Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a42_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 5.A OE1 no hydrogen 3.329 N/A GLU 2.A N GLU 5.A OE2 no hydrogen 3.284 N/A GLY 3.A N GLY 169.A O no hydrogen 2.789 N/A VAL 6.A N GLU 2.A O no hydrogen 3.229 N/A ALA 7.A N GLY 3.A O no hydrogen 3.102 N/A LEU 8.A N PRO 4.A O no hydrogen 3.080 N/A THR 9.A N GLU 5.A O no hydrogen 2.851 N/A THR 9.A OG1 GLU 5.A O no hydrogen 2.824 N/A ALA 10.A N VAL 6.A O no hydrogen 2.939 N/A ASP 11.A N ALA 7.A O no hydrogen 3.016 N/A ILE 12.A N LEU 8.A O no hydrogen 3.072 N/A LEU 13.A N THR 9.A O no hydrogen 2.708 N/A GLU 14.A N ALA 10.A O no hydrogen 2.793 N/A LYS 15.A N ASP 11.A O no hydrogen 2.995 N/A TYR 16.A N ILE 12.A O no hydrogen 3.212 N/A PHE 17.A N LEU 13.A O no hydrogen 2.764 N/A LYS 18.A N GLU 14.A O no hydrogen 2.755 N/A LYS 18.A NZ SER 52.A O no hydrogen 3.061 N/A GLY 19.A N VAL 51.A O no hydrogen 2.907 N/A LYS 20.A N PHE 17.A O no hydrogen 3.009 N/A LYS 20.A NZ TYR 16.A O no hydrogen 2.865 N/A THR 21.A N ASP 102.A OD2 no hydrogen 2.644 N/A LEU 22.A N LEU 49.A O no hydrogen 2.660 N/A GLU 23.A N SER 100.A O no hydrogen 2.668 N/A TYR 24.A N SER 100.A O no hydrogen 3.043 N/A ASP 26.A N VAL 98.A O no hydrogen 2.724 N/A ARG 31.A NE ASN 114.A O no hydrogen 3.345 N/A SER 33.A OG GLY 30.A O no hydrogen 3.004 N/A LYS 34.A NZ SER 33.A OG no hydrogen 3.425 N/A TYR 40.A N PRO 37.A O no hydrogen 2.998 N/A TYR 40.A OH ILE 25.A O no hydrogen 2.578 N/A PHE 43.A N GLY 39.A O no hydrogen 3.036 N/A PHE 43.A N TYR 40.A O no hydrogen 3.054 N/A ILE 44.A N TYR 40.A O no hydrogen 3.066 N/A ASN 46.A N PHE 43.A O no hydrogen 2.880 N/A LEU 49.A N LEU 22.A O no hydrogen 3.294 N/A LYS 50.A N PHE 66.A O no hydrogen 3.122 N/A LYS 50.A NZ GLY 19.A O no hydrogen 2.912 N/A VAL 51.A N LYS 20.A O no hydrogen 2.867 N/A SER 52.A N GLU 64.A O no hydrogen 2.661 N/A SER 52.A OG GLU 64.A O no hydrogen 3.170 N/A SER 52.A OG GLU 64.A OE2 no hydrogen 3.273 N/A ASN 53.A N GLU 64.A O no hydrogen 3.289 N/A ASN 53.A ND2 GLU 14.A OE2 no hydrogen 3.143 N/A VAL 54.A N GLU 14.A OE2 no hydrogen 3.087 N/A ASP 55.A N TRP 62.A O no hydrogen 3.073 N/A THR 56.A N ASP 55.A OD1 no hydrogen 2.451 N/A LYS 57.A N PHE 60.A O no hydrogen 2.876 N/A LYS 57.A NZ LEU 131.A O no hydrogen 2.691 N/A LYS 57.A NZ LEU 134.A O no hydrogen 2.674 N/A GLY 58.A N ASP 137.A OD1 no hydrogen 