Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q1l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N ASP 303.A OD2 no hydrogen 2.838 N/A TYR 4.A N ASP 303.A OD1 no hydrogen 2.673 N/A LEU 5.A N ASP 303.A OD1 no hydrogen 2.701 N/A ARG 6.A N GLU 23.A O no hydrogen 3.017 N/A ARG 6.A NH1 GLU 23.A OE1 no hydrogen 2.719 N/A LEU 8.A N ILE 21.A O no hydrogen 2.999 N/A THR 9.A OG1 GLU 100.A OE2 no hydrogen 2.715 N/A ALA 10.A N THR 19.A O no hydrogen 2.721 N/A SER 13.A N GLU 94.A O no hydrogen 2.534 N/A SER 13.A OG HIS 14.A ND1 no hydrogen 3.404 N/A SER 13.A OG GLU 94.A O no hydrogen 2.814 N/A HIS 14.A N GLU 94.A OE1 no hydrogen 2.679 N/A HIS 14.A ND1 GLU 94.A OE2 no hydrogen 2.778 N/A LEU 18.A N ILE 74.A O no hydrogen 2.783 N/A THR 19.A N ALA 10.A O no hydrogen 2.765 N/A ALA 20.A N LEU 72.A O no hydrogen 3.012 N/A ILE 21.A N LEU 8.A O no hydrogen 2.955 N/A LEU 22.A N ILE 70.A O no hydrogen 2.800 N/A GLU 23.A N ARG 6.A O no hydrogen 2.707 N/A ALA 27.A N ASP 312.A O no hydrogen 2.750 N/A ASN 28.A N THR 65.A O no hydrogen 2.792 N/A LEU 29.A N THR 65.A OG1 no hydrogen 2.869 N/A LEU 31.A N GLY 63.A O no hydrogen 2.826 N/A SER 32.A N GLU 35.A OE2 no hydrogen 2.856 N/A GLU 35.A N SER 32.A OG no hydrogen 3.318 N/A ASN 37.A N GLU 33.A O no hydrogen 2.638 N/A HIS 38.A N GLU 34.A O no hydrogen 2.767 N/A LEU 40.A N ILE 36.A O no hydrogen 3.121 N/A ARG 41.A N ASN 37.A O no hydrogen 2.845 N/A ARG 41.A NH1 GLU 34.A OE1 no hydrogen 3.533 N/A ARG 41.A NH2 GLU 34.A OE2 no hydrogen 2.787 N/A ARG 42.A N HIS 38.A O no hydrogen 3.227 N/A ARG 42.A NE GLU 157.A OE1 no hydrogen 2.998 N/A ARG 42.A NH1 GLU 39.A OE1 no hydrogen 2.851 N/A ARG 42.A NH1 GLU 295.A OE1 no hydrogen 2.676 N/A ARG 42.A NH2 GLU 157.A OE2 no hydrogen 2.990 N/A ARG 42.A NH2 GLU 295.A OE1 no hydrogen 3.213 N/A ARG 42.A NH2 GLU 295.A OE2 no hydrogen 2.802 N/A ARG 43.A N GLU 39.A O no hydrogen 3.194 N/A GLN 44.A N LEU 40.A O no hydrogen 3.153 N/A GLN 44.A NE2 GLU 50.A O no hydrogen 2.940 N/A ARG 45.A N ARG 41.A O no hydrogen 3.167 N/A GLY 46.A N ARG 43.A O no hydrogen 2.937 N/A TYR 47.A N GLN 44.A O no hydrogen 3.490 N/A ASP 52.A N GLN 44.A OE1 no hydrogen 2.653 N/A ALA 54.A N ASN 37.A OD1 no hydrogen 2.727 N/A GLU 55.A N PHE 73.A O no hydrogen 2.901 N/A ILE 56.A N GLU 33.A OE2 no hydrogen 2.708 N/A LEU 57.A N ALA 71.A O no hydrogen 2.722 N/A SER 