Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1isn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 PHE 5.A O no hydrogen 3.180 N/A THR 4.A OG1 CYS 20.A O no hydrogen 2.537 N/A PHE 5.A N CYS 20.A O no hydrogen 3.147 N/A THR 6.A N GLU 73.A OE1 no hydrogen 2.981 N/A THR 6.A OG1 GLU 73.A OE1 no hydrogen 2.963 N/A VAL 7.A N PHE 18.A O no hydrogen 2.966 N/A ARG 8.A N VAL 75.A O no hydrogen 2.761 N/A ILE 9.A N MET 16.A O no hydrogen 2.638 N/A VAL 10.A N PHE 77.A O no hydrogen 3.013 N/A THR 11.A N ALA 14.A O no hydrogen 2.992 N/A THR 11.A OG1 ASP 13.A OD1 no hydrogen 3.125 N/A ALA 14.A N THR 11.A OG1 no hydrogen 2.843 N/A MET 16.A N ILE 9.A O no hydrogen 2.842 N/A PHE 18.A N VAL 7.A O no hydrogen 2.588 N/A ASN 19.A ND2 PHE 5.A O no hydrogen 3.330 N/A ASN 19.A ND2 PHE 18.A O no hydrogen 3.553 N/A CYS 20.A SG GLU 21.A O no hydrogen 3.229 N/A TRP 24.A N GLU 21.A O no hydrogen 3.234 N/A LYS 25.A N ASP 28.A OD1 no hydrogen 3.093 N/A GLY 26.A N LYS 62.A O no hydrogen 3.176 N/A LEU 29.A N LYS 25.A O no hydrogen 3.090 N/A PHE 30.A N GLY 26.A O no hydrogen 2.922 N/A ASP 31.A N LYS 27.A O no hydrogen 2.890 N/A LEU 32.A N ASP 28.A O no hydrogen 3.240 N/A VAL 33.A N LEU 29.A O no hydrogen 2.970 N/A CYS 34.A N PHE 30.A O no hydrogen 2.810 N/A CYS 34.A SG PHE 30.A O no hydrogen 3.673 N/A ARG 35.A N ASP 31.A O no hydrogen 2.837 N/A ARG 35.A NE ASP 31.A O no hydrogen 3.487 N/A THR 36.A N LEU 32.A O no hydrogen 3.158 N/A THR 36.A OG1 VAL 33.A O no hydrogen 3.533 N/A LEU 37.A N CYS 34.A O no hydrogen 3.277 N/A GLY 38.A N ARG 35.A O no hydrogen 2.773 N/A LEU 39.A N CYS 34.A O no hydrogen 3.112 N/A ARG 40.A N GLN 94.A OE1 no hydrogen 2.765 N/A ARG 40.A NH1 GLN 307.A OE1 no hydrogen 3.363 N/A ARG 40.A NH2 GLU 300.A OE2 no hydrogen 2.882 N/A GLU 41.A N GLN 94.A OE1 no hydrogen 3.235 N/A PHE 45.A N THR 42.A O no hydrogen 2.950 N/A GLY 46.A N LEU 80.A O no hydrogen 3.053 N/A GLN 48.A N HIS 78.A O no hydrogen 2.734 N/A LEU 58.A N LEU 47.A O no hydrogen 2.907 N/A LYS 59.A N HIS 67.A NE2 no hydrogen 2.819 N/A LYS 59.A NZ TRP 57.A O no hydrogen 3.032 N/A VAL 64.A N TRP 24.A O no hydrogen 3.164 N/A HIS 67.A N LYS 63.A O no hydrogen 3.384 N/A HIS 67.A ND1 LYS 63.A O no hydrogen 2.535 N/A VAL 69.A N HIS 67.A O no hydrogen 2.560 N/A LYS 71.A NZ LEU 65.A O no hydrogen 2.619 N/A LYS 71.A NZ HIS 67.A O no hydrogen 3.399 N/A VAL 75.A N THR 6.A O no hydrogen 3.301 N/A THR 76.A OG1 PRO 74.A O no hydrogen 3.151 N/A PHE 77.A N ARG 8.A O no hydrogen 