Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6u4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N PHE 21.A O no hydrogen 2.888 N/A SER 5.A N ASN 77.A OD1 no hydrogen 2.815 N/A LEU 6.A N MET 19.A O no hydrogen 2.955 N/A LYS 7.A N ASP 79.A O no hydrogen 3.058 N/A LYS 7.A NZ THR 18.A OG1 no hydrogen 2.985 N/A ILE 8.A N LYS 17.A O no hydrogen 2.765 N/A CYS 9.A N LEU 81.A O no hydrogen 2.614 N/A VAL 10.A N VAL 15.A O no hydrogen 2.774 N/A ASN 14.A N ARG 11.A O no hydrogen 3.179 N/A VAL 15.A N VAL 10.A O no hydrogen 3.030 N/A LYS 17.A N ILE 8.A O no hydrogen 2.984 N/A MET 19.A N LEU 6.A O no hydrogen 2.857 N/A PHE 21.A N LEU 4.A O no hydrogen 2.904 N/A THR 25.A N GLU 22.A O no hydrogen 3.210 N/A THR 25.A OG1 GLU 22.A O no hydrogen 3.116 N/A VAL 27.A N ARG 68.A O no hydrogen 3.006 N/A ALA 30.A N ALA 26.A O no hydrogen 3.024 N/A CYS 31.A N VAL 27.A O no hydrogen 2.802 N/A CYS 31.A SG VAL 27.A O no hydrogen 3.410 N/A ARG 32.A N TYR 28.A O no hydrogen 2.553 N/A VAL 33.A N ASP 29.A O no hydrogen 2.750 N/A ILE 34.A N ALA 30.A O no hydrogen 2.911 N/A ARG 35.A N CYS 31.A O no hydrogen 2.957 N/A ARG 35.A NH1 THR 43.A O no hydrogen 3.096 N/A ARG 35.A NH2 TYR 83.A OH no hydrogen 2.694 N/A GLU 36.A N ARG 32.A O no hydrogen 3.091 N/A ARG 37.A N ILE 34.A O no hydrogen 3.356 N/A VAL 38.A N ILE 34.A O no hydrogen 3.091 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.552 N/A ALA 41.A N VAL 38.A O no hydrogen 2.970 N/A THR 43.A OG1 TYR 49.A OH no hydrogen 2.387 N/A ASP 48.A N GLN 45.A O no hydrogen 3.212 N/A TYR 49.A N ALA 46.A O no hydrogen 3.129 N/A TYR 49.A OH THR 43.A OG1 no hydrogen 2.387 N/A GLY 50.A N LYS 84.A O no hydrogen 3.091 N/A PHE 52.A N GLU 82.A O no hydrogen 2.891 N/A LEU 53.A N ILE 62.A O no hydrogen 2.824 N/A ASP 55.A N LYS 60.A O no hydrogen 2.951 N/A GLU 56.A N ASP 55.A OD1 no hydrogen 2.843 N/A ARG 59.A N ASP 57.A OD1 no hydrogen 2.830 N/A LYS 60.A N ASP 57.A O no hydrogen 3.037 N/A ILE 62.A N LEU 53.A O no hydrogen 2.898 N/A TRP 63.A NE1 ASP 106.A OD2 no hydrogen 2.969 N/A LEU 64.A N LEU 51.A O no hydrogen 2.933 N/A GLU 65.A N TYR 73.A OH no hydrogen 2.946 N/A ARG 68.A N GLU 65.A O no hydrogen 3.022 N/A ARG 68.A NH1 GLU 65.A OE2 no hydrogen 2.626 N/A THR 69.A OG1 ASP 71.A OD1 no hydrogen 2.528 N/A THR 69.A OG1 ASP 71.A OD2 no hydrogen 3.265 N/A LEU 70.A N THR 25.A O no hydrogen 2.863 N/A ASP 71.A N PRO 23.A O no hydrogen 2.926 N/A TYR 72.A N THR 69.A O no hydrogen 2.892 N/A TYR 73.A N LEU 70.A O no hydrogen 3.484 N/A MET 74.A N ASP 71.A