Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ofy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A OG1 SER 8.A OG no hydrogen 3.370 N/A THR 6.A OG1 ALA 10.A O no hydrogen 2.661 N/A SER 8.A N GLU 41.A OE2 no hydrogen 3.155 N/A SER 8.A OG THR 6.A OG1 no hydrogen 3.370 N/A SER 8.A OG GLU 41.A OE1 no hydrogen 2.644 N/A SER 8.A OG GLU 41.A OE2 no hydrogen 3.278 N/A GLY 9.A N THR 6.A OG1 no hydrogen 2.953 N/A ALA 10.A N SER 8.A OG no hydrogen 3.105 N/A SER 12.A OG GLU 4.A O no hydrogen 2.533 N/A ILE 14.A N PHE 35.A O no hydrogen 2.976 N/A VAL 15.A N ASN 155.A OD1 no hydrogen 2.874 N/A MET 16.A N VAL 33.A O no hydrogen 2.675 N/A VAL 19.A N PHE 17.A O no hydrogen 2.885 N/A GLU 21.A N GLU 66.A OE2 no hydrogen 2.595 N/A ASN 24.A ND2 ALA 28.A O no hydrogen 2.912 N/A GLY 27.A N ASN 24.A O no hydrogen 2.841 N/A ALA 28.A N ASN 24.A OD1 no hydrogen 2.833 N/A VAL 33.A N MET 16.A O no hydrogen 3.072 N/A VAL 34.A N ASN 132.A OD1 no hydrogen 2.876 N/A PHE 35.A N ILE 14.A O no hydrogen 2.853 N/A HIS 37.A ND1 GLU 41.A OE1 no hydrogen 2.819 N/A LEU 38.A N SER 12.A O no hydrogen 3.029 N/A ILE 39.A N ASN 36.A OD1 no hydrogen 3.055 N/A HIS 40.A N ASN 36.A O no hydrogen 3.263 N/A HIS 40.A ND1 ASN 36.A O no hydrogen 2.879 N/A GLU 41.A N HIS 37.A O no hydrogen 2.830 N/A LYS 42.A N LEU 38.A O no hydrogen 3.117 N/A LYS 42.A NZ GLU 4.A OE1 no hydrogen 3.330 N/A LYS 42.A NZ GLU 4.A OE2 no hydrogen 2.961 N/A LYS 43.A N ILE 39.A O no hydrogen 3.149 N/A LYS 43.A N HIS 40.A O no hydrogen 3.128 N/A ILE 44.A N HIS 40.A O no hydrogen 2.877 N/A GLU 48.A N ASN 46.A OD1 no hydrogen 3.007 N/A THR 49.A N ASN 46.A O no hydrogen 3.051 N/A THR 49.A OG1 ASN 46.A O no hydrogen 3.165 N/A CYS 50.A N CYS 47.A O no hydrogen 3.205 N/A HIS 51.A N CYS 47.A O no hydrogen 2.959 N/A HIS 52.A N CYS 50.A O no hydrogen 2.732 N/A THR 53.A OG1 ASP 55.A OD2 no hydrogen 2.503 N/A GLY 54.A N HIS 51.A O no hydrogen 2.968 N/A ASP 55.A N THR 53.A OG1 no hydrogen 3.179 N/A VAL 57.A N ASP 55.A O no hydrogen 2.596 N/A THR 61.A N SER 58.A O no hydrogen 2.921 N/A THR 61.A OG1 SER 58.A O no hydrogen 2.691 N/A CYS 62.A N CYS 59.A O no hydrogen 3.032 N/A HIS 63.A N CYS 59.A O no hydrogen 2.848 N/A HIS 63.A ND1 ILE 74.A O no hydrogen 2.742 N/A VAL 65.A N VAL 19.A O no hydrogen 2.891 N/A GLY 67.A N THR 64.A OG1 no hydrogen 3.054 N/A LYS 68.A NZ THR 61.A O no hydrogen 2.817 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.492 N/A GLY 71.A N LYS 68.A O no hydrogen 3.236 N/A ASN 72.A N ALA 69.A O no hydrogen 2.907 N/A ASN 72.A ND2 ALA 69.A O no hydrogen 3.224 N/A TYR 73.A N LYS 68.A O no hydrogen 2.586 N/A ILE 74.A N GLY 71.A O no hydrogen 3.085 N/A LEU 76.A N THR 64.A O no hydrogen 2.973 N/A ARG 78.A N THR 75.A OG1 no hydrogen 3.234 N/A ARG 78.A NH1 ASN 84.A OD1 no hydrogen 2.744 N/A ARG 78.A NH2 ASN 84.A O no hydrogen 3.308 N/A ARG 78.A