Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fd8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 THR 25.A O no hydrogen 3.463 N/A VAL 3.A N THR 25.A O no hydrogen 2.934 N/A PHE 6.A N THR 30.A O no hydrogen 2.965 N/A ILE 7.A N THR 68.A O no hydrogen 2.902 N/A GLY 8.A N PHE 32.A O no hydrogen 2.630 N/A PHE 9.A N ASP 33.A OD2 no hydrogen 2.841 N/A SER 12.A OG CYS 70.A O no hydrogen 3.519 N/A SER 12.A OG GLU 93.A OE1 no hydrogen 2.704 N/A SER 12.A OG GLU 93.A OE2 no hydrogen 3.386 N/A ASN 14.A N GLY 10.A O no hydrogen 3.162 N/A ASN 14.A ND2 GLY 10.A O no hydrogen 2.777 N/A ARG 15.A N LYS 11.A O no hydrogen 2.645 N/A TYR 16.A N SER 12.A O no hydrogen 2.965 N/A HIS 17.A ND1 TYR 297.A OH no hydrogen 2.723 N/A HIS 17.A NE2 GLU 93.A OE2 no hydrogen 2.879 N/A LEU 18.A N ALA 13.A O no hydrogen 2.907 N/A TYR 20.A N HIS 17.A O no hydrogen 3.024 N/A TYR 20.A OH GLN 248.A OE1 no hydrogen 2.825 N/A VAL 21.A N HIS 17.A O no hydrogen 2.992 N/A ARG 23.A N VAL 21.A O no hydrogen 3.176 N/A ARG 23.A NE TYR 20.A O no hydrogen 2.891 N/A ARG 23.A NH1 ASP 292.A OD2 no hydrogen 3.449 N/A ARG 23.A NH1 ASP 298.A OD1 no hydrogen 3.130 N/A ARG 23.A NH2 TYR 20.A O no hydrogen 3.359 N/A ARG 23.A NH2 ASP 292.A OD1 no hydrogen 3.491 N/A ARG 23.A NH2 ASP 292.A OD2 no hydrogen 3.546 N/A LEU 26.A N ARG 23.A O no hydrogen 2.853 N/A GLU 27.A N VAL 3.A O no hydrogen 2.789 N/A LYS 29.A NZ ASP 61.A OD2 no hydrogen 2.654 N/A LYS 29.A NZ GLU 63.A OE1 no hydrogen 3.200 N/A ILE 31.A N ASN 50.A O no hydrogen 2.902 N/A PHE 32.A N PHE 6.A O no hydrogen 2.806 N/A ASP 33.A N THR 52.A O no hydrogen 3.114 N/A HIS 35.A N ASP 33.A OD1 no hydrogen 2.641 N/A LYS 39.A N ASN 37.A OD1 no hydrogen 3.164 N/A ALA 40.A N ASN 37.A OD1 no hydrogen 3.254 N/A ALA 41.A N ASN 37.A O no hydrogen 3.244 N/A ALA 42.A N LYS 39.A O no hydrogen 3.237 N/A LYS 45.A N ALA 41.A O no hydrogen 2.784 N/A LYS 45.A NZ GLU 38.A OE2 no hydrogen 3.264 N/A GLU 46.A N ALA 42.A O no hydrogen 2.929 N/A LYS 47.A N PHE 44.A O no hydrogen 3.021 N/A GLY 48.A N LYS 45.A O no hydrogen 3.066 N/A VAL 49.A N PHE 44.A O no hydrogen 2.958 N/A ASN 50.A N LYS 29.A O no hydrogen 2.832 N/A THR 52.A N ILE 31.A O no hydrogen 3.038 N/A THR 52.A OG1 GLU 57.A OE1 no hydrogen 2.652 N/A ASP 54.A N THR 52.A OG1 no hydrogen 3.089 N/A GLU 57.A N ASP 54.A O no hydrogen 2.762 N/A LEU 58.A N LEU 55.A O no hydrogen 