Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3b5i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ALA 1.A O no hydrogen 3.387 N/A MET 7.A N HIS 3.A O no hydrogen 2.986 N/A LEU 8.A N ALA 4.A O no hydrogen 2.809 N/A HIS 9.A N SER 6.A O no hydrogen 3.279 N/A LEU 11.A N MET 7.A O no hydrogen 3.379 N/A GLU 12.A N LEU 8.A O no hydrogen 3.064 N/A GLU 13.A N HIS 9.A O no hydrogen 2.962 N/A THR 14.A N LEU 10.A O no hydrogen 3.139 N/A THR 14.A OG1 LEU 10.A O no hydrogen 3.239 N/A THR 14.A OG1 SER 340.A OG no hydrogen 2.618 N/A LEU 15.A N LEU 11.A O no hydrogen 2.985 N/A GLU 16.A N GLU 12.A O no hydrogen 3.063 N/A GLU 16.A N GLU 13.A O no hydrogen 3.269 N/A ASN 17.A N THR 14.A O no hydrogen 3.031 N/A HIS 19.A N GLY 188.A O no hydrogen 2.746 N/A SER 25.A N SER 23.A OG no hydrogen 2.815 N/A PHE 29.A N GLU 66.A O no hydrogen 2.788 N/A THR 30.A N ASP 122.A OD2 no hydrogen 2.461 N/A ALA 31.A N THR 68.A O no hydrogen 3.093 N/A VAL 32.A N PHE 123.A O no hydrogen 2.852 N/A ASP 33.A N PHE 70.A O no hydrogen 2.851 N/A LEU 34.A N HIS 125.A O no hydrogen 2.595 N/A GLY 35.A N SER 72.A O no hydrogen 2.711 N/A CYS 36.A N SER 72.A O no hydrogen 2.950 N/A CYS 36.A SG SER 37.A O no hydrogen 3.667 N/A CYS 36.A SG SER 72.A O no hydrogen 3.602 N/A THR 42.A OG1 ASP 33.A OD2 no hydrogen 2.634 N/A HIS 44.A N ALA 40.A O no hydrogen 3.066 N/A ILE 45.A N ASN 41.A O no hydrogen 3.252 N/A ILE 46.A N THR 42.A O no hydrogen 3.281 N/A ASP 47.A N VAL 43.A O no hydrogen 2.879 N/A PHE 48.A N HIS 44.A O no hydrogen 2.807 N/A ILE 49.A N ILE 45.A O no hydrogen 2.707 N/A VAL 50.A N ILE 46.A O no hydrogen 2.972 N/A LYS 51.A N ASP 47.A O no hydrogen 3.015 N/A HIS 52.A N PHE 48.A O no hydrogen 3.156 N/A HIS 52.A N ILE 49.A O no hydrogen 3.055 N/A ILE 53.A N ILE 49.A O no hydrogen 3.072 N/A SER 54.A N VAL 50.A O no hydrogen 2.874 N/A SER 54.A OG VAL 50.A O no hydrogen 2.685 N/A LYS 55.A N LYS 51.A O no hydrogen 3.048 N/A ARG 56.A N HIS 52.A O no hydrogen 2.958 N/A ARG 56.A NH2 LEU 15.A O no hydrogen 2.872 N/A ARG 56.A NH2 VAL 18.A O no hydrogen 2.546 N/A PHE 57.A N ILE 53.A O no hydrogen 3.121 N/A ASP 58.A N SER 54.A O no hydrogen 2.970 N/A ALA 59.A N LYS 55.A O no hydrogen 3.122 N/A ALA 60.A N PHE 57.A O no hydrogen 2.957 N/A GLY 61.A N ASP 58.A O no hydrogen 2.978 N/A ILE 62.A N PHE 57.A O no hydrogen 3.009 N/A THR 68.A N PHE 29.A O no hydrogen 2.987 N/A ALA 69.A N PHE 103.A O no hydrogen 2.801 N/A PHE 70.A N ALA 31.A O no hydrogen 2.832 N/A PHE 71.A N ALA 105.A O no hydrogen 2.797 N/A SER 72.A N ASP 33.A O no hydrogen 2.990 N/A ASP 73.A N VAL 107.A O no hydrogen 3.131 N/A LEU 74.A N ASP 73.A OD2 no hydrogen 2.604 N/A