2.613 N/A LYS 59.A NZ LEU 170.A O no hydrogen 3.011 N/A PHE 60.A N LYS 57.A O no hydrogen 3.132 N/A LEU 61.A N ASN 79.A O no hydrogen 2.974 N/A TRP 62.A N ASP 55.A O no hydrogen 2.876 N/A PHE 63.A N ILE 77.A O no hydrogen 2.953 N/A GLU 64.A N ASN 53.A O no hydrogen 2.836 N/A LEU 65.A N TRP 75.A O no hydrogen 2.738 N/A PHE 66.A N LYS 50.A O no hydrogen 3.005 N/A ASP 67.A N ASN 73.A O no hydrogen 3.082 N/A ASN 69.A N ASP 67.A OD2 no hydrogen 3.082 N/A SER 72.A N ASP 70.A OD2 no hydrogen 3.141 N/A SER 72.A OG ASP 70.A OD2 no hydrogen 2.711 N/A ASN 73.A N ASP 70.A O no hydrogen 2.862 N/A ASN 73.A ND2 ASN 46.A OD1 no hydrogen 3.578 N/A TRP 75.A N LEU 65.A O no hydrogen 2.778 N/A TRP 75.A NE1 ASN 46.A OD1 no hydrogen 2.937 N/A TYR 76.A N SER 121.A O no hydrogen 2.845 N/A ILE 77.A N PHE 63.A O no hydrogen 3.054 N/A TRP 78.A N LYS 119.A O no hydrogen 2.734 N/A ASN 79.A N LEU 61.A O no hydrogen 2.798 N/A THR 80.A N THR 117.A O no hydrogen 3.188 N/A THR 80.A OG1 THR 117.A OG1 no hydrogen 2.791 N/A THR 84.A OG1 ASP 111.A OD1 no hydrogen 2.736 N/A GLY 85.A N PHE 81.A O no hydrogen 2.990 N/A MET 86.A N SER 110.A O no hydrogen 2.761 N/A SER 88.A N TYR 108.A O no hydrogen 2.779 N/A SER 88.A OG PHE 90.A O no hydrogen 2.715 N/A LYS 93.A NZ TYR 94.A OH no hydrogen 3.370 N/A THR 95.A N ALA 92.A O no hydrogen 3.217 N/A THR 95.A OG1 ALA 92.A O no hydrogen 2.581 N/A ARG 96.A N PHE 109.A O no hydrogen 2.892 N/A ARG 96.A NE ASP 111.A O no hydrogen 3.153 N/A ARG 96.A NH2 ASP 111.A O no hydrogen 3.434 N/A ARG 96.A NH2 MET 112.A O no hydrogen 3.441 N/A ALA 97.A N PHE 109.A O no hydrogen 3.280 N/A VAL 98.A N ASP 26.A O no hydrogen 2.727 N/A LEU 99.A N ALA 107.A O no hydrogen 2.910 N/A SER 100.A N TYR 24.A O no hydrogen 2.645 N/A PHE 101.A N LEU 105.A O no hydrogen 2.875 N/A ASP 102.A N THR 21.A O no hydrogen 3.098 N/A LEU 105.A N ASP 102.A O no hydrogen 3.298 N/A ALA 107.A N LEU 99.A O no hydrogen 3.154 N/A TYR 108.A N SER 88.A O no hydrogen 2.775 N/A PHE 109.A N ALA 97.A O no hydrogen 3.196 N/A SER 110.A N MET 86.A O no hydrogen 2.758 N/A SER 110.A OG LYS 93.A O no hydrogen 3.382 N/A ASP 111.A N TYR 94.A O no hydrogen 3.206 N/A ARG 113.A N THR 84.A OG1 no hydrogen 2.830 N/A ASN 114.A N ASP 111.A O no hydrogen 2.951 N/A ASN 114.A N ASP 111.A OD1 no hydrogen 3.109 N/A GLY 116.A N ASP 111.A OD2 no hydrogen 2.642 N/A THR 117.A N THR 80.A O no