Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4as3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 157.A OE1 no hydrogen 3.047 N/A THR 1.A OG1 GLU 157.A OE1 no hydrogen 3.252 N/A THR 1.A OG1 GLU 157.A OE2 no hydrogen 2.973 N/A GLU 4.A N GLU 2.A O no hydrogen 2.918 N/A HIS 5.A N GLU 150.A OE1 no hydrogen 2.936 N/A HIS 5.A ND1 GLU 150.A OE2 no hydrogen 2.657 N/A TRP 6.A NE1 GLY 147.A O no hydrogen 3.053 N/A ALA 11.A N PRO 7.A O no hydrogen 3.132 N/A ARG 12.A N ALA 8.A O no hydrogen 2.848 N/A GLN 13.A N PRO 9.A O no hydrogen 3.227 N/A LEU 14.A N ALA 10.A O no hydrogen 2.775 N/A ASN 15.A N ALA 11.A O no hydrogen 2.905 N/A ASN 15.A ND2 ALA 11.A O no hydrogen 3.001 N/A ALA 16.A N ARG 12.A O no hydrogen 2.971 N/A LEU 17.A N GLN 13.A O no hydrogen 3.098 N/A ILE 18.A N LEU 14.A O no hydrogen 2.983 N/A GLU 19.A N ASN 15.A O no hydrogen 2.997 N/A ALA 20.A N ALA 16.A O no hydrogen 3.002 N/A ASN 21.A N ILE 18.A O no hydrogen 3.381 N/A ASN 21.A ND2 LEU 17.A O no hydrogen 2.712 N/A ASN 23.A N ASN 158.A O no hydrogen 2.798 N/A LYS 24.A NZ ALA 20.A O no hydrogen 2.936 N/A TYR 27.A OH LYS 254.A O no hydrogen 2.708 N/A ALA 28.A N GLU 161.A O no hydrogen 2.804 N/A VAL 29.A N LEU 258.A O no hydrogen 2.927 N/A PHE 30.A N TYR 163.A O no hydrogen 2.962 N/A ASP 31.A N ALA 260.A O no hydrogen 2.796 N/A THR 35.A N MET 32.A O no hydrogen 3.067 N/A THR 35.A OG1 ASP 31.A OD2 no hydrogen 2.996 N/A THR 35.A OG1 ASP 262.A OD1 no hydrogen 2.715 N/A SER 36.A N MET 32.A O no hydrogen 2.747 N/A SER 36.A OG ASP 31.A O no hydrogen 3.014 N/A SER 36.A OG TYR 152.A OH no hydrogen 2.838 N/A TYR 37.A N MET 32.A O no hydrogen 3.480 N/A TYR 37.A OH ASP 33.A OD1 no hydrogen 2.587 N/A ARG 38.A N ARG 143.A O no hydrogen 2.930 N/A ARG 38.A NH2 GLU 324.A OE2 no hydrogen 3.129 N/A TYR 39.A N ASN 34.A OD1 no hydrogen 2.955 N/A LEU 41.A N ASP 33.A OD1 no hydrogen 2.679 N/A GLU 43.A N ASP 40.A OD2 no hydrogen 2.849 N/A SER 44.A N ASP 40.A O no hydrogen 3.335 N/A SER 44.A N LEU 41.A O no hydrogen 3.123 N/A SER 44.A OG ASP 40.A O no hydrogen 2.731 N/A SER 44.A OG LEU 41.A O no hydrogen 2.933 N/A LEU 45.A N LEU 41.A O no hydrogen 2.748 N/A LEU 46.A N GLU 42.A O no hydrogen 2.912 N/A TYR 48.A N SER 44.A O no hydrogen 3.081 N/A TYR 48.A OH GLU 116.A OE1 no hydrogen 2.430 N/A LEU 49.A N LEU 45.A O no hydrogen 2.917 N/A MET 51.A N PRO 47.A O no hydrogen 3.116 N/A GLY 53.A N GLU 50.A O no hydrogen 3.362 N/A LEU 55.A N LEU 49.A O no hydrogen 3.111 N/A ARG 57.A NH1 ASP 71.A OD2 no hydrogen 3.226 N/A