NH2 ASN 84.A OD1 no hydrogen 3.433 N/A ALA 79.A N THR 75.A O no hydrogen 2.846 N/A MET 80.A N LEU 76.A O no hydrogen 2.875 N/A HIS 81.A N ASP 77.A O no hydrogen 3.055 N/A HIS 81.A ND1 ASP 77.A O no hydrogen 2.776 N/A ALA 82.A N ARG 78.A O no hydrogen 2.845 N/A ASN 84.A N ASN 84.A OD1 no hydrogen 2.532 N/A ARG 88.A N THR 93.A OG1 no hydrogen 2.899 N/A ARG 88.A NH1 ALA 86.A O no hydrogen 2.757 N/A LYS 90.A NZ ALA 89.A O no hydrogen 2.617 N/A ASN 92.A ND2 GLU 48.A OE1 no hydrogen 2.867 N/A ASN 92.A ND2 HIS 52.A O no hydrogen 2.587 N/A SER 96.A N SER 99.A OG no hydrogen 2.899 N/A SER 96.A OG ALA 82.A O no hydrogen 2.514 N/A SER 96.A OG SER 99.A OG no hydrogen 3.258 N/A CYS 97.A SG MET 80.A O no hydrogen 3.647 N/A SER 99.A N SER 96.A OG no hydrogen 2.699 N/A SER 99.A OG SER 96.A O no hydrogen 3.407 N/A SER 99.A OG SER 96.A OG no hydrogen 3.258 N/A CYS 100.A N SER 96.A O no hydrogen 3.129 N/A HIS 101.A N CYS 97.A O no hydrogen 3.304 N/A GLU 102.A N VAL 98.A O no hydrogen 2.989 N/A GLN 103.A N SER 99.A O no hydrogen 3.027 N/A GLN 104.A N CYS 100.A O no hydrogen 3.004 N/A THR 105.A N HIS 101.A O no hydrogen 3.322 N/A THR 105.A OG1 GLU 102.A O no hydrogen 2.591 N/A LYS 106.A N GLU 102.A O no hydrogen 3.181 N/A LYS 106.A N GLN 103.A O no hydrogen 3.084 N/A LYS 106.A NZ GLU 102.A OE2 no hydrogen 3.478 N/A LYS 106.A NZ THR 105.A OG1 no hydrogen 2.789 N/A GLU 107.A N GLN 103.A O no hydrogen 2.828 N/A ARG 108.A N GLN 104.A O no hydrogen 3.049 N/A ARG 108.A NE GLU 110.A OE2 no hydrogen 3.349 N/A ARG 108.A NH1 GLN 104.A OE1 no hydrogen 3.093 N/A ARG 108.A NH1 ASP 211.A OD2 no hydrogen 3.213 N/A ARG 108.A NH2 GLU 110.A OE2 no hydrogen 3.043 N/A ARG 108.A NH2 ASP 211.A OD2 no hydrogen 2.644 N/A ARG 109.A NE MET 274.A O no hydrogen 2.915 N/A ARG 109.A NH2 ASP 275.A O no hydrogen 3.205 N/A GLU 110.A N GLU 110.A OE1 no hydrogen 2.639 N/A CYS 111.A N ARG 108.A O no hydrogen 2.738 N/A CYS 111.A SG GLN 104.A O no hydrogen 3.982 N/A ALA 112.A N ARG 108.A O no hydrogen 2.823 N/A HIS 115.A N CYS 111.A O no hydrogen 3.014 N/A ALA 116.A N GLY 113.A O no hydrogen 3.026 N/A ILE 117.A N CYS 114.A O no hydrogen 2.829 N/A VAL 118.A N CYS 114.A O no hydrogen 2.894 N/A TRP 126.A N ASP 123.A OD1 no hydrogen 3.283 N/A CYS 127.A N ASP 123.A O no hydrogen 3.067 N/A CYS 127.A SG ASP 123.A O no hydrogen 3.437 N/A ALA 128.A N GLU 124.A O no hydrogen 2.893 N/A THR 129.A N TRP 126.A O no hydrogen 3.079 N/A THR 129.A OG1 ALA 125.A O no hydrogen 3.035 N/A THR 129.A OG1 TRP 126.A O no hydrogen 3.231 N/A CYS 130.A N CYS 127.A O no hydrogen 3.124 N/A HIS 131.A N CYS 127.A O no hydrogen 2.852 N/A HIS 131.A ND1 LYS 31.A O no hydrogen 2.822 N/A ASN 132.A N PRO 32.A O no hydrogen 3.315 N/A ASN 132.A ND2 THR 129.A O no hydrogen 3.576 N/A THR 134.A N THR 162.A OG1 no hydrogen 2.897 N/A THR 134.A OG1 SER 136.A OG no hydrogen 3.225 N/A