Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6qkl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 PHE 5.A O no hydrogen 2.384 N/A ARG 9.A NH1 GLY 11.A O no hydrogen 3.543 N/A GLY 14.A N ASN 12.A OD1 no hydrogen 2.622 N/A ARG 18.A NE HIS 275.A NE2 no hydrogen 3.238 N/A ARG 20.A NE GLN 271.A OE1 no hydrogen 2.849 N/A ARG 20.A NH2 GLN 271.A OE1 no hydrogen 3.208 N/A ALA 21.A N TYR 274.A O no hydrogen 2.657 N/A ARG 36.A NH1 SER 158.A O no hydrogen 3.479 N/A ARG 36.A NH2 GLY 187.A O no hydrogen 3.119 N/A THR 37.A OG1 ASP 35.A OD2 no hydrogen 3.415 N/A HIS 41.A NE2 GLN 38.A OE1 no hydrogen 3.133 N/A PHE 45.A N LEU 345.A O no hydrogen 3.179 N/A GLY 47.A N LEU 343.A O no hydrogen 2.889 N/A TYR 48.A N GLU 79.A O no hydrogen 2.887 N/A TYR 48.A OH THR 166.A OG1 no hydrogen 2.609 N/A LYS 49.A N ARG 341.A O no hydrogen 3.155 N/A LYS 49.A NZ VAL 335.A O no hydrogen 3.422 N/A LYS 49.A NZ GLY 337.A O no hydrogen 2.941 N/A ALA 50.A N ILE 77.A O no hydrogen 2.805 N/A THR 53.A N VAL 75.A O no hydrogen 2.752 N/A THR 53.A OG1 ASP 367.A O no hydrogen 2.513 N/A VAL 55.A N GLU 73.A O no hydrogen 2.691 N/A VAL 56.A N PHE 365.A O no hydrogen 3.083 N/A ARG 57.A N ILE 71.A O no hydrogen 3.060 N/A ASP 58.A N ASP 58.A OD1 no hydrogen 2.464 N/A LEU 59.A N LYS 69.A O no hydrogen 3.064 N/A SER 64.A N LYS 61.A O no hydrogen 3.382 N/A SER 64.A OG LYS 61.A O no hydrogen 2.738 N/A SER 64.A OG MET 66.A O no hydrogen 2.294 N/A LYS 68.A N LEU 59.A O no hydrogen 2.744 N/A LYS 69.A NZ HIS 67.A O no hydrogen 3.176 N/A ILE 71.A N ARG 57.A O no hydrogen 2.782 N/A GLU 73.A N VAL 55.A O no hydrogen 2.731 N/A VAL 75.A N THR 53.A O no hydrogen 2.649 N/A THR 76.A N LEU 331.A O no hydrogen 3.052 N/A ILE 77.A N GLY 51.A O no hydrogen 3.325 N/A ILE 78.A N LEU 329.A O no hydrogen 3.011 N/A GLU 79.A N TYR 48.A O no hydrogen 2.665 N/A CYS 80.A N GLU 327.A O no hydrogen 2.552 N/A MET 83.A N VAL 205.A O no hydrogen 3.055 N/A ILE 85.A N LYS 203.A O no hydrogen 3.440 N/A VAL 86.A N ILE 163.A O no hydrogen 2.925 N/A LEU 88.A N VAL 104.A O no hydrogen 2.554 N/A VAL 89.A N ARG 161.A O no hydrogen 2.777 N/A TYR 91.A N VAL 159.A O no hydrogen 3.079 N/A TYR 91.A OH GLU 182.A OE1 no hydrogen 2.625 N/A TYR 91.A OH GLU 182.A OE2 no hydrogen 3.323 N/A VAL 92.A N LYS 99.A O no hydrogen 3.285 N/A THR 94.A OG1 VAL 92.A O no hydrogen 3.553 N/A THR 94.A OG1 GLY 97.A O no hydrogen 3.448 N/A GLY 97.A N THR 94.A O no hydrogen 3.415 N/A LYS 99.A N VAL 92.A O no hydrogen 3.182 N/A TYR 101.A N GLY 90.A O no hydrogen 2.699 N/A LYS 102.A NZ TYR 101.A O no hydrogen 3.488 N/A TRP 105.A N TYR 133.A OH no