Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n3k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLN 6.A OE1 no hydrogen 3.101 N/A SER 5.A N SER 3.A OG no hydrogen 3.095 N/A ILE 7.A N SER 3.A O no hydrogen 3.098 N/A ARG 8.A N ALA 4.A O no hydrogen 3.217 N/A ASN 9.A N SER 5.A O no hydrogen 3.401 N/A ASN 9.A ND2 ASP 94.A OD2 no hydrogen 3.266 N/A LEU 10.A N GLN 6.A O no hydrogen 3.204 N/A LEU 10.A N ILE 7.A O no hydrogen 3.047 N/A ASN 11.A N ARG 8.A O no hydrogen 3.313 N/A VAL 13.A N TYR 89.A O no hydrogen 2.973 N/A GLY 15.A N GLN 86.A O no hydrogen 2.834 N/A GLY 16.A N GLN 86.A O no hydrogen 2.804 N/A ALA 20.A N LEU 82.A O no hydrogen 2.875 N/A LEU 21.A N GLY 18.A O no hydrogen 3.080 N/A THR 22.A OG1 LEU 82.A O no hydrogen 3.005 N/A THR 22.A OG1 TYR 87.A O no hydrogen 3.349 N/A GLY 23.A N ARG 88.A O no hydrogen 2.881 N/A LEU 24.A N ASP 330.A O no hydrogen 2.741 N/A ARG 25.A N ILE 90.A O no hydrogen 2.718 N/A ARG 25.A NH1 ASN 11.A O no hydrogen 2.838 N/A ARG 25.A NH1 SER 91.A OG no hydrogen 2.892 N/A ASN 26.A ND2 ASP 330.A OD2 no hydrogen 2.845 N/A LEU 27.A N THR 30.A OG1 no hydrogen 2.820 N/A GLY 28.A N ASN 26.A OD1 no hydrogen 2.858 N/A ASN 29.A ND2 TYR 109.A O no hydrogen 2.930 N/A THR 30.A N ASN 26.A OD1 no hydrogen 3.077 N/A THR 30.A OG1 ASN 26.A OD1 no hydrogen 3.294 N/A CYS 31.A SG HIS 312.A ND1 no hydrogen 3.161 N/A ASN 34.A N THR 30.A O no hydrogen 3.080 N/A ASN 34.A ND2 ASP 330.A OD1 no hydrogen 2.909 N/A SER 35.A N CYS 31.A O no hydrogen 2.837 N/A SER 35.A OG SER 302.A OG no hydrogen 2.726 N/A SER 35.A OG THR 314.A O no hydrogen 2.674 N/A ILE 36.A N TYR 32.A O no hydrogen 3.354 N/A LEU 37.A N MET 33.A O no hydrogen 3.041 N/A GLN 38.A N ASN 34.A O no hydrogen 3.021 N/A GLN 38.A NE2 THR 22.A O no hydrogen 2.956 N/A CYS 39.A N SER 35.A O no hydrogen 3.206 N/A CYS 39.A SG SER 35.A O no hydrogen 3.312 N/A LEU 40.A N ILE 36.A O no hydrogen 2.879 N/A CYS 41.A N LEU 37.A O no hydrogen 2.930 N/A ASN 42.A N GLN 38.A O no hydrogen 3.351 N/A ASN 42.A N CYS 39.A O no hydrogen 3.237 N/A ASN 42.A ND2 GLN 38.A O no hydrogen 2.940 N/A ALA 43.A N LEU 40.A O no hydrogen 3.089 N/A TYR 49.A N HIS 45.A O no hydrogen 2.983 N/A TYR 49.A OH ASP 58.A OD2 no hydrogen 2.606 N/A PHE 50.A N LEU 46.A O no hydrogen 3.435 N/A ASN 51.A N ALA 47.A O no hydrogen 2.783 N/A ARG 52.A N ASP 48.A O no hydrogen 2.993 N/A ARG 52.A NH1 ASP 48.A O no hydrogen 3.066 N/A ASN 53.A N PHE 50.A O no hydrogen 3.226 N/A CYS 54.A N