Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bcr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N HIS 1.A O no hydrogen 2.701 N/A ARG 5.A NH2 ASP 18.A OD1 no hydrogen 3.393 N/A ILE 6.A N MET 19.A O no hydrogen 3.202 N/A GLN 12.A N LEU 9.A O no hydrogen 2.828 N/A TYR 20.A N LEU 38.A O no hydrogen 2.849 N/A SER 21.A N ASP 4.A O no hydrogen 2.484 N/A GLY 22.A N TYR 36.A O no hydrogen 3.322 N/A TYR 23.A OH PHE 107.A O no hydrogen 3.270 N/A ILE 24.A N LEU 34.A O no hydrogen 3.130 N/A THR 25.A OG1 SER 33.A OG no hydrogen 3.052 N/A VAL 26.A N ARG 32.A O no hydrogen 2.726 N/A ALA 30.A N ASP 27A.A OD2 no hydrogen 3.081 N/A GLY 31.A N ASP 27A.A O no hydrogen 2.718 N/A ARG 32.A N ASP 27A.A O no hydrogen 3.072 N/A ARG 32.A NE ASP 127.A OD2 no hydrogen 2.812 N/A ARG 32.A NH1 ASP 115.A OD2 no hydrogen 2.957 N/A ARG 32.A NH2 ASP 127.A OD1 no hydrogen 3.346 N/A SER 33.A N TYR 109.A O no hydrogen 3.052 N/A SER 33.A OG THR 25.A OG1 no hydrogen 3.052 N/A LEU 34.A N ILE 24.A O no hydrogen 2.961 N/A PHE 35.A N SER 108.A OG no hydrogen 2.899 N/A TYR 36.A N GLY 22.A O no hydrogen 2.948 N/A TYR 36.A OH ASP 4.A OD2 no hydrogen 3.029 N/A LEU 37.A N PHE 98.A O no hydrogen 2.842 N/A LEU 38.A N TYR 20.A O no hydrogen 2.802 N/A GLN 39.A N VAL 96.A O no hydrogen 2.802 N/A GLU 40.A N ASP 18.A O no hydrogen 3.000 N/A ALA 41.A N ASN 95.A OD1 no hydrogen 2.935 N/A ALA 45.A N PRO 42.A O no hydrogen 2.875 N/A GLN 46.A N GLU 43.A O no hydrogen 2.917 N/A GLN 46.A NE2 ALA 41.A O no hydrogen 3.217 N/A GLN 46.A NE2 ASN 95.A OD1 no hydrogen 2.733 N/A ALA 48.A N GLN 46.A OE1 no hydrogen 2.743 N/A LEU 50.A N ASP 146.A O no hydrogen 2.901 N/A VAL 51.A N ASN 95.A O no hydrogen 2.799 N/A LEU 52.A N TYR 148.A O no hydrogen 2.870 N/A TRP 53.A N LEU 97.A O no hydrogen 2.777 N/A TRP 53.A NE1 ASN 55.A OD1 no hydrogen 2.931 N/A LEU 54.A N ALA 150.A O no hydrogen 2.509 N/A ASN 55.A N SER 62.A OG no hydrogen 2.906 N/A ASN 55.A ND2 GLU 70.A OE2 no hydrogen 3.124 N/A CYS 60.A N GLY 56.A O no hydrogen 2.702 N/A SER 61.A OG ASP 100.A OD1 no hydrogen 2.852 N/A SER 62.A OG LEU 99.A O no hydrogen 2.764 N/A ALA 64.A N SER 61.A OG no hydrogen 2.995 N/A TYR 65.A N SER 61.A O no hydrogen 3.322 N/A GLY 66.A N ASN 55.A OD1 no hydrogen 2.856 N/A ALA 67.A N SER 62.A O no hydrogen 3.059 N/A SER 68.A OG ALA 64.A O no hydrogen 3.475 N/A SER 68.A OG VAL 63A.A O no hydrogen 2.417 N/A GLU 69.A N TYR 65.A O no hydrogen 2.761 N/A GLY 72.A N GLY 66.A O no hydrogen 2.942 N/A ALA 73.A N GLN 39.A OE1 no hydrogen 2.697 N/A ARG 75.A N VAL 84.A O no hydrogen 2.516 N/A ARG 75.A NH2 GLU 70.A O no hydrogen 2.785 N/A LYS 77.A N GLY 82A.A O no hydrogen 2.548 N/A GLY 