hydrogen 3.037 N/A THR 117.A OG1 THR 80.A OG1 no hydrogen 2.791 N/A PHE 118.A N TYR 32.A OH no hydrogen 3.106 N/A LYS 119.A N TRP 78.A O no hydrogen 3.184 N/A LYS 119.A NZ GLU 38.A OE1 no hydrogen 3.504 N/A LYS 119.A NZ GLU 126.A OE1 no hydrogen 3.272 N/A PHE 120.A N GLU 38.A O no hydrogen 2.912 N/A SER 121.A N TYR 76.A O no hydrogen 2.933 N/A SER 121.A OG GLU 126.A OE2 no hydrogen 2.595 N/A ASN 122.A ND2 ASN 73.A OD1 no hydrogen 3.429 N/A ASN 122.A ND2 LYS 74.A O no hydrogen 2.512 N/A SER 123.A N SER 121.A OG no hydrogen 3.218 N/A GLU 126.A N SER 123.A OG no hydrogen 3.146 N/A LYS 128.A N GLU 124.A O no hydrogen 3.177 N/A LYS 128.A NZ GLU 124.A OE1 no hydrogen 3.069 N/A ARG 129.A N LYS 125.A O no hydrogen 3.130 N/A ARG 129.A NE GLU 133.A OE2 no hydrogen 3.127 N/A ARG 129.A NH2 GLU 133.A OE2 no hydrogen 3.381 N/A LYS 130.A N GLU 126.A O no hydrogen 3.153 N/A LEU 131.A N LEU 127.A O no hydrogen 2.797 N/A GLU 133.A N LYS 130.A O no hydrogen 2.772 N/A LEU 134.A N LEU 131.A O no hydrogen 3.454 N/A GLY 135.A N GLN 163.A O no hydrogen 2.608 N/A PHE 138.A N SER 168.A O no hydrogen 2.931 N/A LEU 139.A N ASP 137.A OD2 no hydrogen 2.707 N/A LYS 140.A N ASP 137.A OD2 no hydrogen 2.705 N/A LYS 140.A NZ ASP 55.A OD1 no hydrogen 2.855 N/A LYS 140.A NZ THR 56.A O no hydrogen 2.795 N/A LYS 140.A NZ THR 56.A OG1 no hydrogen 3.278 N/A ASN 141.A N ASP 137.A O no hydrogen 2.900 N/A ASN 141.A ND2 ASP 143.A OD1 no hydrogen 2.842 N/A SER 147.A OG ASP 145.A OD2 no hydrogen 2.618 N/A ILE 149.A N ILE 146.A O no hydrogen 3.168 N/A LYS 150.A N SER 147.A O no hydrogen 3.098 N/A LYS 150.A NZ LEU 193.A O no hydrogen 3.065 N/A LYS 150.A NZ ASP 195.A OD1 no hydrogen 3.254 N/A TYR 152.A N ILE 149.A O no hydrogen 3.344 N/A ILE 156.A N LYS 188.A O no hydrogen 2.836 N/A VAL 157.A N PRO 186.A O no hydrogen 3.413 N/A LEU 159.A N PRO 155.A O no hydrogen 3.061 N/A LEU 160.A N ILE 156.A O no hydrogen 3.188 N/A LEU 160.A N VAL 157.A O no hydrogen 2.873 N/A MET 161.A N VAL 157.A O no hydrogen 2.844 N/A ASP 162.A N ALA 158.A O no hydrogen 2.884 N/A GLN 163.A NE2 MET 161.A O no hydrogen 2.684 N/A GLN 163.A NE2 LEU 170.A O no hydrogen 2.929 N/A LYS 164.A N ASP 162.A OD1 no hydrogen 2.649 N/A LYS 164.A NZ ASN 132.A O no hydrogen 2.984 N/A LYS 165.A N ASP 162.A OD1 no hydrogen 2.595 N/A LYS 165.A NZ GLN 154.A OE1 no hydrogen 3.082 N/A SER 168.A N PRO 136.A O no