58.A OG PRO 69.A O no hydrogen 2.999 N/A ARG 61.A N LYS 64.A O no hydrogen 2.831 N/A LYS 64.A N ARG 61.A O no hydrogen 3.063 N/A THR 65.A N LEU 29.A O no hydrogen 2.972 N/A THR 65.A OG1 PRO 26.A O no hydrogen 2.681 N/A LEU 66.A N GLY 59.A O no hydrogen 2.834 N/A ILE 70.A N LEU 22.A O no hydrogen 2.795 N/A LEU 72.A N ALA 20.A O no hydrogen 2.771 N/A PHE 73.A N GLU 55.A O no hydrogen 3.054 N/A ILE 74.A N LEU 18.A O no hydrogen 2.752 N/A ASN 76.A N LYS 16.A O no hydrogen 3.164 N/A ASN 76.A ND2 GLU 12.A O no hydrogen 3.401 N/A ASN 76.A ND2 GLY 15.A O no hydrogen 2.666 N/A ARG 77.A NE LYS 51.A O no hydrogen 3.525 N/A ARG 77.A NH2 THR 53.A OG1 no hydrogen 2.670 N/A ASP 78.A N ASN 76.A O no hydrogen 2.462 N/A TYR 84.A N GLY 80.A O no hydrogen 2.860 N/A ASN 85.A N ILE 82.A O no hydrogen 3.041 N/A GLN 86.A N GLY 81.A O no hydrogen 2.593 N/A GLN 86.A NE2 TYR 84.A O no hydrogen 2.692 N/A ARG 90.A N ASP 88.A OD1 no hydrogen 3.221 N/A ASN 91.A N ASP 88.A O no hydrogen 3.217 N/A ASN 91.A ND2 GLN 86.A OE1 no hydrogen 3.336 N/A ILE 92.A N LEU 89.A O no hydrogen 3.204 N/A LEU 93.A N LEU 89.A O no hydrogen 2.916 N/A GLU 94.A N ARG 90.A O no hydrogen 2.801 N/A ARG 95.A NH1 GLY 11.A O no hydrogen 3.241 N/A ARG 95.A NH2 THR 9.A OG1 no hydrogen 3.079 N/A ALA 96.A N ILE 92.A O no hydrogen 2.897 N/A SER 97.A N LEU 93.A O no hydrogen 2.715 N/A SER 97.A OG LEU 93.A O no hydrogen 2.741 N/A ARG 99.A NH1 ASP 52.A OD1 no hydrogen 3.496 N/A ARG 99.A NH1 ASN 76.A OD1 no hydrogen 2.781 N/A ARG 99.A NH2 ASP 52.A OD1 no hydrogen 2.946 N/A GLU 100.A N SER 97.A O no hydrogen 2.984 N/A THR 101.A N ALA 98.A O no hydrogen 3.090 N/A THR 101.A OG1 ALA 98.A O no hydrogen 2.567 N/A ALA 102.A N ARG 99.A O no hydrogen 3.078 N/A ALA 103.A N GLU 100.A O no hydrogen 2.965 N/A ARG 104.A N GLU 100.A O no hydrogen 3.379 N/A ARG 104.A NE GLU 100.A OE1 no hydrogen 2.903 N/A ARG 104.A NH1 SER 219.A OG no hydrogen 2.952 N/A ARG 104.A NH2 SER 219.A O no hydrogen 3.006 N/A VAL 105.A N THR 101.A O no hydrogen 2.848 N/A ALA 106.A N ALA 102.A O no hydrogen 3.145 N/A VAL 107.A N ALA 103.A O no hydrogen 3.094 N/A GLY 108.A N ARG 104.A O no hydrogen 2.904 N/A ALA 109.A N VAL 105.A O no hydrogen 2.761 N/A VAL 110.A N ALA 106.A O no hydrogen 3.376 N/A CYS 111.A N VAL 107.A O no hydrogen 3.215 N/A CYS 111.A SG VAL 107.A O no hydrogen 3.428 N/A LYS 112.A