Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aax_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A N LEU 4.A O no hydrogen 2.916 N/A VAL 5.A N LEU 105.A O no hydrogen 2.822 N/A TRP 9.A N SER 6.A OG no hydrogen 3.148 N/A ALA 10.A N SER 6.A O no hydrogen 2.887 N/A GLU 11.A N ALA 7.A O no hydrogen 2.729 N/A SER 12.A N ASP 8.A O no hydrogen 2.957 N/A ASN 13.A N ALA 10.A O no hydrogen 2.873 N/A ASN 13.A ND2 SER 12.A O no hydrogen 2.593 N/A ALA 16.A N ASN 13.A O no hydrogen 3.238 N/A LYS 18.A NZ ASP 75.A OD1 no hydrogen 3.209 N/A VAL 20.A N THR 76.A O no hydrogen 2.855 N/A VAL 22.A N ILE 78.A O no hydrogen 2.721 N/A GLU 23.A N ILE 40.A O no hydrogen 2.737 N/A VAL 24.A N TYR 80.A O no hydrogen 2.840 N/A GLU 26.A N ASP 25.A OD1 no hydrogen 2.414 N/A ASP 27.A N ASP 25.A OD1 no hydrogen 3.436 N/A SER 29.A OG ASP 27.A OD2 no hydrogen 2.733 N/A TYR 31.A OH ALA 39.A O no hydrogen 2.302 N/A ASP 34.A N ALA 30.A O no hydrogen 3.112 N/A HIS 35.A N SER 121.A O no hydrogen 2.898 N/A HIS 35.A ND1 TYR 31.A O no hydrogen 3.027 N/A ILE 36.A N TYR 80.A OH no hydrogen 3.090 N/A ALA 39.A N ILE 36.A O no hydrogen 2.931 N/A ILE 40.A N PHE 21.A O no hydrogen 2.813 N/A LYS 41.A NZ ASP 32.A OD1 no hydrogen 3.047 N/A LEU 42.A N GLU 23.A O no hydrogen 3.057 N/A ASP 43.A N ASP 47.A OD2 no hydrogen 2.697 N/A TRP 44.A N ASP 25.A O no hydrogen 3.227 N/A ARG 45.A NE GLU 26.A OE1 no hydrogen 3.402 N/A THR 46.A N ASP 43.A OD1 no hydrogen 2.639 N/A ASP 47.A N ASP 43.A O no hydrogen 2.776 N/A LEU 48.A N ASP 43.A O no hydrogen 3.324 N/A GLN 49.A NE2 TRP 44.A O no hydrogen 2.960 N/A GLN 49.A NE2 TYR 94.A OH no hydrogen 2.990 N/A ASP 50.A N ASP 55.A O no hydrogen 2.570 N/A VAL 52.A N ASP 50.A OD1 no hydrogen 2.735 N/A LYS 53.A N ASP 50.A OD1 no hydrogen 2.945 N/A ARG 54.A NH2 GLY 255.A O no hydrogen 2.878 N/A ARG 54.A NH2 THR 258.A OG1 no hydrogen 2.731 N/A PHE 56.A N ASP 55.A OD1 no hydrogen 2.883 N/A VAL 57.A N LEU 48.A O no hydrogen 2.886 N/A GLN 61.A N ASP 58.A OD1 no hydrogen 3.323 N/A PHE 62.A N ASP 58.A O no hydrogen 2.782 N/A SER 63.A N ALA 59.A O no hydrogen 2.981 N/A SER 63.A OG ALA 59.A O no hydrogen 3.025 N/A LYS 64.A N GLN 60.A O no hydrogen 3.185 N/A LYS 64.A NZ GLU 68.A OE2 no hydrogen 3.270 N/A LEU 65.A N GLN 61.A O no hydrogen 2.798 N/A LEU 66.A N PHE 62.A O no hydrogen 3.001 N/A SER 67.A N SER 63.A O no hydrogen 2.871 N/A SER 67.A OG SER 63.A O no hydrogen 2.837 N/A SER 67.A OG THR 130.A O no hydrogen 3.437 N/A GLU 68.A N LYS 64.A O no hydrogen 2.957 N/A ARG 69.A N LEU 66.A O no hydrogen 3.111 N/A ARG 69.A NH1 ASP 47.A OD1 no hydrogen 3.270 N/A GLY 70.A N SER 67.A O no hydrogen 2.945 N/A ILE 71.A N LEU 66.A O no hydrogen 2.944 N/A ALA 72.A N ASP 75.A OD2 no hydrogen 2.640 N/A ASP 75.A N ALA 72.A O no hydrogen 2.940 N/A THR 76.A N LYS 18.A O no hydrogen 2.874 N/A VAL 77.A N LYS 102.A O