Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1j0a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N THR 176.A OG1 no hydrogen 2.766 N/A LYS 4.A N HIS 2.A ND1 no hydrogen 3.296 N/A LYS 4.A NZ ILE 204.A O no hydrogen 2.704 N/A PHE 6.A N HIS 2.A O no hydrogen 2.770 N/A ALA 7.A N PRO 3.A O no hydrogen 2.736 N/A LEU 8.A N LYS 4.A O no hydrogen 2.922 N/A LEU 9.A N ILE 5.A O no hydrogen 3.115 N/A ALA 10.A N ALA 7.A O no hydrogen 3.366 N/A PHE 12.A N LEU 9.A O no hydrogen 2.970 N/A ARG 14.A NE GLU 59.A OE1 no hydrogen 3.284 N/A VAL 15.A N GLU 59.A O no hydrogen 2.802 N/A LEU 17.A N GLU 59.A OE2 no hydrogen 2.613 N/A ILE 18.A N GLU 59.A OE2 no hydrogen 2.810 N/A THR 22.A N GLU 173.A OE1 no hydrogen 3.103 N/A THR 22.A OG1 ASP 43.A OD1 no hydrogen 2.448 N/A GLN 25.A N ILE 40.A O no hydrogen 2.972 N/A TYR 26.A OH ASP 37.A OD1 no hydrogen 2.799 N/A LEU 27.A N VAL 38.A O no hydrogen 2.962 N/A ASN 29.A ND2 ARG 273.A O no hydrogen 2.693 N/A ILE 30.A N GLU 274.A OE2 no hydrogen 3.044 N/A SER 31.A N LEU 27.A O no hydrogen 2.902 N/A SER 31.A OG LEU 27.A O no hydrogen 2.713 N/A SER 31.A OG ALA 36.A O no hydrogen 3.250 N/A ARG 32.A N PRO 28.A O no hydrogen 2.929 N/A ARG 32.A NH1 ASN 29.A OD1 no hydrogen 3.026 N/A GLU 33.A N ASN 29.A O no hydrogen 3.147 N/A ILE 34.A N ILE 30.A O no hydrogen 2.969 N/A GLY 35.A N SER 31.A O no hydrogen 3.165 N/A ALA 36.A N SER 31.A O no hydrogen 3.388 N/A ASP 37.A N GLU 301.A O no hydrogen 2.758 N/A VAL 38.A N SER 31.A OG no hydrogen 2.776 N/A TYR 39.A N ILE 303.A O no hydrogen 2.688 N/A ILE 40.A N GLN 25.A O no hydrogen 2.689 N/A LYS 41.A N PHE 305.A O no hydrogen 2.674 N/A LYS 41.A NZ THR 22.A O no hydrogen 2.733 N/A LYS 41.A NZ THR 22.A OG1 no hydrogen 2.978 N/A LYS 41.A NZ GLU 173.A OE1 no hydrogen 2.861 N/A LYS 41.A NZ GLN 177.A OE1 no hydrogen 2.646 N/A ARG 42.A N PRO 23.A O no hydrogen 2.754 N/A ARG 42.A NE GLN 25.A OE1 no hydrogen 2.610 N/A ARG 42.A NH1 ASP 44.A OD2 no hydrogen 2.943 N/A ARG 42.A NH2 GLN 25.A OE1 no hydrogen 3.215 N/A ASP 43.A N LYS 41.A O no hydrogen 2.999 N/A LEU 45.A N ARG 42.A O no hydrogen 2.978 N/A THR 46.A OG1 ASP 43.A O no hydrogen 3.030 N/A THR 46.A OG1 GLY 52.A O no hydrogen 2.789 N/A GLY 51.A N LEU 48.A O no hydrogen 2.833 N/A ASN 53.A N THR 308.A O no hydrogen 3.199 N/A ASN 53.A ND2 THR 194.A OG1 no hydrogen 2.762 N/A LYS 54.A NZ ASN 53.A OD1 no hydrogen 3.462 N/A ILE 55.A N GLY 52.A O no hydrogen 3.382 N/A ARG 56.A N ASN 53.A O no hydrogen 2.943 N/A ARG 56.A NE ASP 43.A OD2 no hydrogen 2.650 N/A ARG 56.A NH2 ASP 43.A OD1 no hydrogen 2.748 N/A ARG 56.A NH2 ASP 43.A OD2 no hydrogen 3.479 N/A ARG 56.A NH2 GLU 173.A OE1 no