hydrogen 3.177 N/A ALA 106.A N VAL 86.A O no hydrogen 3.104 N/A HIS 108.A N GLU 202.A OE2 no hydrogen 2.891 N/A LEU 109.A N GLN 107.A O no hydrogen 3.099 N/A ASN 112.A N SER 110.A OG no hydrogen 3.426 N/A ARG 114.A N SER 110.A O no hydrogen 3.142 N/A ARG 114.A NE ALA 129.A O no hydrogen 2.853 N/A ARG 114.A NH1 ASP 111.A OD1 no hydrogen 2.558 N/A ARG 114.A NH2 ALA 129.A O no hydrogen 3.327 N/A ARG 115.A N ASN 112.A O no hydrogen 3.250 N/A ARG 116.A N PHE 113.A O no hydrogen 3.087 N/A TYR 118.A N ARG 115.A O no hydrogen 3.338 N/A SER 124.A OG TRP 121.A O no hydrogen 3.108 N/A THR 131.A OG1 LYS 128.A O no hydrogen 3.036 N/A LYS 135.A NZ GLU 138.A OE2 no hydrogen 2.977 N/A GLN 136.A N TYR 133.A O no hydrogen 3.023 N/A TYR 137.A N VAL 134.A O no hydrogen 3.341 N/A TYR 137.A OH TRP 105.A O no hydrogen 3.040 N/A GLU 138.A N LYS 135.A O no hydrogen 3.257 N/A GLU 141.A N THR 139.A OG1 no hydrogen 3.252 N/A LYS 144.A N GLU 140.A O no hydrogen 3.275 N/A SER 145.A OG GLY 142.A O no hydrogen 2.353 N/A ILE 146.A N GLY 142.A O no hydrogen 3.318 N/A ALA 148.A N LYS 144.A O no hydrogen 3.094 N/A SER 149.A N SER 145.A O no hydrogen 2.875 N/A LEU 150.A N ILE 146.A O no hydrogen 2.897 N/A LEU 150.A N GLU 147.A O no hydrogen 3.097 N/A GLN 151.A N GLU 147.A O no hydrogen 2.861 N/A LYS 154.A N LEU 150.A O no hydrogen 2.974 N/A LYS 154.A NZ ASN 195.A OD1 no hydrogen 3.323 N/A ARG 156.A N ALA 152.A O no hydrogen 2.920 N/A CYS 157.A SG ILE 153.A O no hydrogen 3.154 N/A SER 158.A N TYR 91.A O no hydrogen 2.911 N/A VAL 159.A N TYR 91.A O no hydrogen 3.176 N/A ARG 161.A N VAL 89.A O no hydrogen 3.149 N/A ARG 161.A NH1 GLU 182.A OE1 no hydrogen 3.383 N/A VAL 162.A N ILE 183.A O no hydrogen 2.881 N/A ILE 163.A N GLY 87.A O no hydrogen 3.197 N/A ALA 164.A N LEU 181.A O no hydrogen 2.870 N/A HIS 165.A N TYR 84.A O no hydrogen 2.614 N/A THR 166.A N HIS 179.A O no hydrogen 3.072 N/A THR 166.A OG1 TYR 48.A OH no hydrogen 2.609 N/A THR 166.A OG1 HIS 179.A O no hydrogen 3.326 N/A LYS 170.A NZ GLN 167.A OE1 no hydrogen 3.037 N/A LEU 171.A N VAL 168.A O no hydrogen 3.149 N/A THR 174.A OG1 LEU 173.A O no hydrogen 3.297 N/A ALA 178.A N ASN 112.A O no hydrogen 3.271 N/A LEU 181.A N ALA 164.A O no hydrogen 2.927 N/A ILE 183.A N VAL 162.A O no hydrogen 2.878 N/A GLN 184.A NE2 PRO 32.A O no hydrogen 3.364 N/A GLN 184.A NE2 ASN 186.A OD1 no hydrogen 2.344 N/A VAL 185.A N VAL 160.A O no hydrogen 2.727 N/A ASN 186.A N HIS 41.A O no hydrogen 3.056 N/A ASN 186.A ND2 PRO 32.A O no hydrogen 3.343 N/A GLY 188.A N GLN 38.A O no hydrogen 3.385 N/A GLU 192.A N SER 189.A O no hydrogen 2.378 