TYR 49.A O no hydrogen 3.182 N/A CYS 54.A SG ARG 52.A O no hydrogen 3.988 N/A GLN 56.A N ASN 53.A O no hydrogen 3.289 N/A ASP 58.A N TYR 55.A O no hydrogen 3.128 N/A ASN 60.A N ASP 128.A O no hydrogen 2.846 N/A ASN 60.A ND2 ASN 130.A O no hydrogen 2.833 N/A ASN 60.A ND2 ASN 134.A OD1 no hydrogen 2.987 N/A ARG 61.A NH1 LYS 68.A O no hydrogen 3.519 N/A ARG 61.A NH1 GLU 73.A OE1 no hydrogen 3.512 N/A ARG 61.A NH1 GLU 73.A OE2 no hydrogen 3.427 N/A ASN 63.A ND2 GLU 127.A O no hydrogen 2.930 N/A ASN 63.A ND2 GLU 127.A OE1 no hydrogen 2.870 N/A LEU 65.A N ASN 63.A OD1 no hydrogen 3.222 N/A GLY 66.A N ASN 63.A O no hydrogen 2.910 N/A HIS 67.A N ASP 128.A OD1 no hydrogen 2.832 N/A GLY 69.A N ASP 128.A OD1 no hydrogen 2.957 N/A GLU 70.A N HIS 67.A O no hydrogen 3.202 N/A ALA 72.A N ASP 128.A OD2 no hydrogen 3.180 N/A GLU 73.A N GLY 69.A O no hydrogen 2.764 N/A GLU 74.A N GLU 70.A O no hydrogen 2.945 N/A PHE 75.A N VAL 71.A O no hydrogen 2.879 N/A GLY 76.A N ALA 72.A O no hydrogen 2.862 N/A ILE 77.A N GLU 73.A O no hydrogen 3.087 N/A ILE 78.A N GLU 74.A O no hydrogen 3.195 N/A MET 79.A N PHE 75.A O no hydrogen 2.863 N/A LYS 80.A N GLY 76.A O no hydrogen 2.816 N/A LYS 80.A NZ TYR 55.A OH no hydrogen 3.117 N/A ALA 81.A N ILE 77.A O no hydrogen 3.005 N/A LEU 82.A N ILE 78.A O no hydrogen 2.919 N/A TRP 83.A N MET 79.A O no hydrogen 3.104 N/A TRP 83.A N LYS 80.A O no hydrogen 3.092 N/A TRP 83.A NE1 CYS 41.A O no hydrogen 3.130 N/A THR 84.A N LYS 80.A O no hydrogen 3.036 N/A THR 84.A OG1 ALA 81.A O no hydrogen 3.197 N/A ARG 88.A N VAL 13.A O no hydrogen 2.747 N/A ILE 90.A N GLY 23.A O no hydrogen 3.270 N/A SER 91.A N LEU 10.A O no hydrogen 2.752 N/A LYS 93.A N SER 91.A O no hydrogen 2.752 N/A LYS 96.A N PRO 92.A O no hydrogen 2.942 N/A LYS 96.A NZ PHE 106.A O no hydrogen 2.891 N/A LYS 96.A NZ GLY 108.A O no hydrogen 2.739 N/A ILE 97.A N LYS 93.A O no hydrogen 3.210 N/A THR 98.A N ASP 94.A O no hydrogen 3.023 N/A THR 98.A OG1 ASP 94.A O no hydrogen 3.002 N/A ILE 99.A N PHE 95.A O no hydrogen 3.070 N/A GLY 100.A N LYS 96.A O no hydrogen 3.120 N/A LYS 101.A N THR 98.A O no hydrogen 3.157 N/A ILE 102.A N ILE 99.A O no hydrogen 3.258 N/A ASN 103.A N ILE 99.A O no hydrogen 3.245 N/A ASN 103.A ND2 GLN 105.A OE1 no hydrogen 2.770 N/A GLN 105.A N ASN 103.A OD1 no hydrogen 3.503 N/A PHE 106.A N ASN 103.A O no hydrogen 2.948 N/A ALA 107.A N ASP 104.A O no hydrogen 3.121 N/A GLN 111.A NE2 ASN 29.A OD1 no hydrogen 3.212 N/A