Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yi8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N THR 144.A OG1 no hydrogen 3.264 N/A VAL 5.A N GLU 35.A O no hydrogen 3.011 N/A LEU 6.A N LEU 145.A O no hydrogen 3.431 N/A THR 7.A N PHE 37.A O no hydrogen 2.762 N/A THR 7.A OG1 PHE 37.A O no hydrogen 3.401 N/A ASP 9.A N LEU 39.A O no hydrogen 3.245 N/A THR 12.A OG1 ARG 10.A O no hydrogen 2.867 N/A LEU 15.A N ASP 66.A OD2 no hydrogen 2.795 N/A LEU 17.A N ILE 204.A O no hydrogen 3.195 N/A HIS 19.A N HIS 16.A O no hydrogen 2.505 N/A LEU 20.A N HIS 16.A O no hydrogen 3.328 N/A ALA 21.A N LEU 17.A O no hydrogen 2.259 N/A GLY 22.A N GLY 18.A O no hydrogen 3.120 N/A SER 23.A OG HIS 19.A O no hydrogen 3.443 N/A LEU 24.A N HIS 19.A O no hydrogen 2.743 N/A ARG 27.A N SER 23.A O no hydrogen 3.229 N/A ARG 27.A NH1 GLY 8.A O no hydrogen 3.468 N/A ARG 27.A NH1 ASP 9.A OD2 no hydrogen 3.562 N/A ARG 27.A NH2 ASP 9.A OD1 no hydrogen 3.033 N/A ARG 29.A N GLN 25.A O no hydrogen 2.726 N/A LEU 30.A N ASN 26.A O no hydrogen 2.333 N/A GLN 31.A N ARG 27.A O no hydrogen 2.506 N/A GLN 31.A NE2 GLY 71.A O no hydrogen 3.455 N/A ASP 32.A N ASP 32.A OD2 no hydrogen 2.301 N/A GLU 35.A N PRO 3.A O no hydrogen 3.292 N/A PHE 37.A N VAL 5.A O no hydrogen 2.909 N/A VAL 38.A N THR 78.A O no hydrogen 2.982 N/A LEU 39.A N THR 7.A O no hydrogen 2.606 N/A LEU 40.A N VAL 80.A O no hydrogen 2.563 N/A GLN 44.A N GLN 82.A OE1 no hydrogen 2.671 N/A ALA 45.A N ALA 41.A O no hydrogen 2.966 N/A LEU 46.A N VAL 43.A O no hydrogen 2.841 N/A THR 47.A N VAL 43.A O no hydrogen 3.350 N/A THR 47.A N GLN 44.A O no hydrogen 3.242 N/A THR 47.A OG1 GLN 44.A O no hydrogen 2.592 N/A HIS 49.A N ALA 45.A O no hydrogen 3.065 N/A ARG 52.A N HIS 49.A O no hydrogen 2.697 N/A GLN 55.A N ARG 52.A O no hydrogen 3.236 N/A GLN 55.A NE2 THR 12.A O no hydrogen 3.002 N/A VAL 56.A N PRO 53.A O no hydrogen 2.790 N/A ARG 57.A N PRO 53.A O no hydrogen 3.358 N/A GLU 58.A N GLU 54.A O no hydrogen 3.276 N/A ASN 59.A N GLN 55.A O no hydrogen 3.232 N/A VAL 60.A N VAL 56.A O no hydrogen 3.090 N/A VAL 60.A N ARG 57.A O no hydrogen 3.007 N/A ALA 62.A N GLU 58.A O no hydrogen 3.164 N/A VAL 63.A N ASN 59.A O no hydrogen 2.720 N/A ALA 64.A N VAL 60.A O no hydrogen 3.159 N/A LEU 65.A N LEU 61.A O no hydrogen 3.198 N/A ASP 66.A N ALA 62.A O no hydrogen 3.236 N/A TYR 67.A N VAL 63.A O no hydrogen 3.037 N/A TYR 67.A N ALA 64.A O no hydrogen 2.482 N/A TYR 67.A