SER 136.A N THR 134.A OG1 no hydrogen 3.174 N/A SER 136.A OG THR 134.A OG1 no hydrogen 3.225 N/A SER 136.A OG GLU 161.A OE2 no hydrogen 2.527 N/A MET 137.A N THR 134.A O no hydrogen 3.394 N/A THR 138.A N GLN 141.A OE1 no hydrogen 2.687 N/A THR 138.A OG1 GLU 140.A OE1 no hydrogen 3.145 N/A GLN 141.A N THR 138.A OG1 no hydrogen 2.881 N/A MET 142.A N THR 138.A O no hydrogen 2.900 N/A GLN 143.A N PRO 139.A O no hydrogen 2.922 N/A GLN 143.A NE2 ASN 24.A O no hydrogen 2.945 N/A LYS 144.A N GLU 140.A O no hydrogen 2.926 N/A GLY 145.A N GLN 141.A O no hydrogen 2.558 N/A ILE 146.A N MET 142.A O no hydrogen 2.654 N/A ASN 147.A N GLN 143.A O no hydrogen 2.532 N/A GLY 148.A N LYS 144.A O no hydrogen 2.573 N/A GLY 148.A N GLY 145.A O no hydrogen 3.281 N/A THR 149.A N LYS 144.A O no hydrogen 3.010 N/A ASP 154.A N LEU 151.A O no hydrogen 2.510 N/A ASN 155.A N LEU 151.A O no hydrogen 2.883 N/A ASN 155.A ND2 VAL 15.A O no hydrogen 3.093 N/A GLU 156.A N PRO 152.A O no hydrogen 2.705 N/A ALA 157.A N GLY 153.A O no hydrogen 3.254 N/A LEU 158.A N ASP 154.A O no hydrogen 2.996 N/A ALA 159.A N ASN 155.A O no hydrogen 2.907 N/A ALA 160.A N GLU 156.A O no hydrogen 2.782 N/A GLU 161.A N ALA 157.A O no hydrogen 2.955 N/A THR 162.A N LEU 158.A O no hydrogen 3.040 N/A THR 162.A OG1 LEU 158.A O no hydrogen 2.957 N/A VAL 163.A N ALA 159.A O no hydrogen 3.000 N/A LEU 164.A N ALA 160.A O no hydrogen 2.880 N/A ALA 165.A N GLU 161.A O no hydrogen 2.945 N/A ALA 165.A N THR 162.A O no hydrogen 2.963 N/A GLN 166.A N VAL 163.A O no hydrogen 2.941 N/A VAL 172.A N PRO 221.A O no hydrogen 2.833 N/A MET 175.A N SER 173.A OG no hydrogen 2.880 N/A LEU 176.A N SER 173.A O no hydrogen 2.909 N/A ALA 177.A N PRO 174.A O no hydrogen 3.133 N/A LYS 180.A NZ ASN 194.A OD1 no hydrogen 2.498 N/A VAL 181.A N PHE 195.A O no hydrogen 3.112 N/A ILE 183.A N SER 193.A O no hydrogen 2.772 N/A ALA 187.A N ASP 184.A O no hydrogen 3.248 N/A GLU 191.A N LYS 289.A O no hydrogen 2.915 N/A SER 193.A N ILE 183.A O no hydrogen 2.984 N/A SER 193.A OG CYS 287.A O no hydrogen 2.545 N/A PHE 195.A N VAL 181.A O no hydrogen 2.956 N/A THR 196.A OG1 HIS 200.A ND1 no hydrogen 2.816 N/A HIS 197.A N PHE 195.A O no hydrogen 2.897 N/A ARG 198.A N TYR 179.A O no hydrogen 2.998 N/A ARG 198.A NE PRO 174.A O no hydrogen 3.111 N/A ARG 198.A NH2 ALA 177.A O no hydrogen 2.853 N/A HIS 200.A N THR 196.A O no hydrogen 2.868 N/A HIS 200.A ND1 THR 196.A O no hydrogen 3.075 N/A HIS 200.A ND1 THR 196.A OG1 no hydrogen 2.816 N/A LEU 201.A N HIS 197.A O no hydrogen 3.084 N/A THR 202.A N ARG 198.A O no hydrogen 2.915 N/A THR 202.A OG1 ARG 198.A O no hydrogen 2.599 N/A SER 203.A N ARG 199.A O no hydrogen 2.953 N/A LEU 204.A N HIS 200.A O no hydrogen 2.920 N/A MET 205.A N LEU 201.A O no hydrogen 3.014 N/A GLU 206.A N THR 202.A O no hydrogen 2.988 N/A GLU 206.A N SER 203.A O no