hydrogen 3.211 N/A LYS 57.A NZ GLY 157.A O no hydrogen 2.663 N/A LEU 58.A N LYS 54.A O no hydrogen 3.010 N/A GLU 59.A N ILE 55.A O no hydrogen 3.332 N/A TYR 60.A N LYS 57.A O no hydrogen 2.962 N/A LEU 61.A N LYS 57.A O no hydrogen 2.790 N/A LEU 62.A N LEU 58.A O no hydrogen 2.689 N/A GLY 63.A N GLU 59.A O no hydrogen 3.190 N/A ASP 64.A N TYR 60.A O no hydrogen 2.783 N/A ALA 65.A N LEU 61.A O no hydrogen 3.059 N/A LEU 66.A N LEU 62.A O no hydrogen 3.023 N/A SER 67.A N GLY 63.A O no hydrogen 3.062 N/A SER 67.A OG ASP 64.A O no hydrogen 2.538 N/A LYS 68.A N ASP 64.A O no hydrogen 3.315 N/A GLY 69.A N LEU 66.A O no hydrogen 2.739 N/A ALA 70.A N ALA 65.A O no hydrogen 2.984 N/A ASP 71.A N LYS 150.A O no hydrogen 3.272 N/A VAL 73.A N ASP 97.A O no hydrogen 2.576 N/A ILE 74.A N TYR 152.A O no hydrogen 2.795 N/A THR 75.A N ILE 99.A O no hydrogen 3.460 N/A THR 75.A OG1 HIS 83.A NE2 no hydrogen 2.793 N/A THR 75.A OG1 ILE 154.A O no hydrogen 2.822 N/A GLY 77.A N VAL 101.A O no hydrogen 3.274 N/A VAL 79.A N ARG 103.A O no hydrogen 2.820 N/A HIS 80.A ND1 TYR 317.A OH no hydrogen 2.897 N/A HIS 80.A NE2 TYR 256.A OH no hydrogen 2.977 N/A SER 81.A N ALA 78.A O no hydrogen 2.952 N/A HIS 83.A NE2 THR 75.A OG1 no hydrogen 2.793 N/A ALA 84.A N SER 81.A OG no hydrogen 2.930 N/A PHE 85.A N SER 81.A O no hydrogen 3.453 N/A VAL 86.A N ASN 82.A O no hydrogen 3.102 N/A THR 87.A N HIS 83.A O no hydrogen 2.930 N/A THR 87.A OG1 HIS 83.A O no hydrogen 2.715 N/A GLY 88.A N ALA 84.A O no hydrogen 3.004 N/A LEU 89.A N PHE 85.A O no hydrogen 2.821 N/A ALA 90.A N VAL 86.A O no hydrogen 2.813 N/A ALA 91.A N THR 87.A O no hydrogen 2.950 N/A LYS 92.A N GLY 88.A O no hydrogen 2.961 N/A LYS 93.A N LEU 89.A O no hydrogen 2.931 N/A LEU 94.A N ALA 90.A O no hydrogen 3.154 N/A LEU 94.A N ALA 91.A O no hydrogen 3.090 N/A GLY 95.A N LYS 92.A O no hydrogen 2.865 N/A LEU 96.A N ALA 91.A O no hydrogen 2.740 N/A ASP 97.A N ASP 71.A O no hydrogen 3.081 N/A ILE 99.A N VAL 73.A O no hydrogen 2.933 N/A LEU 100.A N GLU 121.A O no hydrogen 2.771 N/A VAL 101.A N THR 75.A O no hydrogen 2.990 N/A LEU 102.A N ARG 123.A O no hydrogen 3.057 N/A GLU 107.A N LYS 105.A O no hydrogen 2.737 N/A LYS 109.A N GLU 107.A O no hydrogen 2.875 N/A ASN 111.A ND2 HIS 80.A O no hydrogen 2.834 N/A ASN 111.A ND2 ASN 82.A OD1 no hydrogen 2.472 N/A LEU 113.A N LYS 109.A O no hydrogen 3.054 N/A LEU 114.A N GLY 110.A O no hydrogen 3.143 N/A ASP 115.A N ASN 111.A O no hydrogen 2.655 N/A LYS 116.A N TYR 112.A O no hydrogen 3.130 N/A ILE 117.A N LEU 113.A O no hydrogen 2.897 N/A MET 118.A N LEU 114.A O no hydrogen 3.064 N/A GLY 119.A N LYS 116.A O no hydrogen 2.846 