Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5brr_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N LYS 141.A O no hydrogen 2.827 N/A ILE 1.A N ASP 202.A OD2 no hydrogen 2.586 N/A LYS 2.A N ASP 197.A O no hydrogen 2.682 N/A LYS 2.A NZ ALA 193G.A O no hydrogen 3.501 N/A LEU 5.A N GLU 155.A O no hydrogen 3.240 N/A SER 11.A N ASP 8.A O no hydrogen 2.925 N/A HIS 12.A N ILE 9.A O no hydrogen 2.792 N/A GLN 15.A N HIS 12.A O no hydrogen 2.879 N/A GLN 15.A NE2 SER 137.A O no hydrogen 2.636 N/A ALA 16.A N GLY 34.A O no hydrogen 2.909 N/A ALA 17.A N ILE 61.A O no hydrogen 3.088 N/A ILE 18.A N CYS 32.A O no hydrogen 2.718 N/A PHE 19.A N THR 59.A O no hydrogen 2.741 N/A ALA 20.A N ARG 29.A O no hydrogen 3.052 N/A LYS 21.A N HIS 57.A O no hydrogen 3.057 N/A LYS 21.A NZ HIS 56.A O no hydrogen 2.512 N/A HIS 22.A N GLY 27E.A O no hydrogen 2.529 N/A HIS 22.A ND1 GLY 27E.A O no hydrogen 1.899 N/A GLU 28.A N GLU 28.A OE1 no hydrogen 2.046 N/A ARG 29.A N ALA 20.A O no hydrogen 2.810 N/A LEU 31.A N ILE 18.A O no hydrogen 2.853 N/A CYS 32.A N ILE 18.A O no hydrogen 3.324 N/A CYS 32.A SG LEU 31.A O no hydrogen 2.976 N/A GLY 33.A N ALA 203.A O no hydrogen 2.949 N/A GLY 34.A N ALA 16.A O no hydrogen 3.029 N/A ILE 35.A N LEU 43.A O no hydrogen 3.017 N/A LEU 36.A N TRP 14.A O no hydrogen 2.945 N/A SER 39.A OG ALA 110.A O no hydrogen 2.673 N/A TRP 41.A N SER 38.A O no hydrogen 3.047 N/A ILE 42.A N LEU 100.A O no hydrogen 2.871 N/A LEU 43.A N ILE 35.A O no hydrogen 2.806 N/A SER 44.A N ALA 98.A O no hydrogen 3.200 N/A SER 44.A OG GLY 33.A O no hydrogen 2.570 N/A HIS 47.A N ASP 96.A OD1 no hydrogen 2.810 N/A HIS 47.A ND1 ASP 96.A OD2 no hydrogen 2.597 N/A CYS 48.A SG ALA 203.A O no hydrogen 3.916 N/A PHE 49.A N ALA 46.A O no hydrogen 2.876 N/A GLN 50.A NE2 HIS 47.A O no hydrogen 2.967 N/A HIS 57.A N PRO 54D.A O no hydrogen 3.003 N/A LEU 58.A N PRO 55.A O no hydrogen 2.624 N/A THR 59.A N PHE 19.A O no hydrogen 2.944 N/A VAL 60.A N PHE 77.A O no hydrogen 2.901 N/A ILE 61.A N ALA 17.A O no hydrogen 2.881 N/A LEU 62.A N GLN 75.A O no hydrogen 2.888 N/A ARG 64.A NE GLU 74.A OE1 no hydrogen 2.537 N/A ARG 64.A NH1 ARG 67.A O no hydrogen 2.953 N/A ARG 64.A NH2 GLU 74.A OE1 no hydrogen 3.137 N/A ARG 64.A NH2 GLU 74.A OE2 no hydrogen 3.153 N/A ARG 67.A N GLU 151.A O no hydrogen 3.369 N/A ARG 67.A NE SER 150.A O no hydrogen 2.887 N/A GLU 74.A N GLY 71.A O no hydrogen 3.413 N/A GLN 75.A N LEU 62.A O no hydrogen 2.955 N/A GLN 75.A NE2 GLN 111.A O no hydrogen 3.238 N/A PHE 77.A N VAL 60.A O no hydrogen 2.798 N/A VAL 79.A N LEU 58.A O no hydrogen 3.383 N/A GLU 80.A N GLN 101.A O no hydrogen 2.840 N/A LYS 81.A N GLN 101.A O no hydrogen 3.438 N/A TYR 82.A OH PHE 53C.A O no hydrogen 2.334 N/A ILE 83.A N LEU 99.A O no hydrogen 2.752 N/A HIS 85.A N ILE 97.A O no hydrogen 3.363 N/A GLU 87.A N HIS 85.A ND1 no hydrogen 3.180 N/A PHE 88.A N HIS 85.A O no hydrogen 3.299 N/A ASP 89.A N ASP 