N GLY 108.A O no hydrogen 2.810 N/A LYS 112.A NZ GLU 39.A OE1 no hydrogen 3.016 N/A LYS 112.A NZ GLU 295.A OE1 no hydrogen 2.677 N/A LYS 113.A N ALA 109.A O no hydrogen 3.124 N/A LYS 113.A NZ PRO 30.A O no hydrogen 2.697 N/A LYS 113.A NZ GLU 35.A OE1 no hydrogen 2.537 N/A LYS 113.A NZ GLU 35.A OE2 no hydrogen 3.503 N/A PHE 114.A N VAL 110.A O no hydrogen 3.013 N/A LEU 115.A N CYS 111.A O no hydrogen 2.900 N/A SER 116.A N LYS 112.A O no hydrogen 2.889 N/A SER 116.A OG LYS 112.A O no hydrogen 3.396 N/A SER 116.A OG LYS 113.A O no hydrogen 2.564 N/A GLU 117.A N PHE 114.A O no hydrogen 3.206 N/A PHE 118.A N LEU 115.A O no hydrogen 2.974 N/A GLY 119.A N SER 116.A O no hydrogen 2.886 N/A ILE 120.A N LEU 115.A O no hydrogen 3.082 N/A LYS 121.A N.A LEU 195.A O no hydrogen 3.181 N/A LYS 121.A N.B LEU 195.A O no hydrogen 3.181 N/A GLY 123.A N PHE 193.A O no hydrogen 2.939 N/A SER 124.A OG SER 291.A O no hydrogen 3.364 N/A SER 124.A OG GLU 295.A OE2 no hydrogen 2.453 N/A PHE 125.A N GLU 191.A O no hydrogen 3.162 N/A VAL 126.A N ARG 162.A O no hydrogen 2.833 N/A VAL 127.A N VAL 189.A O no hydrogen 2.839 N/A SER 128.A N VAL 189.A O no hydrogen 3.289 N/A ILE 129.A N LYS 132.A O no hydrogen 2.945 N/A GLY 130.A N GLY 187.A O no hydrogen 3.017 N/A GLN 131.A N TYR 175.A OH no hydrogen 2.907 N/A LYS 132.A N ILE 129.A O no hydrogen 3.199 N/A LYS 132.A NZ GLU 171.A OE1 no hydrogen 2.701 N/A VAL 134.A N VAL 127.A O no hydrogen 2.820 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.542 N/A LEU 137.A N VAL 134.A O no hydrogen 3.085 N/A LYS 138.A N GLU 135.A O no hydrogen 3.220 N/A LYS 140.A NZ LEU 137.A O no hydrogen 2.717 N/A LYS 140.A NZ TYR 142.A OH no hydrogen 2.827 N/A LYS 140.A NZ GLU 191.A OE2 no hydrogen 2.776 N/A SER 141.A N ASP 139.A OD2 no hydrogen 3.106 N/A SER 141.A OG ASP 139.A OD2 no hydrogen 3.471 N/A TYR 142.A OH GLU 191.A OE1 no hydrogen 2.463 N/A TYR 142.A OH GLU 191.A OE2 no hydrogen 3.255 N/A PHE 143.A N LYS 140.A O no hydrogen 3.121 N/A ALA 144.A N SER 141.A O no hydrogen 3.127 N/A ASN 145.A N TYR 142.A O no hydrogen 2.800 N/A LYS 148.A N ASN 145.A OD1 no hydrogen 3.018 N/A LEU 149.A N ASN 145.A O no hydrogen 2.970 N/A LEU 150.A N PRO 146.A O no hydrogen 2.880 N/A SER 151.A N GLU 147.A O no hydrogen 2.888 N/A TYR 152.A N LYS 148.A O no hydrogen 2.742 N/A HIS 153.A N LEU 149.A O no