N/A LYS 193.A NZ ASP 34.A OD2 no hydrogen 3.052 N/A LYS 193.A NZ VAL 185.A O no hydrogen 3.314 N/A VAL 194.A N ILE 190.A O no hydrogen 2.923 N/A PHE 196.A N GLU 192.A O no hydrogen 2.876 N/A ALA 197.A N LYS 193.A O no hydrogen 2.882 N/A VAL 198.A N VAL 194.A O no hydrogen 2.927 N/A ALA 199.A N ASN 195.A O no hydrogen 2.909 N/A ASN 200.A N ALA 197.A O no hydrogen 2.975 N/A GLU 202.A N ILE 85.A O no hydrogen 3.201 N/A LYS 203.A N ASN 200.A O no hydrogen 3.344 N/A LYS 203.A NZ PHE 201.A O no hydrogen 3.275 N/A VAL 205.A N MET 83.A O no hydrogen 2.855 N/A GLY 209.A N ASN 206.A O no hydrogen 3.434 N/A PHE 211.A N VAL 207.A O no hydrogen 3.060 N/A ILE 217.A N LYS 282.A O no hydrogen 3.331 N/A ASP 218.A N ARG 346.A O no hydrogen 2.836 N/A VAL 219.A N GLU 279.A O no hydrogen 2.916 N/A ILE 220.A N THR 344.A O no hydrogen 2.868 N/A GLY 221.A N ARG 277.A O no hydrogen 2.900 N/A THR 223.A N HIS 275.A O no hydrogen 2.955 N/A THR 223.A OG1 HIS 275.A O no hydrogen 3.546 N/A LYS 226.A N LEU 272.A O no hydrogen 2.848 N/A ASN 229.A N GLY 270.A O no hydrogen 2.817 N/A ASN 229.A ND2 GLY 227.A O no hydrogen 3.665 N/A ARG 234.A N VAL 231.A O no hydrogen 2.963 N/A ARG 234.A NE GLN 271.A O no hydrogen 3.049 N/A ARG 234.A NH1 ARG 268.A O no hydrogen 2.882 N/A ARG 234.A NH2 ARG 18.A O no hydrogen 3.488 N/A ARG 234.A NH2 GLN 271.A O no hydrogen 3.198 N/A TRP 235.A N VAL 231.A O no hydrogen 2.737 N/A TRP 235.A NE1 ARG 268.A O no hydrogen 2.841 N/A LEU 240.A N LEU 248.A O no hydrogen 2.921 N/A CYS 253.A SG GLY 255.A O no hydrogen 3.273 N/A SER 260.A OG PRO 259.A O no hydrogen 2.743 N/A SER 263.A OG THR 265.A OG1 no hydrogen 2.811 N/A THR 265.A OG1 SER 263.A OG no hydrogen 2.811 N/A GLY 270.A N ASN 229.A O no hydrogen 2.943 N/A GLN 271.A NE2 GLY 273.A O no hydrogen 2.775 N/A LEU 272.A N GLY 227.A O no hydrogen 2.823 N/A TYR 274.A N THR 223.A O no hydrogen 3.213 N/A HIS 275.A N THR 223.A OG1 no hydrogen 3.229 N/A HIS 275.A ND1 LYS 19.A O no hydrogen 3.038 N/A ARG 277.A N GLY 221.A O no hydrogen 2.899 N/A ARG 277.A NH1 HIS 276.A O no hydrogen 2.739 N/A GLU 279.A N VAL 219.A O no hydrogen 2.896 N/A ASN 281.A N ASP 218.A OD1 no hydrogen 3.409 N/A LYS 282.A N ILE 217.A O no hydrogen 2.904 N/A LYS 282.A NZ CYS 334.A O no hydrogen 2.402 N/A LYS 283.A NZ ALA 356.A O no hydrogen 2.486 N/A LYS 283.A NZ GLU 359.A O no hydrogen 3.355 N/A ILE 284.A N GLU 215.A O no hydrogen 2.880 N/A TYR 285.A N MET 330.A O no hydrogen 2.850 N/A ARG 286.A N MET 330.A O no hydrogen 3.376 N/A ILE 287.A N GLU 213.A OE1 no hydrogen 3.343 N/A GLY 288.A N PHE 328.A O no hydrogen 2.843 N/A GLN 