no hydrogen 3.042 N/A ILE 78.A N VAL 20.A O no hydrogen 2.895 N/A LEU 79.A N LYS 104.A O no hydrogen 3.088 N/A TYR 80.A N VAL 22.A O no hydrogen 3.185 N/A GLY 81.A N ASN 85.A OD1 no hydrogen 2.862 N/A ASN 85.A N GLY 82.A O no hydrogen 3.171 N/A ASN 85.A ND2 LEU 106.A O no hydrogen 3.419 N/A TRP 86.A N ASN 83.A O no hydrogen 2.955 N/A ALA 89.A N ASN 85.A O no hydrogen 3.008 N/A TYR 90.A N TRP 86.A O no hydrogen 2.931 N/A TYR 90.A OH ILE 230.A O no hydrogen 2.566 N/A ALA 91.A N PHE 87.A O no hydrogen 2.875 N/A TYR 92.A N ALA 88.A O no hydrogen 2.813 N/A TYR 92.A OH GLU 243.A OE1 no hydrogen 2.586 N/A TRP 93.A N ALA 89.A O no hydrogen 3.217 N/A TRP 93.A NE1 ILE 141.A O no hydrogen 2.988 N/A TYR 94.A N TYR 90.A O no hydrogen 2.993 N/A PHE 95.A N ALA 91.A O no hydrogen 2.809 N/A LYS 96.A N TYR 92.A O no hydrogen 3.010 N/A LYS 96.A NZ HIS 100.A O no hydrogen 2.669 N/A LEU 97.A N TRP 93.A O no hydrogen 2.814 N/A TYR 98.A N TYR 94.A O no hydrogen 3.024 N/A TYR 98.A OH VAL 57.A O no hydrogen 2.528 N/A GLY 99.A N LYS 96.A O no hydrogen 3.162 N/A HIS 100.A N PHE 95.A O no hydrogen 3.346 N/A LYS 102.A NZ GLU 74.A O no hydrogen 3.356 N/A VAL 103.A N GLU 101.A O no hydrogen 3.010 N/A LYS 104.A N VAL 77.A O no hydrogen 2.689 N/A LEU 105.A N VAL 3.A O no hydrogen 3.152 N/A LEU 106.A N LEU 79.A O no hydrogen 2.939 N/A ASP 107.A N VAL 5.A O no hydrogen 2.876 N/A GLY 109.A N LEU 106.A O no hydrogen 2.796 N/A ARG 110.A N GLY 81.A O no hydrogen 2.879 N/A ARG 110.A NH1 ASP 34.A O no hydrogen 2.977 N/A ARG 110.A NH2 ASP 34.A O no hydrogen 2.790 N/A LYS 112.A N GLY 108.A O no hydrogen 3.383 N/A LYS 112.A NZ ASP 116.A OD2 no hydrogen 3.322 N/A GLU 114.A N ARG 110.A O no hydrogen 3.457 N/A LEU 115.A N LYS 111.A O no hydrogen 3.175 N/A ASP 116.A N LYS 112.A O no hydrogen 2.813 N/A GLY 117.A N GLU 114.A O no hydrogen 3.067 N/A ARG 118.A NE ASP 116.A OD2 no hydrogen 3.352 N/A ARG 118.A NH2 ASP 116.A OD2 no hydrogen 3.307 N/A SER 121.A N HIS 35.A O no hydrogen 2.682 N/A SER 121.A OG ASP 123.A OD2 no hydrogen 3.523 N/A ASP 123.A N SER 121.A OG no hydrogen 3.195 N/A ARG 127.A NE GLY 70.A O no hydrogen 2.864 N/A ARG 127.A NH2 GLY 70.A O no hydrogen 3.087 N/A THR 130.A N SER 67.A O no hydrogen 2.893 N/A THR 130.A OG1 SER 67.A O no hydrogen 3.336 N/A THR 130.A OG1 ILE 71.A O no hydrogen 2.632 N/A TYR 132.A N SER 67.A OG no hydrogen 2.820 N/A ALA 134.A N SER 63.A OG no hydrogen 2.768 N/A SER 135.A N TYR 98.A O no hydrogen 2.999 N/A SER 135.A OG TYR 98.A O no hydrogen 3.540 N/A ASP 138.A N LEU 97.A O no hydrogen 3.037 N/A THR 140.A N ASP 138.A OD1 no hydrogen 3.019 N/A ARG 142.A N ASN 139.A O no hydrogen 3.426 N/A ARG 142.A NE ASP 254.A OD1 no hydrogen 2.850 N/A ARG 142.A NH2 ASP 55.A OD1 no hydrogen 3.089 N/A ARG 142.A NH2 ASP 254.A OD1 no hydrogen 3.471 N/A ARG 142.A NH2 ASP 254.A OD2 no hydrogen 3.099 N/A