3.059 N/A HIS 78.A N GLN 48.A O no hydrogen 2.946 N/A PHE 79.A N VAL 10.A O no hydrogen 2.782 N/A LEU 80.A N GLY 46.A O no hydrogen 3.168 N/A ALA 81.A N GLN 104.A OE1 no hydrogen 3.105 N/A LYS 82.A N PHE 44.A O no hydrogen 2.593 N/A LYS 82.A NZ GLN 281.A OE1 no hydrogen 3.293 N/A PHE 83.A N PHE 44.A O no hydrogen 2.806 N/A GLU 86.A N GLU 91.A OE2 no hydrogen 3.193 N/A ASN 87.A N GLU 91.A OE2 no hydrogen 3.275 N/A ASN 87.A ND2 GLN 195.A OE1 no hydrogen 3.401 N/A ALA 88.A N GLN 195.A OE1 no hydrogen 2.571 N/A GLU 90.A N ASN 87.A O no hydrogen 2.859 N/A GLU 91.A N ASN 87.A O no hydrogen 2.810 N/A GLU 91.A N ALA 88.A O no hydrogen 3.146 N/A LEU 92.A N ALA 88.A O no hydrogen 2.857 N/A VAL 93.A N GLU 41.A OE1 no hydrogen 2.871 N/A VAL 93.A N GLU 41.A OE2 no hydrogen 3.355 N/A GLN 94.A N GLU 41.A OE1 no hydrogen 2.984 N/A GLN 94.A NE2 GLY 38.A O no hydrogen 3.150 N/A THR 97.A OG1 GLU 41.A OE1 no hydrogen 2.903 N/A GLN 98.A N GLN 94.A O no hydrogen 2.988 N/A GLN 98.A NE2 LEU 92.A O no hydrogen 3.129 N/A HIS 99.A N GLU 95.A O no hydrogen 2.660 N/A HIS 99.A ND1 GLU 187.A OE2 no hydrogen 2.657 N/A LEU 100.A N ILE 96.A O no hydrogen 3.079 N/A PHE 101.A N THR 97.A O no hydrogen 3.145 N/A PHE 101.A N GLN 98.A O no hydrogen 3.190 N/A PHE 102.A N GLN 98.A O no hydrogen 2.820 N/A LEU 103.A N HIS 99.A O no hydrogen 2.985 N/A GLN 104.A NE2 ALA 81.A O no hydrogen 3.185 N/A GLN 104.A NE2 TYR 84.A OH no hydrogen 3.549 N/A VAL 105.A N PHE 101.A O no hydrogen 2.958 N/A LYS 106.A N PHE 102.A O no hydrogen 2.955 N/A LYS 107.A N LEU 103.A O no hydrogen 3.141 N/A GLN 108.A N GLN 104.A O no hydrogen 3.084 N/A GLN 108.A NE2 TYR 84.A OH no hydrogen 2.617 N/A ILE 109.A N VAL 105.A O no hydrogen 2.736 N/A LEU 110.A N LYS 106.A O no hydrogen 2.817 N/A ASP 111.A N LYS 107.A O no hydrogen 2.875 N/A GLU 112.A N ILE 109.A O no hydrogen 2.803 N/A LYS 113.A N GLN 108.A O no hydrogen 2.743 N/A LYS 113.A NZ ASP 111.A OD2 no hydrogen 3.223 N/A VAL 114.A N GLN 108.A O no hydrogen 3.091 N/A CYS 116.A SG PRO 117.A O no hydrogen 3.507 N/A SER 121.A N PRO 117.A O no hydrogen 2.991 N/A SER 121.A OG PRO 117.A O no hydrogen 3.300 N/A SER 121.A OG PRO 118.A O no hydrogen 2.694 N/A VAL 122.A N PRO 118.A O no hydrogen 3.009 N/A LEU 123.A N GLU 119.A O no hydrogen 3.037 N/A LEU 124.A N ALA 120.A O no hydrogen 2.681 N/A ALA 125.A N SER 121.A O no hydrogen 2.732 N/A SER 126.A N VAL 122.A O no hydrogen 2.932 N/A SER 126.A OG LEU 123.A O no hydrogen 2.482 N/A SER 126.A