Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zsi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N VAL 15.A O no hydrogen 2.885 N/A TYR 4.A OH TYR 19.A O no hydrogen 2.825 N/A GLN 6.A N TRP 13.A O no hydrogen 2.840 N/A LEU 8.A N THR 11.A O no hydrogen 2.977 N/A THR 11.A N LEU 8.A O no hydrogen 3.337 N/A THR 11.A OG1 ASN 9.A O no hydrogen 3.351 N/A TRP 13.A N GLN 6.A O no hydrogen 2.746 N/A GLU 14.A N TYR 98.A OH no hydrogen 3.125 N/A VAL 15.A N TYR 4.A O no hydrogen 3.066 N/A GLU 17.A N THR 2.A O no hydrogen 2.881 N/A ARG 18.A NE ASP 38.A OD1 no hydrogen 2.912 N/A ARG 18.A NH2 ASP 38.A OD2 no hydrogen 3.077 N/A TYR 19.A N PRO 16.A O no hydrogen 3.079 N/A TYR 19.A OH ASP 83.A OD2 no hydrogen 2.757 N/A GLN 20.A N PHE 37.A O no hydrogen 2.834 N/A GLN 20.A NE2 GLU 17.A O no hydrogen 2.667 N/A SER 23.A N ALA 35.A O no hydrogen 2.805 N/A VAL 25.A N VAL 33.A O no hydrogen 2.981 N/A GLY 26.A N VAL 33.A O no hydrogen 3.458 N/A SER 27.A OG.A GLY 26.A O no hydrogen 2.803 N/A SER 27.A OG.A SER 32.A OG.B no hydrogen 2.949 N/A GLY 28.A N GLY 31.A O no hydrogen 2.903 N/A SER 32.A N LYS 49.A O no hydrogen 3.047 N/A SER 32.A OG.B SER 27.A OG.A no hydrogen 2.949 N/A VAL 33.A N GLY 26.A O no hydrogen 3.085 N/A CYS 34.A N VAL 47.A O no hydrogen 2.865 N/A ALA 35.A N SER 23.A O no hydrogen 2.766 N/A ALA 36.A N VAL 45.A O no hydrogen 2.911 N/A PHE 37.A N GLN 20.A O no hydrogen 2.645 N/A ASP 38.A N LEU 43.A O no hydrogen 2.972 N/A THR 39.A N ARG 18.A O no hydrogen 2.992 N/A THR 39.A OG1 ARG 18.A O no hydrogen 2.639 N/A LYS 40.A N ASP 38.A OD1 no hydrogen 3.124 N/A THR 41.A N ASP 38.A O no hydrogen 3.136 N/A THR 41.A OG1 ASP 38.A O no hydrogen 3.500 N/A GLY 42.A N ASP 38.A O no hydrogen 2.717 N/A LEU 43.A N THR 41.A OG1 no hydrogen 3.249 N/A VAL 45.A N ALA 36.A O no hydrogen 2.814 N/A ALA 46.A N THR 101.A O no hydrogen 2.832 N/A VAL 47.A N CYS 34.A O no hydrogen 2.835 N/A LYS 48.A N LEU 99.A O no hydrogen 2.817 N/A LYS 48.A NZ TYR 30.A O no hydrogen 3.559 N/A LYS 48.A NZ GLU 66.A OE1 no hydrogen 3.061 N/A LYS 48.A NZ GLU 66.A OE2 no hydrogen 3.161 N/A LYS 49.A N SER 32.A O no hydrogen 2.865 N/A LYS 49.A NZ ILE 12.A O no hydrogen 2.476 N/A LEU 50.A N VAL 97.A O no hydrogen 3.060 N/A SER 51.A N TYR 30.A O no hydrogen 3.477 N/A GLN 55.A N ARG 52.A O no hydrogen 3.398 N/A HIS 59.A N SER 56.A OG no hydrogen 3.233 N/A HIS 59.A ND1 ARG 52.A O no hydrogen 2.777 N/A ALA 60.A N SER 56.A O no