OH ASP 9.A OD1 no hydrogen 2.660 N/A LEU 68.A N ALA 64.A O no hydrogen 3.045 N/A ALA 69.A N LEU 65.A O no hydrogen 2.861 N/A ALA 70.A N TYR 67.A O no hydrogen 3.279 N/A GLY 71.A N LEU 68.A O no hydrogen 3.170 N/A LEU 72.A N TYR 67.A O no hydrogen 3.177 N/A ASP 73.A N GLN 31.A OE1 no hydrogen 2.431 N/A LYS 76.A N ASP 73.A O no hydrogen 2.945 N/A THR 77.A N ASP 73.A O no hydrogen 2.985 N/A THR 77.A OG1 GLN 31.A OE1 no hydrogen 3.241 N/A THR 78.A N LEU 36.A O no hydrogen 3.093 N/A VAL 80.A N VAL 38.A O no hydrogen 2.827 N/A VAL 81.A N THR 308.A OG1 no hydrogen 2.960 N/A GLN 82.A NE2 ASP 137.A OD1 no hydrogen 3.341 N/A ALA 84.A N VAL 81.A O no hydrogen 2.731 N/A VAL 85.A N GLN 82.A O no hydrogen 3.043 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.583 N/A LEU 88.A N VAL 85.A O no hydrogen 3.080 N/A GLU 90.A N PRO 86.A O no hydrogen 3.160 N/A LEU 91.A N GLU 87.A O no hydrogen 2.970 N/A THR 92.A N LEU 88.A O no hydrogen 2.958 N/A THR 92.A OG1 ALA 89.A O no hydrogen 2.646 N/A VAL 93.A N ALA 89.A O no hydrogen 2.987 N/A TYR 94.A N GLU 90.A O no hydrogen 3.432 N/A TYR 94.A OH GLU 90.A OE1 no hydrogen 3.110 N/A PHE 95.A N LEU 91.A O no hydrogen 2.968 N/A LEU 96.A N THR 92.A O no hydrogen 3.021 N/A LEU 96.A N VAL 93.A O no hydrogen 3.109 N/A ASN 97.A N TYR 94.A O no hydrogen 3.148 N/A LEU 98.A N PHE 95.A O no hydrogen 2.963 N/A HIS 103.A N THR 100.A OG1 no hydrogen 2.909 N/A LEU 104.A N THR 100.A O no hydrogen 2.866 N/A ARG 105.A N VAL 101.A O no hydrogen 2.469 N/A GLN 106.A N SER 102.A O no hydrogen 2.936 N/A ASN 107.A N LEU 104.A O no hydrogen 3.304 N/A THR 109.A OG1 ASP 151.A O no hydrogen 2.624 N/A VAL 110.A N ASN 107.A OD1 no hydrogen 3.275 N/A LYS 111.A N ASN 107.A O no hydrogen 3.327 N/A ALA 112.A N PRO 108.A O no hydrogen 3.303 N/A GLU 113.A N THR 109.A O no hydrogen 2.796 N/A ILE 114.A N VAL 110.A O no hydrogen 2.860 N/A ALA 115.A N LYS 111.A O no hydrogen 3.297 N/A GLN 116.A N ALA 112.A O no hydrogen 3.443 N/A LYS 117.A N ILE 114.A O no hydrogen 3.268 N/A LYS 117.A NZ ASP 48.A OD1 no hydrogen 2.994 N/A LYS 117.A NZ ASP 48.A OD2 no hydrogen 2.454 N/A GLY 118.A N ALA 115.A O no hydrogen 2.973 N/A TYR 119.A N ILE 114.A O no hydrogen 3.234 N/A VAL 123.A N GLU 121.A O no hydrogen 2.742 N/A PHE 128.A N PRO 124.A O no hydrogen 2.791 N/A VAL 129.A N ALA 125.A O no hydrogen 2.927 N/A TYR 130.A N PHE 127.A O no hydrogen 2.900 N/A TYR 130.A OH GLU 113.A OE1 no hydrogen 3.356 