Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w1j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N LYS 2.A O no hydrogen 3.132 N/A ILE 13.A N PRO 356.A O no hydrogen 2.923 N/A ASN 14.A ND2 VAL 18.A O no hydrogen 3.230 N/A ALA 15.A N VAL 358.A O no hydrogen 2.729 N/A THR 16.A N ASN 14.A OD1 no hydrogen 3.367 N/A THR 16.A OG1 ASN 14.A OD1 no hydrogen 2.466 N/A GLY 17.A N THR 372.A OG1 no hydrogen 3.199 N/A VAL 19.A N PRO 319.A O no hydrogen 2.559 N/A ASN 23.A N ASN 21.A OD1 no hydrogen 2.783 N/A LEU 24.A N ASN 21.A O no hydrogen 3.219 N/A LEU 24.A N ASN 21.A OD1 no hydrogen 3.079 N/A ARG 26.A N ASN 21.A O no hydrogen 2.850 N/A ARG 26.A NH1 ASP 224.A OD2 no hydrogen 3.257 N/A ALA 27.A N ASP 224.A O no hydrogen 3.351 N/A SER 30.A OG ASP 277.A O no hydrogen 2.846 N/A VAL 33.A N SER 30.A O no hydrogen 3.034 N/A ILE 34.A N SER 30.A O no hydrogen 3.164 N/A ASN 35.A N LYS 31.A O no hydrogen 3.079 N/A ILE 37.A N VAL 33.A O no hydrogen 2.938 N/A SER 38.A N ILE 34.A O no hydrogen 2.666 N/A GLU 39.A N ASN 35.A O no hydrogen 2.745 N/A ILE 40.A N PHE 36.A O no hydrogen 3.034 N/A ALA 41.A N ILE 37.A O no hydrogen 3.050 N/A ALA 41.A N SER 38.A O no hydrogen 2.984 N/A ASN 42.A N SER 38.A O no hydrogen 2.901 N/A ASN 50.A N LYS 55.A O no hydrogen 2.809 N/A GLU 52.A N ASN 50.A OD1 no hydrogen 3.258 N/A GLY 57.A N GLU 48.A O no hydrogen 3.119 N/A ARG 59.A NH1 ILE 255.A O no hydrogen 3.210 N/A HIS 62.A N ARG 59.A O no hydrogen 3.271 N/A HIS 62.A ND1 ARG 59.A O no hydrogen 2.594 N/A HIS 62.A NE2 ASN 46.A O no hydrogen 3.159 N/A LEU 67.A N ILE 63.A O no hydrogen 3.395 N/A ASN 68.A N GLU 64.A O no hydrogen 3.022 N/A GLU 69.A N LYS 65.A O no hydrogen 2.947 N/A LEU 70.A N TYR 66.A O no hydrogen 2.907 N/A THR 71.A N LEU 67.A O no hydrogen 2.748 N/A THR 71.A OG1 LEU 67.A O no hydrogen 3.168 N/A GLY 72.A N ASN 68.A O no hydrogen 2.879 N/A ALA 73.A N THR 71.A OG1 no hydrogen 3.365 N/A SER 75.A N GLY 236.A O no hydrogen 2.870 N/A SER 76.A OG GLU 64.A O no hydrogen 3.438 N/A SER 76.A OG ASN 68.A OD1 no hydrogen 2.517 N/A PHE 77.A N ILE 234.A O no hydrogen 2.905 N/A VAL 79.A N GLY 232.A O no hydrogen 2.681 N/A ASN 80.A N LEU 253.A O no hydrogen 2.688 N/A ASN 82.A ND2 ASP 187.A OD1 no hydrogen 3.017 N/A GLY 84.A N ASN 81.A OD1 no hydrogen 2.697 N/A ALA 85.A N ASN 81.A O no hydrogen 2.918 N/A VAL 86.A N ASN 82.A O no hydrogen 2.827 N/A PHE 87.A N ALA 83.A O no hydrogen 2.861 N/A LEU 88.A N GLY 84.A O no hydrogen 2.563 N/A VAL 89.A N ALA 85.A O no hydrogen 2.992 N/A LEU 90.A N VAL 86.A O no hydrogen 2.921 N/A ASN 91.A N PHE 87.A O no hydrogen 3.070 N/A ASN 91.A ND2 SER 122.A O no hydrogen 3.007 N/A THR 92.A N LEU 88.A O no hydrogen 2.848 N/A THR 92.A OG1 LEU 88.A O no hydrogen 3.190 N/A LEU 93.A N VAL 89.A O no hydrogen 