N/A ILE 120.A N ASP 115.A O no hydrogen 2.846 N/A ARG 123.A N LEU 100.A O no hydrogen 2.793 N/A TYR 125.A N LEU 102.A O no hydrogen 3.161 N/A LYS 128.A N GLU 132.A OE1 no hydrogen 2.538 N/A ASP 129.A N GLU 132.A OE1 no hydrogen 2.964 N/A MET 134.A N PHE 131.A O no hydrogen 3.220 N/A LYS 135.A N GLU 132.A O no hydrogen 3.355 N/A ALA 137.A N LEU 133.A O no hydrogen 2.892 N/A GLU 138.A N MET 134.A O no hydrogen 3.098 N/A GLU 139.A N TYR 136.A O no hydrogen 3.059 N/A ILE 140.A N TYR 136.A O no hydrogen 3.023 N/A ALA 141.A N ALA 137.A O no hydrogen 2.721 N/A GLU 142.A N GLU 138.A O no hydrogen 3.349 N/A GLU 143.A N GLU 139.A O no hydrogen 3.185 N/A LEU 144.A N ILE 140.A O no hydrogen 3.094 N/A LYS 145.A N ALA 141.A O no hydrogen 3.215 N/A ARG 146.A NE GLU 143.A OE1 no hydrogen 3.100 N/A ARG 146.A NH2 GLU 143.A OE1 no hydrogen 3.525 N/A ARG 149.A NE ASP 71.A OD2 no hydrogen 2.691 N/A ARG 149.A NH2 ASP 71.A OD2 no hydrogen 3.280 N/A LYS 150.A N ASP 71.A OD1 no hydrogen 2.567 N/A TYR 152.A N VAL 72.A O no hydrogen 2.777 N/A ILE 154.A N ILE 74.A O no hydrogen 2.843 N/A GLY 158.A N PRO 155.A O no hydrogen 3.012 N/A ALA 159.A N PRO 156.A O no hydrogen 3.077 N/A SER 160.A N GLY 158.A O no hydrogen 2.606 N/A THR 164.A N SER 160.A O no hydrogen 3.133 N/A THR 164.A OG1 SER 160.A O no hydrogen 3.015 N/A LEU 165.A N ILE 162.A O no hydrogen 3.041 N/A GLY 166.A N GLY 163.A O no hydrogen 3.077 N/A TYR 167.A N THR 164.A O no hydrogen 3.007 N/A TYR 167.A OH ASP 43.A OD2 no hydrogen 2.660 N/A VAL 168.A N LEU 165.A O no hydrogen 2.987 N/A ARG 169.A N LEU 165.A O no hydrogen 3.026 N/A ALA 170.A N GLY 166.A O no hydrogen 3.192 N/A VAL 171.A N TYR 167.A O no hydrogen 3.405 N/A GLY 172.A N VAL 168.A O no hydrogen 3.232 N/A GLU 173.A N ARG 169.A O no hydrogen 2.979 N/A ILE 174.A N ALA 170.A O no hydrogen 2.884 N/A ALA 175.A N VAL 171.A O no hydrogen 2.914 N/A THR 176.A N GLY 172.A O no hydrogen 3.294 N/A GLN 177.A N GLU 173.A O no hydrogen 2.995 N/A GLN 177.A NE2 THR 22.A O no hydrogen 3.061 N/A SER 178.A N ILE 174.A O no hydrogen 3.180 N/A VAL 180.A N SER 178.A OG no hydrogen 2.950 N/A LYS 181.A NZ GLU 179.A O no hydrogen 3.262 N/A ASP 183.A N LYS 302.A O no hydrogen 2.728 N/A SER 184.A OG LEU 299.A O no hydrogen 3.103 N/A ILE 185.A N ARG 210.A O no hydrogen 2.982 N/A VAL 186.A N LEU 304.A O no hydrogen 2.995 N/A VAL 187.A N VAL 212.A O no hydrogen 2.969 N/A ALA 189.A N ILE 214.A O no hydrogen 2.703 N/A GLY 193.A N SER 191.A OG no hydrogen 3.037 N/A ALA 196.A N GLY 192.A O no hydrogen 2.774 N/A GLY 197.A N GLY 193.A O no hydrogen 3.138 N/A LEU 198.A N THR 194.A O no hydrogen 3.010 N/A SER 199.A N LEU 