Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7wps_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 9.A N LEU 46.A O no hydrogen 3.443 N/A ARG 19.A NE GLU 21.A OE2 no hydrogen 3.382 N/A ARG 19.A NH2 GLU 21.A OE2 no hydrogen 2.820 N/A ALA 20.A N LEU 18.A O no hydrogen 2.800 N/A THR 26.A OG1 LEU 23.A O no hydrogen 2.332 N/A THR 28.A N ASN 31.A OD1 no hydrogen 2.537 N/A THR 28.A OG1 ARG 53.A O no hydrogen 3.073 N/A CYS 29.A N THR 28.A OG1 no hydrogen 2.718 N/A ASN 31.A ND2 THR 26.A O no hydrogen 3.035 N/A SER 38.A OG ALA 20.A O no hydrogen 3.563 N/A SER 38.A OG GLU 24.A OE1 no hydrogen 3.432 N/A MET 39.A N GLU 24.A OE1 no hydrogen 3.291 N/A CYS 41.A SG VAL 42.A O no hydrogen 3.802 N/A ARG 53.A N LYS 27.A O no hydrogen 3.478 N/A CYS 58.A SG VAL 52.A O no hydrogen 3.479 N/A CYS 66.A N TYR 73.A O no hydrogen 3.018 N/A CYS 66.A SG CYS 88.A O no hydrogen 3.890 N/A CYS 66.A SG ASP 90.A O no hydrogen 3.365 N/A HIS 68.A N LYS 71.A O no hydrogen 3.416 N/A LYS 71.A NZ TYR 73.A OH no hydrogen 2.322 N/A GLU 77.A N ALA 74.A O no hydrogen 3.103 N/A VAL 79.A N CYS 86.A O no hydrogen 2.976 N/A ILE 81.A N ASN 84.A O no hydrogen 3.244 N/A CYS 83.A SG HIS 98.A O no hydrogen 3.143 N/A ASN 84.A N ILE 81.A O no hydrogen 3.276 N/A ASN 84.A ND2 HIS 98.A O no hydrogen 3.236 N/A VAL 87.A N ASN 94.A O no hydrogen 3.073 N/A CYS 88.A SG ASP 90.A O no hydrogen 3.038 N/A TRP 93.A NE1 PHE 67.A O no hydrogen 3.200 N/A ASN 94.A N VAL 87.A O no hydrogen 2.648 N/A THR 96.A N THR 85.A O no hydrogen 3.296 N/A THR 96.A OG1 ASN 84.A OD1 no hydrogen 2.644 N/A THR 96.A OG1 THR 85.A O no hydrogen 3.529 N/A HIS 98.A N ASN 84.A OD1 no hydrogen 3.167 N/A CYS 100.A SG HIS 98.A O no hydrogen 3.780 N/A CYS 104.A N VAL 219.A O no hydrogen 3.108 N/A TYR 112.A N TYR 120.A O no hydrogen 3.246 N/A LEU 113.A N SER 105.A O no hydrogen 3.413 N/A THR 114.A N LEU 118.A O no hydrogen 3.423 N/A THR 114.A OG1 ASP 243.A OD2 no hydrogen 3.086 N/A PHE 115.A N CYS 233.A O no hydrogen 3.374 N/A GLY 117.A N THR 114.A OG1 no hydrogen 3.285 N/A TYR 120.A N TYR 112.A O no hydrogen 3.199 N/A TYR 120.A OH LEU 232.A O no hydrogen 2.495 N/A CYS 126.A SG ALA 269.A O no hydrogen 3.241 N/A TYR 128.A N VAL 146.A O no hydrogen 2.678 N/A VAL 129.A N TRP 262.A O no hydrogen 3.191 N/A GLN 132.A N CYS 230.A O no hydrogen 2.933 N/A ASP 133.A N PHE 142.A O no hydrogen 3.129 N/A SER 137.A N CYS 135.A O no hydrogen 3.073 N/A THR 141.A OG1 ASP 133.A OD2 no hydrogen 3.269 N/A ARG 143.A N LEU 165.A O no hydrogen 3.155 N/A LEU 145.A N THR 163.A O no hydrogen 3.014 N/A VAL 146.A N TYR 128.A O no hydrogen 2.862 N/A GLY 147.A N ARG 161.A O no hydrogen 2.717 N/A CYS 151.A SG MET 109.A O no hydrogen 3.890 N/A SER 152.A OG GLU 125.A OE2 no hydrogen 2.666 N/A LYS 157.A N SER 155.A OG no hydrogen 3.216 N/A LYS 160.A NZ MET 109.A O no hydrogen 3.239 N/A ARG 161.A N GLY 147.A O no hydrogen 2.706 N/A VAL 