94.A O no hydrogen 2.666 N/A ASP 91.A N ASP 89.A OD2 no hydrogen 2.729 N/A THR 92.A N ASP 89.A OD2 no hydrogen 2.573 N/A TYR 93.A N ASP 89.A O no hydrogen 2.832 N/A ASP 94.A N THR 92.A OG1 no hydrogen 3.369 N/A ASN 95.A ND2 GLU 87.A O no hydrogen 3.059 N/A ALA 98.A N SER 44.A O no hydrogen 3.000 N/A LEU 99.A N ILE 83.A O no hydrogen 3.001 N/A LEU 100.A N ILE 42.A O no hydrogen 2.952 N/A GLN 101.A N LYS 81.A O no hydrogen 2.846 N/A LEU 102.A N CYS 40.A O no hydrogen 2.830 N/A LYS 103.A N GLU 78.A O no hydrogen 2.700 N/A LYS 103.A NZ GLU 78.A OE1 no hydrogen 3.338 N/A LYS 103.A NZ VAL 79.A O no hydrogen 3.265 N/A SER 104.A OG ARG 108D.A O no hydrogen 3.356 N/A ALA 110.A N SER 39.A O no hydrogen 3.312 N/A GLN 111.A N GLN 75.A OE1 no hydrogen 2.903 N/A SER 113.A N VAL 116.A O no hydrogen 2.822 N/A VAL 115.A N SER 113.A OG no hydrogen 2.995 N/A VAL 116.A N SER 113.A OG no hydrogen 3.030 N/A ARG 117.A N PRO 13.A O no hydrogen 2.853 N/A VAL 119.A N LEU 36.A O no hydrogen 3.031 N/A LEU 126.A N PRO 123.A O no hydrogen 3.070 N/A TRP 131.A N LEU 160.A O no hydrogen 2.765 N/A THR 132.A N PRO 129.A O no hydrogen 3.218 N/A THR 132.A OG1 PRO 129.A O no hydrogen 2.079 N/A CYS 134.A N VAL 158.A O no hydrogen 2.733 N/A CYS 134.A SG THR 132.A O no hydrogen 3.874 N/A GLU 135.A N VAL 208.A O no hydrogen 2.740 N/A LEU 136.A N ALA 156.A O no hydrogen 3.034 N/A GLY 138.A N LYS 154.A O no hydrogen 3.261 N/A TYR 139.A OH ARG 64.A O no hydrogen 2.573 N/A GLY 140.A N ASP 202.A OD1 no hydrogen 2.677 N/A LYS 141.A N GLN 200.A O no hydrogen 3.100 N/A LYS 141.A NZ SER 146.A O no hydrogen 3.093 N/A HIS 142.A NE2 SER 150.A OG no hydrogen 2.693 N/A GLU 143.A N SER 146.A OG no hydrogen 3.002 N/A SER 146.A N GLU 143.A O no hydrogen 3.055 N/A SER 146.A OG GLU 143.A O no hydrogen 2.253 N/A SER 150.A N TYR 139.A O no hydrogen 2.531 N/A SER 150.A OG HIS 142.A NE2 no hydrogen 2.693 N/A SER 150.A OG ARG 152.A O no hydrogen 2.538 N/A ARG 152.A N SER 150.A OG no hydrogen 3.383 N/A ARG 152.A NE ALA 7.A O no hydrogen 2.877 N/A ARG 152.A NH2 ALA 7.A O no hydrogen 3.122 N/A ARG 152.A NH2 ASP 8.A OD2 no hydrogen 2.822 N/A LEU 153.A N THR 65.A O no hydrogen 2.940 N/A LYS 154.A N GLY 138.A O no hydrogen 3.096 N/A LYS 154.A NZ ILE 1.A O no hydrogen 2.529 N/A LYS 154.A NZ GLY 3.A O no hydrogen 3.240 N/A GLU 155.A N LEU 5.A O no hydrogen 2.912 N/A ALA 156.A N LEU 136.A O no hydrogen 2.797 N/A HIS 157.A N HIS 196.A ND1 no hydrogen 3.418 N/A VAL 158.A N CYS 134.A O no hydrogen 2.987 N/A ARG 159.A N GLY 184.A O no hydrogen 2.832 N/A ARG 159.A NH1 TRP 131.A O no hydrogen 3.037 N/A LEU 160.A N THR 132.A O no hydrogen 3.008 N/A TYR 161.A N CYS 182.A O no hydrogen 2.808 N/A ARG 165.A N PRO 162.A O no hydrogen 2.744 N/A CYS 166.A N SER 163.A O no hydrogen 2.534 N/A HIS 170.A N THR 167.A O no hydrogen 3.330 N/A HIS 170.A NE2 SER 164.A O no hydrogen 2.852 N/A LEU 171.A N SER 168A.A O no hydrogen 2.820 N/A GLN 173.A