Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4lei_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASP 91.A OD2 no hydrogen 3.381 N/A VAL 5.A N GLU 32.A O no hydrogen 2.774 N/A LEU 6.A N LEU 92.A O no hydrogen 2.782 N/A PHE 7.A N ARG 34.A O no hydrogen 2.934 N/A THR 8.A N VAL 94.A O no hydrogen 3.045 N/A LEU 10.A N ASP 96.A OD2 no hydrogen 2.870 N/A ALA 12.A N LEU 10.A O no hydrogen 2.813 N/A HIS 15.A ND1 ASP 96.A OD1 no hydrogen 2.998 N/A HIS 15.A ND1 ASP 96.A OD2 no hydrogen 2.712 N/A PHE 16.A N ALA 12.A O no hydrogen 3.013 N/A PHE 17.A N SER 13.A O no hydrogen 2.645 N/A ASN 18.A N SER 14.A O no hydrogen 3.117 N/A ASN 18.A ND2 LEU 117.A O no hydrogen 3.006 N/A LEU 19.A N PHE 16.A O no hydrogen 2.843 N/A VAL 20.A N PHE 16.A O no hydrogen 3.288 N/A ALA 23.A N LEU 19.A O no hydrogen 3.004 N/A TRP 24.A N VAL 20.A O no hydrogen 2.943 N/A TRP 24.A NE1 ALA 48.A O no hydrogen 2.905 N/A ALA 25.A N PRO 21.A O no hydrogen 2.519 N/A LEU 26.A N LEU 22.A O no hydrogen 2.796 N/A ARG 27.A N ALA 23.A O no hydrogen 3.077 N/A ALA 28.A N TRP 24.A O no hydrogen 2.722 N/A ALA 29.A N ALA 25.A O no hydrogen 3.160 N/A ALA 29.A N LEU 26.A O no hydrogen 2.827 N/A GLY 30.A N LEU 26.A O no hydrogen 3.291 N/A GLY 30.A N ARG 27.A O no hydrogen 2.914 N/A GLU 32.A N MET 3.A O no hydrogen 2.940 N/A ARG 34.A N VAL 5.A O no hydrogen 3.027 N/A VAL 35.A N THR 51.A O no hydrogen 2.741 N/A ALA 36.A N PHE 7.A O no hydrogen 2.826 N/A ILE 37.A N VAL 53.A O no hydrogen 3.036 N/A CYS 38.A SG ASN 40.A OD1 no hydrogen 3.671 N/A ASN 40.A ND2 LEU 59.A O no hydrogen 3.374 N/A MET 41.A N CYS 38.A O no hydrogen 2.734 N/A MET 44.A N MET 41.A O no hydrogen 3.094 N/A VAL 45.A N VAL 42.A O no hydrogen 2.998 N/A THR 46.A N VAL 42.A O no hydrogen 3.131 N/A GLY 47.A N SER 43.A O no hydrogen 2.924 N/A ALA 48.A N MET 44.A O no hydrogen 3.247 N/A ALA 48.A N VAL 45.A O no hydrogen 3.117 N/A GLY 49.A N THR 46.A O no hydrogen 2.731 N/A LEU 50.A N VAL 45.A O no hydrogen 3.175 N/A VAL 53.A N VAL 35.A O no hydrogen 2.832 N/A VAL 55.A N ILE 37.A O no hydrogen 3.119 N/A GLY 56.A N ASP 80.A OD2 no hydrogen 3.169 N/A LEU 59.A N ASN 40.A OD1 no hydrogen 2.911 N/A ILE 62.A N ASP 60.A OD2 no hydrogen 3.310 N/A SER 63.A OG ASP 60.A O no hydrogen 2.857 N/A GLU 68.A N ASP 65.A O no hydrogen 3.257 N/A GLN 69.A N ASP 65.A O no hydrogen 3.526 N/A HIS 71.A N GLU 68.A O no hydrogen 3.094 N/A LEU 72.A N