N/A TYR 130.A OH GLU 113.A OE2 no hydrogen 3.306 N/A VAL 132.A N VAL 129.A O no hydrogen 2.916 N/A SER 133.A N TYR 130.A O no hydrogen 3.164 N/A SER 133.A OG TYR 130.A O no hydrogen 2.952 N/A GLN 134.A N TYR 130.A O no hydrogen 3.153 N/A ALA 135.A N PRO 131.A O no hydrogen 3.185 N/A ALA 136.A N VAL 132.A O no hydrogen 2.943 N/A ASP 137.A N SER 133.A O no hydrogen 3.042 N/A ILE 138.A N GLN 134.A O no hydrogen 2.981 N/A ALA 139.A N ALA 135.A O no hydrogen 2.674 N/A ALA 140.A N ALA 136.A O no hydrogen 3.091 N/A PHE 141.A N ASP 137.A O no hydrogen 2.950 N/A GLY 142.A N ALA 139.A O no hydrogen 3.218 N/A ALA 143.A N ILE 138.A O no hydrogen 3.060 N/A THR 144.A N ARG 4.A O no hydrogen 3.002 N/A THR 144.A OG1 ARG 4.A O no hydrogen 3.337 N/A LEU 145.A N ARG 4.A O no hydrogen 3.320 N/A VAL 146.A N GLN 178.A O no hydrogen 2.727 N/A VAL 148.A N GLN 180.A O no hydrogen 2.533 N/A MET 155.A N GLN 152.A O no hydrogen 2.856 N/A LEU 156.A N GLN 152.A O no hydrogen 2.769 N/A GLU 157.A N LEU 153.A O no hydrogen 2.588 N/A GLN 158.A N MET 155.A O no hydrogen 2.741 N/A THR 159.A N MET 155.A O no hydrogen 2.835 N/A THR 159.A OG1 MET 155.A O no hydrogen 3.145 N/A ARG 160.A N LEU 156.A O no hydrogen 3.471 N/A GLU 161.A N GLU 157.A O no hydrogen 3.216 N/A ILE 162.A N GLN 158.A O no hydrogen 2.865 N/A VAL 163.A N THR 159.A O no hydrogen 2.810 N/A ARG 164.A N ARG 160.A O no hydrogen 2.935 N/A ARG 164.A NH1 GLU 176.A OE1 no hydrogen 3.260 N/A ARG 165.A N GLU 161.A O no hydrogen 2.992 N/A PHE 166.A N ILE 162.A O no hydrogen 2.826 N/A ASN 167.A N VAL 163.A O no hydrogen 2.837 N/A ASN 167.A ND2 LEU 174.A O no hydrogen 2.895 N/A ALA 168.A N ARG 164.A O no hydrogen 2.795 N/A LEU 169.A N ARG 165.A O no hydrogen 2.828 N/A LEU 169.A N PHE 166.A O no hydrogen 3.058 N/A TYR 170.A N PHE 166.A O no hydrogen 2.635 N/A VAL 173.A N ALA 171.A O no hydrogen 2.603 N/A LEU 174.A N ASN 167.A OD1 no hydrogen 2.866 N/A GLN 178.A N THR 144.A O no hydrogen 2.692 N/A GLN 180.A N VAL 146.A O no hydrogen 2.923 N/A GLN 180.A NE2 ASN 26.A OD1 no hydrogen 3.220 N/A ASP 191.A N ASN 202.A OD1 no hydrogen 2.769 N/A GLY 192.A N GLY 189.A O no hydrogen 2.907 N/A LEU 200.A N SER 197.A O no hydrogen 2.916 N/A ALA 205.A N ASP 208.A OD2 no hydrogen 2.483 N/A LEU 206.A N LEU 15.A O no hydrogen 3.505 N/A ASP 208.A N ALA 205.A O no hydrogen 3.205 N/A GLU 212.A N SER 209.A OG no hydrogen 2.720 N/A VAL 213.A N ALA 210.A O no hydrogen 3.075 N/A ALA 