ASN 77.A N LEU 74.A O no hydrogen 2.816 N/A ASN 77.A ND2 SER 37.A O no hydrogen 3.024 N/A THR 81.A N ASP 78.A OD2 no hydrogen 3.284 N/A THR 81.A OG1 ASP 78.A OD1 no hydrogen 2.529 N/A LEU 82.A N ASP 78.A O no hydrogen 3.081 N/A PHE 83.A N PHE 79.A O no hydrogen 2.669 N/A GLN 84.A N ASN 80.A O no hydrogen 3.336 N/A GLN 84.A N THR 81.A O no hydrogen 3.044 N/A GLN 84.A NE2 ASN 80.A O no hydrogen 3.169 N/A LEU 85.A N THR 81.A O no hydrogen 3.367 N/A LEU 85.A N LEU 82.A O no hydrogen 3.115 N/A LEU 86.A N PHE 83.A O no hydrogen 3.373 N/A VAL 90.A N ARG 100.A O no hydrogen 3.135 N/A CYS 96.A SG GLU 95.A O no hydrogen 3.349 N/A ASN 99.A ND2 ARG 100.A O no hydrogen 3.195 N/A ARG 100.A NE PRO 87.A O no hydrogen 2.656 N/A ARG 100.A NH1 TYR 102.A O no hydrogen 3.002 N/A ARG 100.A NH2 PRO 87.A O no hydrogen 3.139 N/A PHE 103.A N PHE 67.A O no hydrogen 2.734 N/A VAL 107.A N PHE 71.A O no hydrogen 2.796 N/A GLY 109.A N ASP 73.A O no hydrogen 3.066 N/A TYR 112.A N SER 110.A OG no hydrogen 3.348 N/A TYR 112.A OH LEU 130.A O no hydrogen 3.413 N/A TYR 112.A OH TRP 132.A O no hydrogen 2.637 N/A ARG 114.A NE PHE 116.A O no hydrogen 3.373 N/A ARG 114.A NE GLU 184.A OE2 no hydrogen 3.091 N/A ARG 114.A NH2 PHE 116.A O no hydrogen 2.916 N/A LEU 115.A N GLU 184.A OE2 no hydrogen 2.640 N/A PHE 116.A N GLU 184.A OE2 no hydrogen 2.669 N/A ARG 119.A N ALA 183.A O no hydrogen 2.770 N/A ARG 119.A NH1 ALA 182.A O no hydrogen 2.792 N/A ARG 119.A NH1 VAL 185.A O no hydrogen 2.678 N/A THR 120.A N GLU 184.A O no hydrogen 2.842 N/A THR 120.A OG1 PRO 117.A O no hydrogen 2.747 N/A ILE 121.A N GLU 184.A O no hydrogen 2.934 N/A ASP 122.A N THR 30.A O no hydrogen 3.018 N/A PHE 123.A N THR 30.A O no hydrogen 3.131 N/A PHE 124.A N ALA 190.A O no hydrogen 3.361 N/A HIS 125.A N VAL 32.A O no hydrogen 2.745 N/A SER 126.A N PHE 192.A O no hydrogen 3.179 N/A SER 126.A OG LEU 34.A O no hydrogen 3.451 N/A PHE 128.A N VAL 194.A O no hydrogen 2.622 N/A SER 129.A OG GLY 35.A O no hydrogen 3.276 N/A SER 129.A OG ALA 127.A O no hydrogen 2.794 N/A TRP 132.A N SER 129.A O no hydrogen 3.130 N/A LEU 133.A N PRO 241.A O no hydrogen 2.845 N/A SER 134.A N ASP 173.A OD1 no hydrogen 2.758 N/A SER 134.A OG ASP 173.A OD1 no hydrogen 3.280 N/A SER 134.A OG ASP 173.A OD2 no hydrogen 2.640 N/A GLN 135.A NE2 VAL 136.A O no hydrogen 2.938 N/A VAL 140.A N PRO 137.A O no hydrogen 2.949 N/A THR 141.A N GLU 138.A O no hydrogen 3.104 N/A THR 141.A OG1 GLU 138.A O no hydrogen 2.671 N/A ASP 142.A N SER 139.A O no hydrogen 3.385 N/A ARG 144.A N ASP 142.A OD2 no hydrogen 3.165 N/A SER 145.A N ASP 142.A O no hydrogen 3.026 N/A TYR 148.A N SER 145.A O no hydrogen 