hydrogen 2.788 N/A LYS 61.A N ILE 57.A O no hydrogen 2.788 N/A LYS 61.A NZ GLU 302.A O no hydrogen 2.667 N/A LYS 61.A NZ ARG 304.A O no hydrogen 3.028 N/A ARG 62.A N ILE 58.A O no hydrogen 2.859 N/A THR 63.A N HIS 59.A O no hydrogen 2.851 N/A THR 63.A OG1 PRO 53.A O no hydrogen 2.975 N/A THR 63.A OG1 HIS 59.A O no hydrogen 2.857 N/A TYR 64.A N ALA 60.A O no hydrogen 3.046 N/A ARG 65.A N LYS 61.A O no hydrogen 2.814 N/A ARG 65.A NE GLU 302.A OE1 no hydrogen 3.361 N/A ARG 65.A NE GLU 302.A OE2 no hydrogen 2.821 N/A ARG 65.A NH2 GLU 302.A OE1 no hydrogen 2.946 N/A GLU 66.A N ARG 62.A O no hydrogen 2.939 N/A LEU 67.A N THR 63.A O no hydrogen 2.975 N/A ARG 68.A N TYR 64.A O no hydrogen 2.817 N/A ARG 68.A NH1 TYR 64.A OH no hydrogen 2.751 N/A LEU 69.A N ARG 65.A O no hydrogen 3.046 N/A LEU 70.A N GLU 66.A O no hydrogen 2.953 N/A LYS 71.A N LEU 67.A O no hydrogen 3.030 N/A LYS 71.A NZ GLU 318.A O no hydrogen 2.624 N/A LYS 71.A NZ GLU 318.A OE1 no hydrogen 2.548 N/A HIS 72.A N LEU 69.A O no hydrogen 2.924 N/A HIS 72.A NE2 ASP 295.A O no hydrogen 2.625 N/A MET 73.A N LEU 69.A O no hydrogen 3.103 N/A LYS 74.A N TYR 131.A OH no hydrogen 2.931 N/A ASN 77.A N HIS 75.A ND1 no hydrogen 3.095 N/A ASN 77.A ND2 LEU 155.A O no hydrogen 3.073 N/A VAL 78.A N HIS 75.A O no hydrogen 3.359 N/A ILE 79.A N ILE 157.A O no hydrogen 3.015 N/A LEU 82.A N VAL 100.A O no hydrogen 2.847 N/A ASP 83.A N VAL 100.A O no hydrogen 3.469 N/A PHE 85.A N TYR 98.A O no hydrogen 3.077 N/A THR 86.A OG1 ASP 96.A O no hydrogen 2.677 N/A ALA 88.A N THR 86.A OG1 no hydrogen 3.309 N/A ARG 89.A N GLU 93.A OE2 no hydrogen 2.570 N/A PHE 94.A N LEU 91.A O no hydrogen 3.125 N/A TYR 98.A N PHE 85.A O no hydrogen 2.939 N/A LEU 99.A N LYS 48.A O no hydrogen 2.898 N/A VAL 100.A N ASP 83.A O no hydrogen 2.892 N/A THR 101.A N ALA 46.A O no hydrogen 3.027 N/A THR 101.A OG1 GLY 80.A O no hydrogen 2.834 N/A LEU 103.A N ARG 44.A O no hydrogen 3.121 N/A LEU 108.A N PRO 144.A O no hydrogen 3.230 N/A LEU 108.A N LEU 147.A O no hydrogen 2.956 N/A ASN 110.A N ASP 107.A OD1 no hydrogen 2.918 N/A LEU 113.A N LEU 194.A O no hydrogen 3.412 N/A THR 114.A OG1 HIS 117.A ND1 no hydrogen 2.759 N/A HIS 117.A ND1 THR 114.A OG1 no hydrogen 2.759 N/A VAL 118.A N THR 114.A O no hydrogen 3.252 N/A GLN 119.A N ASP 115.A O no hydrogen 2.894 N/A GLN 119.A NE2 ASP 115.A OD2 no hydrogen 2.759 N/A PHE 120.A N ASP 116.A O no hydrogen 3.130 N/A LEU 121.A N HIS 