80.A N LYS 77.A O no hydrogen 3.092 N/A LEU 83.A N GLY 11.A O no hydrogen 3.481 N/A VAL 84.A N ARG 75.A O no hydrogen 2.716 N/A ASN 86.A N ALA 73.A O no hydrogen 2.756 N/A ASN 86.A ND2 GLY 72.A O no hydrogen 3.029 N/A TYR 88.A N ASN 86.A OD1 no hydrogen 2.526 N/A ARG 89.A N ASN 86.A O no hydrogen 3.093 N/A ARG 89.A NH1 ASN 86.A O no hydrogen 2.907 N/A TRP 90.A N LEU 71.A O no hydrogen 3.070 N/A ASN 91.A ND2 GLU 40.A O no hydrogen 2.740 N/A LYS 92.A N ARG 89.A O no hydrogen 3.289 N/A LYS 92.A NZ GLU 87.A O no hydrogen 3.080 N/A VAL 93.A N TRP 90.A O no hydrogen 2.971 N/A ALA 94.A N TRP 90.A O no hydrogen 3.091 N/A ASN 95.A N PRO 49.A O no hydrogen 2.742 N/A ASN 95.A ND2 GLN 46.A OE1 no hydrogen 3.147 N/A ASN 95.A ND2 ALA 48.A O no hydrogen 3.174 N/A ASN 95.A ND2 PRO 49.A O no hydrogen 3.294 N/A VAL 96.A N GLN 39.A O no hydrogen 2.881 N/A LEU 97.A N VAL 51.A O no hydrogen 2.721 N/A PHE 98.A N LEU 37.A O no hydrogen 2.640 N/A ASP 100.A N PHE 35.A O no hydrogen 3.095 N/A GLY 104.A N SER 108.A O no hydrogen 3.213 N/A VAL 105.A N PRO 102.A O no hydrogen 2.785 N/A PHE 107.A N ASP 100.A OD2 no hydrogen 3.000 N/A SER 108.A N VAL 105.A O no hydrogen 2.862 N/A SER 108.A OG ASP 100.A O no hydrogen 2.692 N/A TYR 109.A N SER 33.A O no hydrogen 2.868 N/A THR 110.A OG1 ASP 115.A OD2 no hydrogen 2.350 N/A THR 112.A N THR 110.A OG1 no hydrogen 3.281 N/A THR 112.A OG1 ALA 30.A O no hydrogen 2.615 N/A ASP 115.A N THR 112.A O no hydrogen 2.748 N/A TYR 117.A N SER 114.A O no hydrogen 2.707 N/A THR 118.A N ASP 115.A O no hydrogen 2.911 N/A ARG 123.A NH1 ASP 115.A O no hydrogen 2.952 N/A THR 124.A N GLY 120B.A O no hydrogen 3.075 N/A THR 124.A OG1 GLY 120B.A O no hydrogen 2.531 N/A ALA 125.A N ASP 121C.A O no hydrogen 2.738 N/A HIS 126.A N ASN 122.A O no hydrogen 2.982 N/A ASP 127.A N ARG 123.A O no hydrogen 2.869 N/A SER 128.A N THR 124.A O no hydrogen 3.131 N/A SER 128.A OG THR 124.A O no hydrogen 3.054 N/A TYR 129.A N ALA 125.A O no hydrogen 3.130 N/A ALA 130.A N HIS 126.A O no hydrogen 3.114 N/A PHE 131.A N ASP 127.A O no hydrogen 2.969 N/A LEU 132.A N SER 128.A O no hydrogen 3.032 N/A ALA 133.A N TYR 129.A O no hydrogen 3.106 N/A LYS 134.A N ALA 130.A O no hydrogen 2.985 N/A LYS 134.A NZ THR 25.A O no hydrogen 3.203 N/A TRP 135.A N PHE 131.A O no hydrogen 2.692 N/A PHE 136.A N LEU 132.A O no hydrogen 2.704 N/A GLU 137.A N LYS 134.A O no hydrogen 2.703 N/A ARG 138.A N LYS 134.A O no hydrogen 2.978 N/A ARG 138.A NH1 ASP 4.A OD2 no hydrogen 2.553 N/A ARG 138.A NH1 TYR 23.A O no hydrogen 3.103 N/A ARG 138.A NH2 TYR 23.A O no hydrogen 3.265 N/A PHE 139.A N TRP 135.A O no hydrogen 2.907 N/A HIS 141.A N HIS 141.A