195.A O no hydrogen 2.871 N/A SER 199.A OG LEU 195.A O no hydrogen 2.955 N/A LEU 200.A N ALA 196.A O no hydrogen 2.944 N/A GLY 201.A N GLY 197.A O no hydrogen 2.803 N/A LEU 202.A N LEU 198.A O no hydrogen 2.883 N/A SER 203.A N SER 199.A O no hydrogen 2.871 N/A SER 203.A OG GLU 243.A OE2 no hydrogen 3.380 N/A ILE 204.A N LEU 200.A O no hydrogen 2.731 N/A LEU 205.A N GLY 201.A O no hydrogen 3.117 N/A LEU 205.A N LEU 202.A O no hydrogen 3.038 N/A ASN 206.A N SER 203.A O no hydrogen 2.984 N/A GLU 207.A N LEU 202.A O no hydrogen 3.013 N/A ARG 210.A N ASP 183.A O no hydrogen 3.065 N/A ARG 210.A NH1 GLU 247.A OE2 no hydrogen 2.803 N/A ARG 210.A NH2 GLU 298.A O no hydrogen 2.444 N/A VAL 212.A N ILE 185.A O no hydrogen 2.929 N/A GLY 213.A N GLU 247.A O no hydrogen 2.895 N/A ILE 214.A N VAL 187.A O no hydrogen 2.923 N/A ALA 215.A N TYR 249.A O no hydrogen 2.865 N/A VAL 216.A N ALA 189.A O no hydrogen 3.287 N/A ARG 218.A NH2 GLU 221.A OE1 no hydrogen 2.481 N/A LYS 226.A N VAL 222.A O no hydrogen 3.179 N/A LYS 226.A NZ ALA 159.A O no hydrogen 3.540 N/A LEU 227.A N MET 223.A O no hydrogen 2.875 N/A ASN 229.A N SER 225.A O no hydrogen 3.091 N/A ASN 229.A ND2 ASN 229.A O no hydrogen 2.633 N/A LEU 230.A N LYS 226.A O no hydrogen 2.508 N/A ILE 231.A N LEU 227.A O no hydrogen 2.830 N/A LYS 232.A N ASP 228.A O no hydrogen 3.027 N/A GLU 233.A N ASN 229.A O no hydrogen 3.279 N/A ALA 234.A N LEU 230.A O no hydrogen 3.152 N/A ALA 235.A N ILE 231.A O no hydrogen 3.019 N/A GLU 236.A N LYS 232.A O no hydrogen 2.932 N/A GLU 236.A N GLU 233.A O no hydrogen 3.126 N/A LEU 237.A N GLU 233.A O no hydrogen 3.074 N/A LEU 238.A N ALA 234.A O no hydrogen 2.970 N/A GLY 239.A N GLU 236.A O no hydrogen 2.966 N/A VAL 240.A N ALA 235.A O no hydrogen 2.810 N/A GLU 243.A N SER 203.A OG no hydrogen 3.276 N/A GLU 247.A N PRO 211.A O no hydrogen 3.119 N/A TYR 249.A N GLY 213.A O no hydrogen 3.050 N/A TYR 249.A OH GLU 247.A OE1 no hydrogen 2.671 N/A TYR 251.A N ALA 215.A O no hydrogen 3.131 N/A TYR 251.A OH ASP 292.A OD1 no hydrogen 2.652 N/A SER 252.A N ASP 250.A OD1 no hydrogen 3.064 N/A SER 252.A OG ASP 250.A OD1 no hydrogen 2.994 N/A SER 252.A OG ASP 250.A OD2 no hydrogen 3.229 N/A TYR 256.A OH HIS 80.A NE2 no hydrogen 2.977 N/A TYR 256.A OH TYR 282.A OH no hydrogen 3.214 N/A LYS 258.A N GLU 255.A O no hydrogen 3.099 N/A ALA 264.A N THR 260.A O no hydrogen 2.732 N/A GLN 265.A N GLY 261.A O no hydrogen 2.803 N/A GLN 265.A NE2 GLY 261.A O no hydrogen 3.272 N/A ILE 266.A N GLU 262.A O no hydrogen 3.078 N/A ILE 267.A N VAL 263.A O no hydrogen 3.111 N/A ARG 268.A N ALA 264.A O no hydrogen 3.200 N/A LYS 269.A N GLN 265.A O no