hydrogen 2.682 N/A SER 168.A OG GLY 135.A O no hydrogen 2.673 N/A GLY 169.A N GLN 163.A OE1 no hydrogen 2.661 N/A ASN 172.A ND2 THR 271.A O no hydrogen 3.192 N/A TYR 173.A N GLU 2.A OE2 no hydrogen 2.794 N/A TYR 173.A OH GLU 5.A OE2 no hydrogen 2.309 N/A LEU 174.A N GLU 2.A OE1 no hydrogen 2.941 N/A VAL 175.A N GLY 171.A O no hydrogen 3.008 N/A ALA 176.A N ASN 172.A O no hydrogen 3.369 N/A GLU 177.A N TYR 173.A O no hydrogen 2.821 N/A ILE 178.A N LEU 174.A O no hydrogen 2.649 N/A LEU 179.A N VAL 175.A O no hydrogen 2.823 N/A TYR 180.A N ALA 176.A O no hydrogen 3.102 N/A TYR 180.A OH ASP 257.A OD2 no hydrogen 2.391 N/A ARG 181.A N GLU 177.A O no hydrogen 3.252 N/A ARG 181.A N ILE 178.A O no hydrogen 3.030 N/A ARG 181.A NH2 GLU 244.A OE2 no hydrogen 3.187 N/A ALA 182.A N ILE 178.A O no hydrogen 3.056 N/A LYS 183.A N TYR 180.A O no hydrogen 3.355 N/A ILE 184.A N LEU 179.A O no hydrogen 3.051 N/A ASP 185.A N LYS 280.A O no hydrogen 3.264 N/A HIS 187.A N ASP 185.A OD2 no hydrogen 2.935 N/A LYS 188.A N ASP 185.A O no hydrogen 2.953 N/A LYS 188.A NZ GLU 197.A OE1 no hydrogen 3.210 N/A LYS 188.A NZ GLU 197.A OE2 no hydrogen 2.596 N/A LYS 188.A NZ LEU 281.A O no hydrogen 2.935 N/A GLY 190.A N GLN 154.A O no hydrogen 3.039 N/A ASN 192.A N LEU 189.A O no hydrogen 2.833 N/A THR 194.A N GLU 197.A OE1 no hydrogen 2.656 N/A THR 194.A OG1 GLU 197.A OE1 no hydrogen 3.294 N/A GLU 197.A N THR 194.A OG1 no hydrogen 3.104 N/A ILE 198.A N THR 194.A O no hydrogen 2.810 N/A GLU 199.A N ASP 195.A O no hydrogen 3.066 N/A ASN 200.A N GLN 196.A O no hydrogen 2.874 N/A LEU 201.A N GLU 197.A O no hydrogen 2.623 N/A TRP 202.A N ILE 198.A O no hydrogen 2.874 N/A TYR 203.A N ASN 200.A O no hydrogen 3.081 N/A TRP 204.A N ASN 200.A O no hydrogen 3.206 N/A ILE 205.A N LEU 201.A O no hydrogen 2.924 N/A TYR 207.A N TYR 203.A O no hydrogen 2.933 N/A TYR 207.A OH GLU 244.A OE1 no hydrogen 2.499 N/A GLU 208.A N TRP 204.A O no hydrogen 2.747 N/A THR 209.A N ILE 205.A O no hydrogen 2.946 N/A THR 209.A OG1 ILE 205.A O no hydrogen 2.812 N/A THR 209.A OG1 LYS 206.A O no hydrogen 3.044 N/A LYS 210.A N LYS 206.A O no hydrogen 2.955 N/A LYS 210.A NZ ASN 235.A OD1 no hydrogen 3.084 N/A LYS 210.A NZ HIS 237.A O no hydrogen 3.007 N/A LYS 210.A NZ ILE 240.A O no hydrogen 2.985 N/A LEU 211.A N TYR 207.A O no hydrogen 2.968 N/A ALA 212.A N GLU 208.A O no hydrogen 2.897 