hydrogen 2.972 N/A GLU 154.A N LEU 150.A O no hydrogen 2.931 N/A LYS 155.A N SER 151.A O no hydrogen 3.031 N/A ALA 156.A N TYR 152.A O no hydrogen 2.906 N/A GLU 157.A N HIS 153.A O no hydrogen 3.080 N/A GLU 157.A N GLU 154.A O no hydrogen 3.205 N/A ASP 158.A N LYS 155.A O no hydrogen 2.669 N/A SER 159.A N ALA 156.A O no hydrogen 2.933 N/A SER 159.A OG ASP 169.A OD1 no hydrogen 2.867 N/A SER 159.A OG ASP 169.A OD2 no hydrogen 3.183 N/A GLU 160.A N ASP 169.A OD2 no hydrogen 2.787 N/A LEU 161.A N SER 159.A OG no hydrogen 3.156 N/A ARG 162.A N SER 159.A O no hydrogen 3.270 N/A ARG 162.A NE SER 291.A OG no hydrogen 3.276 N/A ARG 162.A NH1 SER 124.A O no hydrogen 3.151 N/A ARG 162.A NH1 GLU 157.A OE2 no hydrogen 2.671 N/A ARG 162.A NH2 SER 291.A OG no hydrogen 3.265 N/A ILE 163.A N SER 159.A OG no hydrogen 3.064 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.817 N/A LYS 168.A N PHE 165.A O no hydrogen 2.775 N/A ASP 169.A N PRO 166.A O no hydrogen 2.691 N/A PHE 172.A N LYS 168.A O no hydrogen 2.815 N/A LYS 173.A N ASP 169.A O no hydrogen 2.652 N/A LYS 173.A NZ GLU 160.A OE1 no hydrogen 2.721 N/A THR 174.A N GLU 170.A O no hydrogen 3.028 N/A THR 174.A N GLU 171.A O no hydrogen 3.260 N/A THR 174.A OG1 GLU 170.A O no hydrogen 2.992 N/A TYR 175.A N GLU 171.A O no hydrogen 3.316 N/A ILE 176.A N PHE 172.A O no hydrogen 2.964 N/A ASP 177.A N LYS 173.A O no hydrogen 3.199 N/A GLU 178.A N THR 174.A O no hydrogen 2.791 N/A VAL 179.A N ILE 176.A O no hydrogen 2.675 N/A LYS 180.A N ILE 176.A O no hydrogen 2.751 N/A GLU 181.A N ASP 177.A O no hydrogen 3.056 N/A LYS 182.A N VAL 179.A O no hydrogen 2.905 N/A GLY 183.A N LYS 180.A O no hydrogen 3.303 N/A SER 185.A OG ILE 281.A O no hydrogen 2.731 N/A SER 185.A OG PRO 282.A O no hydrogen 3.565 N/A SER 185.A OG THR 283.A OG1 no hydrogen 2.891 N/A VAL 189.A N SER 128.A O no hydrogen 2.923 N/A PHE 190.A N VAL 277.A O no hydrogen 3.028 N/A GLU 191.A N PHE 125.A O no hydrogen 3.071 N/A VAL 192.A N VAL 275.A O no hydrogen 2.825 N/A PHE 193.A N GLY 123.A O no hydrogen 2.838 N/A ALA 194.A N ILE 273.A O no hydrogen 3.025 N/A LEU 195.A N LYS 121.A O.A no hydrogen 2.578 N/A LEU 195.A N LYS 121.A O.B no hydrogen 2.578 N/A ASN 196.A ND2 GLY 119.A O no hydrogen 2.967 N/A GLY 200.A N THR 269.A O no hydrogen 3.291 N/A LEU 201.A N THR 269.A OG1 no hydrogen 2.934 N/A SER 