3.004 N/A LEU 59.A N LEU 55.A O no hydrogen 3.089 N/A THR 60.A N ASN 56.A O no hydrogen 3.131 N/A THR 60.A OG1 ASN 56.A O no hydrogen 2.583 N/A ASP 61.A N LEU 58.A O no hydrogen 3.105 N/A GLU 63.A N ASP 61.A OD1 no hydrogen 2.650 N/A ILE 64.A N ASP 61.A O no hydrogen 3.318 N/A ILE 64.A N ASP 61.A OD1 no hydrogen 3.295 N/A GLU 65.A N LYS 4.A O no hydrogen 2.671 N/A LEU 66.A N LYS 4.A O no hydrogen 3.176 N/A ILE 67.A N SER 89.A O no hydrogen 2.923 N/A THR 68.A N GLY 5.A O no hydrogen 3.006 N/A THR 68.A OG1 TYR 297.A OH no hydrogen 2.857 N/A ILE 69.A N ILE 91.A O no hydrogen 2.836 N/A CYS 70.A N ILE 7.A O no hydrogen 3.039 N/A THR 71.A OG1 THR 75.A OG1 no hydrogen 2.756 N/A THR 75.A N PRO 72.A O no hydrogen 2.917 N/A THR 75.A OG1 THR 71.A OG1 no hydrogen 2.756 N/A THR 75.A OG1 PRO 72.A O no hydrogen 2.687 N/A HIS 76.A N ALA 73.A O no hydrogen 2.964 N/A HIS 76.A ND1 PRO 95.A O no hydrogen 2.581 N/A HIS 76.A NE2 THR 71.A O no hydrogen 2.663 N/A TYR 77.A OH GLU 105.A OE1 no hydrogen 3.153 N/A TYR 77.A OH GLU 105.A OE2 no hydrogen 2.845 N/A LEU 79.A N THR 75.A O no hydrogen 3.144 N/A ALA 80.A N HIS 76.A O no hydrogen 3.032 N/A LYS 81.A N TYR 77.A O no hydrogen 3.028 N/A LYS 81.A NZ TYR 77.A OH no hydrogen 2.908 N/A GLN 82.A N ASP 78.A O no hydrogen 2.988 N/A GLN 82.A NE2 ASP 78.A O no hydrogen 3.569 N/A ALA 83.A N LEU 79.A O no hydrogen 2.898 N/A ILE 84.A N ALA 80.A O no hydrogen 3.014 N/A LEU 85.A N LYS 81.A O no hydrogen 3.018 N/A ALA 86.A N GLN 82.A O no hydrogen 3.076 N/A GLY 87.A N ILE 84.A O no hydrogen 2.629 N/A LYS 88.A N ALA 83.A O no hydrogen 3.003 N/A LYS 88.A NZ LEU 59.A O no hydrogen 2.432 N/A LYS 88.A NZ ASP 61.A O no hydrogen 3.039 N/A SER 89.A N GLU 65.A O no hydrogen 3.140 N/A VAL 90.A N VAL 116.A O no hydrogen 2.809 N/A ILE 91.A N ILE 67.A O no hydrogen 2.778 N/A GLU 93.A N ILE 69.A O no hydrogen 3.162 N/A ASP 98.A N ASP 98.A OD1 no hydrogen 2.512 N/A HIS 102.A N THR 99.A OG1 no hydrogen 2.856 N/A ALA 103.A N THR 99.A O no hydrogen 2.915 N/A GLU 104.A N LEU 100.A O no hydrogen 2.841 N/A GLU 105.A N GLU 101.A O no hydrogen 2.968 N/A LEU 106.A N HIS 102.A O no hydrogen 2.930 N/A PHE 107.A N ALA 103.A O no hydrogen 3.125 N/A ALA 108.A N GLU 104.A O no hydrogen 2.961 N/A LEU 109.A N GLU 105.A O no hydrogen 2.913 N/A GLY 110.A N LEU 106.A O no hydrogen 3.188 N/A GLN 111.A N PHE 107.A O no hydrogen 2.911 N/A