Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w8k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N SER 113.A OG no hydrogen 3.286 N/A VAL 4.A N SER 146.A O no hydrogen 3.048 N/A LEU 5.A N LEU 110.A O no hydrogen 2.910 N/A PHE 6.A N GLY 144.A O no hydrogen 2.971 N/A VAL 7.A N ALA 108.A O no hydrogen 3.081 N/A ASP 8.A N THR 142.A O no hydrogen 2.984 N/A PHE 9.A N ASP 106.A O no hydrogen 3.090 N/A ASP 10.A N THR 140.A O no hydrogen 3.128 N/A TYR 11.A OH GLU 18.A OE1 no hydrogen 3.167 N/A GLN 15.A N TYR 11.A O no hydrogen 2.752 N/A GLN 15.A NE2 ASP 10.A O no hydrogen 2.802 N/A VAL 16.A N PHE 12.A O no hydrogen 2.877 N/A GLU 17.A N TYR 13.A O no hydrogen 3.357 N/A GLU 17.A N ALA 14.A O no hydrogen 3.271 N/A GLU 18.A N GLN 15.A O no hydrogen 3.019 N/A VAL 19.A N GLN 15.A O no hydrogen 2.748 N/A LEU 20.A N VAL 16.A O no hydrogen 3.152 N/A ASN 21.A N GLU 18.A O no hydrogen 2.948 N/A LEU 24.A N ASN 21.A O no hydrogen 2.924 N/A LYS 25.A N PRO 22.A O no hydrogen 3.202 N/A LYS 27.A N LEU 24.A O no hydrogen 2.890 N/A LYS 27.A NZ SER 23.A O no hydrogen 3.296 N/A VAL 29.A N ASN 48.A OD1 no hydrogen 3.061 N/A VAL 30.A N VAL 73.A O no hydrogen 2.774 N/A VAL 31.A N THR 46.A O no hydrogen 2.942 N/A CYS 32.A N LEU 75.A O no hydrogen 2.705 N/A CYS 32.A SG VAL 30.A O no hydrogen 3.256 N/A VAL 33.A N ALA 43.A O no hydrogen 2.803 N/A SER 35.A OG SER 41.A OG no hydrogen 3.301 N/A ARG 37.A NH1 ASN 255.A OD1 no hydrogen 3.300 N/A ARG 37.A NH2 ASN 255.A OD1 no hydrogen 2.687 N/A PHE 38.A N SER 41.A OG no hydrogen 3.192 N/A SER 41.A OG SER 35.A OG no hydrogen 3.301 N/A SER 41.A OG PHE 38.A O no hydrogen 2.659 N/A ALA 43.A N VAL 33.A O no hydrogen 3.110 N/A VAL 44.A N ILE 60.A O no hydrogen 3.117 N/A ALA 45.A N VAL 31.A O no hydrogen 2.858 N/A ASN 48.A N VAL 29.A O no hydrogen 3.243 N/A ASN 48.A ND2 GLU 18.A OE2 no hydrogen 3.056 N/A ASN 48.A ND2 LYS 27.A O no hydrogen 2.507 N/A ALA 51.A N ASN 48.A O no hydrogen 2.847 N/A ALA 51.A N ASN 48.A OD1 no hydrogen 3.392 N/A ARG 52.A N ASN 48.A O no hydrogen 2.926 N/A ARG 52.A NH1 THR 46.A OG1 no hydrogen 3.397 N/A LYS 53.A N TYR 49.A O no hydrogen 2.480 N/A PHE 54.A N ALA 51.A O no hydrogen 3.145 N/A GLY 55.A N ARG 52.A O no hydrogen 3.236 N/A GLY 59.A N VAL 44.A O no hydrogen 2.589 N/A ALA 65.A N ILE 62.A O no hydrogen 3.275 N/A LYS 66.A N ILE 62.A O no hydrogen 3.337 N/A LYS 66.A NZ ASP 40.A OD1 no hydrogen 3.199 N/A LYS 67.A N VAL 63.A O no hydrogen 