3.473 N/A ASN 157.A N THR 155.A OG1 no hydrogen 3.104 N/A GLU 159.A N LYS 146.A O no hydrogen 2.922 N/A LYS 161.A N LEU 144.A O no hydrogen 2.778 N/A ALA 162.A N LEU 144.A O no hydrogen 3.332 N/A ILE 163.A N ALA 174.A O no hydrogen 2.851 N/A SER 164.A N ASP 142.A O no hydrogen 3.035 N/A SER 164.A OG ASP 142.A O no hydrogen 3.440 N/A PHE 165.A N VAL 172.A O no hydrogen 2.691 N/A LYS 166.A N ARG 140.A O no hydrogen 2.663 N/A LYS 166.A NZ ASP 171.A OD1 no hydrogen 2.712 N/A LEU 167.A N ASP 171.A OD2 no hydrogen 3.024 N/A ALA 168.A N ASP 139.A OD1 no hydrogen 3.502 N/A ALA 168.A N ASP 139.A OD2 no hydrogen 2.773 N/A GLY 170.A N LEU 167.A O no hydrogen 3.346 N/A VAL 172.A N PHE 165.A O no hydrogen 3.157 N/A ALA 174.A N ILE 163.A O no hydrogen 2.714 N/A PHE 175.A N TYR 183.A O no hydrogen 2.886 N/A LEU 176.A N LYS 161.A O no hydrogen 2.870 N/A ALA 177.A N ARG 181.A O no hydrogen 2.842 N/A GLY 180.A N ALA 177.A O no hydrogen 2.918 N/A ARG 181.A N ASP 179.A OD1 no hydrogen 3.058 N/A ARG 181.A NE ASP 179.A OD2 no hydrogen 3.049 N/A ARG 181.A NH2 ASP 179.A OD2 no hydrogen 3.415 N/A ARG 181.A NH2 TYR 183.A OH no hydrogen 2.887 N/A PHE 182.A N GLU 191.A OE1 no hydrogen 2.791 N/A TYR 183.A N PHE 175.A O no hydrogen 2.913 N/A TYR 183.A OH ASP 179.A OD2 no hydrogen 2.580 N/A ASP 184.A N ASN 188.A O no hydrogen 2.887 N/A ALA 186.A N ASP 184.A OD1 no hydrogen 2.882 N/A GLY 187.A N ASP 184.A O no hydrogen 2.999 N/A ASN 188.A N ASP 184.A OD1 no hydrogen 2.931 N/A ASN 188.A ND2 ASP 184.A OD2 no hydrogen 3.144 N/A SER 189.A OG GLU 191.A O no hydrogen 2.698 N/A LEU 190.A N PHE 182.A O no hydrogen 2.747 N/A GLU 191.A N SER 189.A OG no hydrogen 3.102 N/A ARG 192.A NE ASP 243.A OD2 no hydrogen 2.638 N/A ARG 192.A NH2 ASP 243.A OD1 no hydrogen 2.590 N/A ARG 192.A NH2 ASP 243.A OD2 no hydrogen 3.208 N/A ASN 195.A N THR 241.A O no hydrogen 2.764 N/A ARG 196.A NH1 ALA 318.A O no hydrogen 2.922 N/A ARG 196.A NH1 LYS 320.A O no hydrogen 2.691 N/A ARG 196.A NH2 LYS 320.A O no hydrogen 3.059 N/A TYR 203.A N ASP 200.A O no hydrogen 2.879 N/A ARG 204.A N LYS 201.A O no hydrogen 3.312 N/A ARG 204.A NE VAL 199.A O no hydrogen 2.785 N/A ARG 204.A NH2 VAL 199.A O no hydrogen 3.154 N/A THR 207.A N ASP 229.A O no hydrogen 2.871 N/A ASN 211.A N HIS 225.A O no hydrogen 2.897 N/A LYS 213.A N ASN 211.A OD1 no hydrogen 3.132 N/A ARG 214.A N ASN 211.A O no hydrogen 3.346 N/A