OG HIS 178.A NE2 no hydrogen 2.599 N/A TYR 127.A N LEU 123.A O no hydrogen 3.146 N/A TYR 127.A N LEU 124.A O no hydrogen 2.800 N/A ALA 128.A N LEU 124.A O no hydrogen 2.995 N/A VAL 129.A N ALA 125.A O no hydrogen 3.205 N/A GLN 130.A N TYR 127.A O no hydrogen 3.061 N/A GLN 130.A NE2 ARG 181.A O no hydrogen 3.121 N/A ALA 131.A N TYR 127.A O no hydrogen 3.149 N/A LYS 132.A N ALA 128.A O no hydrogen 3.171 N/A LYS 132.A NZ GLU 149.A OE2 no hydrogen 2.947 N/A TYR 133.A N VAL 129.A O no hydrogen 2.804 N/A TYR 133.A OH GLU 149.A OE2 no hydrogen 2.891 N/A GLY 134.A N GLN 130.A O no hydrogen 3.038 N/A SER 139.A N ASP 137.A OD1 no hydrogen 3.050 N/A VAL 140.A N ASP 137.A OD1 no hydrogen 3.181 N/A HIS 141.A N ASP 137.A O no hydrogen 2.673 N/A LYS 142.A NZ SER 139.A O no hydrogen 3.200 N/A ARG 143.A NE GLU 169.A OE2 no hydrogen 3.158 N/A ARG 143.A NH2 GLU 169.A OE2 no hydrogen 3.512 N/A PHE 145.A N LYS 142.A O no hydrogen 3.146 N/A LEU 146.A N GLU 168.A OE2 no hydrogen 2.762 N/A ALA 147.A N GLY 144.A O no hydrogen 2.821 N/A LEU 159.A N VAL 156.A O no hydrogen 3.063 N/A MET 162.A N LEU 159.A O no hydrogen 3.187 N/A MET 166.A N THR 163.A O no hydrogen 2.773 N/A TRP 167.A N THR 163.A O no hydrogen 3.207 N/A TRP 167.A N PRO 164.A O no hydrogen 3.306 N/A GLU 169.A N MET 166.A O no hydrogen 2.948 N/A ARG 170.A N MET 166.A O no hydrogen 3.347 N/A ARG 170.A NH2 GLU 119.A OE1 no hydrogen 3.064 N/A ILE 171.A N TRP 167.A O no hydrogen 3.024 N/A THR 172.A N GLU 168.A O no hydrogen 2.976 N/A THR 172.A OG1 GLU 168.A O no hydrogen 2.397 N/A ALA 173.A N GLU 169.A O no hydrogen 2.679 N/A TYR 175.A N ILE 171.A O no hydrogen 2.953 N/A TYR 175.A OH GLY 134.A O no hydrogen 2.486 N/A TYR 175.A OH HIS 141.A NE2 no hydrogen 2.972 N/A ALA 176.A N THR 172.A O no hydrogen 3.072 N/A GLU 177.A N TRP 174.A O no hydrogen 2.543 N/A HIS 178.A N TRP 174.A O no hydrogen 3.206 N/A HIS 178.A N TYR 175.A O no hydrogen 3.028 N/A HIS 178.A NE2 SER 126.A OG no hydrogen 2.599 N/A ARG 179.A N ALA 176.A O no hydrogen 3.378 N/A GLY 180.A N ASP 135.A OD1 no hydrogen 2.632 N/A ARG 181.A N HIS 178.A O no hydrogen 3.182 N/A ARG 181.A NH1 GLU 185.A OE2 no hydrogen 2.711 N/A ARG 183.A NE GLU 187.A OE2 no hydrogen 3.248 N/A ALA 186.A N ALA 182.A O no hydrogen 2.773 N/A GLU 187.A N ARG 183.A O no hydrogen 3.123 N/A MET 188.A N ASP 184.A O no hydrogen 3.206 N/A GLU 189.A N GLU 185.A O no hydrogen 3.106 N/A TYR 190.A N ALA 186.A O no hydrogen 3.027 N/A LEU 191.A N GLU 187.A O no