2.791 N/A LEU 69.A N ALA 65.A O no hydrogen 2.706 N/A ALA 72.A N LEU 69.A O no hydrogen 3.240 N/A VAL 73.A N PRO 28.A O no hydrogen 2.855 N/A TYR 74.A OH LEU 69.A O no hydrogen 2.585 N/A LEU 75.A N VAL 30.A O no hydrogen 3.023 N/A TYR 82.A N ARG 78.A O no hydrogen 3.367 N/A TYR 82.A OH GLU 17.A OE2 no hydrogen 3.012 N/A GLN 83.A N LYS 79.A O no hydrogen 2.562 N/A GLN 83.A NE2 SER 87.A OG no hydrogen 3.077 N/A GLN 84.A N GLU 80.A O no hydrogen 3.121 N/A VAL 85.A N VAL 81.A O no hydrogen 3.254 N/A SER 86.A N TYR 82.A O no hydrogen 3.081 N/A SER 86.A OG ILE 105.A O no hydrogen 2.899 N/A SER 87.A N GLN 83.A O.A no hydrogen 3.040 N/A SER 87.A OG GLN 83.A O.A no hydrogen 3.183 N/A ARG 88.A N GLN 84.A O no hydrogen 3.227 N/A ARG 88.A NE GLU 137.A OE2 no hydrogen 3.053 N/A ILE 89.A N VAL 85.A O no hydrogen 3.299 N/A MET 90.A N SER 86.A O no hydrogen 2.677 N/A ASN 91.A N ARG 88.A O no hydrogen 2.877 N/A LEU 92.A N ILE 89.A O no hydrogen 3.100 N/A TYR 96.A N LEU 93.A O no hydrogen 2.713 N/A TYR 96.A OH GLU 128.A OE1 no hydrogen 3.293 N/A TYR 96.A OH GLU 128.A OE2 no hydrogen 2.560 N/A LYS 99.A N SER 97.A OG no hydrogen 3.210 N/A GLU 101.A N TYR 109.A O no hydrogen 2.815 N/A SER 104.A N GLU 107.A O no hydrogen 3.334 N/A SER 104.A OG ASP 106.A OD2 no hydrogen 2.493 N/A SER 104.A OG GLU 107.A OE2 no hydrogen 2.465 N/A ASP 106.A N SER 104.A OG no hydrogen 3.161 N/A ALA 108.A N VAL 7.A O no hydrogen 3.242 N/A TYR 109.A N GLU 101.A O no hydrogen 2.859 N/A LEU 110.A N LEU 5.A O no hydrogen 2.842 N/A ASP 111.A N LYS 99.A O no hydrogen 2.968 N/A SER 113.A N ASP 111.A OD1 no hydrogen 3.375 N/A SER 113.A OG ASP 111.A OD1 no hydrogen 3.041 N/A LYS 115.A N ILE 112.A O no hydrogen 3.250 N/A LYS 115.A NZ GLU 98.A OE1 no hydrogen 3.074 N/A VAL 116.A N ILE 112.A O no hydrogen 3.441 N/A ARG 117.A N GLU 121.A OE1 no hydrogen 2.437 N/A TYR 119.A OH ASP 169.A OD1 no hydrogen 3.110 N/A ARG 120.A N ASP 118.A OD1 no hydrogen 3.041 N/A GLU 121.A N ASP 118.A OD1 no hydrogen 3.475 N/A ALA 122.A N ASP 118.A O no hydrogen 2.656 N/A TYR 123.A N TYR 119.A O no hydrogen 3.175 N/A LEU 125.A N GLU 121.A O no hydrogen 3.072 N/A GLY 126.A N ALA 122.A O no hydrogen 2.722 N/A LEU 127.A N TYR 123.A O no hydrogen 3.515 N/A GLU 128.A N ASN 124.A O no hydrogen 3.385 N/A ILE 129.A N LEU 125.A O no hydrogen 3.243 N/A LYS 130.A N GLY 126.A O no hydrogen 3.024 N/A LYS 130.A NZ VAL 141.A O no hydrogen 2.819 N/A LYS 130.A NZ ASN 162.A