ARG 57.A NH2 ASP 71.A OD1 no hydrogen 3.153 N/A ARG 57.A NH2 GLU 77.A O no hydrogen 2.708 N/A ASP 58.A N THR 56.A OG1 no hydrogen 3.000 N/A ARG 59.A N THR 56.A OG1 no hydrogen 3.398 N/A SER 63.A N ASP 61.A OD2 no hydrogen 3.520 N/A SER 63.A OG ASP 61.A OD2 no hydrogen 3.314 N/A LEU 64.A N ASP 61.A O no hydrogen 2.923 N/A LYS 65.A NZ ARG 57.A O no hydrogen 2.876 N/A ILE 67.A N TYR 82.A OH no hydrogen 2.845 N/A LYS 70.A N GLU 77.A OE1 no hydrogen 2.659 N/A LYS 70.A NZ ASP 132.A OD1 no hydrogen 3.335 N/A GLN 72.A N HIS 75.A O no hydrogen 3.322 N/A HIS 75.A N GLN 72.A O no hydrogen 2.898 N/A GLU 77.A N ASP 71.A OD1 no hydrogen 2.660 N/A SER 78.A OG THR 127.A O no hydrogen 2.946 N/A SER 78.A OG THR 127.A OG1 no hydrogen 3.426 N/A LEU 79.A N GLU 50.A OE1 no hydrogen 3.104 N/A LEU 79.A N GLU 50.A OE2 no hydrogen 2.366 N/A PHE 80.A N GLU 50.A OE1 no hydrogen 3.357 N/A SER 81.A N SER 78.A OG no hydrogen 3.140 N/A SER 81.A OG GLU 77.A OE2 no hydrogen 2.435 N/A TYR 82.A N SER 78.A O no hydrogen 3.242 N/A TYR 82.A OH ILE 67.A O no hydrogen 2.374 N/A TYR 83.A N LEU 79.A O no hydrogen 2.983 N/A TYR 83.A OH GLU 43.A OE2 no hydrogen 2.389 N/A TYR 84.A N PHE 80.A O no hydrogen 2.983 N/A ARG 85.A N SER 81.A O no hydrogen 2.937 N/A ARG 85.A NE GLU 77.A OE2 no hydrogen 2.715 N/A ARG 85.A NH2 PRO 68.A O no hydrogen 2.898 N/A ARG 85.A NH2 GLU 77.A OE1 no hydrogen 2.604 N/A LEU 86.A N TYR 82.A O no hydrogen 2.979 N/A LEU 86.A N TYR 83.A O no hydrogen 2.956 N/A CYS 87.A N TYR 83.A O no hydrogen 3.032 N/A CYS 87.A SG TYR 83.A O no hydrogen 3.711 N/A GLU 88.A N TYR 84.A O no hydrogen 3.298 N/A ILE 89.A N LEU 86.A O no hydrogen 2.907 N/A ASP 90.A N LEU 86.A O no hydrogen 3.279 N/A MET 92.A N ASP 90.A OD1 no hydrogen 2.956 N/A VAL 93.A N ASP 90.A O no hydrogen 2.914 N/A CYS 94.A N ASP 90.A O no hydrogen 3.168 N/A TYR 95.A N ASP 91.A O no hydrogen 2.851 N/A TRP 97.A N VAL 93.A O no hydrogen 3.382 N/A TRP 97.A NE1 LEU 64.A O no hydrogen 2.752 N/A VAL 98.A N CYS 94.A O no hydrogen 3.073 N/A ALA 99.A N PRO 96.A O no hydrogen 2.842 N/A GLN 100.A N PRO 96.A O no hydrogen 2.961 N/A GLN 100.A NE2 PRO 230.A O no hydrogen 2.790 N/A PHE 102.A N ALA 99.A O no hydrogen 3.270 N/A SER 103.A N GLN 100.A O no hydrogen 3.120 N/A SER 103.A OG GLN 100.A O no hydrogen 2.980 N/A GLY 104.A N VAL 228.A O no hydrogen 2.817 N/A THR 106.A N GLU 109.A OE1 no hydrogen 3.009 N/A LEU 107.A N LEU 226.A O no hydrogen 3.225 N/A ARG 108.A N LEU 224.A O no hydrogen 2.871 N/A ARG 108.A NE ASP 225.A OD1 no hydrogen 