GLN 69.A O no hydrogen 2.721 N/A VAL 73.A N GLU 68.A O no hydrogen 3.365 N/A SER 77.A N ASP 74.A OD2 no hydrogen 3.248 N/A SER 77.A OG LEU 72.A O no hydrogen 3.370 N/A LEU 78.A N ASP 74.A O no hydrogen 3.389 N/A ASP 79.A N ASP 75.A O no hydrogen 3.333 N/A LEU 81.A N SER 77.A O no hydrogen 3.140 N/A MET 82.A N LEU 78.A O no hydrogen 2.659 N/A GLY 83.A N ASP 79.A O no hydrogen 2.659 N/A PHE 84.A N ASP 80.A O no hydrogen 2.879 N/A ALA 85.A N LEU 81.A O no hydrogen 2.521 N/A GLU 86.A N MET 82.A O no hydrogen 2.630 N/A LYS 87.A N GLY 83.A O no hydrogen 3.417 N/A TRP 88.A N PHE 84.A O no hydrogen 2.580 N/A GLN 89.A N ALA 85.A O no hydrogen 2.495 N/A ASP 91.A N ARG 4.A O no hydrogen 2.914 N/A VAL 93.A N ARG 112.A O no hydrogen 2.946 N/A VAL 94.A N LEU 6.A O no hydrogen 2.878 N/A TRP 95.A N VAL 114.A O no hydrogen 2.766 N/A ASP 96.A N THR 8.A O no hydrogen 3.009 N/A ALA 97.A N MET 116.A O no hydrogen 3.173 N/A VAL 99.A N ASP 96.A O no hydrogen 3.215 N/A CYS 100.A N HIS 71.A O no hydrogen 2.802 N/A VAL 104.A N CYS 100.A O no hydrogen 3.128 N/A VAL 105.A N SER 101.A O no hydrogen 3.153 N/A ALA 106.A N GLY 102.A O no hydrogen 2.857 N/A ARG 107.A N PRO 103.A O no hydrogen 2.931 N/A ARG 107.A NH1 ASP 162.A OD1 no hydrogen 2.777 N/A ALA 108.A N VAL 104.A O no hydrogen 2.990 N/A LEU 109.A N VAL 105.A O no hydrogen 2.734 N/A LEU 109.A N ALA 106.A O no hydrogen 3.167 N/A GLY 110.A N ALA 106.A O no hydrogen 2.544 N/A GLY 110.A N ARG 107.A O no hydrogen 3.134 N/A ALA 111.A N ALA 106.A O no hydrogen 3.140 N/A ARG 112.A N ASP 91.A O no hydrogen 3.238 N/A ARG 112.A NH1 GLN 169.A OE1 no hydrogen 3.569 N/A HIS 113.A N GLN 169.A OE1 no hydrogen 3.037 N/A HIS 113.A NE2 GLU 164.A O no hydrogen 2.846 N/A VAL 114.A N VAL 93.A O no hydrogen 2.722 N/A ARG 115.A N ALA 170.A O no hydrogen 2.896 N/A ARG 115.A NE THR 167.A O no hydrogen 2.994 N/A ARG 115.A NE THR 171.A OG1 no hydrogen 2.980 N/A ARG 115.A NH1 ASP 121.A OD1 no hydrogen 2.682 N/A ARG 115.A NH2 ASP 121.A OD1 no hydrogen 3.184 N/A ARG 115.A NH2 ASP 121.A OD2 no hydrogen 2.833 N/A ARG 115.A NH2 THR 171.A OG1 no hydrogen 2.877 N/A MET 116.A N TRP 95.A O no hydrogen 2.844 N/A LEU 117.A N ILE 172.A O no hydrogen 3.152 N/A VAL 122.A N LEU 120.A O no hydrogen 2.849 N/A GLY 124.A N ASP 121.A OD1 no hydrogen 2.966 N/A TRP 125.A N ASP 121.A O no hydrogen 2.539 N/A LEU 126.A N VAL 122.A O no hydrogen 2.682 N/A ARG 