ND1 no hydrogen 2.689 N/A TYR 142.A N PHE 139.A O no hydrogen 2.859 N/A TYR 142.A OH GLU 40.A OE2 no hydrogen 2.543 N/A LYS 143.A N PRO 140.A O no hydrogen 3.162 N/A LYS 143.A NZ GLU 137.A OE1 no hydrogen 3.539 N/A LYS 143.A NZ GLU 137.A OE2 no hydrogen 3.561 N/A TYR 144.A N VAL 173.A O no hydrogen 2.633 N/A ARG 145.A N TYR 142.A O no hydrogen 2.963 N/A ARG 145.A NH1 GLN 46.A OE1 no hydrogen 3.553 N/A ARG 145.A NH1 ALA 48.A O no hydrogen 2.828 N/A ARG 145.A NH2 HIS 141.A O no hydrogen 3.366 N/A PHE 147.A N ASN 175.A O no hydrogen 2.878 N/A TYR 148.A N LEU 50.A O no hydrogen 2.851 N/A ILE 149.A N GLY 178.A O no hydrogen 3.071 N/A ALA 150.A N LEU 52.A O no hydrogen 2.887 N/A GLY 151.A N MET 180.A O no hydrogen 3.436 N/A GLU 152.A N LEU 54.A O no hydrogen 3.249 N/A SER 153.A N GLY 182.A O no hydrogen 3.081 N/A TYR 154.A OH ASP 121C.A OD1 no hydrogen 2.631 N/A TYR 154.A OH ASP 121C.A OD2 no hydrogen 3.313 N/A ALA 155.A N GLU 152.A O no hydrogen 2.748 N/A GLY 156.A N SER 153.A O no hydrogen 2.660 N/A HIS 157.A N TYR 154.A O no hydrogen 2.816 N/A HIS 157.A ND1 TYR 154.A OH no hydrogen 2.783 N/A VAL 159.A N ALA 155.A O no hydrogen 2.985 N/A GLU 161.A N HIS 157.A O no hydrogen 3.140 N/A LEU 162.A N TYR 158.A O no hydrogen 2.774 N/A SER 163.A N VAL 159.A O no hydrogen 2.583 N/A SER 163.A OG VAL 159.A O no hydrogen 2.785 N/A GLN 164.A N PRO 160.A O no hydrogen 2.759 N/A LEU 165.A N GLU 161.A O no hydrogen 3.033 N/A VAL 166.A N LEU 162.A O no hydrogen 3.078 N/A HIS 167.A N SER 163.A O no hydrogen 3.080 N/A ARG 168.A N GLN 164.A O no hydrogen 2.925 N/A SER 169.A N LEU 165.A O no hydrogen 2.819 N/A SER 169.A OG TYR 129.A OH no hydrogen 3.425 N/A LYS 170.A N VAL 166.A O no hydrogen 3.345 N/A VAL 173.A N ASN 171.A OD1 no hydrogen 3.124 N/A LEU 176.A N ILE 174.A O no hydrogen 3.102 N/A LYS 177.A N PHE 147.A O no hydrogen 2.709 N/A LYS 177.A NZ ASP 146.A OD1 no hydrogen 3.300 N/A MET 180.A N ILE 149.A O no hydrogen 3.078 N/A GLY 182.A N GLY 151.A O no hydrogen 3.104 N/A LEU 185.A N SER 153.A O no hydrogen 3.295 N/A ILE 186.A N ASP 191.A OD2 no hydrogen 2.867 N/A ASP 187.A N ASP 191.A OD2 no hydrogen 2.961 N/A HIS 190.A N ASP 187.A OD1 no hydrogen 2.884 N/A HIS 190.A ND1 ASP 187.A OD1 no hydrogen 3.105 N/A ASP 191.A N ASP 187.A O no hydrogen 2.734 N/A TYR 192.A N ASP 188.A O no hydrogen 2.858 N/A TYR 192.A OH SER 221.A O no hydrogen 3.020 N/A VAL 193.A N TYR 189.A O no hydrogen 3.218 N/A GLY 194.A N HIS 190.A O no hydrogen 2.891 N/A THR 195.A N ASP 191.A O no hydrogen 2.843 N/A THR 195.A OG1 ASP 191.A O no hydrogen 2.526 N/A PHE 196.A N TYR 192.A O no hydrogen 3.053 N/A GLU 197.A N VAL 193.A O no hydrogen 3.085 