2.510 N/A ARG 108.A NH2 ASP 225.A OD2 no hydrogen 3.255 N/A GLU 109.A N THR 106.A OG1 no hydrogen 3.145 N/A LEU 110.A N THR 106.A O no hydrogen 3.057 N/A LYS 111.A N LEU 107.A O no hydrogen 2.949 N/A LYS 111.A NZ ASP 115.A OD1 no hydrogen 3.340 N/A LYS 111.A NZ ASP 115.A OD2 no hydrogen 2.996 N/A LYS 111.A NZ MET 175.A O no hydrogen 3.024 N/A LYS 111.A NZ ASP 179.A OD2 no hydrogen 2.107 N/A GLY 112.A N ARG 108.A O no hydrogen 3.228 N/A GLY 112.A N GLU 109.A O no hydrogen 2.639 N/A TYR 113.A N GLU 109.A O no hydrogen 3.150 N/A VAL 114.A N LEU 110.A O no hydrogen 2.946 N/A ASP 115.A N LYS 111.A O no hydrogen 3.239 N/A GLU 116.A N GLY 112.A O no hydrogen 2.877 N/A LEU 117.A N TYR 113.A O no hydrogen 2.702 N/A MET 118.A N VAL 114.A O no hydrogen 2.773 N/A ALA 119.A N ASP 115.A O no hydrogen 3.121 N/A ALA 119.A N GLU 116.A O no hydrogen 2.752 N/A TYR 120.A N GLU 116.A O no hydrogen 2.507 N/A ILE 124.A N VAL 139.A O no hydrogen 2.764 N/A ALA 126.A N LEU 137.A O no hydrogen 2.861 N/A THR 127.A OG1 SER 78.A OG no hydrogen 3.426 N/A TYR 128.A N ALA 135.A O no hydrogen 2.977 N/A TYR 129.A OH LYS 70.A O no hydrogen 2.791 N/A ASP 130.A N LYS 133.A O no hydrogen 2.865 N/A LYS 133.A N ASP 130.A O no hydrogen 2.902 N/A ALA 135.A N TYR 128.A O no hydrogen 2.932 N/A LEU 137.A N ALA 126.A O no hydrogen 2.842 N/A VAL 139.A N ILE 124.A O no hydrogen 2.881 N/A ARG 143.A N ARG 38.A O no hydrogen 3.216 N/A SER 146.A N GLN 327.A OXT no hydrogen 3.242 N/A SER 146.A OG GLN 327.A OXT no hydrogen 2.890 N/A GLY 147.A N ILE 326.A O no hydrogen 2.906 N/A GLN 148.A NE2 THR 35.A O no hydrogen 2.687 N/A ARG 149.A N PHE 145.A O no hydrogen 2.915 N/A GLU 150.A N SER 146.A O no hydrogen 2.945 N/A LEU 151.A N GLY 147.A O no hydrogen 2.989 N/A TYR 152.A N GLN 148.A O no hydrogen 2.884 N/A TYR 152.A OH SER 36.A OG no hydrogen 2.838 N/A ASN 153.A N ARG 149.A O no hydrogen 3.416 N/A ASN 153.A ND2 ARG 149.A O no hydrogen 3.094 N/A ASN 153.A ND2 GLY 183.A O no hydrogen 2.754 N/A LYS 154.A N GLU 150.A O no hydrogen 2.872 N/A LYS 154.A NZ THR 1.A O no hydrogen 3.527 N/A LEU 155.A N LEU 151.A O no hydrogen 2.895 N/A MET 156.A N TYR 152.A O no hydrogen 2.950 N/A GLU 157.A N ASN 153.A O no hydrogen 2.799 N/A ASN 158.A N LEU 155.A O no hydrogen 3.293 N/A ASN 158.A ND2 LYS 154.A O no hydrogen 2.697 N/A GLY 159.A N MET 156.A O no hydrogen 2.920 N/A ILE 160.A N LEU 155.A O no hydrogen 2.864 N/A GLU 161.A N ALA 26.A O no hydrogen 3.069 N/A TYR 163.A N ALA 28.A O no hydrogen 2.765 N/A TYR 163.A OH