127.A N SER 123.A O no hydrogen 2.666 N/A ARG 127.A NE GLU 163.A OE2 no hydrogen 3.348 N/A ARG 127.A NH1 ASP 144.A OD1 no hydrogen 3.201 N/A ARG 127.A NH2 ASP 144.A OD1 no hydrogen 3.407 N/A ARG 127.A NH2 ASP 144.A OD2 no hydrogen 2.783 N/A ARG 127.A NH2 GLU 163.A OE1 no hydrogen 3.479 N/A SER 128.A N GLY 124.A O no hydrogen 2.783 N/A GLY 129.A N TRP 125.A O no hydrogen 2.931 N/A PHE 130.A N LEU 126.A O no hydrogen 3.039 N/A LEU 131.A N ARG 127.A O no hydrogen 2.986 N/A GLU 132.A N SER 128.A O no hydrogen 3.231 N/A GLU 132.A N GLY 129.A O no hydrogen 3.253 N/A TYR 133.A N GLY 129.A O no hydrogen 3.189 N/A GLN 134.A N PHE 130.A O no hydrogen 2.908 N/A GLN 134.A NE2 ARG 142.A O no hydrogen 3.308 N/A GLN 134.A NE2 VAL 143.A O no hydrogen 3.399 N/A GLU 135.A N LEU 131.A O no hydrogen 3.076 N/A SER 136.A OG TYR 133.A O no hydrogen 2.922 N/A LYS 137.A N GLN 134.A O no hydrogen 3.309 N/A GLN 141.A N PRO 138.A O no hydrogen 2.526 N/A ARG 142.A N PRO 139.A O no hydrogen 3.262 N/A ARG 142.A NE GLU 135.A O no hydrogen 3.024 N/A ARG 142.A NH2 GLU 135.A O no hydrogen 2.659 N/A VAL 143.A N GLN 141.A O no hydrogen 2.454 N/A GLY 147.A N ASP 144.A OD1 no hydrogen 3.253 N/A THR 148.A N ASP 144.A O no hydrogen 2.952 N/A THR 148.A OG1 ASP 144.A O no hydrogen 2.701 N/A THR 148.A OG1 PRO 145.A O no hydrogen 3.021 N/A TRP 149.A N PRO 145.A O no hydrogen 2.957 N/A LEU 150.A N LEU 146.A O no hydrogen 3.063 N/A GLY 151.A N GLY 147.A O no hydrogen 2.786 N/A ALA 152.A N THR 148.A O no hydrogen 3.073 N/A LYS 153.A NZ GLU 68.A OE1 no hydrogen 3.402 N/A LYS 153.A NZ GLU 68.A OE2 no hydrogen 2.575 N/A LYS 153.A NZ ASP 75.A OD1 no hydrogen 3.537 N/A LEU 154.A N LEU 150.A O no hydrogen 2.725 N/A ALA 155.A N GLY 151.A O no hydrogen 2.546 N/A LYS 156.A N ALA 152.A O no hydrogen 3.147 N/A LYS 156.A NZ ASP 75.A OD1 no hydrogen 3.463 N/A LYS 156.A NZ ASP 75.A OD2 no hydrogen 2.419 N/A PHE 157.A N LEU 154.A O no hydrogen 2.990 N/A GLY 158.A N ALA 155.A O no hydrogen 2.806 N/A ALA 159.A N LEU 154.A O no hydrogen 3.001 N/A GLU 164.A N ASP 162.A OD2 no hydrogen 2.867 N/A ILE 165.A N ASP 162.A O no hydrogen 3.134 N/A VAL 166.A N GLU 163.A O no hydrogen 2.988 N/A GLY 168.A N GLU 164.A O no hydrogen 2.618 N/A GLN 169.A N HIS 113.A O no hydrogen 2.917 N/A GLN 169.A NE2 GLU 164.A OE1 no hydrogen 3.351 N/A THR 171.A N ASP 186.A O no hydrogen 3.068 N/A THR 171.A OG1 THR 167.A O no