3.362 N/A ASN 149.A ND2 PHE 154.A O no hydrogen 2.735 N/A GLY 151.A N ASP 236.A OD2 no hydrogen 2.611 N/A THR 162.A OG1 ALA 147.A O no hydrogen 2.974 N/A THR 163.A N GLY 159.A O no hydrogen 2.676 N/A THR 163.A OG1 GLY 159.A O no hydrogen 3.309 N/A THR 163.A OG1 GLU 160.A O no hydrogen 3.056 N/A THR 164.A N GLU 160.A O no hydrogen 2.927 N/A THR 164.A OG1 GLU 160.A O no hydrogen 2.961 N/A THR 164.A OG1 GLU 160.A OE1 no hydrogen 3.521 N/A TYR 166.A N THR 162.A O no hydrogen 3.399 N/A TYR 166.A OH ILE 240.A O no hydrogen 2.685 N/A LYS 167.A N THR 163.A O no hydrogen 3.203 N/A LYS 167.A NZ ASP 249.A OD1 no hydrogen 3.117 N/A ARG 168.A N THR 164.A O no hydrogen 3.335 N/A GLN 169.A N ALA 165.A O no hydrogen 3.085 N/A GLN 169.A NE2 GLN 169.A O no hydrogen 3.427 N/A GLN 169.A NE2 ASP 173.A OD2 no hydrogen 3.066 N/A PHE 170.A N TYR 166.A O no hydrogen 2.740 N/A GLN 171.A N LYS 167.A O no hydrogen 2.781 N/A GLN 171.A NE2 ASP 249.A O no hydrogen 3.274 N/A GLN 171.A NE2 GLU 252.A OE1 no hydrogen 3.458 N/A ALA 172.A N ARG 168.A O no hydrogen 2.880 N/A ASP 173.A N GLN 169.A O no hydrogen 2.992 N/A LEU 174.A N PHE 170.A O no hydrogen 2.784 N/A ALA 175.A N ALA 172.A O no hydrogen 3.044 N/A GLU 176.A N ALA 172.A O no hydrogen 2.944 N/A PHE 177.A N ASP 173.A O no hydrogen 2.910 N/A LEU 178.A N LEU 174.A O no hydrogen 3.144 N/A ARG 179.A N ALA 175.A O no hydrogen 2.954 N/A ALA 180.A N GLU 176.A O no hydrogen 2.857 N/A ARG 181.A N PHE 177.A O no hydrogen 2.804 N/A ARG 181.A NE GLU 184.A OE1 no hydrogen 3.108 N/A ARG 181.A NH1 PHE 111.A O no hydrogen 2.842 N/A ARG 181.A NH2 ARG 113.A O no hydrogen 3.355 N/A ARG 181.A NH2 GLU 184.A OE1 no hydrogen 2.797 N/A ALA 182.A N LEU 178.A O no hydrogen 2.775 N/A ALA 183.A N ARG 179.A O no hydrogen 3.220 N/A GLU 184.A N ARG 181.A O no hydrogen 2.829 N/A VAL 185.A N ARG 181.A O no hydrogen 2.951 N/A LYS 186.A N ILE 121.A O no hydrogen 2.757 N/A LYS 186.A NZ THR 120.A O no hydrogen 3.123 N/A LYS 186.A NZ ASP 122.A OD2 no hydrogen 3.561 N/A GLY 189.A N LYS 186.A O no hydrogen 3.186 N/A ALA 190.A N ASP 122.A O no hydrogen 3.243 N/A MET 191.A N LEU 341.A O no hydrogen 2.646 N/A PHE 192.A N PHE 124.A O no hydrogen 3.120 N/A LEU 193.A N ALA 339.A O no hydrogen 2.713 N/A VAL 194.A N SER 126.A O no hydrogen 3.135 N/A CYS 195.A N ILE 337.A O no hydrogen 3.152 N/A CYS 195.A SG LEU 196.A O no hydrogen 3.876 N/A GLY 197.A N PHE 335.A O no hydrogen 2.686 N/A ARG 198.A N PRO 245.A O no hydrogen 2.978 N/A ARG 198.A NE ALA 244.A O no hydrogen 3.020 N/A ARG 198.A NH1 SER 200.A O no hydrogen 2.851 N/A SER 200.A OG ASP 202.A O no hydrogen 2.879 N/A ASP 202.A N SER 200.A OG no