GLU 161.A OE1 no hydrogen 3.306 N/A VAL 164.A N ASN 190.A O no hydrogen 3.111 N/A ILE 165.A N PHE 30.A O no hydrogen 3.007 N/A SER 166.A N ILE 192.A O no hydrogen 3.039 N/A ALA 168.A N SER 166.A OG no hydrogen 2.887 N/A HIS 169.A N GLU 42.A OE2 no hydrogen 3.018 N/A HIS 169.A NE2 THR 196.A OG1 no hydrogen 2.630 N/A GLU 170.A N VAL 194.A O no hydrogen 2.615 N/A GLU 171.A N HIS 169.A ND1 no hydrogen 3.054 N/A VAL 173.A N HIS 169.A O no hydrogen 2.984 N/A ARG 174.A N GLU 170.A O no hydrogen 2.849 N/A ARG 174.A NE PRO 188.A O no hydrogen 2.804 N/A ARG 174.A NH1 GLU 170.A OE2 no hydrogen 3.397 N/A ARG 174.A NH1 GLU 171.A OE1 no hydrogen 2.859 N/A ARG 174.A NH2 GLU 170.A OE2 no hydrogen 2.852 N/A ARG 174.A NH2 PRO 188.A O no hydrogen 2.988 N/A MET 175.A N GLU 171.A O no hydrogen 3.193 N/A VAL 176.A N VAL 173.A O no hydrogen 3.155 N/A ALA 177.A N VAL 173.A O no hydrogen 2.835 N/A ALA 178.A N ARG 174.A O no hydrogen 2.888 N/A ARG 181.A N ASP 179.A OD1 no hydrogen 3.198 N/A TYR 182.A N ASP 179.A O no hydrogen 3.193 N/A TYR 182.A OH ASP 115.A OD1 no hydrogen 2.340 N/A GLY 183.A N PRO 180.A O no hydrogen 3.109 N/A TYR 184.A OH SER 36.A O no hydrogen 2.772 N/A ASN 185.A ND2 ASN 153.A OD1 no hydrogen 3.171 N/A ALA 186.A N ALA 177.A O no hydrogen 3.151 N/A LYS 187.A NZ GLU 161.A OE2 no hydrogen 2.884 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.701 N/A ASN 190.A N LYS 187.A O no hydrogen 2.847 N/A ASN 190.A ND2 GLU 161.A OE2 no hydrogen 2.788 N/A ASN 190.A ND2 VAL 162.A O no hydrogen 3.196 N/A VAL 191.A N PRO 188.A O no hydrogen 3.400 N/A ILE 192.A N VAL 164.A O no hydrogen 2.810 N/A GLY 193.A N GLU 170.A OE1 no hydrogen 3.091 N/A VAL 194.A N ALA 168.A O no hydrogen 2.908 N/A THR 195.A OG1 GLY 193.A O no hydrogen 3.471 N/A THR 196.A OG1 HIS 169.A NE2 no hydrogen 2.630 N/A THR 196.A OG1 THR 229.A O no hydrogen 2.889 N/A LEU 197.A N TYR 231.A O no hydrogen 2.997 N/A LEU 198.A N THR 207.A O no hydrogen 2.717 N/A LYS 199.A N GLU 227.A O no hydrogen 2.920 N/A ASN 200.A N GLU 205.A O no hydrogen 3.011 N/A ARG 201.A NE GLU 227.A OE1 no hydrogen 2.854 N/A ARG 201.A NH2 GLU 227.A OE1 no hydrogen 3.337 N/A THR 203.A N ASN 200.A OD1 no hydrogen 2.443 N/A GLY 204.A N ASN 200.A O no hydrogen 2.770 N/A GLU 205.A N THR 203.A OG1 no hydrogen 3.114 N/A THR 207.A N LEU 198.A O no hydrogen 2.971 N/A THR 207.A OG1 THR 208.A O no hydrogen 3.530 N/A ARG 210.A NE GLU 170.A OE1 no hydrogen 3.173 N/A ARG 210.A NE GLU 170.A OE2 no hydrogen 3.031 N/A ARG 210.A NH2 GLU 189.A O