N/A TYR 213.A N THR 209.A O no hydrogen 3.038 N/A TYR 213.A OH ASP 11.A OD2 no hydrogen 2.535 N/A ASP 214.A N LYS 210.A O no hydrogen 2.862 N/A SER 215.A N ALA 212.A O no hydrogen 3.125 N/A SER 215.A OG LEU 211.A O no hydrogen 2.887 N/A SER 215.A OG GLU 246.A OE1 no hydrogen 3.320 N/A ASN 216.A N GLU 246.A OE1 no hydrogen 3.044 N/A ASN 216.A ND2 GLU 225.A O no hydrogen 3.039 N/A ILE 218.A N TYR 220.A O no hydrogen 3.468 N/A GLY 219.A N TYR 220.A O no hydrogen 3.158 N/A LEU 224.A N MET 221.A O no hydrogen 2.848 N/A GLU 225.A N VAL 222.A O no hydrogen 3.318 N/A SER 228.A N LEU 224.A O no hydrogen 2.716 N/A SER 228.A OG ASN 216.A O no hydrogen 2.659 N/A SER 229.A N GLU 225.A O no hydrogen 3.244 N/A SER 229.A OG GLU 225.A O no hydrogen 3.487 N/A SER 229.A OG ASN 226.A O no hydrogen 3.214 N/A LYS 230.A N GLU 227.A O no hydrogen 2.975 N/A ARG 233.A NE GLY 232.A O no hydrogen 3.112 N/A ARG 233.A NH1 TYR 213.A O no hydrogen 3.435 N/A ARG 233.A NH2 SER 228.A O no hydrogen 2.437 N/A ARG 233.A NH2 ILE 231.A O no hydrogen 2.937 N/A ARG 233.A NH2 GLY 232.A O no hydrogen 3.560 N/A LYS 234.A N TYR 213.A OH no hydrogen 3.137 N/A LYS 234.A NZ ASP 11.A OD1 no hydrogen 3.411 N/A TYR 236.A N LYS 234.A O no hydrogen 2.909 N/A HIS 237.A NE2 ASN 141.A O no hydrogen 3.067 N/A THR 243.A N TYR 207.A OH no hydrogen 2.988 N/A GLU 244.A N GLU 244.A OE1 no hydrogen 2.323 N/A PHE 247.A N SER 215.A OG no hydrogen 2.799 N/A LEU 250.A N GLU 177.A OE1 no hydrogen 2.910 N/A VAL 251.A N GLU 177.A OE2 no hydrogen 3.014 N/A TYR 252.A N GLU 177.A OE2 no hydrogen 2.681 N/A LYS 254.A N VAL 251.A O no hydrogen 2.974 N/A ASP 257.A N ASN 261.A O no hydrogen 2.718 N/A GLY 260.A N ASP 257.A O no hydrogen 3.100 N/A VAL 263.A N LYS 255.A O no hydrogen 2.906 N/A ILE 264.A N TRP 274.A O no hydrogen 2.890 N/A LYS 267.A N ASP 266.A OD2 no hydrogen 2.692 N/A THR 271.A OG1 ASP 266.A O no hydrogen 3.436 N/A THR 272.A N ASP 266.A O no hydrogen 2.895 N/A TRP 274.A N ILE 264.A O no hydrogen 3.392 N/A TRP 274.A NE1 ASP 266.A OD1 no hydrogen 3.247 N/A ALA 275.A N GLN 279.A OE1 no hydrogen 2.690 N/A ILE 278.A N ALA 275.A O no hydrogen 2.691 N/A GLN 279.A N ALA 275.A O no hydrogen 2.807 N/A GLN 279.A NE2 ILE 184.A O no hydrogen 3.213 N/A LYS 280.A N LYS 183.A O no hydrogen 2.811 N/A LYS 280.A NZ PRO 276.A O no hydrogen 2.982 N/A LYS 280.A NZ ALA 277.A O no hydrogen 3.551 N/A