hydrogen 2.720 N/A ILE 172.A N ARG 115.A O no hydrogen 2.738 N/A ASP 173.A N ILE 188.A O no hydrogen 2.791 N/A ILE 175.A N ASP 173.A OD1 no hydrogen 3.255 N/A ARG 180.A N SER 177.A O no hydrogen 3.094 N/A ARG 180.A NE ASP 173.A OD2 no hydrogen 2.730 N/A ARG 180.A NH2 ASP 173.A OD2 no hydrogen 2.908 N/A ARG 180.A NH2 SER 189.A OG no hydrogen 2.807 N/A LEU 185.A N VAL 183.A O no hydrogen 2.754 N/A TYR 187.A OH ASP 121.A OD2 no hydrogen 2.706 N/A ILE 188.A N THR 171.A O no hydrogen 2.834 N/A MET 190.A N ASP 173.A O no hydrogen 3.147 N/A ARG 191.A N PRO 360.A O no hydrogen 2.879 N/A ARG 191.A NE SER 359.A O no hydrogen 3.319 N/A LEU 205.A N PRO 202.A O no hydrogen 2.855 N/A ARG 206.A NH2 LEU 201.A O no hydrogen 3.346 N/A VAL 214.A N GLU 246.A O no hydrogen 2.880 N/A CYS 215.A N VAL 279.A O no hydrogen 2.932 N/A ILE 216.A N ILE 248.A O no hydrogen 2.850 N/A THR 217.A N ILE 281.A O no hydrogen 3.133 N/A THR 217.A OG1 THR 250.A OG1 no hydrogen 2.771 N/A ARG 223.A NH2 ARG 223.A O no hydrogen 3.510 N/A GLN 230.A NE2 GLU 255.A O no hydrogen 3.646 N/A ARG 235.A N ALA 231.A O no hydrogen 3.060 N/A ARG 235.A NH1 PHE 327.A O no hydrogen 2.733 N/A LEU 236.A N MET 232.A O no hydrogen 2.721 N/A LEU 237.A N VAL 233.A O no hydrogen 2.617 N/A ARG 238.A N GLU 234.A O no hydrogen 2.735 N/A ARG 238.A NH1 GLU 257.A O no hydrogen 2.736 N/A ARG 238.A NH2 GLU 234.A OE2 no hydrogen 2.595 N/A ARG 238.A NH2 GLU 257.A O no hydrogen 3.371 N/A GLY 239.A N ARG 235.A O no hydrogen 2.785 N/A ALA 240.A N LEU 236.A O no hydrogen 2.779 N/A ALA 241.A N LEU 237.A O no hydrogen 3.290 N/A ARG 242.A N ARG 238.A O no hydrogen 3.290 N/A ARG 242.A N GLY 239.A O no hydrogen 3.243 N/A LEU 243.A N ALA 240.A O no hydrogen 3.109 N/A VAL 245.A N LEU 243.A O no hydrogen 2.802 N/A GLU 246.A N PRO 212.A O no hydrogen 3.277 N/A VAL 247.A N ASN 261.A O no hydrogen 2.759 N/A ILE 248.A N VAL 214.A O no hydrogen 2.734 N/A ALA 249.A N ARG 263.A O no hydrogen 2.858 N/A THR 250.A N ILE 216.A O no hydrogen 2.785 N/A THR 250.A OG1 ILE 216.A O no hydrogen 3.465 N/A THR 250.A OG1 THR 217.A OG1 no hydrogen 2.771 N/A THR 250.A OG1 THR 250.A O no hydrogen 2.733 N/A SER 252.A OG ASP 254.A OD1 no hydrogen 3.117 N/A ASN 261.A ND2 ALA 241.A O no hydrogen 3.138 N/A ASN 261.A ND2 LEU 243.A O no hydrogen 3.147 N/A ASN 261.A ND2 VAL 245.A O no hydrogen 2.581 N/A ARG 263.A N VAL 247.A O no hydrogen 2.799 N/A HIS 265.A