hydrogen 3.163 N/A THR 204.A N ASP 202.A OD1 no hydrogen 3.086 N/A THR 204.A OG1 HIS 156.A O no hydrogen 3.348 N/A THR 204.A OG1 GLY 157.A O no hydrogen 3.242 N/A ASP 205.A N ASP 202.A O no hydrogen 2.800 N/A GLN 206.A NE2 PRO 203.A O no hydrogen 2.945 N/A GLN 206.A NE2 ALA 244.A O no hydrogen 3.695 N/A GLY 207.A N ASP 205.A OD1 no hydrogen 3.385 N/A GLY 210.A N GLN 206.A O no hydrogen 3.014 N/A LEU 211.A N GLY 207.A O no hydrogen 3.118 N/A LEU 212.A N GLY 208.A O no hydrogen 2.944 N/A PHE 213.A N ALA 209.A O no hydrogen 3.072 N/A GLY 214.A N GLY 210.A O no hydrogen 2.855 N/A ASP 219.A N THR 215.A O no hydrogen 3.149 N/A ALA 220.A N HIS 216.A O no hydrogen 2.974 N/A TRP 221.A N PHE 217.A O no hydrogen 3.466 N/A ASP 222.A N ASP 219.A O no hydrogen 3.116 N/A ASP 223.A N ALA 220.A O no hydrogen 3.006 N/A LEU 224.A N ALA 220.A O no hydrogen 3.036 N/A ARG 226.A N ASP 222.A O no hydrogen 3.170 N/A ARG 226.A NH2 ASP 223.A OD1 no hydrogen 3.356 N/A ARG 235.A NE ASP 236.A OD2 no hydrogen 3.195 N/A ASP 236.A N ALA 232.A O no hydrogen 3.356 N/A GLY 237.A N LYS 234.A O no hydrogen 3.233 N/A PHE 238.A N ARG 235.A O no hydrogen 3.327 N/A ILE 240.A N VAL 153.A O no hydrogen 3.288 N/A VAL 242.A N ILE 240.A O no hydrogen 2.905 N/A TYR 243.A N HIS 131.A O no hydrogen 3.014 N/A TYR 243.A OH ASP 249.A OD2 no hydrogen 2.934 N/A ALA 244.A N GLN 206.A OE1 no hydrogen 2.871 N/A SER 246.A N ASP 249.A OD2 no hydrogen 3.018 N/A SER 246.A OG ASP 249.A OD2 no hydrogen 2.748 N/A PHE 250.A N SER 246.A O no hydrogen 3.081 N/A LYS 251.A N LEU 247.A O no hydrogen 2.770 N/A LYS 251.A NZ ASP 255.A OD2 no hydrogen 3.486 N/A GLU 252.A N GLN 248.A O no hydrogen 2.899 N/A VAL 253.A N PHE 250.A O no hydrogen 3.132 N/A VAL 254.A N PHE 250.A O no hydrogen 3.443 N/A ASP 255.A N LYS 251.A O no hydrogen 3.170 N/A ALA 256.A N VAL 254.A O no hydrogen 2.966 N/A ASN 257.A N VAL 253.A O no hydrogen 2.979 N/A ASN 257.A N VAL 254.A O no hydrogen 3.021 N/A GLY 258.A N VAL 254.A O no hydrogen 2.862 N/A SER 259.A N ASN 257.A OD1 no hydrogen 2.798 N/A ALA 261.A N SER 342.A O no hydrogen 2.584 N/A ASP 263.A N SER 340.A O no hydrogen 2.972 N/A LYS 264.A NZ GLU 13.A OE1 no hydrogen 3.033 N/A VAL 266.A N VAL 338.A O no hydrogen 3.116 N/A TYR 268.A N HIS 336.A O no hydrogen 3.224 N/A GLY 270.A N PHE 334.A O no hydrogen 3.182 N/A SER 272.A N LEU 332.A O no hydrogen 3.240 N/A SER 272.A OG GLY 271.A O no hydrogen 2.973 N/A SER 272.A OG SER 272.A O no hydrogen 2.416 N/A ASN 277.A N GLU 284.A OE1 no hydrogen 2.755 N/A GLU 278.A N GLU 284.A OE2 no hydrogen 2.811 N/A ASP 281.A N GLU 278.A O no hydrogen 3.110 N/A SER 283.A N ASP 281.A OD2 no hydrogen 