GLU 112.A N ALA 108.A O no hydrogen 3.032 N/A LYS 113.A N LEU 109.A O no hydrogen 3.042 N/A LYS 113.A NZ LEU 85.A O no hydrogen 3.296 N/A GLY 114.A N GLY 110.A O no hydrogen 2.810 N/A GLY 114.A N GLN 111.A O no hydrogen 3.276 N/A VAL 115.A N GLY 110.A O no hydrogen 3.162 N/A VAL 116.A N SER 89.A OG no hydrogen 2.906 N/A TYR 119.A N VAL 92.A O no hydrogen 2.765 N/A ARG 123.A NE ASP 176.A OD2 no hydrogen 2.722 N/A ARG 123.A NH1 LEU 311.A O no hydrogen 3.354 N/A ARG 123.A NH1 GLN 316.A OE1 no hydrogen 3.300 N/A ARG 123.A NH2 ASP 176.A OD1 no hydrogen 2.703 N/A ARG 123.A NH2 ASP 176.A OD2 no hydrogen 3.514 N/A ARG 123.A NH2 GLN 316.A OE1 no hydrogen 3.003 N/A PHE 124.A N ASN 121.A O no hydrogen 2.849 N/A ASP 125.A N ARG 122.A O no hydrogen 3.293 N/A GLY 126.A N ASP 246.A OD2 no hydrogen 3.014 N/A TYR 128.A OH ARG 177.A O no hydrogen 2.839 N/A LEU 129.A N ASP 125.A O no hydrogen 3.139 N/A ALA 130.A N GLY 126.A O no hydrogen 2.942 N/A LYS 131.A NZ GLU 135.A OE2 no hydrogen 3.181 N/A GLN 132.A N LEU 129.A O no hydrogen 2.959 N/A GLN 132.A NE2 GLN 136.A OE1 no hydrogen 3.033 N/A VAL 133.A N ALA 130.A O no hydrogen 3.041 N/A GLU 135.A N LYS 131.A O no hydrogen 3.001 N/A GLN 136.A N GLN 132.A O no hydrogen 2.832 N/A GLY 137.A N VAL 134.A O no hydrogen 3.129 N/A GLY 140.A N GLY 137.A O no hydrogen 3.037 N/A GLU 141.A N SER 236.A OG no hydrogen 2.907 N/A ASN 143.A N HIS 234.A O no hydrogen 2.798 N/A GLU 144.A N HIS 234.A O no hydrogen 3.327 N/A VAL 145.A N LYS 215.A O no hydrogen 3.094 N/A GLU 146.A N ILE 232.A O no hydrogen 2.707 N/A THR 147.A N LYS 217.A O no hydrogen 2.840 N/A HIS 148.A N ARG 230.A O no hydrogen 3.237 N/A HIS 148.A ND1 ASP 150.A OD2 no hydrogen 2.723 N/A HIS 148.A NE2 GLU 146.A OE2 no hydrogen 2.435 N/A ILE 149.A N LYS 219.A O no hydrogen 3.215 N/A TYR 151.A N ASN 221.A O no hydrogen 3.036 N/A ARG 153.A N HIS 222.A O no hydrogen 2.848 N/A GLY 155.A N GLU 195.A OE2 no hydrogen 2.566 N/A SER 156.A N ARG 153.A O no hydrogen 3.117 N/A SER 156.A OG ARG 153.A O no hydrogen 2.984 N/A LYS 163.A NZ GLU 164.A OE2 no hydrogen 3.026 N/A ASN 165.A N PRO 162.A O no hydrogen 3.296 N/A GLY 166.A N LYS 163.A O no hydrogen 3.028 N/A SER 167.A N ASP 201.A O no hydrogen 2.920 N/A SER 167.A OG ASP 201.A O no hydrogen 3.205 N/A PHE 168.A N ASP 201.A OD1 no hydrogen 2.954 N/A GLY 170.A N GLY 166.A O no hydrogen 2.990 N/A LEU 