203.A N ARG 209.A O no hydrogen 2.979 N/A ILE 205.A N SER 203.A OG no hydrogen 3.282 N/A ARG 209.A N GLN 206.A O no hydrogen 2.980 N/A ARG 210.A N TRP 207.A O no hydrogen 3.453 N/A ILE 211.A N GLY 267.A O no hydrogen 2.843 N/A GLY 213.A N ASP 212.A OD1 no hydrogen 2.667 N/A ARG 214.A N ARG 210.A O no hydrogen 3.207 N/A ARG 214.A NE ARG 209.A O no hydrogen 3.519 N/A ARG 214.A NH1 GLU 307.A OE2 no hydrogen 3.114 N/A ARG 214.A NH2 ARG 209.A O no hydrogen 3.249 N/A ARG 214.A NH2 GLU 307.A OE2 no hydrogen 2.632 N/A ILE 215.A N ILE 211.A O no hydrogen 2.887 N/A ALA 216.A N ASP 212.A O no hydrogen 2.820 N/A GLN 217.A N GLY 213.A O no hydrogen 2.970 N/A ALA 218.A N ARG 214.A O no hydrogen 3.129 N/A SER 219.A OG ALA 218.A O no hydrogen 2.801 N/A ILE 223.A N ILE 220.A O no hydrogen 3.117 N/A LYS 224.A N ALA 278.A O no hydrogen 2.848 N/A GLU 227.A N ARG 276.A O no hydrogen 2.804 N/A GLY 229.A N VAL 274.A O no hydrogen 2.820 N/A LEU 230.A N ASN 260.A O no hydrogen 2.838 N/A PHE 232.A N GLU 227.A OE1 no hydrogen 2.405 N/A ALA 234.A N GLY 231.A O no hydrogen 2.917 N/A ALA 235.A N PHE 232.A O no hydrogen 3.131 N/A ARG 236.A N GLU 233.A O no hydrogen 3.076 N/A ARG 237.A N ALA 234.A O no hydrogen 3.468 N/A ARG 237.A NH1 GLN 241.A O no hydrogen 3.417 N/A GLN 241.A N PHE 238.A O no hydrogen 2.796 N/A VAL 242.A N GLY 239.A O no hydrogen 3.135 N/A HIS 243.A N GLY 239.A O no hydrogen 2.861 N/A GLY 247.A N PHE 255.A O no hydrogen 2.775 N/A SER 249.A N GLY 253.A O no hydrogen 3.035 N/A GLY 253.A N SER 249.A O no hydrogen 2.841 N/A PHE 255.A N GLY 247.A O no hydrogen 3.052 N/A ARG 256.A NE GLU 265.A OE1 no hydrogen 2.653 N/A ARG 256.A NH2 GLU 265.A OE2 no hydrogen 2.834 N/A HIS 257.A N GLU 245.A O no hydrogen 2.801 N/A SER 258.A OG ASP 244.A OD1 no hydrogen 2.692 N/A ASN 259.A ND2 PHE 143.A O no hydrogen 2.921 N/A ASN 259.A ND2 PRO 272.A O no hydrogen 2.721 N/A ASN 260.A N ASP 244.A OD1 no hydrogen 2.778 N/A ASN 260.A ND2 VAL 242.A O no hydrogen 2.896 N/A LEU 261.A N ASP 244.A OD2 no hydrogen 3.097 N/A GLY 262.A N ASN 259.A O no hydrogen 3.271 N/A GLY 263.A N ASN 259.A OD1 no hydrogen 2.864 N/A GLU 265.A N ILE 268.A O no hydrogen 2.752 N/A ILE 268.A N GLU 265.A O no hydrogen 3.154 N/A THR 269.A N LEU 201.A O no hydrogen 2.990 N/A THR 269.A OG1 PRO 198.A O no hydrogen 2.802 N/A ASN 270.A N GLY 263.A O no hydrogen 