OD1 no hydrogen 3.421 N/A ASN 131.A N LEU 127.A O no hydrogen 3.114 N/A ASN 131.A ND2 LEU 127.A O no hydrogen 3.495 N/A LYS 132.A N.A GLU 128.A O no hydrogen 2.877 N/A ILE 133.A N ILE 129.A O no hydrogen 3.223 N/A LEU 134.A N LYS 130.A O no hydrogen 3.137 N/A GLU 135.A N ASN 131.A O no hydrogen 3.024 N/A GLU 137.A N ILE 133.A O no hydrogen 3.029 N/A LYS 138.A NZ GLU 135.A O no hydrogen 3.190 N/A THR 140.A N GLN 15.A OE1 no hydrogen 3.070 N/A THR 140.A OG1 GLN 15.A OE1 no hydrogen 3.423 N/A THR 142.A N ASP 8.A O no hydrogen 2.821 N/A THR 142.A OG1 ASP 10.A OD1 no hydrogen 3.228 N/A VAL 143.A N GLY 163.A O no hydrogen 2.881 N/A GLY 144.A N PHE 6.A O no hydrogen 2.938 N/A ILE 145.A N LYS 165.A O no hydrogen 2.975 N/A SER 146.A OG ILE 167.A O no hydrogen 3.104 N/A ASN 148.A ND2 TYR 234.A O no hydrogen 3.534 N/A LYS 149.A NZ GLU 101.A OE1 no hydrogen 2.982 N/A LYS 149.A NZ GLU 101.A OE2 no hydrogen 2.985 N/A PHE 151.A N ASN 148.A O no hydrogen 2.699 N/A PHE 151.A N ASN 148.A OD1 no hydrogen 2.926 N/A ALA 152.A N ASN 148.A O no hydrogen 3.201 N/A LYS 153.A N LYS 149.A O no hydrogen 3.128 N/A LYS 153.A NZ ASP 157.A OD2 no hydrogen 3.427 N/A ILE 154.A N VAL 150.A O no hydrogen 3.369 N/A ALA 155.A N PHE 151.A O no hydrogen 2.842 N/A ALA 156.A N ALA 152.A O no hydrogen 3.136 N/A ASP 157.A N LYS 153.A O no hydrogen 2.804 N/A MET 158.A N ILE 154.A O no hydrogen 3.134 N/A ALA 159.A N ALA 155.A O no hydrogen 3.202 N/A LYS 160.A N MET 158.A O no hydrogen 2.385 N/A LYS 160.A NZ ASP 157.A OD1 no hydrogen 2.608 N/A ASN 162.A N ASP 10.A OD1 no hydrogen 3.282 N/A ASN 162.A N ASP 10.A OD2 no hydrogen 2.923 N/A LYS 165.A N VAL 143.A O no hydrogen 2.957 N/A ILE 167.A N ILE 145.A O no hydrogen 2.771 N/A GLU 171.A N ASP 168.A OD1 no hydrogen 2.865 N/A LYS 173.A N.A GLU 170.A O.A no hydrogen 2.909 N/A LYS 173.A NZ ASP 169.A O no hydrogen 3.191 N/A LYS 173.A NZ ASP 232.A OD2 no hydrogen 2.445 N/A ARG 174.A N GLU 170.A O.A no hydrogen 3.357 N/A ARG 174.A NH1 GLU 178.A OE1 no hydrogen 3.527 N/A LEU 175.A N GLU 171.A O no hydrogen 2.709 N/A LEU 175.A N VAL 172.A O no hydrogen 3.165 N/A ILE 176.A N VAL 172.A O no hydrogen 2.633 N/A GLU 178.A N ARG 174.A O no hydrogen 2.705 N/A LEU 179.A N LEU 175.A O no hydrogen 3.043 N/A ALA 192.A N GLY 188.A O no hydrogen 3.178 N/A GLU 193.A N ASN 189.A O no hydrogen 2.767 N/A LYS 194.A N ILE 190.A O no hydrogen 3.187 N/A LEU 195.A N THR 191.A O no hydrogen 2.880 N/A LYS 