162.A N LEU 173.A O no hydrogen 3.296 N/A ILE 164.A N ILE 171.A O no hydrogen 3.194 N/A GLY 169.A N VAL 166.A O no hydrogen 3.124 N/A GLU 170.A N ARG 182.A O no hydrogen 2.964 N/A GLU 172.A N ASN 179.A O no hydrogen 2.692 N/A LEU 173.A N VAL 162.A O no hydrogen 3.075 N/A PHE 174.A N GLU 177.A O no hydrogen 3.301 N/A ASN 179.A N GLU 172.A O no hydrogen 2.599 N/A LYS 181.A N GLU 170.A O no hydrogen 2.783 N/A ARG 182.A N GLU 170.A O no hydrogen 2.984 N/A ARG 182.A NH1 GLY 168.A O no hydrogen 2.427 N/A GLU 187.A N LYS 185.A O no hydrogen 2.913 N/A THR 188.A N ASP 186.A OD1 no hydrogen 3.242 N/A THR 188.A OG1 ASP 186.A OD1 no hydrogen 2.340 N/A THR 188.A OG1 HIS 189.A ND1 no hydrogen 3.211 N/A PHE 190.A N GLU 187.A O no hydrogen 3.262 N/A VAL 193.A N ILE 200.A O no hydrogen 2.904 N/A SER 195.A N VAL 193.A O no hydrogen 2.930 N/A SER 195.A OG ALA 389.A O no hydrogen 3.049 N/A ARG 197.A N GLU 408.A O no hydrogen 3.361 N/A ILE 199.A N TRP 211.A O no hydrogen 2.868 N/A ILE 200.A N VAL 193.A O no hydrogen 3.141 N/A LEU 203.A N LEU 207.A O no hydrogen 3.472 N/A SER 208.A N VAL 220.A O no hydrogen 3.003 N/A SER 208.A OG LEU 207.A O no hydrogen 2.785 N/A VAL 209.A N LEU 201.A O no hydrogen 2.881 N/A ASP 212.A N SER 216.A OG no hydrogen 3.276 N/A HIS 214.A N ASP 212.A OD1 no hydrogen 2.996 N/A LEU 215.A N ASP 212.A OD1 no hydrogen 2.820 N/A SER 216.A N ASP 212.A OD1 no hydrogen 2.814 N/A SER 218.A N VAL 210.A O no hydrogen 3.228 N/A SER 218.A OG CYS 104.A O no hydrogen 3.302 N/A VAL 220.A N SER 208.A O no hydrogen 2.842 N/A LEU 221.A N ALA 102.A O no hydrogen 3.425 N/A LYS 222.A NZ ASP 101.A OD2 no hydrogen 2.904 N/A GLU 227.A N PHE 236.A O no hydrogen 2.842 N/A LYS 228.A NZ ASN 138.A OD1 no hydrogen 2.236 N/A CYS 230.A N GLN 132.A O no hydrogen 3.139 N/A LEU 232.A N VAL 129.A O no hydrogen 3.162 N/A CYS 233.A N LEU 130.A O no hydrogen 3.180 N/A CYS 233.A SG LEU 130.A O no hydrogen 3.752 N/A GLY 234.A N GLY 231.A O no hydrogen 3.184 N/A ASN 235.A ND2 ASP 237.A OD2 no hydrogen 2.655 N/A GLY 238.A N ASP 116.A OD1 no hydrogen 2.842 N/A GLN 240.A NE2 GLY 117.A O no hydrogen 2.371 N/A ASN 242.A ND2 ASP 237.A OD2 no hydrogen 2.636 N/A SER 246.A N GLN 250.A O no hydrogen 2.959 N/A SER 246.A OG ASN 248.A OD1 no hydrogen 2.023 N/A SER 246.A OG GLN 250.A O no hydrogen 3.375 N/A SER 247.A OG SER 261.A O no hydrogen 3.101 N/A LEU 249.A N SER 246.A O no hydrogen 3.106 N/A GLU 252.A N LEU 244.A O no hydrogen 3.101 N/A ASP 257.A N ASP 254.A O no hydrogen 3.081 N/A PHE 258.A N PRO 255.A O no hydrogen 2.938 N/A GLY 259.A N PRO 255.A O no hydrogen 3.265 N/A SER 261.A N PHE 258.A O no hydrogen 2.767 N/A SER 261.A OG PHE 258.A O no hydrogen 2.181 N/A TRP 262.A N GLY 259.A O no hydrogen 2.997 N/A LYS 263.A NZ ASN 260.A O no hydrogen 2.625 N/A LYS 263.A NZ ASN 260.A OD1 no hydrogen 3.556 N/A VAL 264.A N GLN 127.A O no hydrogen 3.033 N/A SER 266.A