171.A N SER 167.A O no hydrogen 2.696 N/A GLY 172.A N SER 167.A O no hydrogen 3.130 N/A LEU 175.A N LEU 171.A O no hydrogen 3.130 N/A ARG 177.A N HIS 174.A O no hydrogen 3.455 N/A ARG 177.A NH1 ARG 122.A O no hydrogen 3.029 N/A ARG 177.A NH1 ASP 125.A OD2 no hydrogen 2.633 N/A ALA 179.A N ASP 176.A O no hydrogen 2.890 N/A GLY 182.A N ILE 178.A O no hydrogen 2.904 N/A ARG 183.A NH1 THR 319.A OG1 no hydrogen 3.125 N/A ARG 183.A NH2 GLU 322.A OE1 no hydrogen 3.190 N/A ASP 185.A N HIS 209.A O no hydrogen 3.008 N/A VAL 187.A N TYR 336.A O no hydrogen 2.703 N/A THR 188.A N ASP 207.A O no hydrogen 3.075 N/A TYR 189.A N SER 334.A O no hydrogen 2.856 N/A TYR 189.A OH ILE 323.A O no hydrogen 2.694 N/A ILE 191.A N SER 332.A OG no hydrogen 2.787 N/A ARG 192.A N TYR 203.A O no hydrogen 3.015 N/A ARG 192.A NE ASP 190.A OD1 no hydrogen 2.740 N/A ARG 192.A NH2 ASP 190.A OD2 no hydrogen 3.297 N/A ASN 193.A ND2 ILE 157.A O no hydrogen 3.110 N/A ASN 193.A ND2 VAL 200.A O no hydrogen 2.909 N/A ASN 194.A N ASN 202.A OD1 no hydrogen 3.142 N/A ASN 194.A ND2 ASN 221.A OD1 no hydrogen 3.144 N/A GLU 195.A N ASN 193.A OD1 no hydrogen 2.757 N/A VAL 196.A N ASN 193.A OD1 no hydrogen 2.603 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 3.099 N/A ALA 199.A N VAL 196.A O no hydrogen 2.914 N/A VAL 200.A N GLU 159.A O no hydrogen 3.168 N/A ASN 202.A N ARG 192.A O no hydrogen 3.130 N/A ASN 202.A ND2 ASN 194.A OD1 no hydrogen 3.575 N/A PHE 204.A N THR 220.A O no hydrogen 3.099 N/A ASP 205.A N ASP 190.A O no hydrogen 2.972 N/A VAL 206.A N VAL 218.A O no hydrogen 2.998 N/A ASP 207.A N THR 188.A O no hydrogen 3.093 N/A LEU 208.A N VAL 216.A O no hydrogen 2.659 N/A HIS 209.A N GLN 186.A O no hydrogen 2.949 N/A TYR 210.A N LEU 214.A O no hydrogen 2.819 N/A TYR 210.A OH GLY 182.A O no hydrogen 2.880 N/A GLY 211.A N ASP 185.A OD1 no hydrogen 3.130 N/A LEU 214.A N TYR 210.A O no hydrogen 3.330 N/A LYS 215.A N ASN 143.A O no hydrogen 3.307 N/A LYS 215.A NZ ASP 207.A OD2 no hydrogen 3.186 N/A VAL 216.A N LEU 208.A O no hydrogen 2.901 N/A LYS 217.A N VAL 145.A O no hydrogen 2.846 N/A LYS 217.A NZ ASP 205.A OD1 no hydrogen 2.823 N/A LYS 217.A NZ ASP 207.A OD1 no hydrogen 2.781 N/A LYS 217.A NZ ASP 207.A OD2 no hydrogen 3.047 N/A VAL 218.A N VAL 206.A O no hydrogen 2.863 N/A LYS 219.A N THR 147.A O no hydrogen 2.968 N/A LYS 219.A NZ ASP 205.A OD2 no