hydrogen 3.065 N/A LYS 269.A NZ GLU 33.A OE1 no hydrogen 3.420 N/A LYS 269.A NZ GLU 33.A OE2 no hydrogen 3.233 N/A VAL 270.A N ILE 266.A O no hydrogen 3.039 N/A GLY 271.A N ILE 267.A O no hydrogen 3.237 N/A THR 272.A N ARG 268.A O no hydrogen 2.918 N/A THR 272.A OG1 ARG 268.A O no hydrogen 2.961 N/A THR 272.A OG1 LYS 269.A O no hydrogen 3.427 N/A ARG 273.A N LYS 269.A O no hydrogen 2.764 N/A GLU 274.A N VAL 270.A O no hydrogen 2.979 N/A ILE 276.A N VAL 270.A O no hydrogen 3.437 N/A ASP 279.A N THR 283.A OG1 no hydrogen 2.876 N/A TYR 282.A N ASP 279.A OD2 no hydrogen 2.964 N/A THR 283.A N ASP 279.A OD1 no hydrogen 2.945 N/A THR 283.A OG1 ASP 279.A OD1 no hydrogen 2.596 N/A GLY 284.A N ASP 279.A O no hydrogen 2.920 N/A LYS 285.A NZ VAL 216.A O no hydrogen 3.529 N/A LYS 285.A NZ SER 252.A O no hydrogen 3.477 N/A LYS 285.A NZ GLU 255.A O no hydrogen 3.555 N/A LYS 285.A NZ LYS 258.A O no hydrogen 2.865 N/A ALA 286.A N TYR 282.A O no hydrogen 2.932 N/A PHE 287.A N THR 283.A O no hydrogen 2.682 N/A TYR 288.A N GLY 284.A O no hydrogen 2.952 N/A GLY 289.A N LYS 285.A O no hydrogen 2.752 N/A LEU 290.A N ALA 286.A O no hydrogen 2.998 N/A VAL 291.A N PHE 287.A O no hydrogen 2.996 N/A ASP 292.A N TYR 288.A O no hydrogen 3.005 N/A LEU 293.A N GLY 289.A O no hydrogen 2.989 N/A ALA 294.A N LEU 290.A O no hydrogen 2.780 N/A ARG 295.A N VAL 291.A O no hydrogen 3.024 N/A LYS 296.A N ASP 292.A O no hydrogen 3.184 N/A GLY 297.A N ALA 294.A O no hydrogen 2.673 N/A GLU 298.A N LEU 293.A O no hydrogen 3.171 N/A GLU 301.A N ASP 183.A OD2 no hydrogen 2.920 N/A LYS 302.A N ASP 183.A OD2 no hydrogen 2.590 N/A ILE 303.A N ASP 37.A O no hydrogen 2.799 N/A LEU 304.A N SER 184.A O no hydrogen 3.056 N/A PHE 305.A N TYR 39.A O no hydrogen 2.644 N/A ILE 306.A N VAL 186.A O no hydrogen 3.116 N/A HIS 307.A N LYS 41.A O no hydrogen 2.789 N/A GLY 309.A N HIS 307.A ND1 no hydrogen 3.099 N/A SER 312.A OG ASN 111.A OD1 no hydrogen 2.673 N/A GLY 313.A N GLY 310.A O no hydrogen 2.845 N/A THR 314.A N ILE 311.A O no hydrogen 3.007 N/A THR 314.A OG1 LEU 278.A O no hydrogen 2.728 N/A PHE 315.A N SER 312.A O no hydrogen 3.007 N/A HIS 316.A N SER 312.A O no hydrogen 2.789 N/A TYR 317.A N GLY 313.A O no hydrogen 2.846 N/A TYR 317.A OH HIS 80.A ND1 no hydrogen 2.897 N/A LEU 321.A N TYR 317.A O no hydrogen 3.257 N/A LEU 321.A N GLY 318.A O no hydrogen 2.984 N/A LEU 322.A N GLY 318.A O no hydrogen 2.952 N/A SER 323.A N ASP 319.A O no hydrogen 2.898 N/A SER 323.A OG ASP 319.A O no hydrogen 3.024 N/A SER 323.A OG LYS 320.A O no hydrogen 3.085 N/A LEU 324.A N LEU 321.A O no hydrogen 3.103 N/A LEU 325.A N LEU 322.A O no hydrogen 2.653 N/A