GLN 112.A NE2 SER 110.A O no hydrogen 3.581 N/A SER 114.A N TYR 313.A OH no hydrogen 3.175 N/A GLN 115.A N ASP 113.A OD1 no hydrogen 2.934 N/A GLU 116.A N ASP 113.A O no hydrogen 3.093 N/A LEU 117.A N ASP 113.A O no hydrogen 3.418 N/A LEU 118.A N SER 114.A O no hydrogen 2.950 N/A LEU 119.A N GLN 115.A O no hydrogen 3.047 N/A PHE 120.A N GLU 116.A O no hydrogen 3.242 N/A LEU 121.A N LEU 117.A O no hydrogen 2.883 N/A MET 122.A N LEU 118.A O no hydrogen 2.979 N/A ASP 123.A N LEU 119.A O no hydrogen 3.195 N/A GLY 124.A N PHE 120.A O no hydrogen 2.722 N/A LEU 125.A N LEU 121.A O no hydrogen 2.699 N/A HIS 126.A N MET 122.A O no hydrogen 3.004 N/A HIS 126.A ND1 SER 165.A OG no hydrogen 2.727 N/A HIS 126.A NE2 ASN 163.A OD1 no hydrogen 2.783 N/A GLU 127.A N ASP 123.A O no hydrogen 2.933 N/A ASP 128.A N GLY 124.A O no hydrogen 3.078 N/A LEU 129.A N HIS 126.A O no hydrogen 3.069 N/A ASN 130.A ND2 GLU 127.A OE1 no hydrogen 3.179 N/A ASN 130.A ND2 LEU 162.A O no hydrogen 3.159 N/A ASN 130.A ND2 ASN 163.A OD1 no hydrogen 3.648 N/A LYS 131.A N GLU 164.A O no hydrogen 2.781 N/A LYS 131.A NZ ASP 57.A O no hydrogen 3.102 N/A ALA 132.A N ASN 130.A OD1 no hydrogen 2.978 N/A ASN 134.A ND2 ASN 60.A OD1 no hydrogen 3.176 N/A ARG 135.A N ASP 133.A OD2 no hydrogen 2.718 N/A LYS 136.A NZ LEU 162.A O no hydrogen 3.261 N/A LYS 139.A NZ.B GLN 161.A OE1 no hydrogen 3.453 N/A ASN 143.A ND2 ARG 189.A O no hydrogen 3.185 N/A LEU 146.A N ASN 143.A O no hydrogen 3.075 N/A LYS 150.A N ASP 147.A OD2 no hydrogen 3.121 N/A ALA 151.A N ASP 147.A O no hydrogen 2.905 N/A ALA 152.A N ASP 148.A O no hydrogen 2.906 N/A GLU 153.A N PHE 149.A O no hydrogen 3.073 N/A HIS 154.A N LYS 150.A O no hydrogen 3.050 N/A ALA 155.A N ALA 151.A O no hydrogen 2.953 N/A TRP 156.A N ALA 152.A O no hydrogen 2.867 N/A GLN 157.A N GLU 153.A O no hydrogen 2.879 N/A GLN 157.A NE2 GLU 153.A OE1 no hydrogen 2.994 N/A LYS 158.A N HIS 154.A O no hydrogen 3.018 N/A LYS 158.A NZ ARG 137.A O no hydrogen 3.268 N/A LYS 158.A NZ LYS 139.A O.A no hydrogen 2.772 N/A LYS 158.A NZ LYS 139.A O.B no hydrogen 2.805 N/A HIS 159.A N ALA 155.A O no hydrogen 2.998 N/A HIS 159.A NE2 GLN 172.A OE1 no hydrogen 2.528 N/A LYS 160.A N TRP 156.A O no hydrogen 2.944 N/A GLN 161.A N GLN 157.A O no hydrogen 3.111 N/A GLN 161.A NE2 GLN 157.A O no hydrogen 3.575 N/A LEU 162.A N HIS 159.A O no hydrogen 3.222 N/A ASN 163.A ND2 HIS 159.A O no hydrogen 3.412 N/A GLU 164.A N ASN 130.A OD1 no hydrogen 