hydrogen 2.764 N/A THR 220.A N PHE 204.A O no hydrogen 2.956 N/A THR 220.A OG1 ILE 149.A O no hydrogen 2.977 N/A HIS 222.A ND1 ASN 202.A O no hydrogen 2.953 N/A SER 223.A N ASN 221.A OD1 no hydrogen 2.788 N/A VAL 224.A N TYR 151.A O no hydrogen 2.935 N/A ARG 230.A N LYS 242.A O no hydrogen 2.574 N/A ARG 230.A NE ASP 127.A OD2 no hydrogen 3.208 N/A PHE 231.A N LYS 242.A O no hydrogen 3.116 N/A ILE 232.A N GLU 146.A O no hydrogen 2.910 N/A VAL 233.A N PHE 240.A O no hydrogen 2.915 N/A HIS 234.A N GLU 144.A O no hydrogen 2.970 N/A HIS 234.A ND1 SER 239.A OG no hydrogen 2.782 N/A GLY 235.A N GLY 238.A O no hydrogen 2.838 N/A SER 236.A N GLU 141.A O no hydrogen 2.922 N/A ASN 237.A N LEU 139.A O no hydrogen 2.932 N/A SER 239.A N THR 273.A O no hydrogen 2.838 N/A SER 239.A OG HIS 234.A ND1 no hydrogen 2.782 N/A PHE 240.A N VAL 233.A O no hydrogen 2.908 N/A ILE 241.A N GLU 271.A O no hydrogen 3.037 N/A LYS 242.A N PHE 231.A O no hydrogen 2.999 N/A LYS 242.A NZ ASP 265.A OD2 no hydrogen 3.433 N/A ASP 246.A N ASP 127.A OD1 no hydrogen 3.115 N/A GLN 248.A N ASP 246.A OD1 no hydrogen 2.739 N/A GLN 248.A NE2 PHE 124.A O no hydrogen 3.346 N/A GLN 248.A NE2 ASP 246.A OD2 no hydrogen 2.780 N/A ASN 250.A ND2 GLN 247.A OE1 no hydrogen 3.046 N/A ASP 251.A N GLN 247.A O no hydrogen 2.820 N/A LEU 252.A N GLN 248.A O no hydrogen 2.944 N/A LYS 253.A N GLU 249.A O no hydrogen 2.769 N/A ALA 254.A N ASP 251.A O no hydrogen 3.255 N/A GLY 255.A N LEU 252.A O no hydrogen 3.162 N/A ILE 256.A N ASP 251.A O no hydrogen 2.794 N/A PHE 262.A N ALA 259.A O no hydrogen 3.345 N/A GLU 264.A N GLY 261.A O no hydrogen 3.189 N/A TYR 269.A N PRO 267.A O no hydrogen 3.094 N/A GLU 271.A N ILE 241.A O no hydrogen 2.941 N/A VAL 272.A N LYS 284.A O no hydrogen 2.982 N/A THR 273.A N SER 239.A O no hydrogen 2.927 N/A TYR 274.A N ILE 282.A O no hydrogen 2.975 N/A ARG 275.A N ASN 237.A O no hydrogen 2.997 N/A ARG 275.A NE GLY 279.A O no hydrogen 3.484 N/A ARG 275.A NH2 GLY 279.A O no hydrogen 3.176 N/A ASN 276.A N ASP 280.A O no hydrogen 3.224 N/A ASN 276.A ND2 ASP 280.A OD2 no hydrogen 2.871 N/A ASN 278.A N ASN 276.A OD1 no hydrogen 2.665 N/A ASN 278.A ND2 ASN 276.A OD1 no hydrogen 3.683 N/A GLY 279.A N ASN 276.A O no hydrogen 3.145 N/A ASP 280.A N ASN 276.A OD1 no hydrogen 3.079 N/A ILE 282.A N TYR 274.A O no hydrogen 2.735 N/A LYS 284.A N VAL 272.A O no hydrogen 