2.549 N/A ILE 273.A N ALA 194.A O no hydrogen 2.971 N/A VAL 274.A N GLY 262.A O no hydrogen 3.046 N/A VAL 275.A N VAL 192.A O no hydrogen 2.849 N/A ARG 276.A N GLU 227.A O no hydrogen 2.743 N/A ARG 276.A NE GLU 191.A OE2 no hydrogen 2.810 N/A ARG 276.A NH1 GLU 227.A OE2 no hydrogen 2.808 N/A ARG 276.A NH2 GLU 191.A OE2 no hydrogen 3.191 N/A VAL 277.A N PHE 190.A O no hydrogen 2.865 N/A ALA 278.A N GLY 225.A O no hydrogen 2.911 N/A ALA 289.A N GLY 46.A O no hydrogen 3.176 N/A ALA 290.A N ALA 286.A O no hydrogen 2.942 N/A SER 291.A N VAL 287.A O no hydrogen 2.991 N/A SER 291.A OG PRO 288.A O no hydrogen 2.492 N/A VAL 292.A N PRO 288.A O no hydrogen 3.382 N/A VAL 293.A N ALA 289.A O no hydrogen 3.073 N/A GLY 294.A N ALA 290.A O no hydrogen 2.764 N/A GLU 295.A N SER 291.A O no hydrogen 3.109 N/A ALA 296.A N VAL 292.A O no hydrogen 3.276 N/A ALA 298.A N GLU 295.A O no hydrogen 2.955 N/A ILE 299.A N ALA 296.A O no hydrogen 3.067 N/A LEU 301.A N LEU 297.A O no hydrogen 2.954 N/A ALA 302.A N ALA 298.A O no hydrogen 2.887 N/A ASP 303.A N ILE 299.A O no hydrogen 2.944 N/A ALA 304.A N VAL 300.A O no hydrogen 2.873 N/A LEU 305.A N LEU 301.A O no hydrogen 2.804 N/A LEU 306.A N ALA 302.A O no hydrogen 2.962 N/A GLU 307.A N ASP 303.A O no hydrogen 2.926 N/A LYS 308.A N ALA 304.A O no hydrogen 3.254 N/A LEU 309.A N LEU 305.A O no hydrogen 2.891 N/A GLY 310.A N LEU 306.A O no hydrogen 2.608 N/A ASP 312.A N GLU 315.A OE1 no hydrogen 2.817 N/A VAL 316.A N PHE 313.A O no hydrogen 3.172 N/A LYS 317.A NZ GLU 117.A OE1 no hydrogen 3.421 N/A LYS 318.A N GLU 314.A O no hydrogen 3.209 N/A ARG 319.A N GLU 315.A O no hydrogen 3.238 N/A ARG 319.A NH1 LEU 309.A O no hydrogen 2.765 N/A PHE 320.A N VAL 316.A O no hydrogen 2.946 N/A GLU 321.A N LYS 317.A O no hydrogen 3.034 N/A ASP 322.A N LYS 318.A O no hydrogen 3.062 N/A TYR 323.A N ARG 319.A O no hydrogen 2.974 N/A TYR 323.A OH PRO 199.A O no hydrogen 2.436 N/A VAL 324.A N PHE 320.A O no hydrogen 2.772 N/A ASN 325.A N GLU 321.A O no hydrogen 3.054 N/A HIS 326.A N ASP 322.A O no hydrogen 2.960 N/A VAL 327.A N TYR 323.A O no hydrogen 2.900 N/A LYS 328.A N VAL 324.A O no hydrogen 2.965 N/A SER 329.A N ASN 325.A O no hydrogen 3.256 N/A SER 329.A OG ASN 325.A O no hydrogen 2.902 N/A SER 329.A OG HIS 326.A O no hydrogen 3.567 N/A PHE 330.A N VAL 327.A O no hydrogen 2.990 N/A