no hydrogen 2.749 N/A ARG 210.A NH2 VAL 191.A O no hydrogen 2.959 N/A LYS 211.A N THR 208.A OG1 no hydrogen 3.080 N/A LYS 211.A NZ GLU 215.A OE2 no hydrogen 3.292 N/A GLN 212.A N THR 208.A O no hydrogen 3.222 N/A GLN 212.A N ALA 209.A O no hydrogen 2.887 N/A GLN 212.A NE2 ASN 223.A OD1 no hydrogen 3.322 N/A ILE 213.A N ALA 209.A O no hydrogen 2.820 N/A ALA 214.A N ARG 210.A O no hydrogen 2.873 N/A GLU 215.A N LYS 211.A O no hydrogen 2.983 N/A GLY 216.A N GLN 212.A O no hydrogen 2.927 N/A LYS 217.A N GLN 212.A O no hydrogen 3.158 N/A ASN 223.A N PRO 220.A O no hydrogen 2.912 N/A ASN 223.A ND2 GLN 212.A OE1 no hydrogen 3.058 N/A LEU 224.A N LYS 221.A O no hydrogen 3.209 N/A LEU 226.A N ASN 223.A O no hydrogen 2.723 N/A GLU 227.A N LYS 199.A O no hydrogen 2.755 N/A VAL 228.A N PHE 105.A O no hydrogen 2.772 N/A THR 229.A N LEU 197.A O no hydrogen 3.041 N/A THR 229.A OG1 LEU 197.A O no hydrogen 2.992 N/A TYR 231.A N THR 229.A OG1 no hydrogen 3.415 N/A TRP 233.A N THR 195.A O no hydrogen 2.855 N/A THR 237.A OG1 SER 166.A O no hydrogen 2.523 N/A TRP 238.A N ALA 236.A O no hydrogen 2.883 N/A LYS 242.A N MET 239.A O no hydrogen 3.046 N/A LYS 242.A NZ ILE 165.A O no hydrogen 3.105 N/A LYS 242.A NZ ASP 267.A OD1 no hydrogen 2.509 N/A ALA 244.A N ALA 240.A O no hydrogen 2.835 N/A ALA 245.A N GLY 241.A O no hydrogen 2.698 N/A ILE 246.A N LYS 242.A O no hydrogen 3.129 N/A LEU 247.A N GLN 243.A O no hydrogen 3.204 N/A THR 248.A N ALA 244.A O no hydrogen 3.068 N/A THR 248.A OG1 ALA 244.A O no hydrogen 2.816 N/A TYR 249.A N ALA 245.A O no hydrogen 2.901 N/A ILE 250.A N ILE 246.A O no hydrogen 2.890 N/A ASP 251.A N ILE 246.A O no hydrogen 3.042 N/A TRP 253.A N ASP 251.A OD1 no hydrogen 3.027 N/A LYS 254.A N ASP 251.A OD1 no hydrogen 2.701 N/A LYS 254.A NZ GLY 25.A O no hydrogen 2.626 N/A ARG 255.A NE GLY 274.A O no hydrogen 2.964 N/A ARG 255.A NH2 THR 275.A O no hydrogen 2.796 N/A ILE 257.A N TYR 27.A O no hydrogen 3.028 N/A VAL 259.A N VAL 280.A O no hydrogen 2.981 N/A ALA 260.A N VAL 29.A O no hydrogen 2.917 N/A GLY 261.A N LEU 282.A O no hydrogen 3.088 N/A ASP 262.A N ASP 267.A OD2 no hydrogen 3.014 N/A THR 263.A N ASP 267.A OD2 no hydrogen 2.957 N/A THR 263.A OG1 ASP 262.A OD2 no hydrogen 3.072 N/A ASP 267.A N THR 263.A O no hydrogen 2.780 N/A LEU 271.A N ASP 267.A O no hydrogen 2.972 N/A PHE 272.A N GLY 268.A O no hydrogen 2.931 N/A ASN 273.A N TYR 269.A O no hydrogen 2.858 N/A GLY 274.A N MET 270.A O no hydrogen 3.008 N/A THR 275.A N MET 270.A O no hydrogen 