ALA 143.A N ASN 252.A O no hydrogen 2.960 N/A PHE 144.A N GLU 147.A OE2 no hydrogen 2.896 N/A ARG 145.A NH1 GLU 259.A OE2 no hydrogen 2.579 N/A VAL 148.A N PHE 144.A O no hydrogen 2.874 N/A LEU 149.A N ARG 145.A O no hydrogen 2.632 N/A ALA 150.A N ASP 146.A O no hydrogen 2.715 N/A ALA 151.A N GLU 147.A O no hydrogen 2.939 N/A ALA 151.A N VAL 148.A O no hydrogen 3.344 N/A LYS 155.A NZ GLU 223.A OE2 no hydrogen 3.163 N/A ASN 156.A N GLU 223.A O no hydrogen 2.763 N/A ASN 156.A ND2 ASP 219.A O no hydrogen 2.567 N/A ASN 156.A ND2 THR 224.A OG1 no hydrogen 3.038 N/A ILE 158.A N ILE 225.A O no hydrogen 3.003 N/A ASP 159.A N ILE 189.A O no hydrogen 2.645 N/A VAL 160.A N TYR 227.A O no hydrogen 3.054 N/A ARG 161.A N ASP 159.A OD1 no hydrogen 3.065 N/A ARG 161.A NH1 ASP 159.A OD1 no hydrogen 3.277 N/A ARG 161.A NH1 ASP 159.A OD2 no hydrogen 2.400 N/A ARG 161.A NH1 GLY 183.A O no hydrogen 3.278 N/A ARG 161.A NH2 GLY 183.A O no hydrogen 2.915 N/A SER 162.A N GLU 165.A OE2 no hydrogen 2.839 N/A SER 162.A OG GLU 165.A OE2 no hydrogen 2.739 N/A PHE 166.A N SER 162.A O no hydrogen 2.877 N/A SER 167.A N PRO 163.A O no hydrogen 2.789 N/A SER 167.A OG PRO 163.A O no hydrogen 3.509 N/A SER 167.A OG ASP 164.A O no hydrogen 3.419 N/A GLY 168.A N GLU 165.A O no hydrogen 3.112 N/A LYS 169.A N SER 167.A OG no hydrogen 3.275 N/A ILE 170.A N ASP 164.A O no hydrogen 3.017 N/A SER 179.A OG TRP 257.A O no hydrogen 3.028 N/A GLN 180.A NE2 SER 262.A OG no hydrogen 3.410 N/A HIS 184.A N GLU 269.A O no hydrogen 3.227 N/A HIS 184.A ND1 ILE 185.A O no hydrogen 3.107 N/A HIS 184.A NE2 GLY 271.A O no hydrogen 3.098 N/A ILE 185.A N TYR 227.A OH no hydrogen 3.073 N/A GLY 187.A N GLU 269.A OE1 no hydrogen 3.378 N/A ALA 188.A N ILE 185.A O no hydrogen 2.895 N/A ILE 189.A N LEU 157.A O no hydrogen 2.623 N/A VAL 191.A N ASP 159.A O no hydrogen 3.035 N/A TRP 193.A N VAL 160.A O no hydrogen 3.085 N/A ARG 195.A N PRO 192.A O no hydrogen 2.932 N/A ALA 196.A N TRP 193.A O no hydrogen 2.961 N/A ALA 197.A N SER 194.A O no hydrogen 3.228 N/A ASN 198.A N THR 202.A O no hydrogen 2.984 N/A ASN 198.A ND2 THR 202.A OG1 no hydrogen 2.974 N/A GLY 201.A N ASN 198.A O no hydrogen 2.975 N/A THR 202.A N ASP 200.A OD1 no hydrogen 2.751 N/A THR 202.A OG1 ASP 200.A OD1 no hydrogen 2.593 N/A THR 202.A OG1 ASP 200.A OD2 no hydrogen 3.280 N/A PHE 203.A N ASP 107.A OD1 no hydrogen 2.760 N/A LYS 204.A NZ ARG 195.A O no hydrogen 3.232 N/A SER 205.A N GLU 208.A OE1 no hydrogen 2.662 N/A SER 205.A OG GLU 208.A OE1 no hydrogen 2.658 N/A GLU 208.A N SER 205.A OG no hydrogen 3.032 N/A LEU 209.A N SER 205.A O no hydrogen 2.892 N/A ALA 210.A N ASP 206.A O no hydrogen 2.957 N/A LYS 211.A N GLU 207.A O no hydrogen 3.341 N/A LYS 211.A NZ ASP 215.A OD2 no hydrogen 2.671 N/A LEU 212.A N GLU 208.A O no hydrogen 2.901 N/A TYR 213.A N LEU 209.A O no hydrogen 