3.083 N/A SER 165.A OG HIS 126.A ND1 no hydrogen 2.727 N/A ALA 169.A N SER 165.A O no hydrogen 3.108 N/A LEU 170.A N ILE 166.A O no hydrogen 2.897 N/A PHE 171.A N ILE 167.A O no hydrogen 2.892 N/A GLN 172.A N VAL 168.A O no hydrogen 3.271 N/A GLY 173.A N PHE 194.A O no hydrogen 3.126 N/A GLN 174.A N LYS 247.A O no hydrogen 2.957 N/A GLN 174.A NE2 ALA 152.A O no hydrogen 2.985 N/A GLN 174.A NE2 PHE 191.A O no hydrogen 3.117 N/A PHE 175.A N GLU 192.A O no hydrogen 2.874 N/A LYS 176.A N GLU 244.A O no hydrogen 2.817 N/A LYS 176.A NZ ASP 148.A OD1 no hydrogen 3.412 N/A LYS 176.A NZ ASP 148.A OD2 no hydrogen 2.773 N/A SER 177.A N THR 190.A O no hydrogen 2.800 N/A SER 177.A OG GLU 192.A OE1 no hydrogen 2.872 N/A SER 177.A OG GLU 192.A OE2 no hydrogen 3.407 N/A THR 178.A N LYS 242.A O no hydrogen 2.743 N/A VAL 179.A N SER 188.A O no hydrogen 2.941 N/A GLN 180.A N LEU 240.A O no hydrogen 2.780 N/A GLN 180.A NE2 HIS 185.A O no hydrogen 3.316 N/A CYS 181.A N LYS 186.A O no hydrogen 3.263 N/A LEU 182.A N ASP 238.A O no hydrogen 2.868 N/A HIS 185.A N CYS 181.A O no hydrogen 2.854 N/A LYS 186.A NZ ASP 144.A OD1 no hydrogen 3.128 N/A SER 188.A N VAL 179.A O no hydrogen 2.924 N/A ARG 189.A NH1 LEU 146.A O no hydrogen 3.246 N/A ARG 189.A NH2 LEU 146.A O no hydrogen 2.536 N/A THR 190.A N SER 177.A O no hydrogen 2.770 N/A GLU 192.A N GLU 192.A OE2 no hydrogen 2.807 N/A PHE 194.A N GLY 173.A O no hydrogen 3.074 N/A LEU 197.A N LEU 253.A O no hydrogen 2.855 N/A SER 198.A OG HIS 255.A ND1 no hydrogen 2.605 N/A LEU 199.A N HIS 255.A O no hydrogen 2.808 N/A SER 203.A OG LYS 206.A O no hydrogen 3.104 N/A SER 205.A N SER 203.A OG no hydrogen 3.106 N/A LYS 206.A N SER 203.A OG no hydrogen 3.130 N/A CYS 207.A N SER 272.A O no hydrogen 3.385 N/A CYS 207.A SG THR 208.A O no hydrogen 3.749 N/A THR 208.A N ASP 211.A OD2 no hydrogen 2.967 N/A LEU 209.A N ASP 274.A O no hydrogen 2.898 N/A ASP 211.A N THR 208.A OG1 no hydrogen 3.095 N/A CYS 212.A N THR 208.A O no hydrogen 3.362 N/A CYS 212.A SG THR 208.A O no hydrogen 3.337 N/A LEU 213.A N LEU 209.A O no hydrogen 2.911 N/A ARG 214.A N GLN 210.A O no hydrogen 2.792 N/A ARG 214.A NH1 ASP 211.A OD1 no hydrogen 2.665 N/A ARG 214.A NH2 ASP 211.A OD1 no hydrogen 3.234 N/A LEU 215.A N ASP 211.A O no hydrogen 2.984 N/A PHE 216.A N CYS 212.A O no hydrogen 2.947 N/A SER 217.A OG ILE 243.A O no hydrogen 2.995 N/A LYS 218.A N LEU 215.A O no hydrogen 3.434 N/A GLU 220.A N LYS 241.A O no hydrogen 