O no hydrogen 2.994 N/A ARG 76.A N ASP 79.A OD2 no hydrogen 3.152 N/A ASN 77.A ND2 ALA 3.A O no hydrogen 3.072 N/A GLY 78.A N SER 5.A O no hydrogen 2.805 N/A ASP 79.A N ARG 76.A O no hydrogen 3.104 N/A LEU 81.A N LYS 7.A O no hydrogen 2.972 N/A GLU 82.A N PHE 52.A O no hydrogen 3.134 N/A TYR 83.A N CYS 9.A O no hydrogen 2.658 N/A LYS 84.A N GLY 50.A O no hydrogen 2.869 N/A LYS 86.A N ASP 48.A O no hydrogen 3.183 N/A LYS 86.A NZ SER 107.A OG no hydrogen 3.404 N/A ARG 88.A N VAL 104.A O no hydrogen 2.908 N/A ARG 88.A NE ASP 106.A OD1 no hydrogen 2.534 N/A ARG 88.A NH1 GLN 90.A OE1 no hydrogen 2.771 N/A ARG 88.A NH2 ASP 106.A OD1 no hydrogen 3.009 N/A GLN 90.A N VAL 102.A O no hydrogen 2.906 N/A GLN 90.A NE2 LYS 91.A O no hydrogen 3.559 N/A LYS 91.A NZ ASN 179.A OD1 no hydrogen 2.767 N/A ILE 92.A N LYS 100.A O no hydrogen 2.853 N/A ARG 93.A N LEU 182.A O no hydrogen 2.525 N/A ARG 93.A NH1 GLY 97.A O no hydrogen 3.251 N/A ARG 93.A NH2 GLU 134.A OE1 no hydrogen 3.525 N/A MET 94.A N SER 98.A O no hydrogen 2.743 N/A GLY 97.A N MET 94.A O no hydrogen 3.312 N/A SER 98.A N ASP 96.A OD1 no hydrogen 3.220 N/A SER 98.A OG ASP 96.A OD1 no hydrogen 2.773 N/A SER 98.A OG ASP 96.A OD2 no hydrogen 3.372 N/A LYS 100.A N ILE 92.A O no hydrogen 2.776 N/A VAL 102.A N GLN 90.A O no hydrogen 3.013 N/A VAL 104.A N ARG 88.A O no hydrogen 2.926 N/A ASP 106.A N LYS 86.A O no hydrogen 2.853 N/A SER 107.A N ASP 105.A OD1 no hydrogen 3.072 N/A SER 107.A OG ASP 105.A OD1 no hydrogen 2.618 N/A SER 107.A OG ASP 105.A OD2 no hydrogen 3.238 N/A LYS 108.A N ASP 105.A O no hydrogen 3.016 N/A THR 109.A N GLU 112.A OE2 no hydrogen 2.952 N/A THR 109.A OG1 GLU 112.A OE2 no hydrogen 3.119 N/A THR 109.A OG1 HIS 167.A O no hydrogen 3.308 N/A VAL 110.A N ARG 169.A O no hydrogen 2.947 N/A GLY 111.A N HIS 167.A O no hydrogen 3.360 N/A LEU 113.A N THR 109.A O no hydrogen 3.021 N/A LEU 114.A N VAL 110.A O no hydrogen 2.944 N/A VAL 115.A N GLU 112.A O no hydrogen 3.298 N/A THR 116.A OG1 LEU 113.A O no hydrogen 2.898 N/A ILE 117.A N LEU 113.A O no hydrogen 2.853 N/A CYS 118.A N LEU 114.A O no hydrogen 3.146 N/A CYS 118.A SG LEU 114.A O no hydrogen 3.547 N/A SER 119.A OG VAL 115.A O no hydrogen 3.247 N/A ILE 121.A N CYS 118.A O no hydrogen 2.714 N/A GLY 122.A N CYS 118.A O no hydrogen 3.102 N/A ILE 123.A N CYS 118.A O no hydrogen 3.283 N/A THR 124.A OG1 ASP 196.A OD2 no hydrogen 2.991 N/A ASN 125.A N ASN 125.A OD1 no hydrogen 2.578 N/A ASN 125.A ND2 GLU 128.A OE2 no hydrogen 3.204 