ARG 214.A NE VAL 223.A O no hydrogen 2.697 N/A ARG 214.A NH2 VAL 223.A O no hydrogen 3.002 N/A HIS 216.A N ARG 221.A O no hydrogen 2.682 N/A GLY 220.A N HIS 216.A O no hydrogen 2.767 N/A ARG 221.A N THR 219.A OG1 no hydrogen 3.134 N/A ARG 221.A NH2 ASP 78.A OD1 no hydrogen 2.908 N/A VAL 223.A N ARG 214.A O no hydrogen 2.736 N/A HIS 225.A N ASN 211.A O no hydrogen 2.916 N/A HIS 225.A ND1 GLY 209.A O no hydrogen 2.777 N/A HIS 225.A NE2 ASP 229.A OD1 no hydrogen 3.131 N/A THR 228.A N PHE 307.A O no hydrogen 2.726 N/A ASP 229.A N SER 208.A O no hydrogen 2.774 N/A PHE 230.A N LEU 305.A O no hydrogen 2.960 N/A ALA 231.A N GLN 205.A O no hydrogen 2.826 N/A THR 232.A N PHE 230.A O no hydrogen 2.885 N/A GLY 235.A N ALA 294.A O no hydrogen 2.754 N/A ALA 236.A N PRO 233.A O no hydrogen 3.110 N/A VAL 238.A N ALA 292.A O no hydrogen 2.812 N/A TYR 239.A N PRO 198.A O no hydrogen 2.720 N/A TYR 239.A OH ASP 200.A OD2 no hydrogen 2.835 N/A SER 240.A N GLN 289.A O no hydrogen 3.010 N/A SER 240.A OG GLY 242.A O no hydrogen 2.594 N/A THR 241.A N TYR 271.A OH no hydrogen 3.374 N/A GLY 242.A N SER 240.A OG no hydrogen 3.198 N/A GLY 244.A N VAL 285.A O no hydrogen 3.020 N/A LYS 245.A N GLU 262.A O no hydrogen 2.932 N/A VAL 246.A N GLN 283.A O no hydrogen 2.864 N/A ILE 247.A N VAL 260.A O no hydrogen 3.001 N/A VAL 248.A N VAL 260.A O no hydrogen 3.342 N/A ARG 250.A N TYR 258.A O no hydrogen 3.112 N/A ARG 250.A NH2 ASP 40.A O no hydrogen 3.211 N/A LYS 251.A NZ HIS 252.A O no hydrogen 2.837 N/A HIS 252.A N GLY 256.A O no hydrogen 2.736 N/A TYR 254.A N HIS 252.A ND1 no hydrogen 2.876 N/A ALA 255.A N HIS 252.A ND1 no hydrogen 2.990 N/A ASN 257.A N THR 297.A OG1 no hydrogen 2.911 N/A ASN 257.A ND2 LEU 274.A O no hydrogen 3.019 N/A TYR 258.A N ARG 250.A O no hydrogen 2.837 N/A TYR 258.A OH ASP 40.A OD1 no hydrogen 2.556 N/A LEU 259.A N TYR 271.A O no hydrogen 2.938 N/A VAL 260.A N VAL 248.A O no hydrogen 3.066 N/A ILE 261.A N THR 269.A O no hydrogen 2.914 N/A GLU 262.A N LYS 245.A O no hydrogen 2.927 N/A HIS 263.A N TYR 267.A O no hydrogen 2.920 N/A HIS 263.A ND1 ASP 243.A O no hydrogen 2.885 N/A HIS 263.A NE2 THR 269.A OG1 no hydrogen 2.749 N/A ASN 264.A N TYR 267.A O no hydrogen 3.508 N/A ASN 264.A ND2 GLY 180.A O no hydrogen 2.885 N/A ASN 264.A ND2 GLU 191.A OE2 no hydrogen 3.429 N/A VAL 266.A N ASN 264.A OD1 no hydrogen 2.796 N/A TYR 267.A N ASN 264.A OD1 