2.823 N/A LEU 222.A N SER 239.A O no hydrogen 2.724 N/A ASN 226.A N THR 223.A O no hydrogen 2.811 N/A ARG 227.A NE ASP 238.A OD1 no hydrogen 2.680 N/A ARG 227.A NH2 ASP 238.A OD1 no hydrogen 3.465 N/A CYS 230.A N ALA 235.A O no hydrogen 2.848 N/A ARG 237.A N PHE 228.A O no hydrogen 2.773 N/A SER 239.A N LEU 222.A O no hydrogen 2.880 N/A SER 239.A OG ARG 237.A O no hydrogen 2.791 N/A LEU 240.A N GLN 180.A O no hydrogen 2.804 N/A LYS 241.A N GLU 220.A O no hydrogen 2.769 N/A LYS 242.A N THR 178.A O no hydrogen 2.798 N/A LYS 242.A NZ SER 217.A O no hydrogen 2.774 N/A GLU 244.A N LYS 176.A O no hydrogen 2.842 N/A TRP 246.A N GLN 174.A O no hydrogen 2.851 N/A LYS 247.A N GLN 174.A O no hydrogen 3.043 N/A VAL 251.A N LEU 170.A O no hydrogen 2.880 N/A LEU 252.A N TYR 351.A O no hydrogen 2.556 N/A VAL 254.A N LEU 349.A O no hydrogen 2.896 N/A HIS 255.A N LEU 197.A O no hydrogen 2.796 N/A HIS 255.A ND1 SER 198.A OG no hydrogen 2.605 N/A HIS 255.A NE2 TYR 347.A OH no hydrogen 2.921 N/A LEU 256.A N TYR 347.A O no hydrogen 2.978 N/A LYS 257.A N LEU 199.A O no hydrogen 2.868 N/A ARG 258.A NE ALA 346.A O no hydrogen 2.823 N/A ARG 258.A NH1 LEU 269.A O no hydrogen 3.007 N/A ARG 258.A NH1 THR 271.A O no hydrogen 2.916 N/A ARG 258.A NH2 THR 271.A O no hydrogen 3.185 N/A ARG 258.A NH2 ALA 346.A O no hydrogen 2.933 N/A SER 260.A N GLN 267.A O no hydrogen 2.924 N/A TYR 261.A OH GLY 263.A O no hydrogen 3.339 N/A TYR 261.A OH ARG 264.A O no hydrogen 3.311 N/A ASP 262.A N TRP 265.A O no hydrogen 3.047 N/A ARG 264.A N ASP 262.A OD1 no hydrogen 2.752 N/A TRP 265.A N ASP 262.A OD1 no hydrogen 2.795 N/A LYS 266.A NZ ASP 309.A OD1 no hydrogen 2.760 N/A LYS 266.A NZ ASP 309.A OD2 no hydrogen 3.382 N/A GLN 267.A N SER 260.A O no hydrogen 2.768 N/A GLN 267.A NE2 ASP 262.A OD2 no hydrogen 2.723 N/A LYS 268.A NZ HIS 304.A ND1 no hydrogen 2.876 N/A LEU 269.A N ARG 258.A O no hydrogen 2.791 N/A THR 271.A OG1 SER 203.A O no hydrogen 2.762 N/A SER 272.A N SER 205.A O no hydrogen 2.840 N/A ASP 274.A N CYS 207.A O no hydrogen 2.827 N/A ASN 279.A N ASN 297.A OD1 no hydrogen 2.824 N/A LEU 280.A N TYR 296.A O no hydrogen 2.863 N/A SER 283.A N ASP 281.A OD1 no hydrogen 3.123 N/A SER 283.A OG ASP 281.A OD1 no hydrogen 3.383 N/A TYR 285.A N LEU 282.A O no hydrogen 3.038 N/A VAL 286.A N SER 283.A O no hydrogen 3.495 N/A ILE 287.A N ILE 245.A O no hydrogen 2.912 N/A GLY 288.A N TRP 246.A O no hydrogen 3.212 N/A LYS 290.A NZ SER 283.A O no hydrogen 