3.146 N/A ALA 214.A N ALA 210.A O no hydrogen 2.851 N/A ASP 215.A N LYS 211.A O no hydrogen 2.820 N/A ALA 216.A N LEU 212.A O no hydrogen 3.227 N/A GLY 217.A N TYR 213.A O no hydrogen 3.252 N/A GLY 217.A N ALA 214.A O no hydrogen 2.883 N/A LEU 218.A N TYR 213.A O no hydrogen 2.970 N/A ASP 219.A N ASN 156.A OD1 no hydrogen 2.770 N/A SER 221.A N ASP 219.A OD1 no hydrogen 3.034 N/A SER 221.A OG ASP 219.A OD1 no hydrogen 2.743 N/A LYS 222.A N ASP 219.A O no hydrogen 2.773 N/A LYS 222.A NZ ASN 153.A O no hydrogen 2.840 N/A THR 224.A N ASN 249.A O no hydrogen 3.157 N/A ILE 225.A N ASN 156.A O no hydrogen 2.829 N/A ALA 226.A N LYS 251.A O no hydrogen 2.916 N/A TYR 227.A N ILE 158.A O no hydrogen 2.999 N/A TYR 227.A OH ASP 159.A OD2 no hydrogen 2.395 N/A CYS 228.A N SER 256.A OG no hydrogen 2.868 N/A ARG 229.A NH2 GLU 177.A O no hydrogen 3.391 N/A ARG 233.A NH1 GLU 165.A OE2 no hydrogen 2.899 N/A ARG 233.A NH2 GLU 165.A OE1 no hydrogen 3.338 N/A SER 234.A N GLY 231.A O no hydrogen 3.183 N/A SER 234.A OG ASN 252.A OD1 no hydrogen 2.571 N/A SER 235.A N GLY 231.A O no hydrogen 3.054 N/A SER 235.A OG GLY 231.A O no hydrogen 2.913 N/A SER 235.A OG GLU 232.A O no hydrogen 3.131 N/A TRP 238.A N SER 234.A O no hydrogen 2.783 N/A TRP 238.A NE1 VAL 250.A O no hydrogen 2.758 N/A PHE 239.A N SER 235.A O no hydrogen 3.074 N/A VAL 240.A N HIS 236.A O no hydrogen 3.322 N/A LEU 241.A N THR 237.A O no hydrogen 2.801 N/A ARG 242.A N TRP 238.A O no hydrogen 2.838 N/A ARG 242.A NH1 GLU 243.A OE2 no hydrogen 2.862 N/A GLU 243.A N PHE 239.A O no hydrogen 2.868 N/A LEU 244.A N PHE 239.A O no hydrogen 3.225 N/A LEU 244.A N VAL 240.A O no hydrogen 3.258 N/A LEU 245.A N VAL 240.A O no hydrogen 2.992 N/A HIS 247.A N LEU 241.A O no hydrogen 2.976 N/A GLN 248.A N GLN 248.A OE1 no hydrogen 3.109 N/A ASN 249.A ND2 GLN 248.A OE1 no hydrogen 3.567 N/A LYS 251.A N THR 224.A O no hydrogen 3.024 N/A LYS 251.A NZ ASN 139.A O no hydrogen 2.654 N/A LYS 251.A NZ ARG 142.A O no hydrogen 3.054 N/A LYS 251.A NZ GLU 147.A OE1 no hydrogen 3.205 N/A ASN 252.A N ILE 141.A O no hydrogen 2.879 N/A TYR 253.A N ALA 226.A O no hydrogen 2.873 N/A TYR 253.A OH GLU 259.A OE1 no hydrogen 2.584 N/A SER 256.A OG TYR 253.A O no hydrogen 3.086 N/A TRP 257.A N CYS 228.A O no hydrogen 3.049 N/A TRP 257.A NE1 ARG 181.A O no hydrogen 2.917 N/A THR 258.A N ARG 229.A O no hydrogen 3.108 N/A THR 258.A OG1 ARG 229.A O no hydrogen 2.971 N/A THR 258.A OG1 GLY 255.A O no hydrogen 3.271 N/A TYR 260.A N SER 256.A O no hydrogen 2.994 N/A TYR 260.A OH PRO 267.A O no hydrogen 2.851 N/A GLY 261.A N TRP 257.A O no hydrogen 2.768 N/A SER 262.A N GLU 259.A O no hydrogen 2.846 N/A SER 262.A OG THR 258.A O no hydrogen 3.320 N/A LEU 263.A N TYR 260.A O no hydrogen 3.066 N/A GLU 269.A N HIS 184.A O no hydrogen 3.129 N/A GLY 271.A N SER 167.A O no hydrogen 2.684 N/A