117.A O no hydrogen 2.944 N/A ILE 122.A N VAL 118.A O no hydrogen 3.001 N/A TYR 123.A N GLN 119.A O no hydrogen 2.974 N/A TYR 123.A OH GLU 291.A OE2 no hydrogen 2.715 N/A GLN 124.A N PHE 120.A O no hydrogen 3.125 N/A GLN 124.A NE2 PHE 120.A O no hydrogen 3.108 N/A GLN 124.A NE2 CYS 153.A O no hydrogen 2.954 N/A ILE 125.A N LEU 121.A O no hydrogen 3.116 N/A LEU 126.A N ILE 122.A O no hydrogen 3.031 N/A ARG 127.A N TYR 123.A O no hydrogen 2.856 N/A ARG 127.A NE ASP 290.A O no hydrogen 2.854 N/A ARG 127.A NH1 GLU 76.A OE1 no hydrogen 2.944 N/A ARG 127.A NH1 ASN 77.A OD1 no hydrogen 2.912 N/A ARG 127.A NH2 GLU 76.A OE1 no hydrogen 3.312 N/A ARG 127.A NH2 ASP 290.A O no hydrogen 3.159 N/A ARG 127.A NH2 ASP 290.A OD1 no hydrogen 3.045 N/A GLY 128.A N GLN 124.A O no hydrogen 3.060 N/A LEU 129.A N ILE 125.A O no hydrogen 2.803 N/A LYS 130.A N LEU 126.A O no hydrogen 2.908 N/A LYS 130.A NZ GLU 291.A O no hydrogen 2.798 N/A TYR 131.A N ARG 127.A O no hydrogen 3.477 N/A TYR 131.A OH HIS 72.A O no hydrogen 3.083 N/A ILE 132.A N GLY 128.A O no hydrogen 3.022 N/A HIS 133.A N LEU 129.A O no hydrogen 2.764 N/A HIS 133.A NE2 ASP 183.A OD2 no hydrogen 2.775 N/A SER 134.A N LYS 130.A O no hydrogen 2.912 N/A SER 134.A OG TYR 131.A O no hydrogen 2.661 N/A ALA 135.A N ILE 132.A O no hydrogen 3.172 N/A ASP 136.A N HIS 133.A O no hydrogen 2.933 N/A ILE 137.A N ILE 132.A O no hydrogen 3.337 N/A HIS 139.A N ASP 183.A OD2 no hydrogen 2.856 N/A HIS 139.A NE2 LEU 158.A O no hydrogen 2.671 N/A ARG 140.A N ASP 183.A OD1 no hydrogen 2.833 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 3.190 N/A LYS 143.A NZ THR 163.A OG1 no hydrogen 2.671 N/A ASN 146.A N.A LYS 143.A O no hydrogen 2.938 N/A ASN 146.A N.B LYS 143.A O no hydrogen 2.937 N/A ASN 146.A ND2.A ASP 141.A O no hydrogen 2.799 N/A ASN 146.A ND2.B ASP 141.A O no hydrogen 2.518 N/A LEU 147.A N.A PRO 144.A O no hydrogen 3.107 N/A LEU 147.A N.B PRO 144.A O no hydrogen 3.099 N/A ALA 148.A N LYS 156.A O no hydrogen 2.854 N/A VAL 149.A N ALA 106.A O no hydrogen 2.718 N/A ASN 150.A N GLU 154.A O no hydrogen 2.780 N/A ASN 150.A ND2 ASP 152.A OD1 no hydrogen 3.288 N/A CYS 153.A N ASN 150.A O no hydrogen 3.387 N/A LEU 155.A N GLN 124.A OE1 no hydrogen 2.948 N/A LYS 156.A N ALA 148.A O no hydrogen 2.819 N/A LYS 156.A NZ GLU 76.A O no hydrogen 2.656 N/A ILE 157.A N ASN 77.A O no hydrogen 2.816 N/A LEU 158.A N ASN 146.A O.A no hydrogen 2.797 N/A LEU 158.A