OG SER 266.A O no hydrogen 2.532 N/A CYS 268.A SG SER 265.A O no hydrogen 3.353 N/A CYS 268.A SG SER 265.A OG no hydrogen 2.930 N/A CYS 268.A SG ALA 269.A O no hydrogen 4.040 N/A THR 271.A N ASN 260.A OD1 no hydrogen 3.210 N/A THR 271.A OG1 PRO 123.A O no hydrogen 2.902 N/A THR 282.A OG1 CYS 326.A O no hydrogen 2.987 N/A THR 282.A OG1 GLU 329.A OE2 no hydrogen 2.716 N/A HIS 284.A N ALA 281.A O no hydrogen 3.177 N/A GLN 290.A N ASN 286.A O no hydrogen 3.115 N/A THR 291.A N MET 288.A O no hydrogen 3.094 N/A THR 291.A OG1 MET 288.A O no hydrogen 2.568 N/A VAL 293.A N LYS 289.A O no hydrogen 3.095 N/A SER 295.A N THR 291.A O no hydrogen 2.959 N/A SER 295.A OG THR 291.A O no hydrogen 3.273 N/A SER 295.A OG MET 292.A O no hydrogen 3.075 N/A SER 296.A N MET 292.A O no hydrogen 3.427 N/A SER 296.A OG MET 292.A O no hydrogen 3.226 N/A SER 296.A OG VAL 293.A O no hydrogen 2.995 N/A CYS 297.A N VAL 293.A O no hydrogen 3.009 N/A CYS 297.A SG VAL 293.A O no hydrogen 3.231 N/A ARG 298.A N SER 295.A O no hydrogen 2.924 N/A LEU 300.A N CYS 297.A O no hydrogen 3.473 N/A THR 301.A N ARG 298.A O no hydrogen 2.872 N/A PHE 305.A N SER 302.A O no hydrogen 3.183 N/A GLN 306.A NE2 SER 302.A O no hydrogen 2.936 N/A CYS 308.A N PHE 305.A O no hydrogen 2.857 N/A CYS 308.A SG TYR 344.A OH no hydrogen 3.668 N/A ASN 309.A N PHE 305.A O no hydrogen 3.003 N/A ASN 309.A ND2 LEU 300.A O no hydrogen 2.962 N/A LYS 310.A NZ GLN 306.A O no hydrogen 3.409 N/A LEU 311.A N CYS 308.A O no hydrogen 2.865 N/A VAL 312.A N CYS 308.A O no hydrogen 2.822 N/A GLU 315.A N ASP 313.A OD1 no hydrogen 3.123 N/A LEU 318.A N PRO 314.A O no hydrogen 2.880 N/A ASP 319.A N GLU 315.A O no hydrogen 3.436 N/A ILE 322.A N LEU 318.A O no hydrogen 3.103 N/A TYR 323.A N ASP 319.A O no hydrogen 3.215 N/A ASP 324.A N VAL 320.A O no hydrogen 2.881 N/A THR 325.A N CYS 321.A O no hydrogen 3.248 N/A CYS 326.A SG ILE 322.A O no hydrogen 3.031 N/A SER 327.A N TYR 323.A O no hydrogen 3.441 N/A SER 327.A OG PRO 154.A O no hydrogen 3.322 N/A SER 327.A OG TYR 323.A O no hydrogen 3.228 N/A SER 327.A OG ASP 324.A O no hydrogen 2.623 N/A CYS 328.A N ASP 324.A O no hydrogen 2.642 N/A CYS 338.A N CYS 334.A O no hydrogen 3.264 N/A CYS 338.A SG CYS 334.A O no hydrogen 3.005 N/A ASP 339.A N ALA 335.A O no hydrogen 3.133 N/A THR 340.A N PHE 337.A O no hydrogen 3.340 N/A THR 340.A OG1 PHE 337.A O no hydrogen 2.918 N/A ALA 343.A N ASP 339.A O no hydrogen 3.351 N/A TYR 344.A N ILE 341.A O no hydrogen 2.924 N/A TYR 344.A OH VAL 312.A O no hydrogen 3.024 N/A ALA 345.A N ILE 341.A O no hydrogen 2.841 N/A HIS 346.A N ALA 342.A O no hydrogen 2.979 N/A CYS 348.A N TYR 344.A O no hydrogen 3.006 N/A CYS 348.A SG TYR 344.A O no hydrogen 3.085 N/A ALA 349.A N ALA 345.A O no hydrogen 2.894 N/A ALA 349.A N HIS 346.A O no hydrogen 2.979 N/A GLN 350.A N HIS 346.A O no hydrogen 3.020 N/A HIS 351.A ND1 VAL 347.A O no