2.890 N/A ALA 94.A N LEU 90.A O no hydrogen 2.837 N/A GLY 96.A N GLY 123.A O no hydrogen 2.725 N/A LYS 97.A N ALA 94.A O no hydrogen 2.731 N/A GLU 98.A N ASN 147.A O no hydrogen 2.951 N/A VAL 99.A N ILE 125.A O no hydrogen 2.767 N/A ILE 100.A N LEU 150.A O no hydrogen 2.889 N/A ILE 101.A N ARG 127.A O no hydrogen 3.062 N/A ARG 103.A N VAL 129.A O no hydrogen 2.867 N/A ARG 103.A NE GLY 130.A O no hydrogen 2.869 N/A GLY 104.A N SER 102.A OG no hydrogen 2.909 N/A GLU 105.A N SER 102.A O no hydrogen 3.322 N/A ILE 109.A N PHE 113.A O no hydrogen 2.982 N/A ARG 114.A NE GLU 108.A OE1 no hydrogen 2.755 N/A ARG 114.A NH1 ASP 117.A OD2 no hydrogen 3.431 N/A ILE 115.A N VAL 107.A O no hydrogen 2.972 N/A ASP 117.A N ARG 114.A O no hydrogen 3.157 N/A ILE 118.A N ARG 114.A O no hydrogen 3.009 N/A MET 119.A N ILE 115.A O no hydrogen 2.902 N/A LYS 120.A N PRO 116.A O no hydrogen 3.109 N/A LYS 121.A N ASP 117.A O no hydrogen 3.127 N/A SER 122.A N MET 119.A O no hydrogen 3.097 N/A SER 122.A OG MET 119.A O no hydrogen 2.850 N/A GLY 123.A N LYS 120.A O no hydrogen 3.207 N/A ALA 124.A N SER 122.A OG no hydrogen 2.999 N/A ILE 125.A N LYS 97.A O no hydrogen 2.854 N/A ARG 127.A N VAL 99.A O no hydrogen 2.785 N/A VAL 129.A N ILE 101.A O no hydrogen 3.120 N/A THR 131.A N LYS 134.A O no hydrogen 2.989 N/A THR 131.A OG1 LYS 134.A O no hydrogen 2.422 N/A ASN 133.A ND2 PHE 164.A O no hydrogen 3.251 N/A LYS 134.A N THR 131.A OG1 no hydrogen 3.135 N/A THR 135.A N GLU 166.A O no hydrogen 2.835 N/A THR 135.A OG1 THR 131.A O no hydrogen 3.247 N/A THR 135.A OG1 LYS 134.A O no hydrogen 2.772 N/A LYS 136.A N ASP 139.A OD2 no hydrogen 2.492 N/A ASP 139.A N LYS 136.A O no hydrogen 3.397 N/A TYR 140.A N VAL 137.A O no hydrogen 2.570 N/A GLU 141.A N VAL 137.A O no hydrogen 3.041 N/A GLY 142.A N SER 138.A O no hydrogen 2.947 N/A ALA 143.A N TYR 140.A O no hydrogen 3.182 N/A ILE 144.A N GLU 141.A O no hydrogen 3.325 N/A ASN 145.A N THR 148.A OG1 no hydrogen 3.068 N/A ASN 145.A ND2 GLU 98.A OE2 no hydrogen 2.862 N/A ASN 145.A ND2 ALA 143.A O no hydrogen 3.396 N/A ASN 147.A N ASN 145.A OD1 no hydrogen 2.622 N/A THR 148.A N ASN 145.A O no hydrogen 3.002 N/A ALA 149.A N GLU 98.A O no hydrogen 2.792 N/A LEU 150.A N GLU 98.A O no hydrogen 3.360 N/A LEU 151.A N PRO 183.A O no hydrogen 3.000 N/A MET 152.A N ILE 100.A O no hydrogen 2.847 N/A LYS 153.A N TYR 185.A O no hydrogen 2.906 N/A LYS 153.A NZ GLU 105.A OE2 no hydrogen 2.473 N/A LYS 153.A NZ GLU 167.A OE2 no hydrogen 3.523 N/A VAL 154.A N GLU 105.A OE1 no hydrogen 3.208 N/A HIS 155.A N ASP 187.A O no hydrogen 3.018 N/A HIS 155.A NE2 GLU 205.A OE1 no hydrogen 3.154 N/A SER 157.A OG GLY 322.A O no hydrogen 3.437 N/A ASN 158.A ND2 GLU 108.A O no hydrogen 2.985 N/A GLU 166.A N ASN 133.A O no