N/A PHE 198.A N GLY 194.A O no hydrogen 3.016 N/A TRP 199.A N THR 195.A O no hydrogen 3.080 N/A TRP 200.A N PHE 196.A O no hydrogen 2.853 N/A TRP 200.A NE1 ASP 207.A OD1 no hydrogen 2.761 N/A ASN 201.A N GLU 197.A O no hydrogen 2.814 N/A ASN 201.A ND2 GLU 197.A O no hydrogen 2.863 N/A HIS 202.A N TRP 199.A O no hydrogen 2.936 N/A HIS 202.A ND1 PHE 198.A O no hydrogen 2.601 N/A GLY 203.A N TRP 200.A O no hydrogen 3.332 N/A ILE 204.A N TRP 199.A O no hydrogen 3.088 N/A SER 206.A N GLU 239.A OE1 no hydrogen 2.625 N/A SER 206.A OG THR 209.A OG1 no hydrogen 3.292 N/A SER 206.A OG GLU 239.A OE2 no hydrogen 2.893 N/A THR 209.A N SER 206.A OG no hydrogen 3.085 N/A THR 209.A OG1 SER 206.A OG no hydrogen 3.292 N/A THR 209.A OG1 GLU 239.A OE2 no hydrogen 2.391 N/A TYR 210.A N SER 206.A O no hydrogen 3.158 N/A ARG 211.A N ASP 207.A O no hydrogen 3.315 N/A ARG 212.A N ASP 208.A O no hydrogen 2.822 N/A LEU 213.A N THR 209.A O no hydrogen 2.711 N/A LYS 214.A N TYR 210.A O no hydrogen 3.146 N/A GLU 215.A N ARG 211.A O no hydrogen 3.042 N/A ALA 216.A N ARG 212.A O no hydrogen 2.686 N/A CYS 217.A N LEU 213.A O no hydrogen 2.964 N/A CYS 217.A SG LEU 213.A O no hydrogen 3.741 N/A ASP 220.A N CYS 217.A O no hydrogen 3.149 N/A PHE 222.A N ASP 188.A OD2 no hydrogen 3.001 N/A ILE 223.A N SER 221.A OG no hydrogen 3.109 N/A HIS 224.A N SER 221.A OG no hydrogen 2.790 N/A SER 226.A N ASP 220.A OD2 no hydrogen 2.632 N/A SER 226.A OG ASP 220.A OD1 no hydrogen 3.512 N/A SER 226.A OG ASP 220.A OD2 no hydrogen 2.473 N/A CYS 229.A N SER 226.A OG no hydrogen 3.162 N/A ASP 230.A N SER 226.A O no hydrogen 2.842 N/A ALA 231.A N PRO 227.A O no hydrogen 2.874 N/A ALA 232.A N ALA 228.A O no hydrogen 2.991 N/A THR 233.A N CYS 229.A O no hydrogen 2.899 N/A THR 233.A OG1 CYS 229.A O no hydrogen 3.244 N/A ASP 234.A N ASP 230.A O no hydrogen 2.830 N/A VAL 235.A N ALA 231.A O no hydrogen 3.374 N/A ALA 236.A N ALA 232.A O no hydrogen 3.197 N/A THR 237.A N THR 233.A O no hydrogen 3.206 N/A THR 237.A OG1 THR 233.A O no hydrogen 3.047 N/A ALA 238.A N ASP 234.A O no hydrogen 3.253 N/A GLU 239.A N VAL 235.A O no hydrogen 2.848 N/A GLN 240.A N ALA 236.A O no hydrogen 2.815 N/A GLY 241.A N THR 237.A O no hydrogen 3.374 N/A ILE 243.A N GLY 241.A O no hydrogen 3.100 N/A TYR 246.A N ASP 244.A OD1 no hydrogen 2.902 N/A SER 247.A N ASP 244.A O no hydrogen 3.017 N/A SER 247.A OG THR 250.A OG1 no hydrogen 2.747 N/A THR 250.A N SER 247.A O no hydrogen 3.416 N/A THR 250.A OG1 SER 247.A O no hydrogen 3.290 N/A THR 250.A OG1 SER 247.A OG no hydrogen 2.747 N/A VAL 63A.A N ASP 100.A OD1 no hydrogen 3.133 N/A SER 119A.A OG ASP 115.A O no hydrogen 3.008 N/A