N ASN 146.A O.B no hydrogen 2.712 N/A PHE 160.A N ASP 159.A OD1 no hydrogen 2.811 N/A GLY 161.A N ASN 146.A OD1.A no hydrogen 2.575 N/A GLY 161.A N ASN 146.A OD1.B no hydrogen 2.894 N/A TRP 165.A NE1 GLY 203.A O no hydrogen 2.984 N/A TYR 166.A N THR 163.A O no hydrogen 3.101 N/A TYR 166.A OH GLU 193.A OE1 no hydrogen 2.655 N/A TYR 166.A OH GLU 193.A OE2 no hydrogen 3.386 N/A ARG 167.A N ARG 164.A O no hydrogen 3.080 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.823 N/A ILE 171.A N ALA 168.A O no hydrogen 3.051 N/A MET 172.A N ALA 168.A O no hydrogen 3.415 N/A LEU 173.A N PRO 169.A O no hydrogen 2.992 N/A ASN 174.A N ILE 171.A O no hydrogen 3.090 N/A TRP 175.A N GLU 170.A O no hydrogen 3.061 N/A GLN 180.A NE2 HIS 133.A O no hydrogen 2.834 N/A THR 181.A N ASN 179.A OD1 no hydrogen 2.851 N/A THR 181.A OG1 ASN 179.A OD1 no hydrogen 3.211 N/A THR 181.A OG1 SER 267.A O no hydrogen 3.089 N/A VAL 182.A N ASN 179.A O no hydrogen 3.277 N/A ASP 183.A N GLN 180.A O no hydrogen 3.028 N/A TRP 185.A N THR 181.A O no hydrogen 3.050 N/A SER 186.A N VAL 182.A O no hydrogen 3.340 N/A SER 186.A OG TYR 166.A O no hydrogen 2.590 N/A SER 186.A OG VAL 182.A O no hydrogen 3.145 N/A VAL 187.A N ASP 183.A O no hydrogen 2.971 N/A GLY 188.A N ILE 184.A O no hydrogen 2.979 N/A CYS 189.A N TRP 185.A O no hydrogen 3.068 N/A CYS 189.A SG TRP 165.A O no hydrogen 3.903 N/A CYS 189.A SG TRP 185.A O no hydrogen 3.422 N/A ILE 190.A N SER 186.A O no hydrogen 3.015 N/A MET 191.A N VAL 187.A O no hydrogen 2.775 N/A ALA 192.A N GLY 188.A O no hydrogen 3.116 N/A GLU 193.A N CYS 189.A O no hydrogen 3.146 N/A LEU 194.A N ILE 190.A O no hydrogen 2.995 N/A LEU 195.A N MET 191.A O no hydrogen 3.178 N/A THR 196.A N ALA 192.A O no hydrogen 3.127 N/A THR 196.A OG1 ALA 192.A O no hydrogen 2.886 N/A GLY 197.A N GLU 193.A O no hydrogen 2.777 N/A ARG 198.A N THR 196.A OG1 no hydrogen 3.421 N/A GLY 203.A N PHE 201.A O no hydrogen 2.870 N/A GLY 203.A N GLN 209.A OE1 no hydrogen 3.166 N/A THR 204.A N ASP 208.A OD2 no hydrogen 2.923 N/A THR 204.A OG1 ASP 205.A OD2 no hydrogen 3.267 N/A THR 204.A OG1 ASP 208.A OD2 no hydrogen 3.343 N/A ILE 207.A N.A ASP 205.A OD1 no hydrogen 3.040 N/A ILE 207.A N.B ASP 205.A OD1 no hydrogen 3.041 N/A ASP 208.A N ASP 205.A OD1 no hydrogen 2.909 N/A GLN 209.A N ASP 205.A O no hydrogen 2.936 N/A GLN 209.A NE2 PHE 201.A O no hydrogen 2.984 N/A LYS 211.A N ILE 207.A O no hydrogen 3.237 N/A LYS 