3.115 N/A THR 275.A OG1 MET 270.A O no hydrogen 3.512 N/A THR 275.A OG1 LEU 271.A O no hydrogen 2.507 N/A ALA 276.A N PRO 256.A O no hydrogen 2.612 N/A GLY 279.A N ALA 276.A O no hydrogen 2.926 N/A VAL 280.A N ILE 257.A O no hydrogen 2.906 N/A HIS 281.A N ASN 317.A O no hydrogen 2.980 N/A HIS 281.A ND1 ARG 316.A O no hydrogen 2.629 N/A LEU 282.A N VAL 259.A O no hydrogen 2.773 N/A TRP 283.A N VAL 319.A O no hydrogen 2.776 N/A VAL 284.A N GLY 261.A O no hydrogen 3.017 N/A ASN 285.A N VAL 321.A O no hydrogen 2.834 N/A ARG 286.A NE ASP 262.A OD2 no hydrogen 2.792 N/A ARG 286.A NH2 ASP 262.A OD2 no hydrogen 2.968 N/A ARG 286.A NH2 THR 263.A OG1 no hydrogen 3.231 N/A LYS 287.A N ASN 285.A OD1 no hydrogen 3.406 N/A MET 291.A N LYS 287.A O no hydrogen 3.285 N/A MET 291.A N ALA 288.A O no hydrogen 3.228 N/A GLU 292.A N ALA 288.A O no hydrogen 3.380 N/A GLN 293.A N LYS 289.A O no hydrogen 2.890 N/A ILE 294.A N TYR 290.A O no hydrogen 2.836 N/A ASN 295.A N MET 291.A O no hydrogen 3.077 N/A GLY 296.A N GLU 292.A O no hydrogen 2.901 N/A MET 297.A N GLN 293.A O no hydrogen 3.027 N/A ILE 298.A N ILE 294.A O no hydrogen 2.798 N/A LYS 299.A N ASN 295.A O no hydrogen 3.214 N/A GLN 300.A N GLY 296.A O no hydrogen 2.993 N/A HIS 301.A N MET 297.A O no hydrogen 2.719 N/A SER 302.A N ILE 298.A O no hydrogen 2.813 N/A SER 302.A OG ILE 298.A O no hydrogen 2.881 N/A ALA 303.A N LYS 299.A O no hydrogen 3.111 N/A ALA 304.A N GLN 300.A O no hydrogen 2.904 N/A GLN 305.A N HIS 301.A O no hydrogen 2.905 N/A GLN 305.A NE2 THR 313.A OG1 no hydrogen 3.099 N/A ALA 306.A N SER 302.A O no hydrogen 3.279 N/A LYS 307.A N ALA 303.A O no hydrogen 3.017 N/A ALA 308.A N GLN 305.A O no hydrogen 3.115 N/A GLY 309.A N ALA 306.A O no hydrogen 3.019 N/A LEU 310.A N GLN 305.A O no hydrogen 2.913 N/A THR 313.A N GLN 305.A OE1 no hydrogen 2.778 N/A ALA 314.A N GLN 305.A OE1 no hydrogen 2.948 N/A ARG 316.A N THR 313.A O no hydrogen 3.216 N/A ARG 316.A NE VAL 312.A O no hydrogen 3.475 N/A ARG 316.A NH1 ASN 278.A OD1 no hydrogen 3.241 N/A ARG 316.A NH2 VAL 312.A O no hydrogen 3.129 N/A ASN 317.A ND2 GLY 279.A O no hydrogen 3.044 N/A TRP 318.A NE1 ALA 314.A O no hydrogen 2.676 N/A VAL 319.A N HIS 281.A O no hydrogen 2.821 N/A VAL 321.A N TRP 283.A O no hydrogen 2.914 N/A THR 322.A N GLN 325.A OE1 no hydrogen 2.782 N/A GLU 324.A N GLU 324.A OE1 no hydrogen 2.775 N/A GLN 325.A N THR 322.A O no hydrogen 2.968 N/A ILE 326.A N PRO 323.A O no hydrogen 3.084 N/A GLN 327.A NE2 GLN 327.A OXT no hydrogen 3.421 N/A