hydrogen 3.116 N/A LYS 192.A N MET 188.A O no hydrogen 2.885 N/A LYS 192.A NZ GLU 89.A OE2 no hydrogen 2.872 N/A LYS 192.A NZ GLU 189.A OE1 no hydrogen 3.519 N/A LYS 192.A NZ GLU 189.A OE2 no hydrogen 2.928 N/A ILE 193.A N GLU 189.A O no hydrogen 3.311 N/A ALA 194.A N TYR 190.A O no hydrogen 3.000 N/A GLN 195.A N LEU 191.A O no hydrogen 2.726 N/A GLN 195.A NE2 LYS 192.A O no hydrogen 3.417 N/A LEU 197.A N ALA 194.A O no hydrogen 3.031 N/A TYR 200.A N LEU 197.A O no hydrogen 3.288 N/A ASN 203.A N VAL 219.A O no hydrogen 2.821 N/A TYR 204.A OH ARG 232.A O no hydrogen 2.652 N/A PHE 205.A N LEU 217.A O no hydrogen 2.709 N/A ARG 208.A N ASN 269.A O no hydrogen 2.823 N/A ASN 209.A N THR 213.A O no hydrogen 3.123 N/A ASN 209.A ND2 THR 213.A O no hydrogen 3.025 N/A LYS 211.A N ASN 209.A OD1 no hydrogen 3.307 N/A GLY 212.A N ASN 209.A O no hydrogen 2.728 N/A LEU 215.A N ILE 207.A O no hydrogen 3.056 N/A LEU 217.A N PHE 205.A O no hydrogen 2.612 N/A GLY 218.A N HIS 225.A O no hydrogen 2.752 N/A VAL 219.A N ASN 203.A O no hydrogen 2.877 N/A ASP 220.A N GLY 223.A O no hydrogen 3.465 N/A LEU 222.A N ASP 220.A OD1 no hydrogen 3.236 N/A GLY 223.A N ASP 220.A OD1 no hydrogen 2.974 N/A LEU 224.A N PHE 239.A O no hydrogen 2.613 N/A HIS 225.A N GLY 218.A O no hydrogen 2.725 N/A HIS 225.A ND1 SER 238.A OG no hydrogen 3.132 N/A HIS 225.A NE2 ASP 220.A OD1 no hydrogen 2.946 N/A ILE 226.A N ILE 237.A O no hydrogen 3.148 N/A TYR 227.A N LEU 216.A O no hydrogen 2.763 N/A GLU 230.A N ASP 228.A OD1 no hydrogen 3.192 N/A ASN 231.A N ASP 228.A O no hydrogen 2.675 N/A LYS 236.A N ILE 226.A O no hydrogen 2.951 N/A ILE 237.A N ILE 226.A O no hydrogen 3.491 N/A SER 238.A OG HIS 225.A ND1 no hydrogen 3.132 N/A PHE 239.A N LEU 224.A O no hydrogen 2.711 N/A TRP 241.A NE1 ASP 220.A O no hydrogen 2.836 N/A GLU 243.A N PRO 240.A O no hydrogen 2.970 N/A ILE 244.A N PRO 240.A O no hydrogen 3.126 N/A ARG 245.A N LYS 257.A O no hydrogen 2.929 N/A ASN 246.A N LYS 257.A O no hydrogen 3.209 N/A GLU 253.A N SER 250.A O no hydrogen 3.115 N/A PHE 254.A N PHE 268.A O no hydrogen 2.849 N/A THR 255.A N SER 248.A O no hydrogen 3.111 N/A LYS 257.A N ASN 246.A O no hydrogen 2.799 N/A LEU 259.A N GLU 243.A O no hydrogen 2.818 N/A ILE 263.A N ASP 260.A O no hydrogen 2.938 N/A PHE 266.A N ILE 256.A O no hydrogen 3.269 N/A PHE 268.A N PHE 254.A O no hydrogen 2.837 N/A ASN 269.A N ARG 208.A O no hydrogen 2.655 N/A ASN 269.A ND2 LYS 252.A O no hydrogen 3.016 N/A SER 270.A N