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 3.034 N/A GLU 128.A N ASN 125.A O no hydrogen 3.121 N/A TYR 129.A N TYR 126.A O no hydrogen 3.431 N/A SER 130.A N ARG 185.A O no hydrogen 3.007 N/A SER 130.A OG HIS 167.A NE2 no hydrogen 2.879 N/A ILE 132.A N LEU 183.A O no hydrogen 3.007 N/A GLN 133.A N ASN 163.A O no hydrogen 3.123 N/A GLN 133.A NE2 GLU 180.A OE1 no hydrogen 3.252 N/A LYS 148.A N LEU 143.A O no hydrogen 2.955 N/A LYS 148.A NZ LYS 148.A O no hydrogen 2.353 N/A GLU 150.A N GLU 146.A O no hydrogen 3.093 N/A LYS 151.A N ARG 147.A O no hydrogen 2.773 N/A LEU 152.A N LYS 148.A O no hydrogen 3.421 N/A LYS 153.A N MET 149.A O no hydrogen 3.038 N/A LYS 153.A NZ GLU 150.A OE2 no hydrogen 2.627 N/A ALA 154.A N GLU 150.A O no hydrogen 2.987 N/A LYS 155.A N LYS 151.A O no hydrogen 3.027 N/A LEU 156.A N LEU 152.A O no hydrogen 2.700 N/A THR 158.A OG1 ASP 159.A O no hydrogen 3.197 N/A ASP 159.A N ASP 159.A OD2 no hydrogen 2.442 N/A ASN 163.A ND2 GLN 133.A O no hydrogen 3.535 N/A LEU 165.A N LEU 131.A O no hydrogen 3.095 N/A ASP 166.A N GLN 174.A OE1 no hydrogen 2.507 N/A HIS 167.A NE2 SER 130.A OG no hydrogen 2.879 N/A SER 168.A N ASP 166.A OD1 no hydrogen 3.180 N/A SER 168.A OG ASP 166.A OD1 no hydrogen 2.766 N/A ARG 169.A N ASP 166.A O no hydrogen 3.307 N/A THR 170.A N GLU 173.A OE2 no hydrogen 2.811 N/A ARG 172.A NE ASP 106.A OD2 no hydrogen 3.192 N/A ARG 172.A NH1 ASP 106.A OD2 no hydrogen 2.709 N/A GLU 173.A N THR 170.A OG1 no hydrogen 3.360 N/A GLN 174.A N THR 170.A O no hydrogen 3.370 N/A GLN 174.A NE2 ARG 169.A O no hydrogen 3.322 N/A GLN 174.A NE2 THR 170.A O no hydrogen 3.382 N/A VAL 176.A N PHE 171.A O no hydrogen 2.970 N/A GLU 180.A N ASP 177.A O no hydrogen 3.146 N/A LEU 182.A N LYS 91.A O no hydrogen 3.101 N/A LEU 183.A N ILE 132.A O no hydrogen 3.134 N/A LEU 184.A N ARG 93.A O no hydrogen 2.918 N/A ARG 185.A N SER 130.A O no hydrogen 3.218 N/A ARG 186.A NE PHE 188.A O no hydrogen 2.700 N/A ARG 186.A NH2 GLU 128.A OE1 no hydrogen 2.871 N/A ARG 186.A NH2 SER 191.A O no hydrogen 2.788 N/A LYS 187.A N GLU 128.A O no hydrogen 2.760 N/A PHE 188.A N GLU 128.A O no hydrogen 3.142 N/A TYR 190.A N GLU 128.A OE1 no hydrogen 2.958 N/A SER 191.A N GLU 128.A OE1 no hydrogen 3.491 N/A SER 191.A OG GLU 128.A OE2 no hydrogen 2.492 N/A SER 191.A OG ASP 196.A OD1 no hydrogen 3.258 N/A SER 197.A N THR 124.A OG1 no hydrogen 3.193 N/A SER 197.A OG GLY 122.A O no hydrogen 2.327 N/A ARG 198.A NH1 GLN 193.A O no hydrogen 3.241 N/A GLN 202.A N ASP 199.A OD1 no hydrogen 2.887 N/A