hydrogen 3.206 N/A ARG 207.A N SER 203.A O no hydrogen 3.442 N/A ILE 208.A N MET 205.A O no hydrogen 3.139 N/A LYS 209.A N GLU 206.A O no hydrogen 3.329 N/A LYS 209.A NZ GLU 206.A OE2 no hydrogen 2.979 N/A ASP 211.A N ILE 208.A O no hydrogen 3.054 N/A ALA 214.A N ASP 211.A OD1 no hydrogen 2.746 N/A GLN 215.A N ASP 211.A O no hydrogen 2.812 N/A GLN 215.A NE2 LYS 209.A O no hydrogen 2.877 N/A ALA 216.A N LYS 212.A O no hydrogen 3.200 N/A PHE 217.A N LEU 213.A O no hydrogen 3.305 N/A HIS 218.A N ALA 214.A O no hydrogen 2.830 N/A ASN 219.A ND2 ALA 125.A O no hydrogen 3.315 N/A ASN 219.A ND2 ALA 216.A O no hydrogen 3.550 N/A ILE 223.A N LYS 220.A O no hydrogen 2.871 N/A CYS 225.A N GLU 222.A O no hydrogen 3.292 N/A CYS 225.A SG GLU 222.A O no hydrogen 3.498 N/A ALA 226.A N ILE 223.A O no hydrogen 2.967 N/A THR 227.A N LEU 224.A O no hydrogen 3.071 N/A THR 227.A OG1 LEU 224.A O no hydrogen 2.745 N/A CYS 228.A N CYS 225.A O no hydrogen 3.270 N/A HIS 229.A N CYS 225.A O no hydrogen 2.965 N/A THR 237.A N SER 235.A OG no hydrogen 2.850 N/A SER 243.A N LYS 240.A O no hydrogen 2.789 N/A CYS 244.A N CYS 241.A O no hydrogen 3.080 N/A HIS 245.A N CYS 241.A O no hydrogen 2.847 N/A HIS 245.A ND1 PRO 257.A O no hydrogen 2.697 N/A THR 246.A OG1 GLU 248.A O no hydrogen 2.549 N/A LYS 247.A NZ GLU 248.A OE2 no hydrogen 2.625 N/A ASN 253.A N ASP 250.A O no hydrogen 2.878 N/A ASN 253.A ND2 ASP 250.A OD2 no hydrogen 2.934 N/A ARG 256.A N ASN 253.A O no hydrogen 2.916 N/A ARG 256.A NH1 CYS 244.A O no hydrogen 3.116 N/A LEU 259.A N THR 246.A O no hydrogen 2.770 N/A ALA 261.A N ASN 258.A OD1 no hydrogen 3.005 N/A ALA 262.A N ASN 258.A O no hydrogen 2.844 N/A TYR 263.A N LEU 259.A O no hydrogen 3.112 N/A HIS 264.A N MET 260.A O no hydrogen 3.009 N/A LEU 265.A N ALA 261.A O no hydrogen 2.719 N/A GLN 266.A N ALA 262.A O no hydrogen 3.069 N/A GLN 266.A NE2 CYS 228.A O no hydrogen 2.967 N/A CYS 267.A N TYR 263.A O no hydrogen 2.879 N/A CYS 267.A SG TYR 263.A O no hydrogen 2.996 N/A MET 268.A N HIS 264.A O no hydrogen 2.791 N/A GLY 269.A N LEU 265.A O no hydrogen 2.867 N/A CYS 270.A N GLN 266.A O no hydrogen 3.217 N/A HIS 271.A N CYS 267.A O no hydrogen 3.222 N/A LYS 272.A N MET 268.A O no hydrogen 2.840 N/A GLY 273.A N GLY 269.A O no hydrogen 2.935 N/A MET 274.A N CYS 270.A O no hydrogen 2.969 N/A ASP 275.A N LYS 272.A O no hydrogen 3.108 N/A VAL 276.A N HIS 271.A O no hydrogen 2.783 N/A ASP 283.A N ARG 280.A O no hydrogen 2.980 N/A CYS 284.A SG THR 282.A O no hydrogen 3.616 N/A THR 285.A N ASP 283.A OD1 no hydrogen 3.184 N/A THR 286.A N ASP 283.A OD1 no hydrogen 2.901 N/A THR 286.A OG1 ASP 283.A OD1 no hydrogen 2.920 N/A THR 286.A OG1 ASP 283.A OD2 no hydrogen 2.397 N/A HIS 288.A ND1 HIS 288.A O no hydrogen 2.776 N/A ALA 291.A N LYS 189.A O no hydrogen 3.024 N/A LYS 293.A N ALA 291.A O no hydrogen 3.175 N/A