291.A N LYS 325.A O no hydrogen 2.910 N/A GLN 291.A NE2 ILE 298.A O no hydrogen 2.806 N/A SER 299.A OG GLU 309.A OE1 no hydrogen 3.211 N/A THR 303.A OG1 GLU 304.A O no hydrogen 2.575 N/A THR 303.A OG1 LEU 363.A O no hydrogen 3.418 N/A THR 303.A OG1 LYS 364.A O no hydrogen 2.897 N/A THR 308.A OG1 ASP 306.A O no hydrogen 3.384 N/A THR 308.A OG1 ASP 306.A OD1 no hydrogen 3.256 N/A LYS 310.A NZ ASP 306.A OD2 no hydrogen 2.422 N/A THR 311.A OG1 ASN 313.A O no hydrogen 3.246 N/A ILE 312.A N THR 300.A OG1 no hydrogen 2.683 N/A ASN 313.A N THR 311.A OG1 no hydrogen 3.259 N/A MET 315.A N THR 368.A O no hydrogen 3.151 N/A GLY 317.A N PRO 314.A O no hydrogen 3.124 N/A TYR 321.A N PHE 318.A O no hydrogen 3.264 N/A TYR 321.A OH GLU 79.A OE1 no hydrogen 2.317 N/A VAL 324.A N ASN 313.A OD1 no hydrogen 2.964 N/A LYS 325.A N GLU 79.A OE2 no hydrogen 3.369 N/A HIS 326.A NE2 LYS 170.A O no hydrogen 2.602 N/A LEU 329.A N ILE 78.A O no hydrogen 2.790 N/A MET 330.A N ARG 286.A O no hydrogen 2.834 N/A LEU 331.A N THR 76.A O no hydrogen 3.192 N/A LYS 332.A N LYS 283.A O no hydrogen 2.983 N/A LYS 332.A NZ TYR 285.A OH no hydrogen 3.390 N/A GLY 333.A N ALA 74.A O no hydrogen 3.083 N/A LYS 340.A N LYS 49.A O no hydrogen 3.089 N/A LYS 340.A NZ HIS 320.A O no hydrogen 2.653 N/A LEU 343.A N GLY 47.A O no hydrogen 3.037 N/A THR 344.A N ILE 220.A O no hydrogen 2.892 N/A THR 344.A OG1 GLY 26.A O no hydrogen 2.560 N/A ARG 346.A N ASP 218.A O no hydrogen 2.878 N/A ARG 346.A NH1 SER 30.A O no hydrogen 2.567 N/A ARG 346.A NH2 ASP 218.A OD2 no hydrogen 2.406 N/A LYS 347.A N THR 43.A O no hydrogen 2.807 N/A LYS 347.A NZ VAL 210.A O no hydrogen 2.829 N/A SER 348.A OG THR 350.A O no hydrogen 2.535 N/A ILE 361.A N ASN 214.A OD1 no hydrogen 3.245 N/A LYS 364.A N VAL 56.A O no hydrogen 2.990 N/A LYS 364.A NZ GLU 70.A OE2 no hydrogen 2.857 N/A PHE 365.A N VAL 56.A O no hydrogen 3.460 N/A ASP 367.A N HIS 54.A O no hydrogen 3.158 N/A THR 368.A OG1 GLN 378.A O no hydrogen 2.558 N/A SER 369.A OG GLY 375.A O no hydrogen 2.787 N/A SER 369.A OG HIS 377.A O no hydrogen 2.871 N/A SER 370.A OG MET 315.A O no hydrogen 3.096 N/A LYS 371.A NZ THR 53.A OG1 no hydrogen 2.476 N/A LYS 371.A NZ ASP 367.A O no hydrogen 2.695 N/A LYS 371.A NZ ASP 367.A OD2 no hydrogen 3.457 N/A GLY 375.A N SER 370.A O no hydrogen 3.169 N/A LYS 383.A N THR 379.A O no hydrogen 3.404 N/A THR 384.A OG1 GLU 381.A O no hydrogen 2.976 N/A LYS 385.A N GLU 381.A O no hydrogen 2.941 N/A LYS 385.A NZ ASP 382.A OD1 no hydrogen 3.326 N/A TYR 386.A N LYS 383.A O no hydrogen 3.326 N/A PHE 387.A N LYS 383.A O no hydrogen 3.221 N/A