214.A N ALA 210.A O no hydrogen 2.927 N/A ARG 215.A N ASP 211.A O no hydrogen 3.403 N/A LYS 216.A N VAL 213.A O no hydrogen 2.682 N/A LYS 216.A NZ ALA 203.A O no hydrogen 2.435 N/A VAL 217.A N VAL 213.A O no hydrogen 2.830 N/A MET 218.A N ALA 214.A O no hydrogen 2.968 N/A MET 220.A N VAL 217.A O no hydrogen 2.298 N/A TYR 221.A N LEU 190.A O no hydrogen 3.429 N/A HIS 226.A N ASP 223.A O no hydrogen 3.266 N/A HIS 226.A ND1 ASP 268.A OD1 no hydrogen 2.595 N/A HIS 226.A NE2 ASP 231.A O no hydrogen 2.329 N/A SER 230.A OG ASP 231.A OD1 no hydrogen 3.164 N/A ASP 231.A N ARG 228.A O no hydrogen 3.264 N/A GLY 233.A N TYR 261.A O no hydrogen 2.421 N/A PHE 241.A N ASN 238.A O no hydrogen 2.609 N/A THR 242.A N ASN 238.A O no hydrogen 3.306 N/A PHE 243.A N PRO 239.A O no hydrogen 2.583 N/A LEU 244.A N VAL 240.A O no hydrogen 2.828 N/A ASP 245.A N PHE 241.A O no hydrogen 2.818 N/A ALA 246.A N PHE 243.A O no hydrogen 3.036 N/A PHE 247.A N PHE 243.A O no hydrogen 3.266 N/A ASP 248.A N LEU 244.A O no hydrogen 3.239 N/A ARG 253.A NE ASP 248.A OD2 no hydrogen 3.430 N/A ARG 253.A NH1 ASP 248.A OD2 no hydrogen 3.206 N/A GLN 255.A N PRO 251.A O no hydrogen 2.844 N/A GLN 255.A NE2 GLN 255.A O no hydrogen 3.662 N/A GLN 255.A NE2 ASP 259.A OD2 no hydrogen 3.023 N/A ALA 256.A N ARG 253.A O no hydrogen 3.276 N/A LEU 257.A N ARG 253.A O no hydrogen 3.290 N/A LYS 258.A N VAL 254.A O no hydrogen 3.090 N/A ASP 259.A N ALA 256.A O no hydrogen 3.152 N/A GLN 260.A N ALA 256.A O no hydrogen 3.216 N/A GLN 260.A N LEU 257.A O no hydrogen 3.083 N/A TYR 261.A N LEU 257.A O no hydrogen 2.496 N/A TYR 261.A OH ASP 223.A OD1 no hydrogen 2.959 N/A TYR 261.A OH ASP 268.A OD1 no hydrogen 2.973 N/A ARG 262.A N LYS 258.A O no hydrogen 3.155 N/A GLY 264.A N GLN 260.A O no hydrogen 3.233 N/A GLY 265.A N ALA 229.A O no hydrogen 2.725 N/A VAL 271.A N GLY 267.A O no hydrogen 2.939 N/A LYS 272.A N ASP 268.A O no hydrogen 2.882 N/A LYS 272.A NZ MET 218.A O no hydrogen 3.111 N/A LYS 272.A NZ MET 220.A O no hydrogen 2.609 N/A LYS 273.A N VAL 269.A O no hydrogen 2.695 N/A HIS 274.A N LYS 270.A O no hydrogen 3.041 N/A HIS 274.A N VAL 271.A O no hydrogen 2.526 N/A LEU 275.A N VAL 271.A O no hydrogen 3.087 N/A ILE 276.A N LYS 272.A O no hydrogen 3.019 N/A VAL 278.A N HIS 274.A O no hydrogen 2.766 N/A LEU 279.A N LEU 275.A O no hydrogen 3.200 N/A GLY 281.A N ASP 277.A O no hydrogen 2.947 N/A VAL 282.A N VAL 278.A O no hydrogen 3.246 N/A