GLN 202.A NE2 ASP 199.A OD2 no hydrogen 2.302 N/A LEU 203.A N ASP 199.A O no hydrogen 3.095 N/A ASN 204.A N PRO 200.A O no hydrogen 2.918 N/A LEU 205.A N VAL 201.A O no hydrogen 3.416 N/A LEU 206.A N GLN 202.A O no hydrogen 3.311 N/A TYR 207.A N LEU 203.A O no hydrogen 2.896 N/A VAL 208.A N ASN 204.A O no hydrogen 2.759 N/A GLN 209.A N LEU 205.A O no hydrogen 3.167 N/A ALA 210.A N LEU 206.A O no hydrogen 2.985 N/A ARG 211.A N TYR 207.A O no hydrogen 2.833 N/A ASP 212.A N VAL 208.A O no hydrogen 3.164 N/A ASP 213.A N GLN 209.A O no hydrogen 3.227 N/A ILE 214.A N ALA 210.A O no hydrogen 3.226 N/A LEU 215.A N ARG 211.A O no hydrogen 2.924 N/A ASN 216.A N ASP 212.A O no hydrogen 2.827 N/A SER 218.A N ASN 216.A OD1 no hydrogen 2.814 N/A SER 218.A OG ASP 213.A OD1 no hydrogen 3.245 N/A HIS 219.A N ASP 213.A O no hydrogen 2.805 N/A HIS 219.A NE2 THR 299.A OG1 no hydrogen 2.479 N/A SER 222.A OG GLU 224.A OE1 no hydrogen 2.993 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.632 N/A LYS 225.A N SER 222.A OG no hydrogen 3.394 N/A ALA 226.A N SER 222.A O no hydrogen 2.813 N/A CYS 227.A N PHE 223.A O no hydrogen 3.178 N/A CYS 227.A SG PHE 223.A O no hydrogen 3.064 N/A GLU 228.A N GLU 224.A O no hydrogen 3.245 N/A PHE 229.A N LYS 225.A O no hydrogen 2.960 N/A GLY 230.A N ALA 226.A O no hydrogen 2.879 N/A GLY 231.A N CYS 227.A O no hydrogen 2.724 N/A PHE 232.A N GLU 228.A O no hydrogen 3.140 N/A GLN 233.A N PHE 229.A O no hydrogen 2.764 N/A GLN 233.A NE2 GLN 237.A OE1 no hydrogen 3.031 N/A GLN 233.A NE2 GLU 255.A O no hydrogen 2.752 N/A ALA 234.A N GLY 230.A O no hydrogen 2.798 N/A GLN 235.A N GLY 231.A O no hydrogen 3.198 N/A GLN 235.A NE2 GLY 279.A O no hydrogen 3.292 N/A GLN 235.A NE2 MET 281.A O no hydrogen 2.948 N/A ILE 236.A N PHE 232.A O no hydrogen 3.030 N/A GLN 237.A N GLN 233.A O no hydrogen 2.998 N/A PHE 238.A N ALA 234.A O no hydrogen 2.815 N/A GLY 239.A N GLN 235.A O no hydrogen 2.970 N/A VAL 242.A N HIS 246.A ND1 no hydrogen 2.890 N/A LYS 245.A N VAL 242.A O no hydrogen 3.117 N/A HIS 246.A N VAL 242.A O no hydrogen 2.967 N/A LYS 247.A N LYS 245.A O no hydrogen 2.666 N/A GLY 249.A N GLU 268.A OE2 no hydrogen 2.894 N/A PHE 250.A N LYS 247.A O no hydrogen 3.076 N/A LEU 251.A N GLU 268.A OE1 no hydrogen 3.284 N/A GLU 255.A N ASP 252.A O no hydrogen 3.242 N/A PHE 256.A N LEU 253.A O no hydrogen 3.164 N/A LEU 257.A N LEU 253.A O no hydrogen 3.247 N/A TYR 261.A N PRO 258.A O no hydrogen 3.092 N/A TYR 261.A OH VAL 221.A O no hydrogen 2.697 N/A GLN 264.A N