3.303 N/A LYS 290.A NZ VAL 286.A O no hydrogen 3.231 N/A LEU 293.A N LYS 290.A O no hydrogen 3.295 N/A TYR 296.A N LEU 280.A O no hydrogen 2.889 N/A TYR 296.A OH PRO 249.A O no hydrogen 2.456 N/A ASN 297.A N THR 352.A O no hydrogen 2.853 N/A LEU 298.A N LEU 277.A O no hydrogen 2.792 N/A PHE 299.A N PHE 350.A O no hydrogen 2.944 N/A SER 300.A OG PHE 299.A O no hydrogen 2.674 N/A VAL 301.A N TYR 316.A O no hydrogen 2.813 N/A SER 302.A N ILE 348.A O no hydrogen 2.826 N/A SER 302.A OG SER 35.A OG no hydrogen 2.726 N/A ASN 303.A N THR 314.A O no hydrogen 2.863 N/A ASN 303.A ND2 THR 314.A OG1 no hydrogen 3.256 N/A HIS 304.A N ALA 345.A O no hydrogen 2.776 N/A TYR 305.A N HIS 312.A O no hydrogen 2.791 N/A HIS 312.A N TYR 305.A O no hydrogen 2.802 N/A HIS 312.A NE2 ASP 329.A OD1 no hydrogen 2.694 N/A TYR 313.A OH GLN 112.A O no hydrogen 2.823 N/A THR 314.A N ASN 303.A O no hydrogen 3.100 N/A ALA 315.A N PHE 328.A O no hydrogen 2.978 N/A TYR 316.A N VAL 301.A O no hydrogen 2.929 N/A CYS 317.A N PHE 326.A O no hydrogen 2.891 N/A CYS 317.A SG SER 300.A OG no hydrogen 3.457 N/A LYS 318.A N PHE 299.A O no hydrogen 2.860 N/A ASN 319.A N ARG 324.A O no hydrogen 2.915 N/A ASN 319.A ND2 PRO 19.A O no hydrogen 3.592 N/A ARG 322.A N ASN 319.A OD1 no hydrogen 3.112 N/A ARG 322.A NH2 SER 17.A O no hydrogen 3.416 N/A GLN 323.A NE2 ALA 320.A O no hydrogen 2.662 N/A PHE 326.A N CYS 317.A O no hydrogen 2.837 N/A LYS 327.A N SER 334.A O no hydrogen 2.769 N/A PHE 328.A N ALA 315.A O no hydrogen 2.684 N/A ASP 329.A N GLU 332.A O no hydrogen 3.046 N/A GLU 332.A N ASP 329.A O no hydrogen 3.060 N/A SER 334.A N LYS 327.A O no hydrogen 3.044 N/A ILE 336.A N TRP 325.A O no hydrogen 3.294 N/A SER 340.A N SER 337.A O no hydrogen 2.797 N/A VAL 341.A N VAL 338.A O no hydrogen 3.334 N/A LYS 342.A NZ ASP 274.A OD1 no hydrogen 2.955 N/A ALA 345.A N SER 343.A OG no hydrogen 3.243 N/A TYR 347.A N SER 302.A O no hydrogen 2.672 N/A TYR 347.A OH ASP 113.A OD1 no hydrogen 2.677 N/A TYR 347.A OH ASP 113.A OD2 no hydrogen 3.401 N/A ILE 348.A N SER 302.A O no hydrogen 3.121 N/A LEU 349.A N VAL 254.A O no hydrogen 2.848 N/A PHE 350.A N SER 300.A O no hydrogen 2.820 N/A TYR 351.A N LEU 252.A O no hydrogen 2.796 N/A TYR 351.A OH PRO 276.A O no hydrogen 2.691 N/A THR 352.A N ASN 297.A O no hydrogen 2.942 N/A THR 352.A OG1 PRO 250.A O no hydrogen 3.372 N/A SER 353.A N PRO 250.A O no hydrogen 2.926 N/A LEU 354.A N THR 352.A OG1 no hydrogen 3.138 N/A