3.162 N/A ARG 287.A N SER 283.A O no hydrogen 3.379 N/A ALA 288.A N GLU 284.A O no hydrogen 3.152 N/A PHE 289.A N VAL 285.A O no hydrogen 3.135 N/A ALA 290.A N GLY 286.A O no hydrogen 2.856 N/A SER 291.A N ARG 287.A O no hydrogen 2.707 N/A SER 292.A N ALA 288.A O no hydrogen 3.119 N/A SER 292.A OG ALA 288.A O no hydrogen 3.427 N/A CYS 293.A N PHE 289.A O no hydrogen 3.415 N/A CYS 293.A SG LEU 212.A O no hydrogen 3.520 N/A CYS 293.A SG PHE 289.A O no hydrogen 3.712 N/A ARG 294.A N ALA 290.A O no hydrogen 3.091 N/A ARG 294.A NH1 ASN 311.A OD1 no hydrogen 3.064 N/A ARG 294.A NH2 ASN 311.A OD1 no hydrogen 3.153 N/A SER 295.A N SER 291.A O no hydrogen 3.235 N/A SER 295.A OG SER 291.A O no hydrogen 2.578 N/A SER 295.A OG SER 292.A O no hydrogen 2.992 N/A VAL 296.A N SER 292.A O no hydrogen 2.960 N/A ALA 297.A N CYS 293.A O no hydrogen 3.106 N/A GLY 298.A N ARG 294.A O no hydrogen 2.825 N/A LEU 300.A N ALA 297.A O no hydrogen 3.094 N/A GLU 302.A N GLY 298.A O no hydrogen 3.428 N/A ALA 303.A N VAL 299.A O no hydrogen 3.269 N/A ALA 303.A N LEU 300.A O no hydrogen 3.253 N/A HIS 304.A N VAL 301.A O no hydrogen 3.243 N/A ILE 305.A N VAL 301.A O no hydrogen 2.717 N/A SER 310.A N GLY 306.A O no hydrogen 2.802 N/A SER 310.A OG GLU 302.A OE2 no hydrogen 3.184 N/A PHE 314.A N SER 310.A O no hydrogen 2.841 N/A ARG 316.A N LEU 313.A O no hydrogen 2.691 N/A ARG 316.A NE ASP 223.A OD2 no hydrogen 3.342 N/A ARG 316.A NH2 ASP 223.A OD2 no hydrogen 2.743 N/A VAL 317.A N LEU 313.A O no hydrogen 3.024 N/A SER 319.A N ARG 316.A O no hydrogen 3.108 N/A ARG 320.A N ARG 316.A O no hydrogen 2.703 N/A ARG 320.A NH2 ASP 219.A O no hydrogen 3.437 N/A ALA 321.A N VAL 317.A O no hydrogen 2.721 N/A THR 322.A OG1 SER 319.A O no hydrogen 3.087 N/A SER 323.A N SER 319.A O no hydrogen 3.450 N/A HIS 324.A N ARG 320.A O no hydrogen 2.973 N/A HIS 324.A ND1 ARG 320.A O no hydrogen 2.339 N/A ALA 325.A N THR 322.A O no hydrogen 3.322 N/A LEU 332.A N VAL 328.A O no hydrogen 2.957 N/A GLN 333.A N ASN 331.A O no hydrogen 3.158 N/A GLN 333.A NE2 VAL 330.A O no hydrogen 3.646 N/A HIS 336.A N TYR 268.A O no hydrogen 2.946 N/A HIS 336.A ND1 TYR 268.A OH no hydrogen 2.917 N/A ILE 337.A N CYS 195.A O no hydrogen 2.811 N/A VAL 338.A N VAL 266.A O no hydrogen 2.814 N/A ALA 339.A N LEU 193.A O no hydrogen 2.582 N/A SER 340.A N LYS 264.A O no hydrogen 3.008 N/A SER 340.A OG THR 14.A OG1 no hydrogen 2.618 N/A LEU 341.A N MET 191.A O no hydrogen 2.673 N/A SER 342.A N ALA 261.A O no hydrogen 2.944 N/A SER 342.A OG ASP 263.A OD1 no hydrogen 3.432 N/A PHE 343.A N GLY 189.A O no hydrogen 2.980 N/A THR 344.A N SER 259.A O no hydrogen 3.320 N/A