N ALA 249.A O no hydrogen 3.128 N/A TYR 267.A OH ASN 196.A O no hydrogen 2.059 N/A ASN 271.A N ASN 196.A OD1 no hydrogen 3.005 N/A GLU 272.A N GLU 272.A OE1 no hydrogen 2.626 N/A LEU 273.A N PRO 269.A O no hydrogen 2.997 N/A LEU 274.A N LEU 270.A O no hydrogen 2.706 N/A GLU 275.A N ASN 271.A O no hydrogen 3.222 N/A GLU 275.A N GLU 272.A O no hydrogen 3.242 N/A SER 276.A N LEU 273.A O no hydrogen 2.783 N/A SER 276.A OG LEU 273.A O no hydrogen 2.762 N/A CYS 277.A N LEU 274.A O no hydrogen 3.466 N/A CYS 277.A SG LEU 273.A O no hydrogen 3.574 N/A SER 278.A N ARG 213.A O no hydrogen 2.874 N/A VAL 279.A N ARG 213.A O no hydrogen 3.355 N/A ILE 280.A N PRO 298.A O no hydrogen 3.274 N/A ILE 281.A N CYS 215.A O no hydrogen 2.779 N/A HIS 282.A N LEU 300.A O no hydrogen 2.955 N/A HIS 282.A NE2 GLN 299.A OE1 no hydrogen 2.656 N/A HIS 283.A ND1 LEU 302.A O no hydrogen 3.254 N/A GLY 284.A N HIS 282.A ND1 no hydrogen 3.041 N/A THR 286.A OG1 VAL 118.A O no hydrogen 3.520 N/A GLN 289.A N THR 286.A O no hydrogen 3.092 N/A GLU 290.A N THR 286.A O no hydrogen 3.233 N/A THR 291.A N THR 287.A O no hydrogen 3.243 N/A THR 291.A OG1 THR 287.A O no hydrogen 2.685 N/A ALA 292.A N THR 288.A O no hydrogen 3.158 N/A THR 293.A N GLN 289.A O no hydrogen 2.718 N/A THR 293.A OG1 GLN 289.A O no hydrogen 2.941 N/A THR 293.A OG1 GLN 289.A OE1 no hydrogen 3.121 N/A VAL 294.A N GLU 290.A O no hydrogen 2.161 N/A ASN 295.A N THR 291.A O no hydrogen 3.005 N/A ASN 295.A N ALA 292.A O no hydrogen 2.845 N/A GLY 296.A N THR 293.A O no hydrogen 2.996 N/A VAL 297.A N ALA 292.A O no hydrogen 3.247 N/A GLN 299.A N ALA 318.A O no hydrogen 3.070 N/A GLN 299.A NE2 GLN 289.A O no hydrogen 3.418 N/A GLN 299.A NE2 THR 293.A OG1 no hydrogen 2.903 N/A GLN 299.A NE2 VAL 297.A O no hydrogen 3.596 N/A LEU 300.A N ILE 280.A O no hydrogen 2.816 N/A ILE 301.A N LEU 320.A O no hydrogen 3.224 N/A LEU 302.A N HIS 282.A O no hydrogen 2.823 N/A ARG 309.A N ASP 305.A O no hydrogen 3.226 N/A ALA 310.A N GLU 306.A O no hydrogen 3.402 N/A GLU 311.A N SER 307.A O no hydrogen 2.504 N/A LEU 312.A N ARG 308.A O no hydrogen 2.734 N/A LEU 313.A N ARG 309.A O no hydrogen 2.818 N/A ALA 314.A N ALA 310.A O no hydrogen 2.996 N/A ASP 315.A N GLU 311.A O no hydrogen 2.933 N/A ARG 316.A N LEU 312.A O no hydrogen 3.396 N/A ARG 316.A NH1 GLU 355.A OE1 no hydrogen 2.662 N/A ARG 316.A NH1 GLU 355.A OE2 no hydrogen 3.171 N/A