TYR 261.A O no hydrogen 3.088 N/A ARG 270.A N GLY 266.A O no hydrogen 3.057 N/A ILE 271.A N ALA 267.A O no hydrogen 3.002 N/A PHE 272.A N GLU 268.A O no hydrogen 2.947 N/A GLN 273.A N LYS 269.A O no hydrogen 2.769 N/A GLU 274.A N ARG 270.A O no hydrogen 3.099 N/A HIS 275.A N ILE 271.A O no hydrogen 2.902 N/A HIS 275.A NE2 GLY 239.A O no hydrogen 2.581 N/A LYS 276.A N PHE 272.A O no hydrogen 3.233 N/A ASN 277.A N GLN 273.A O no hydrogen 3.278 N/A ASN 277.A ND2 GLU 274.A OE1 no hydrogen 3.391 N/A CYS 278.A N HIS 275.A O no hydrogen 3.321 N/A CYS 278.A SG GLU 274.A O no hydrogen 3.491 N/A GLY 279.A N LYS 276.A O no hydrogen 3.203 N/A GLU 285.A N SER 282.A OG no hydrogen 3.152 N/A ALA 286.A N SER 282.A O no hydrogen 2.878 N/A LYS 287.A N GLU 283.A O no hydrogen 2.914 N/A LYS 287.A NZ ASN 204.A OD1 no hydrogen 2.423 N/A LYS 287.A NZ GLU 283.A OE1 no hydrogen 3.491 N/A VAL 288.A N ILE 284.A O no hydrogen 3.091 N/A LYS 289.A N GLU 285.A O no hydrogen 3.159 N/A TYR 290.A N ALA 286.A O no hydrogen 3.008 N/A VAL 291.A N LYS 287.A O no hydrogen 3.050 N/A LYS 292.A N VAL 288.A O no hydrogen 2.925 N/A LYS 292.A NZ THR 124.A O no hydrogen 2.747 N/A LYS 292.A NZ GLU 127.A OE1 no hydrogen 3.001 N/A LYS 292.A NZ GLU 127.A OE2 no hydrogen 2.991 N/A LEU 293.A N LYS 289.A O no hydrogen 2.913 N/A ALA 294.A N TYR 290.A O no hydrogen 3.108 N/A ARG 295.A N VAL 291.A O no hydrogen 2.989 N/A ARG 295.A NH1 VAL 195.A O no hydrogen 2.532 N/A ARG 295.A NH2 ASP 196.A OD2 no hydrogen 3.375 N/A SER 296.A N LYS 292.A O no hydrogen 2.871 N/A SER 296.A OG LYS 292.A O no hydrogen 3.259 N/A SER 296.A OG LEU 293.A O no hydrogen 2.400 N/A LEU 297.A N ALA 294.A O no hydrogen 3.263 N/A ARG 298.A NH2 GLU 342.A OE1 no hydrogen 3.055 N/A THR 299.A OG1 HIS 219.A NE2 no hydrogen 2.479 N/A THR 299.A OG1 PRO 220.A O no hydrogen 3.432 N/A TYR 300.A N LEU 297.A O no hydrogen 3.067 N/A SER 303.A N ILE 324.A O no hydrogen 3.096 N/A PHE 305.A N LEU 322.A O no hydrogen 2.780 N/A VAL 307.A N ARG 320.A O no hydrogen 2.744 N/A LYS 308.A N GLN 373.A O no hydrogen 3.091 N/A GLU 309.A N VAL 318.A O no hydrogen 3.136 N/A LYS 316.A N LYS 314.A O no hydrogen 2.408 N/A VAL 318.A N GLU 309.A O no hydrogen 2.570 N/A ARG 320.A N VAL 307.A O no hydrogen 2.808 N/A LEU 321.A N VAL 332.A O no hydrogen 2.964 N/A LEU 322.A N PHE 305.A O no hydrogen 2.791 N/A GLY 323.A N MET 330.A O no hydrogen 2.966 N/A ILE 324.A N SER 303.A O no hydrogen 2.851 N/A THR 325.A N SER 328.A O no hydrogen 3.064 N/A THR 325.A OG1 GLY 301.A O no hydrogen 