196.A N ALA 192.A O no hydrogen 2.726 N/A LYS 196.A NZ.A ILE 200.A O no hydrogen 2.694 N/A LYS 197.A N GLU 193.A O no hydrogen 3.229 N/A LEU 198.A N LYS 194.A O no hydrogen 2.867 N/A GLY 199.A N LYS 196.A O no hydrogen 2.636 N/A ILE 200.A N LEU 195.A O no hydrogen 2.880 N/A ASN 201.A N ASP 205.A OD2 no hydrogen 3.000 N/A ASP 205.A N LYS 202.A O no hydrogen 2.925 N/A THR 206.A N LEU 203.A O no hydrogen 3.200 N/A THR 206.A OG1 LEU 203.A O no hydrogen 2.625 N/A SER 208.A OG ASP 205.A O no hydrogen 3.477 N/A SER 208.A OG SER 208.A O no hydrogen 2.619 N/A LYS 213.A N GLU 210.A O no hydrogen 2.854 N/A LYS 215.A N PHE 211.A O no hydrogen 2.741 N/A GLY 216.A N ASP 212.A O no hydrogen 3.303 N/A MET 217.A N LYS 213.A O no hydrogen 2.711 N/A ILE 218.A N LEU 214.A O no hydrogen 2.909 N/A ALA 223.A N GLY 219.A O no hydrogen 3.240 N/A LYS 224.A N GLU 220.A O no hydrogen 2.594 N/A TYR 225.A N ALA 221.A O no hydrogen 2.916 N/A TYR 225.A OH PRO 185.A O no hydrogen 3.317 N/A LEU 226.A N LYS 222.A O no hydrogen 2.867 N/A ILE 227.A N ALA 223.A O no hydrogen 3.364 N/A SER 228.A N LYS 224.A O no hydrogen 2.885 N/A SER 228.A OG LYS 224.A O no hydrogen 2.846 N/A SER 228.A OG TYR 225.A O no hydrogen 2.902 N/A LEU 229.A N TYR 225.A O no hydrogen 3.146 N/A ALA 230.A N LEU 226.A O no hydrogen 2.973 N/A ARG 231.A N ILE 227.A O no hydrogen 3.005 N/A GLU 233.A N SER 228.A O no hydrogen 3.095 N/A ARG 241.A NE GLU 101.A OE1 no hydrogen 2.690 N/A ARG 241.A NH2 GLU 101.A OE1 no hydrogen 3.213 N/A SER 245.A OG PHE 338.A O no hydrogen 3.003 N/A ILE 246.A N PHE 338.A O no hydrogen 2.762 N/A ARG 248.A NE GLU 272.A OE1 no hydrogen 2.553 N/A LYS 253.A NZ SER 35.A O no hydrogen 2.990 N/A SER 256.A N ILE 331.A O no hydrogen 3.044 N/A ARG 257.A NH2 ASP 327.A O no hydrogen 2.912 N/A GLU 260.A N ASN 258.A OD1 no hydrogen 3.185 N/A ILE 262.A N ASN 258.A O no hydrogen 3.443 N/A LYS 263.A N LEU 259.A O no hydrogen 2.921 N/A LYS 263.A NZ GLU 260.A OE2 no hydrogen 2.695 N/A TYR 265.A N ILE 262.A O no hydrogen 3.283 N/A PHE 267.A N LYS 263.A O no hydrogen 3.131 N/A ARG 268.A N PRO 264.A O no hydrogen 3.179 N/A ARG 268.A N TYR 265.A O no hydrogen 3.180 N/A ALA 269.A N TYR 265.A O no hydrogen 3.078 N/A ILE 270.A N LEU 266.A O no hydrogen 2.940 N/A GLU 271.A N PHE 267.A O no hydrogen 2.918 N/A GLU 272.A N ARG 268.A O no hydrogen 2.891 N/A SER 273.A N ALA 269.A O no hydrogen 3.035 N/A TYR 274.A N ILE 270.A O no hydrogen 2.859 N/A TYR 