hydrogen 2.988 N/A GLY 352.A N ALA 349.A O no hydrogen 2.812 N/A LYS 353.A N CYS 348.A O no hydrogen 2.933 N/A LYS 353.A NZ HIS 351.A O no hydrogen 3.139 N/A ARG 358.A NE TYR 383.A OH no hydrogen 3.009 N/A ARG 358.A NH1 GLU 408.A OE1 no hydrogen 3.550 N/A ARG 358.A NH2 CYS 363.A O no hydrogen 2.839 N/A ALA 360.A N THR 359.A OG1 no hydrogen 2.669 N/A GLU 368.A N SER 366.A OG no hydrogen 3.349 N/A GLU 369.A N GLU 369.A OE1 no hydrogen 2.735 N/A ASN 371.A ND2 TRP 381.A O no hydrogen 3.270 N/A CYS 379.A SG TYR 377.A OH no hydrogen 3.856 N/A GLU 380.A N ASN 371.A OD1 no hydrogen 3.415 N/A ARG 382.A N HIS 411.A O no hydrogen 2.887 N/A ASN 384.A N GLY 409.A O no hydrogen 3.238 N/A SER 385.A OG VAL 355.A O no hydrogen 2.219 N/A ALA 387.A N VAL 407.A O no hydrogen 2.944 N/A THR 393.A N HIS 396.A O no hydrogen 2.995 N/A CYS 394.A N LEU 420.A O no hydrogen 3.145 N/A GLN 395.A N GLN 395.A OE1 no hydrogen 2.765 N/A HIS 396.A N THR 393.A OG1 no hydrogen 2.806 N/A GLU 398.A N GLU 398.A OE1 no hydrogen 2.644 N/A CYS 402.A SG VAL 404.A O no hydrogen 3.071 N/A VAL 407.A N ALA 387.A O no hydrogen 2.754 N/A CYS 410.A SG SER 366.A O no hydrogen 3.736 N/A HIS 411.A N ARG 382.A O no hydrogen 2.692 N/A HIS 411.A NE2 VAL 407.A O no hydrogen 3.248 N/A HIS 413.A N GLU 380.A O no hydrogen 2.755 N/A CYS 414.A SG PRO 415.A O no hydrogen 3.871 N/A LYS 418.A NZ CYS 427.A O no hydrogen 3.241 N/A ILE 419.A N VAL 428.A O no hydrogen 2.539 N/A THR 426.A OG1 GLU 378.A OE1 no hydrogen 3.052 N/A THR 426.A OG1 GLU 380.A OE2 no hydrogen 3.141 N/A THR 426.A OG1 CYS 427.A O no hydrogen 3.379 N/A VAL 428.A N ILE 419.A O no hydrogen 2.806 N/A GLU 431.A N GLU 431.A OE1 no hydrogen 2.669 N/A ASP 432.A N ASP 429.A O no hydrogen 3.307 N/A CYS 433.A N PRO 430.A O no hydrogen 2.983 N/A VAL 435.A N CYS 433.A O no hydrogen 2.764 N/A CYS 436.A SG VAL 466.A O no hydrogen 3.134 N/A ARG 442.A NE PHE 443.A O no hydrogen 2.979 N/A ARG 442.A NH2 PHE 443.A O no hydrogen 2.685 N/A SER 445.A OG CYS 394.A O no hydrogen 3.284 N/A SER 445.A OG PRO 434.A O no hydrogen 2.129 N/A LYS 448.A NZ GLY 446.A O no hydrogen 3.375 N/A LYS 448.A NZ ASP 465.A O no hydrogen 3.052 N/A THR 450.A OG1 HIS 463.A NE2 no hydrogen 3.357 N/A ASN 452.A ND2 HIS 458.A O no hydrogen 2.383 N/A SER 454.A OG ASN 452.A OD1 no hydrogen 3.550 N/A GLU 457.A N ASP 455.A OD1 no hydrogen 3.240 N/A GLU 457.A N GLU 457.A OE1 no hydrogen 2.767 N/A CYS 459.A N PRO 456.A O no hydrogen 2.933 N/A CYS 462.A SG ILE 461.A O no hydrogen 3.104 N/A HIS 463.A N GLU 472.A OE1 no hydrogen 2.980 N/A HIS 463.A ND1 GLU 472.A OE1 no hydrogen 3.058 N/A HIS 463.A NE2 THR 450.A OG1 no hydrogen 3.357 N/A CYS 464.A SG ASN 468.A O no hydrogen 3.181 N/A CYS 464.A SG ASN 468.A OD1 no hydrogen 3.222 N/A ASP 465.A N ASN 468.A OD1 no hydrogen 3.013 N/A CYS 471.A SG THR 470.A O no hydrogen 3.125 N/A CYS 474.A SG CYS 459.A O no hydrogen 3.012 N/A