LEU 283.A N LEU 279.A O no hydrogen 3.242 N/A ALA 284.A N ASN 280.A O no hydrogen 2.891 N/A ARG 287.A N LEU 283.A O no hydrogen 2.742 N/A THR 288.A N PRO 285.A O no hydrogen 2.813 N/A THR 288.A OG1 ALA 284.A O no hydrogen 2.769 N/A ARG 289.A N PRO 285.A O no hydrogen 3.189 N/A ARG 289.A NH1 ALA 69.A O no hydrogen 2.540 N/A ARG 290.A N ILE 286.A O no hydrogen 3.202 N/A ARG 290.A NH2 GLU 294.A OE1 no hydrogen 2.963 N/A GLU 292.A N THR 288.A O no hydrogen 3.121 N/A GLU 292.A N ARG 289.A O no hydrogen 2.840 N/A TYR 293.A N ARG 289.A O no hydrogen 2.954 N/A TYR 293.A N ARG 290.A O no hydrogen 2.908 N/A GLU 294.A N ARG 290.A O no hydrogen 2.826 N/A ASP 296.A N TYR 293.A O no hydrogen 2.566 N/A ALA 299.A N ASP 296.A O no hydrogen 3.215 N/A ARG 302.A N ASP 298.A O no hydrogen 3.259 N/A PHE 303.A N ALA 299.A O no hydrogen 2.818 N/A VAL 304.A N VAL 300.A O no hydrogen 3.265 N/A THR 305.A N LEU 301.A O no hydrogen 2.809 N/A THR 305.A OG1 LEU 301.A O no hydrogen 2.699 N/A THR 305.A OG1 ARG 302.A O no hydrogen 2.943 N/A GLU 306.A N ARG 302.A O no hydrogen 2.870 N/A GLY 307.A N PHE 303.A O no hydrogen 3.310 N/A THR 308.A N VAL 304.A O no hydrogen 2.767 N/A THR 308.A OG1 VAL 304.A O no hydrogen 2.821 N/A ALA 309.A N THR 305.A O no hydrogen 3.008 N/A ARG 310.A N GLU 306.A O no hydrogen 2.925 N/A ARG 310.A NH1 THR 77.A O no hydrogen 2.701 N/A ARG 310.A NH1 THR 78.A OG1 no hydrogen 2.427 N/A GLY 311.A N GLY 307.A O no hydrogen 2.648 N/A ARG 312.A N THR 308.A O no hydrogen 2.698 N/A GLU 313.A N ALA 309.A O no hydrogen 3.156 N/A VAL 314.A N ARG 310.A O no hydrogen 3.437 N/A ALA 315.A N GLY 311.A O no hydrogen 2.881 N/A ALA 316.A N ARG 312.A O no hydrogen 3.034 N/A GLN 317.A N GLU 313.A O no hydrogen 3.358 N/A THR 318.A N VAL 314.A O no hydrogen 3.022 N/A THR 318.A OG1 ALA 140.A O no hydrogen 2.841 N/A LEU 319.A N ALA 315.A O no hydrogen 3.054 N/A GLY 320.A N ALA 316.A O no hydrogen 2.765 N/A GLN 321.A N GLN 317.A O no hydrogen 3.201 N/A VAL 322.A N THR 318.A O no hydrogen 2.791 N/A ARG 323.A N LEU 319.A O no hydrogen 2.844 N/A ARG 323.A NE GLU 90.A OE1 no hydrogen 2.969 N/A ARG 323.A NH1 GLU 90.A OE2 no hydrogen 2.950 N/A ARG 324.A N GLY 320.A O no hydrogen 3.448 N/A ALA 325.A N GLN 321.A O no hydrogen 2.825 N/A MET 326.A N VAL 322.A O no hydrogen 2.770 N/A ARG 327.A N ARG 324.A O no hydrogen 2.734 N/A LEU 328.A N ARG 323.A O no hydrogen 2.939 N/A HIS 331.A N LEU 328.A O no hydrogen 2.793 N/A