274.A OH ILE 307.A O no hydrogen 3.337 N/A TYR 275.A N GLU 271.A O no hydrogen 3.259 N/A LYS 276.A N GLU 272.A O no hydrogen 3.138 N/A LEU 277.A N SER 273.A O no hydrogen 3.125 N/A ASP 278.A N TYR 274.A O no hydrogen 3.428 N/A ARG 280.A NE LEU 277.A O no hydrogen 3.109 N/A LYS 283.A N LYS 340.A O no hydrogen 2.199 N/A ALA 284.A N SER 339.A O no hydrogen 3.164 N/A HIS 286.A N ARG 337.A O no hydrogen 2.811 N/A VAL 287.A N ARG 299.A O no hydrogen 2.909 N/A VAL 288.A N GLY 335.A O no hydrogen 2.650 N/A ALA 289.A N VAL 297.A O no hydrogen 2.946 N/A VAL 290.A N ARG 333.A O no hydrogen 3.378 N/A GLU 292.A N LYS 330.A O no hydrogen 2.668 N/A LEU 294.A N THR 291.A O no hydrogen 3.095 N/A ASP 295.A N THR 291.A OG1 no hydrogen 3.388 N/A VAL 297.A N ALA 289.A O no hydrogen 3.248 N/A ARG 301.A NH1 THR 302.A O no hydrogen 3.416 N/A PHE 303.A N LYS 283.A O no hydrogen 2.828 N/A ILE 307.A N PRO 282.A O no hydrogen 2.801 N/A SER 308.A OG THR 311.A OG1 no hydrogen 3.071 N/A THR 311.A N SER 308.A OG no hydrogen 3.305 N/A THR 311.A OG1 SER 308.A OG no hydrogen 3.071 N/A ALA 312.A N SER 308.A O no hydrogen 2.729 N/A TYR 313.A N LYS 309.A O no hydrogen 3.262 N/A SER 314.A OG GLU 310.A O no hydrogen 3.493 N/A GLU 315.A N THR 311.A O no hydrogen 3.113 N/A SER 316.A N ALA 312.A O no hydrogen 3.180 N/A SER 316.A OG ALA 312.A O no hydrogen 2.769 N/A SER 316.A OG TYR 313.A O no hydrogen 2.556 N/A VAL 317.A N SER 314.A O no hydrogen 3.112 N/A LYS 318.A N SER 314.A O no hydrogen 3.401 N/A LEU 319.A N GLU 315.A O no hydrogen 3.072 N/A GLN 321.A N VAL 317.A O no hydrogen 2.605 N/A LYS 322.A N LYS 318.A O no hydrogen 3.093 N/A ILE 323.A N LEU 319.A O no hydrogen 3.173 N/A LEU 324.A N LEU 320.A O no hydrogen 2.781 N/A GLU 325.A N LYS 322.A O no hydrogen 3.364 N/A ARG 329.A NE ASP 327.A OD1 no hydrogen 3.242 N/A ARG 329.A NH1 ASP 293.A OD2 no hydrogen 3.479 N/A ARG 329.A NH1 ASP 295.A OD2 no hydrogen 3.561 N/A ARG 329.A NH2 ASP 295.A OD2 no hydrogen 2.971 N/A LYS 330.A NZ GLU 292.A OE2 no hydrogen 2.818 N/A ILE 331.A N SER 256.A O no hydrogen 2.765 N/A ARG 332.A N VAL 290.A O no hydrogen 3.047 N/A ARG 333.A N VAL 290.A O no hydrogen 3.057 N/A ARG 333.A NH2 ILE 249.A O no hydrogen 3.522 N/A ILE 334.A N VAL 250.A O no hydrogen 3.522 N/A GLY 335.A N VAL 288.A O no hydrogen 2.935 N/A ARG 337.A N HIS 286.A O no hydrogen 3.041 N/A PHE 338.A N ILE 246.A O no hydrogen 2.668 N/A ILE 342.A N ILE 281.A O no hydrogen 2.358 N/A