no hydrogen 2.731 N/A TYR 267.A OH ASP 179.A O no hydrogen 2.638 N/A LYS 268.A N LEU 310.A O no hydrogen 3.109 N/A LYS 268.A NZ ASN 313.A OD1 no hydrogen 2.789 N/A THR 269.A N ILE 261.A O no hydrogen 3.002 N/A THR 269.A OG1 HIS 263.A NE2 no hydrogen 2.749 N/A THR 269.A OG1 TYR 271.A OH no hydrogen 2.766 N/A ARG 270.A N GLU 308.A O no hydrogen 2.904 N/A ARG 270.A NH1 HIS 36.A O no hydrogen 3.109 N/A ARG 270.A NH1 GLU 308.A OE1 no hydrogen 2.971 N/A ARG 270.A NH2 HIS 36.A O no hydrogen 3.258 N/A TYR 271.A N LEU 259.A O no hydrogen 2.899 N/A TYR 271.A OH THR 269.A OG1 no hydrogen 2.766 N/A LEU 272.A N HIS 306.A O no hydrogen 3.062 N/A HIS 273.A N ALA 255.A O no hydrogen 2.916 N/A HIS 273.A ND1 THR 297.A O no hydrogen 2.768 N/A LEU 274.A N ASN 257.A O no hydrogen 2.930 N/A ASP 275.A N LEU 293.A O no hydrogen 2.848 N/A LYS 276.A N LEU 293.A O no hydrogen 3.337 N/A LEU 278.A N ILE 291.A O no hydrogen 2.793 N/A GLY 282.A N VAL 246.A O no hydrogen 2.795 N/A GLN 283.A N LYS 280.A O no hydrogen 3.058 N/A VAL 285.A N GLY 244.A O no hydrogen 2.741 N/A LYS 286.A N GLN 289.A OE1 no hydrogen 2.823 N/A ARG 287.A N ASP 243.A OD1 no hydrogen 2.789 N/A ARG 287.A NH1 ALA 193.A O no hydrogen 3.132 N/A GLY 288.A N SER 240.A O no hydrogen 2.789 N/A GLN 289.A N LYS 286.A O no hydrogen 3.099 N/A ILE 291.A N VAL 238.A O no hydrogen 2.923 N/A ALA 292.A N VAL 238.A O no hydrogen 3.425 N/A LEU 293.A N LYS 276.A O no hydrogen 2.868 N/A ALA 294.A N ALA 236.A O no hydrogen 2.674 N/A THR 297.A N HIS 273.A O no hydrogen 3.282 N/A THR 297.A OG1 LEU 274.A O no hydrogen 2.758 N/A ARG 299.A N TYR 254.A O no hydrogen 2.735 N/A HIS 304.A N GLY 295.A O no hydrogen 3.334 N/A HIS 304.A ND1 GLY 302.A O no hydrogen 2.710 N/A LEU 305.A N PHE 230.A O no hydrogen 3.261 N/A HIS 306.A NE2 GLU 308.A OE2 no hydrogen 2.596 N/A PHE 307.A N THR 228.A O no hydrogen 2.824 N/A GLU 308.A N ARG 270.A O no hydrogen 2.970 N/A LEU 310.A N LYS 268.A O no hydrogen 2.753 N/A VAL 311.A N ARG 314.A O no hydrogen 2.833 N/A ARG 312.A N VAL 266.A O no hydrogen 2.761 N/A ARG 312.A NE GLU 159.A OE2 no hydrogen 2.716 N/A ARG 312.A NH2 GLU 159.A OE1 no hydrogen 3.175 N/A ARG 312.A NH2 GLU 159.A OE2 no hydrogen 3.345 N/A ARG 314.A N VAL 311.A O no hydrogen 2.904 N/A VAL 316.A N VAL 309.A O no hydrogen 3.018 N/A MET 319.A N ASP 317.A OD1 no hydrogen 2.887 N/A LYS 320.A N ASP 317.A O no hydrogen 3.084 N/A