hydrogen 2.853 N/A LEU 173.A N LYS 169.A O no hydrogen 3.202 N/A VAL 174.A N LEU 170.A O no hydrogen 2.967 N/A LYS 175.A N GLU 171.A O no hydrogen 3.170 N/A LEU 176.A N ASP 172.A O no hydrogen 2.910 N/A GLY 177.A N LEU 173.A O no hydrogen 2.753 N/A HIS 178.A N VAL 174.A O no hydrogen 2.975 N/A LYS 179.A N LYS 175.A O no hydrogen 2.964 N/A LYS 179.A NZ GLU 141.A OE2 no hydrogen 2.945 N/A TYR 180.A N LEU 176.A O no hydrogen 3.242 N/A TYR 180.A OH GLU 141.A OE2 no hydrogen 2.264 N/A ILE 182.A N GLY 177.A O no hydrogen 2.862 N/A THR 184.A N ASP 217.A OD2 no hydrogen 2.690 N/A TYR 185.A N LEU 151.A O no hydrogen 2.854 N/A TYR 185.A OH SER 220.A OG no hydrogen 2.539 N/A TYR 186.A N LEU 218.A O no hydrogen 2.790 N/A ASP 187.A N LYS 153.A O no hydrogen 2.942 N/A ALA 188.A N SER 220.A O no hydrogen 3.031 N/A LYS 197.A N ASN 195.A OD1 no hydrogen 3.018 N/A PHE 199.A N LEU 196.A O no hydrogen 2.670 N/A PHE 208.A N LEU 192.A O no hydrogen 2.879 N/A ASP 210.A N ASN 207.A OD1 no hydrogen 2.929 N/A CYS 211.A N ASN 207.A O no hydrogen 2.873 N/A ILE 212.A N PHE 208.A O no hydrogen 2.808 N/A SER 213.A N ARG 209.A O no hydrogen 3.162 N/A SER 213.A OG ARG 209.A O no hydrogen 3.232 N/A SER 213.A OG ASP 210.A O no hydrogen 3.027 N/A GLY 215.A N ILE 212.A O no hydrogen 2.810 N/A ASP 217.A N THR 184.A O no hydrogen 3.056 N/A ASP 217.A N THR 184.A OG1 no hydrogen 3.065 N/A LEU 218.A N THR 184.A O no hydrogen 2.867 N/A VAL 219.A N VAL 235.A O no hydrogen 2.949 N/A SER 220.A N TYR 186.A O no hydrogen 3.011 N/A SER 220.A OG ASN 82.A OD1 no hydrogen 3.191 N/A SER 220.A OG TYR 185.A OH no hydrogen 2.539 N/A SER 222.A N GLY 189.A O no hydrogen 3.132 N/A GLY 223.A N ALA 231.A O no hydrogen 2.900 N/A GLY 228.A N GLY 223.A O no hydrogen 2.828 N/A GLN 230.A NE2 ASN 80.A O no hydrogen 3.128 N/A GLY 232.A N VAL 79.A O no hydrogen 2.565 N/A ILE 233.A N GLY 221.A O no hydrogen 2.847 N/A ILE 234.A N PHE 77.A O no hydrogen 2.806 N/A VAL 235.A N VAL 219.A O no hydrogen 3.061 N/A GLY 236.A N SER 75.A O no hydrogen 2.906 N/A LYS 237.A N ASP 217.A O no hydrogen 3.175 N/A LYS 238.A N GLU 74.A OE1 no hydrogen 2.919 N/A LEU 240.A N LYS 237.A O no hydrogen 2.990 N/A ILE 241.A N LYS 237.A O no hydrogen 3.093 N/A GLU 242.A N LYS 238.A O no hydrogen 3.039 N/A LYS 243.A N ASN 239.A O no hydrogen 3.345 N/A ILE 244.A N LEU 240.A O no hydrogen 2.857 N/A LYS 245.A N ILE 241.A O no hydrogen 2.602 N/A LYS 246.A N GLU 242.A O no hydrogen 3.134 N/A ASN 247.A N ILE 244.A O no hydrogen 2.762 N/A ASN 247.A ND2 ASN 91.A OD1 no hydrogen 2.803 N/A ASN 247.A ND2 THR 92.A OG1 no hydrogen 3.097 N/A ILE 249.A N ASN 247.A OD1 no hydrogen 2.981 N/A ALA 250.A N ASN 247.A O no hydrogen 3.006 N/A ARG 251.A N PRO 248.A O no hydrogen 2.998 N/A ARG 251.A NH1 ARG 251.A