211.A NZ ASP 208.A OD1 no hydrogen 3.082 N/A LEU 212.A N ASP 208.A O no hydrogen 3.009 N/A ILE 213.A N GLN 209.A O no hydrogen 3.064 N/A LEU 214.A N LEU 210.A O no hydrogen 2.880 N/A ARG 215.A N LYS 211.A O no hydrogen 3.027 N/A LEU 216.A N ILE 213.A O no hydrogen 3.176 N/A VAL 217.A N ILE 213.A O no hydrogen 2.969 N/A GLY 218.A N LEU 214.A O no hydrogen 2.949 N/A LEU 224.A N GLU 223.A OE1 no hydrogen 3.020 N/A LEU 225.A N GLY 221.A O no hydrogen 3.269 N/A LYS 226.A N ALA 222.A O no hydrogen 3.364 N/A LYS 227.A N LEU 224.A O no hydrogen 3.027 N/A ILE 228.A N LEU 225.A O no hydrogen 3.164 N/A ALA 233.A N SER 230.A OG no hydrogen 3.183 N/A ARG 234.A N SER 230.A O no hydrogen 3.102 N/A ARG 234.A NE ILE 228.A O no hydrogen 2.779 N/A ARG 234.A NH1 GLU 231.A OE1 no hydrogen 2.926 N/A ARG 234.A NH2 SER 229.A O no hydrogen 2.932 N/A ARG 234.A NH2 GLU 231.A OE1 no hydrogen 2.688 N/A ASN 235.A N GLU 231.A O no hydrogen 2.814 N/A TYR 236.A N SER 232.A O no hydrogen 2.914 N/A TYR 236.A OH ILE 207.A O no hydrogen 3.276 N/A ILE 237.A N ALA 233.A O no hydrogen 2.870 N/A GLN 238.A N ARG 234.A O no hydrogen 3.017 N/A SER 239.A N ASN 235.A O no hydrogen 3.136 N/A SER 239.A N TYR 236.A O no hydrogen 3.335 N/A SER 239.A OG ASN 235.A O no hydrogen 2.953 N/A SER 239.A OG TYR 236.A O no hydrogen 3.014 N/A MET 242.A N LEU 216.A O no hydrogen 3.020 N/A ASN 246.A N ASN 243.A O no hydrogen 2.721 N/A VAL 247.A N ASN 243.A O no hydrogen 2.978 N/A PHE 248.A N PHE 244.A O no hydrogen 2.788 N/A ILE 249.A N ASN 246.A O no hydrogen 3.113 N/A ALA 251.A N PHE 248.A O no hydrogen 3.159 N/A ASN 252.A ND2 ASP 115.A OD2 no hydrogen 2.889 N/A LEU 254.A N ASN 252.A OD1 no hydrogen 2.986 N/A VAL 256.A N ASN 252.A O no hydrogen 3.012 N/A ASP 257.A N PRO 253.A O no hydrogen 3.083 N/A LEU 258.A N LEU 254.A O no hydrogen 3.122 N/A LEU 259.A N ALA 255.A O no hydrogen 3.110 N/A GLU 260.A N VAL 256.A O no hydrogen 3.039 N/A LYS 261.A N ASP 257.A O no hydrogen 3.159 N/A LYS 261.A N LEU 258.A O no hydrogen 2.922 N/A LYS 261.A NZ ASP 257.A OD1 no hydrogen 3.085 N/A LYS 261.A NZ ASP 257.A OD2 no hydrogen 3.026 N/A MET 262.A N LEU 258.A O no hydrogen 2.989 N/A MET 262.A N LEU 259.A O no hydrogen 3.316 N/A LEU 263.A N LEU 259.A O no hydrogen 2.927 N/A ASP 268.A N ASP 266.A OD1 no hydrogen 3.119 N/A LYS 269.A N ASP 266.A O no hydrogen 3.044 N/A ARG 270.A N SER 267.A O no hydrogen 3.497 N/A ARG 270.A NE VAL 264.A O no hydrogen 