N SER 168A.A O no hydrogen 2.800 N/A ARG 174.A NH1 LEU 172.A O no hydrogen 2.753 N/A THR 177.A OG1 ASP 94.A OD1 no hydrogen 2.855 N/A ASN 179.A N THR 177.A OG1 no hydrogen 3.008 N/A ASN 179.A ND2 ASP 94.A OD1 no hydrogen 2.968 N/A MET 180.A N THR 177.A O no hydrogen 2.992 N/A LEU 181.A N TYR 236.A O no hydrogen 2.811 N/A ALA 183.A N GLY 234.A O no hydrogen 2.973 N/A GLY 184.A N ARG 159.A O no hydrogen 3.148 N/A HIS 196.A N ASP 185.A OD2 no hydrogen 3.216 N/A HIS 196.A ND1 HIS 157.A O no hydrogen 3.102 N/A ASP 197.A N LYS 2.A O no hydrogen 3.079 N/A ALA 198.A N ASP 197.A OD1 no hydrogen 2.936 N/A CYS 199.A N ASP 202.A OD2 no hydrogen 2.588 N/A ASP 202.A N CYS 199.A O no hydrogen 2.735 N/A GLY 204.A N ILE 221.A O no hydrogen 3.152 N/A GLY 205.A N ASP 202.A O no hydrogen 2.960 N/A LEU 207.A N GLY 219.A O no hydrogen 3.013 N/A VAL 208.A N GLU 135.A O no hydrogen 2.895 N/A CYS 209.A N THR 216.A O no hydrogen 3.098 N/A ARG 214.A N ASN 211.A O no hydrogen 2.644 N/A THR 216.A N CYS 209.A O no hydrogen 2.870 N/A THR 216.A OG1 CYS 209.A O no hydrogen 2.881 N/A THR 216.A OG1 ARG 214.A O no hydrogen 3.277 N/A LEU 217.A N ALA 120.A O no hydrogen 2.919 N/A VAL 218.A N LEU 207.A O no hydrogen 3.040 N/A GLY 219.A N LEU 207.A O no hydrogen 3.254 N/A ILE 220.A N THR 237.A O no hydrogen 3.207 N/A ILE 221.A N GLY 205.A O no hydrogen 2.963 N/A SER 222.A N VAL 235.A O no hydrogen 3.368 N/A SER 222.A OG ASP 96.A OD2 no hydrogen 2.831 N/A TRP 223.A N VAL 235.A O no hydrogen 3.275 N/A CYS 227.A SG ALA 198.A O no hydrogen 3.368 N/A GLY 228.A N ASP 197.A OD2 no hydrogen 2.641 N/A GLY 234.A N ALA 183.A O no hydrogen 2.620 N/A VAL 235.A N TRP 223.A O no hydrogen 2.690 N/A TYR 236.A N LEU 181.A O no hydrogen 2.639 N/A THR 237.A N ILE 220.A O no hydrogen 2.990 N/A THR 237.A OG1 ASP 96.A O no hydrogen 2.627 N/A LYS 238.A N ASN 179.A O no hydrogen 2.722 N/A LYS 238.A NZ ASP 178.A O no hydrogen 3.146 N/A LYS 238.A NZ MET 180.A O no hydrogen 3.544 N/A VAL 239.A N VAL 218.A O no hydrogen 2.924 N/A THR 240.A OG1 ASN 241.A OD1 no hydrogen 3.504 N/A ASN 241.A N LYS 238.A O no hydrogen 3.240 N/A ASN 241.A ND2 ASP 178.A O no hydrogen 2.932 N/A ASN 241.A ND2 ASN 179.A OD1 no hydrogen 2.738 N/A TYR 242.A N VAL 239.A O no hydrogen 3.121 N/A TYR 242.A OH ASN 95.A OD1 no hydrogen 2.380 N/A LEU 243.A N THR 240.A O no hydrogen 3.420 N/A ILE 246.A N TYR 242.A O no hydrogen 2.972 N/A ARG 247.A N LEU 243.A O no hydrogen 3.071 N/A ARG 247.A NE ASP 248.A OD1 no hydrogen 2.883 N/A ARG 247.A NH2 ASP 248.A OD1 no hydrogen 2.504 N/A ARG 247.A NH2 ASP 248.A OD2 no hydrogen 3.442 N/A ASP 248.A N ASP 244.A O no hydrogen 2.630 N/A ASN 249.A N ILE 246.A O no hydrogen 3.212 N/A ASN 249.A ND2 TRP 245.A O no hydrogen 2.575 N/A MET 250.A N ARG 247.A O no hydrogen 3.029 N/A SER 106B.A N SER 104.A OG no hydrogen 3.340 N/A PHE 53C.A N GLU 51A.A O no hydrogen 2.811 N/A SER 107C.A OG SER 106B.A O no hydrogen 2.597 N/A