3.165 N/A GLN 285.A NE2 PRO 267.A O no hydrogen 3.510 N/A ILE 286.A N GLY 270.A O no hydrogen 2.787 N/A THR 288.A OG1 ASP 265.A OD2 no hydrogen 2.677 N/A GLY 291.A N GLY 263.A O no hydrogen 2.883 N/A ASP 292.A N PHE 124.A O no hydrogen 3.285 N/A TYR 293.A N GLN 248.A OE1 no hydrogen 2.900 N/A TYR 293.A OH ASP 125.A OD1 no hydrogen 2.507 N/A GLY 294.A N ASP 292.A OD1 no hydrogen 2.846 N/A ARG 295.A N ASP 292.A O no hydrogen 2.932 N/A TYR 296.A N TYR 293.A O no hydrogen 3.198 N/A TYR 296.A OH PRO 118.A O no hydrogen 2.712 N/A TYR 297.A OH HIS 17.A ND1 no hydrogen 2.723 N/A TYR 297.A OH THR 68.A OG1 no hydrogen 2.857 N/A ASP 298.A N GLY 294.A O no hydrogen 3.074 N/A ALA 299.A N ARG 295.A O no hydrogen 3.151 N/A VAL 300.A N TYR 296.A O no hydrogen 3.102 N/A TYR 301.A N TYR 297.A O no hydrogen 2.980 N/A GLU 302.A N ASP 298.A O no hydrogen 2.939 N/A THR 303.A N ALA 299.A O no hydrogen 3.075 N/A THR 303.A N VAL 300.A O no hydrogen 3.257 N/A THR 303.A OG1 ALA 299.A O no hydrogen 3.043 N/A THR 303.A OG1 ALA 308.A O no hydrogen 2.845 N/A LEU 304.A N VAL 300.A O no hydrogen 2.913 N/A LYS 305.A N TYR 301.A O no hydrogen 2.934 N/A LYS 305.A NZ GLU 65.A OE1 no hydrogen 2.690 N/A ALA 308.A N GLU 302.A O no hydrogen 2.873 N/A GLN 310.A NE2 VAL 312.A O no hydrogen 2.872 N/A THR 313.A N GLN 316.A OE1 no hydrogen 3.062 N/A GLN 316.A N THR 313.A OG1 no hydrogen 3.107 N/A ALA 317.A N THR 313.A O no hydrogen 3.139 N/A LEU 318.A N LYS 314.A O no hydrogen 2.898 N/A THR 319.A N GLU 315.A O no hydrogen 2.808 N/A THR 319.A OG1 GLU 315.A O no hydrogen 2.739 N/A ASN 320.A N GLN 316.A O no hydrogen 2.936 N/A ILE 321.A N ALA 317.A O no hydrogen 3.262 N/A GLU 322.A N LEU 318.A O no hydrogen 2.987 N/A ILE 323.A N THR 319.A O no hydrogen 3.106 N/A LEU 324.A N ASN 320.A O no hydrogen 3.011 N/A GLU 325.A N ILE 321.A O no hydrogen 2.911 N/A ALA 326.A N GLU 322.A O no hydrogen 2.856 N/A GLY 327.A N ILE 323.A O no hydrogen 3.137 N/A PHE 328.A N GLU 325.A O no hydrogen 2.955 N/A LEU 329.A N ALA 326.A O no hydrogen 3.182 N/A SER 332.A OG TYR 189.A O no hydrogen 3.542 N/A SER 332.A OG ILE 191.A O no hydrogen 3.240 N/A SER 334.A N TYR 189.A O no hydrogen 3.103 N/A TYR 336.A N VAL 187.A O no hydrogen 2.835 N/A TYR 336.A OH GLU 322.A OE2 no hydrogen 2.718 N/A LEU 338.A N ASP 185.A O no hydrogen 2.731 N/A LYS 339.A N GLU 322.A OE2 no hydrogen 3.174 N/A