O no hydrogen 3.020 N/A LEU 253.A N ILE 249.A O no hydrogen 3.267 N/A ARG 254.A N ARG 251.A O no hydrogen 3.402 N/A ARG 254.A NH1 GLU 48.A OE2 no hydrogen 3.076 N/A THR 259.A N ASP 256.A OD2 no hydrogen 2.766 N/A THR 259.A OG1 ASP 256.A OD1 no hydrogen 2.445 N/A LEU 260.A N ASP 256.A O no hydrogen 3.189 N/A SER 261.A N LYS 257.A O no hydrogen 2.870 N/A SER 261.A OG LYS 257.A O no hydrogen 2.702 N/A GLY 262.A N LEU 258.A O no hydrogen 2.832 N/A LEU 263.A N THR 259.A O no hydrogen 2.491 N/A GLU 264.A N LEU 260.A O no hydrogen 2.791 N/A MET 265.A N SER 261.A O no hydrogen 3.011 N/A THR 266.A N GLY 262.A O no hydrogen 2.914 N/A THR 266.A OG1 GLY 262.A O no hydrogen 2.604 N/A LEU 267.A N LEU 263.A O no hydrogen 2.909 N/A LYS 268.A N GLU 264.A O no hydrogen 2.781 N/A LYS 268.A NZ GLU 272.A OE2 no hydrogen 2.508 N/A LEU 269.A N MET 265.A O no hydrogen 3.109 N/A TYR 270.A N THR 266.A O no hydrogen 3.282 N/A TYR 270.A OH LEU 226.A O no hydrogen 2.709 N/A PHE 271.A N LEU 267.A O no hydrogen 2.989 N/A GLU 272.A N LYS 268.A O no hydrogen 2.876 N/A LYS 273.A N TYR 270.A O no hydrogen 2.797 N/A ARG 274.A N LEU 269.A O no hydrogen 2.984 N/A ARG 274.A NE ASP 277.A OD1 no hydrogen 3.003 N/A ARG 274.A NH1 ASP 32.A OD2 no hydrogen 2.647 N/A GLU 276.A N GLU 276.A OE1 no hydrogen 2.541 N/A ASP 277.A N ARG 274.A O no hydrogen 3.044 N/A ILE 278.A N TYR 275.A O no hydrogen 2.831 N/A ILE 281.A N ILE 278.A O no hydrogen 3.108 N/A ARG 282.A N ILE 278.A O no hydrogen 3.066 N/A MET 283.A N PRO 279.A O no hydrogen 2.823 N/A LEU 284.A N VAL 280.A O no hydrogen 3.187 N/A LEU 284.A N ILE 281.A O no hydrogen 3.270 N/A THR 285.A N ILE 281.A O no hydrogen 3.144 N/A THR 285.A N ARG 282.A O no hydrogen 3.271 N/A THR 285.A OG1 ILE 281.A O no hydrogen 3.100 N/A LEU 291.A N ASP 287.A O no hydrogen 3.307 N/A GLN 293.A N LYS 289.A O no hydrogen 3.028 N/A LYS 294.A N ALA 290.A O no hydrogen 3.147 N/A LYS 294.A N LEU 291.A O no hydrogen 3.172 N/A LYS 294.A NZ MET 370.A O no hydrogen 2.927 N/A LYS 294.A NZ VAL 373.A O no hydrogen 2.679 N/A ALA 295.A N LEU 291.A O no hydrogen 2.749 N/A ALA 295.A N ARG 292.A O no hydrogen 2.475 N/A LYS 296.A N ARG 292.A O no hydrogen 2.947 N/A LYS 296.A NZ GLU 299.A OE1 no hydrogen 3.426 N/A LEU 298.A N ALA 295.A O no hydrogen 3.036 N/A GLU 299.A N ALA 295.A O no hydrogen 3.358 N/A LYS 300.A N LYS 296.A O no hydrogen 3.025 N/A LEU 301.A N LEU 298.A O no hydrogen 2.695 N/A LEU 302.A N GLU 299.A O no hydrogen 2.821 N/A LYS 303.A N GLU 299.A O no hydrogen 3.117 N/A ILE 305.A N LEU 302.A O no hydrogen 3.262 N/A LYS 309.A N ARG 337.A O no hydrogen 2.852 N/A SER 311.A N ALA 335.A O no hydrogen 2.848 N/A ILE 313.A N CYS 333.A O no hydrogen 2.961 N/A ASP 315.A N THR 331.A O no hydrogen 2.986 N/A LYS 316.A NZ GLU 