2.921 N/A LYS 326.A N THR 325.A OG1 no hydrogen 2.650 N/A SER 328.A OG GLU 342.A OE2 no hydrogen 3.031 N/A VAL 329.A N TRP 343.A O no hydrogen 2.742 N/A MET 330.A N GLY 323.A O no hydrogen 3.052 N/A ARG 331.A N GLN 341.A O no hydrogen 2.909 N/A ARG 331.A NH1 GLU 309.A OE1 no hydrogen 3.137 N/A VAL 332.A N LEU 321.A O no hydrogen 3.030 N/A ASP 333.A N GLU 338.A O no hydrogen 2.993 N/A LYS 335.A N ASP 333.A OD1 no hydrogen 2.844 N/A THR 336.A N ASP 333.A OD1 no hydrogen 3.016 N/A THR 336.A OG1 GLU 338.A OE2 no hydrogen 3.015 N/A LYS 337.A N ASP 333.A O no hydrogen 2.774 N/A LYS 337.A NZ GLU 260.A OE1 no hydrogen 2.685 N/A LYS 337.A NZ TYR 261.A OH no hydrogen 3.202 N/A LYS 337.A NZ GLU 334.A O no hydrogen 2.774 N/A GLU 338.A N THR 336.A OG1 no hydrogen 3.370 N/A LEU 340.A N ARG 331.A O no hydrogen 2.930 N/A TRP 343.A N VAL 329.A O no hydrogen 2.688 N/A LEU 345.A N ASP 327.A O no hydrogen 2.614 N/A THR 347.A N PRO 344.A O no hydrogen 3.155 N/A THR 347.A OG1 PRO 344.A O no hydrogen 2.684 N/A VAL 348.A N LEU 345.A O no hydrogen 3.186 N/A LYS 349.A N ASP 361.A O no hydrogen 2.834 N/A ARG 350.A N ASP 361.A O no hydrogen 3.446 N/A ARG 350.A NE ASP 361.A OD2 no hydrogen 2.755 N/A TRP 351.A NE1 SER 381.A OG no hydrogen 2.727 N/A ALA 352.A N THR 359.A O no hydrogen 2.987 N/A SER 354.A N SER 357.A O no hydrogen 2.930 N/A SER 354.A OG SER 357.A OG no hydrogen 3.416 N/A PHE 358.A N VAL 372.A O no hydrogen 2.860 N/A THR 359.A N ALA 352.A O no hydrogen 2.805 N/A LEU 360.A N TYR 370.A O no hydrogen 2.921 N/A ASP 361.A N ARG 350.A O no hydrogen 2.919 N/A GLU 364.A N GLU 364.A OE1 no hydrogen 2.507 N/A SER 368.A OG TYR 369.A O no hydrogen 3.328 N/A TYR 369.A N SER 368.A OG no hydrogen 2.235 N/A TYR 370.A OH GLU 309.A OE1 no hydrogen 2.408 N/A VAL 372.A N PHE 358.A O no hydrogen 2.940 N/A GLN 373.A N LYS 308.A O no hydrogen 2.732 N/A THR 374.A N LYS 356.A O no hydrogen 3.023 N/A GLU 376.A N THR 374.A OG1 no hydrogen 2.945 N/A GLN 379.A N GLN 379.A OE1 no hydrogen 2.427 N/A ILE 380.A N GLU 376.A O no hydrogen 2.950 N/A SER 381.A N GLY 377.A O no hydrogen 2.833 N/A GLN 382.A N GLU 378.A O no hydrogen 2.902 N/A LEU 383.A N GLN 379.A O no hydrogen 3.164 N/A ILE 384.A N ILE 380.A O no hydrogen 3.080 N/A ALA 385.A N SER 381.A O no hydrogen 2.966 N/A GLY 386.A N GLN 382.A O no hydrogen 3.053 N/A TYR 387.A N LEU 383.A O no hydrogen 3.249 N/A TYR 387.A N ILE 384.A O no hydrogen 3.267 N/A ILE 388.A N ILE 384.A O no hydrogen 3.036 N/A ASP 389.A N ALA 385.A O no hydrogen 2.652 N/A