ARG 316.A NH2 GLU 355.A OE2 no hydrogen 2.895 N/A GLY 317.A N ALA 314.A O no hydrogen 2.673 N/A LEU 320.A N GLN 299.A O no hydrogen 3.176 N/A THR 326.A N ASP 323.A OD2 no hydrogen 2.820 N/A THR 326.A OG1 ASP 323.A OD2 no hydrogen 3.194 N/A PHE 327.A N ASP 323.A O no hydrogen 2.920 N/A THR 328.A N ASP 331.A OD2 no hydrogen 2.517 N/A THR 328.A OG1 ASP 330.A OD1 no hydrogen 3.159 N/A THR 328.A OG1 ASP 330.A OD2 no hydrogen 3.318 N/A VAL 332.A N THR 328.A O no hydrogen 3.286 N/A ARG 333.A N GLU 329.A O no hydrogen 2.933 N/A GLY 334.A N ASP 330.A O no hydrogen 2.693 N/A GLN 335.A N ASP 331.A O no hydrogen 2.682 N/A LEU 336.A N VAL 332.A O no hydrogen 2.857 N/A ALA 337.A N ARG 333.A O no hydrogen 2.747 N/A ARG 338.A N GLY 334.A O no hydrogen 3.130 N/A ARG 338.A N GLN 335.A O no hydrogen 2.833 N/A LEU 339.A N GLN 335.A O no hydrogen 3.146 N/A LEU 340.A N LEU 336.A O no hydrogen 2.945 N/A ASP 341.A N ARG 338.A O no hydrogen 2.970 N/A GLU 342.A N ARG 338.A O no hydrogen 2.838 N/A ALA 347.A N PRO 343.A O no hydrogen 2.952 N/A ASN 348.A N SER 344.A O no hydrogen 2.456 N/A ASN 348.A ND2 GLY 317.A O no hydrogen 2.810 N/A ALA 349.A N PHE 345.A O no hydrogen 2.694 N/A ALA 350.A N ALA 347.A O no hydrogen 2.783 N/A LEU 351.A N ALA 347.A O no hydrogen 3.225 N/A ILE 352.A N ASN 348.A O no hydrogen 3.416 N/A ARG 353.A N ALA 349.A O no hydrogen 2.853 N/A ARG 354.A N ALA 350.A O no hydrogen 2.725 N/A ARG 354.A NE ALA 350.A O no hydrogen 3.323 N/A GLU 355.A N LEU 351.A O no hydrogen 2.773 N/A ILE 356.A N ILE 352.A O no hydrogen 2.904 N/A GLU 357.A N ARG 353.A O no hydrogen 2.804 N/A GLU 358.A N GLU 355.A O no hydrogen 3.103 N/A SER 359.A N ILE 356.A O no hydrogen 3.106 N/A SER 359.A OG ILE 356.A O no hydrogen 2.522 N/A SER 361.A N ASP 364.A OD2 no hydrogen 2.885 N/A SER 361.A OG ASP 364.A OD2 no hydrogen 2.756 N/A ASP 364.A N SER 361.A OG no hydrogen 2.930 N/A ILE 365.A N SER 361.A O no hydrogen 3.050 N/A ILE 365.A N PRO 362.A O no hydrogen 2.607 N/A VAL 366.A N PRO 362.A O no hydrogen 3.201 N/A LEU 369.A N ILE 365.A O no hydrogen 3.062 N/A LEU 369.A N VAL 366.A O no hydrogen 2.659 N/A GLU 370.A N VAL 366.A O no hydrogen 3.000 N/A LYS 371.A N PRO 367.A O no hydrogen 2.778 N/A LEU 372.A N ARG 368.A O no hydrogen 3.324 N/A VAL 373.A N LEU 369.A O no hydrogen 2.834 N/A ALA 374.A N GLU 370.A O no hydrogen 2.810 N/A GLU 375.A N LEU 372.A O no hydrogen 3.472 N/A