LYS 252.A O no hydrogen 3.413 N/A SER 270.A OG THR 206.A O no hydrogen 3.246 N/A ARG 274.A NH2 ASP 68.A OD1 no hydrogen 3.151 N/A ASN 276.A N LYS 272.A O no hydrogen 2.932 N/A ASN 276.A ND2 SER 270.A O no hydrogen 3.424 N/A ASN 276.A ND2 LYS 272.A O no hydrogen 2.659 N/A LYS 277.A N ARG 274.A O no hydrogen 2.932 N/A LEU 278.A N ARG 274.A O no hydrogen 2.867 N/A ILE 279.A N VAL 275.A O no hydrogen 2.759 N/A GLN 281.A N LYS 277.A O no hydrogen 2.894 N/A LEU 282.A N LEU 278.A O no hydrogen 2.913 N/A CYS 283.A N ILE 279.A O no hydrogen 2.968 N/A CYS 283.A N LEU 280.A O no hydrogen 2.908 N/A CYS 283.A SG ILE 279.A O no hydrogen 3.152 N/A ILE 284.A N LEU 280.A O no hydrogen 3.262 N/A GLY 285.A N GLN 281.A O no hydrogen 3.094 N/A ASN 286.A N LEU 282.A O no hydrogen 3.025 N/A HIS 287.A N CYS 283.A O no hydrogen 2.911 N/A HIS 287.A ND1 ASP 288.A OD1 no hydrogen 3.298 N/A ASP 288.A N ILE 284.A O no hydrogen 2.986 N/A ASP 288.A N GLY 285.A O no hydrogen 3.072 N/A LEU 289.A N GLY 285.A O no hydrogen 3.321 N/A PHE 290.A N ASN 286.A O no hydrogen 3.080 N/A MET 291.A N HIS 287.A O no hydrogen 3.242 N/A ARG 292.A N ASP 288.A O no hydrogen 2.591 N/A ARG 293.A N LEU 289.A O no hydrogen 2.739 N/A ARG 293.A NH1 GLU 91.A OE1 no hydrogen 2.759 N/A ARG 294.A N PHE 290.A O no hydrogen 3.438 N/A ARG 294.A NH1 GLU 86.A OE2 no hydrogen 2.787 N/A ARG 294.A NH2 GLU 86.A OE1 no hydrogen 3.392 N/A ARG 294.A NH2 GLU 86.A OE2 no hydrogen 3.211 N/A LYS 295.A N MET 291.A O no hydrogen 3.291 N/A VAL 301.A N SER 298.A O no hydrogen 2.789 N/A VAL 301.A N SER 298.A OG no hydrogen 3.406 N/A GLN 302.A N SER 298.A O no hydrogen 2.800 N/A GLN 303.A N LEU 299.A O no hydrogen 2.999 N/A LYS 305.A N VAL 301.A O no hydrogen 3.027 N/A LYS 305.A NZ GLU 90.A O no hydrogen 3.467 N/A LYS 305.A NZ GLU 90.A OE2 no hydrogen 2.918 N/A LYS 305.A NZ ASP 297.A OD2 no hydrogen 3.192 N/A ALA 306.A N GLN 302.A O no hydrogen 3.308 N/A GLN 307.A N GLN 303.A O no hydrogen 2.944 N/A ALA 308.A N MET 304.A O no hydrogen 3.090 N/A ARG 309.A N LYS 305.A O no hydrogen 3.070 N/A GLU 310.A N ALA 306.A O no hydrogen 2.876 N/A GLU 311.A N GLN 307.A O no hydrogen 2.841 N/A ALA 313.A N ARG 309.A O no hydrogen 3.468 N/A ARG 314.A N GLU 310.A O no hydrogen 3.133 N/A GLN 316.A N LYS 312.A O no hydrogen 2.998 N/A MET 317.A N ALA 313.A O no hydrogen 2.703 N/A GLU 318.A N ARG 314.A O no hydrogen 2.974 N/A GLN 320.A N GLN 316.A O no hydrogen 3.312 N/A ARG 321.A N MET 317.A O no hydrogen 2.863 N/A