328.A OE1 no hydrogen 3.008 N/A ALA 317.A N LEU 329.A O no hydrogen 3.288 N/A GLY 322.A N ILE 20.A O no hydrogen 3.006 N/A LEU 327.A N LEU 324.A O no hydrogen 3.370 N/A LEU 329.A N ALA 317.A O no hydrogen 2.928 N/A THR 331.A N ASP 315.A O no hydrogen 2.889 N/A THR 331.A OG1 ASP 369.A OD1 no hydrogen 2.749 N/A CYS 333.A N ILE 313.A O no hydrogen 2.992 N/A VAL 334.A N PHE 368.A O no hydrogen 3.009 N/A ALA 335.A N SER 311.A O no hydrogen 2.766 N/A ILE 336.A N LEU 366.A O no hydrogen 2.869 N/A ARG 337.A N LYS 309.A O no hydrogen 2.872 N/A ARG 340.A N ASP 339.A OD1 no hydrogen 2.553 N/A ARG 340.A NH1 LEU 389.A O no hydrogen 3.553 N/A LEU 341.A N HIS 338.A ND1 no hydrogen 3.391 N/A SER 343.A OG ASP 364.A OD1 no hydrogen 3.236 N/A GLU 345.A N SER 342.A O no hydrogen 3.034 N/A LEU 346.A N SER 342.A O no hydrogen 2.844 N/A SER 347.A N SER 343.A O no hydrogen 2.769 N/A SER 347.A OG GLN 344.A O no hydrogen 3.150 N/A ARG 348.A N GLN 344.A O no hydrogen 3.433 N/A ARG 348.A NE GLU 345.A OE1 no hydrogen 3.151 N/A ARG 348.A NH2 GLU 345.A OE1 no hydrogen 3.015 N/A ARG 349.A NE GLU 345.A OE2 no hydrogen 2.718 N/A ARG 349.A NH2 GLU 345.A OE2 no hydrogen 3.278 N/A LEU 350.A N LEU 346.A O no hydrogen 3.087 N/A ARG 351.A N SER 347.A O no hydrogen 3.068 N/A LEU 352.A N ARG 349.A O no hydrogen 3.191 N/A ALA 353.A N LEU 350.A O no hydrogen 3.427 N/A ILE 357.A N LEU 350.A O no hydrogen 2.854 N/A VAL 358.A N ILE 13.A O no hydrogen 2.992 N/A ARG 362.A N GLN 365.A O no hydrogen 3.074 N/A ARG 362.A NH1 ASP 315.A OD2 no hydrogen 3.305 N/A ARG 362.A NH2 ASP 315.A OD2 no hydrogen 2.461 N/A GLN 365.A N ARG 362.A O no hydrogen 2.853 N/A LEU 366.A N ILE 336.A O no hydrogen 3.207 N/A LEU 367.A N ARG 360.A O no hydrogen 3.231 N/A PHE 368.A N VAL 334.A O no hydrogen 3.193 N/A ASP 369.A N ALA 15.A O no hydrogen 2.747 N/A ARG 371.A N ASP 369.A OD1 no hydrogen 3.385 N/A THR 372.A OG1 ASN 14.A O no hydrogen 2.433 N/A VAL 373.A N MET 370.A O no hydrogen 3.218 N/A PHE 374.A N ASP 377.A OD2 no hydrogen 3.048 N/A GLU 376.A N GLU 376.A OE1 no hydrogen 2.555 N/A ASP 377.A N PHE 374.A O no hydrogen 2.887 N/A ILE 381.A N ASP 377.A O no hydrogen 2.722 N/A ILE 381.A N LEU 378.A O no hydrogen 2.720 N/A LYS 382.A N LEU 378.A O no hydrogen 2.961 N/A LYS 383.A N LYS 379.A O no hydrogen 3.194 N/A LYS 383.A NZ GLU 387.A OE1 no hydrogen 2.417 N/A THR 384.A N ILE 381.A O no hydrogen 3.050 N/A THR 384.A OG1 THR 380.A O no hydrogen 2.771 N/A LEU 385.A N ILE 381.A O no hydrogen 2.926 N/A GLN 386.A N LYS 382.A O no hydrogen 3.089 N/A GLU 387.A N LYS 383.A O no hydrogen 3.190 N/A LEU 388.A N LEU 385.A O no hydrogen 3.321 N/A LEU 389.A N LEU 385.A O no hydrogen 3.173 N/A SER 390.A N GLN 386.A O no hydrogen 2.943 N/A SER 390.A OG GLN 386.A O no hydrogen 2.978 N/A