2.614 N/A ARG 270.A NH1 GLU 170.A OE2 no hydrogen 3.020 N/A ARG 270.A NH1 THR 181.A O no hydrogen 3.071 N/A ARG 270.A NH2 GLU 170.A OE1 no hydrogen 2.812 N/A ARG 270.A NH2 GLU 170.A OE2 no hydrogen 3.479 N/A ARG 270.A NH2 VAL 264.A O no hydrogen 3.343 N/A ARG 270.A NH2 LEU 265.A O no hydrogen 3.033 N/A ILE 271.A N LYS 261.A O no hydrogen 3.012 N/A THR 272.A N GLN 275.A OE1 no hydrogen 3.090 N/A GLN 275.A N THR 272.A OG1 no hydrogen 2.997 N/A ALA 276.A N THR 272.A O no hydrogen 2.854 N/A LEU 277.A N ALA 273.A O no hydrogen 2.925 N/A ALA 278.A N GLN 275.A O no hydrogen 3.311 N/A HIS 279.A N ALA 276.A O no hydrogen 3.074 N/A HIS 279.A NE2 ASP 257.A OD2 no hydrogen 2.566 N/A TYR 281.A N HIS 279.A ND1 no hydrogen 3.250 N/A TYR 281.A OH ASP 115.A OD1 no hydrogen 2.640 N/A PHE 282.A N HIS 279.A O no hydrogen 3.070 N/A ALA 283.A N ALA 280.A O no hydrogen 3.053 N/A TYR 285.A N PHE 282.A O no hydrogen 2.917 N/A TYR 285.A OH ASP 116.A OD1 no hydrogen 2.540 N/A HIS 286.A N PHE 282.A O no hydrogen 2.770 N/A HIS 286.A ND1 GLU 291.A OE2 no hydrogen 2.885 N/A ASP 287.A N GLU 291.A OE2 no hydrogen 3.076 N/A ASP 290.A N ASP 287.A O no hydrogen 2.848 N/A ALA 294.A N SER 134.A OG no hydrogen 2.794 N/A GLN 299.A NE2 ASP 136.A O no hydrogen 2.670 N/A SER 300.A N ASP 298.A OD1 no hydrogen 2.855 N/A SER 300.A OG ASP 298.A OD1 no hydrogen 2.670 N/A SER 300.A OG ASP 298.A OD2 no hydrogen 3.438 N/A GLU 302.A N GLN 299.A O no hydrogen 3.169 N/A SER 303.A N SER 300.A O no hydrogen 3.461 N/A SER 303.A OG SER 300.A O no hydrogen 2.944 N/A ARG 304.A N PHE 301.A O no hydrogen 2.928 N/A LEU 307.A N GLU 310.A OE1 no hydrogen 3.030 N/A GLU 310.A N LEU 307.A O no hydrogen 3.179 N/A TRP 311.A N LEU 307.A O no hydrogen 3.151 N/A LYS 312.A N ILE 308.A O no hydrogen 2.802 N/A LYS 312.A NZ PHE 94.A O no hydrogen 2.940 N/A SER 313.A N ASP 309.A O no hydrogen 2.967 N/A LEU 314.A N GLU 310.A O no hydrogen 2.978 N/A THR 315.A N TRP 311.A O no hydrogen 2.936 N/A THR 315.A OG1 TRP 311.A O no hydrogen 2.641 N/A TYR 316.A N LYS 312.A O no hydrogen 2.981 N/A ASP 317.A N SER 313.A O no hydrogen 2.944 N/A GLU 318.A N LEU 314.A O no hydrogen 3.201 N/A VAL 319.A N THR 315.A O no hydrogen 3.065 N/A ILE 320.A N TYR 316.A O no hydrogen 3.028 N/A SER 321.A N ASP 317.A O no hydrogen 2.907 N/A SER 321.A OG ASP 317.A O no hydrogen 2.991 N/A SER 321.A OG GLU 318.A O no hydrogen 3.461 N/A PHE 322.A N VAL 319.A O no hydrogen 3.425 N/A