Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bcs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N HIS 1.A O no hydrogen 2.876 N/A ARG 5.A N ALA 2.A O no hydrogen 3.137 N/A ILE 6.A N MET 19.A O no hydrogen 2.920 N/A GLN 12.A N LEU 9.A O no hydrogen 2.800 N/A TYR 20.A N LEU 38.A O no hydrogen 2.895 N/A SER 21.A N ASP 4.A O no hydrogen 2.850 N/A GLY 22.A N TYR 36.A O no hydrogen 3.211 N/A TYR 23.A OH PHE 107.A O no hydrogen 3.201 N/A ILE 24.A N LEU 34.A O no hydrogen 2.913 N/A VAL 26.A N ARG 32.A O no hydrogen 2.811 N/A ALA 30.A N ASP 27A.A OD1 no hydrogen 2.403 N/A GLY 31.A N ASP 27A.A O no hydrogen 2.618 N/A ARG 32.A N ASP 27A.A O no hydrogen 2.884 N/A ARG 32.A NE ASP 127.A OD2 no hydrogen 2.878 N/A ARG 32.A NH1 ASP 115.A OD2 no hydrogen 3.049 N/A ARG 32.A NH2 ASP 127.A OD1 no hydrogen 3.252 N/A SER 33.A N TYR 109.A O no hydrogen 2.853 N/A SER 33.A OG ILE 24.A O no hydrogen 3.495 N/A LEU 34.A N ILE 24.A O no hydrogen 2.884 N/A PHE 35.A N SER 108.A OG no hydrogen 3.038 N/A TYR 36.A N GLY 22.A O no hydrogen 2.916 N/A TYR 36.A OH ASP 4.A OD2 no hydrogen 2.710 N/A LEU 37.A N PHE 98.A O no hydrogen 2.870 N/A LEU 38.A N TYR 20.A O no hydrogen 2.712 N/A GLN 39.A N VAL 96.A O no hydrogen 2.859 N/A GLU 40.A N ASP 18.A O no hydrogen 3.012 N/A ALA 41.A N ASN 95.A OD1 no hydrogen 3.031 N/A ASP 44.A N ASP 44.A OD1 no hydrogen 2.540 N/A ALA 45.A N PRO 42.A O no hydrogen 2.745 N/A GLN 46.A N GLU 43.A O no hydrogen 2.828 N/A GLN 46.A NE2 ALA 41.A O no hydrogen 2.739 N/A GLN 46.A NE2 ASN 95.A OD1 no hydrogen 2.767 N/A ALA 48.A N GLN 46.A OE1 no hydrogen 2.678 N/A LEU 50.A N ASP 146.A O no hydrogen 3.003 N/A VAL 51.A N ASN 95.A O no hydrogen 2.682 N/A LEU 52.A N TYR 148.A O no hydrogen 2.805 N/A TRP 53.A N LEU 97.A O no hydrogen 2.794 N/A TRP 53.A NE1 ASN 55.A OD1 no hydrogen 2.902 N/A LEU 54.A N ALA 150.A O no hydrogen 2.806 N/A ASN 55.A N SER 62.A OG no hydrogen 3.050 N/A ASN 55.A ND2 GLU 70.A OE2 no hydrogen 3.140 N/A CYS 60.A N GLY 56.A O no hydrogen 2.910 N/A SER 61.A OG ASP 100.A OD1 no hydrogen 2.534 N/A SER 62.A OG TRP 53.A O no hydrogen 3.513 N/A SER 62.A OG LEU 99.A O no hydrogen 2.635 N/A ALA 64.A N SER 61.A OG no hydrogen 3.023 N/A TYR 65.A N SER 61.A O no hydrogen 3.038 N/A GLY 66.A N ASN 55.A OD1 no hydrogen 2.765 N/A ALA 67.A N SER 62.A O no hydrogen 2.992 N/A SER 68.A OG VAL 63A.A O no hydrogen 2.607 N/A GLU 69.A N TYR 65.A O no hydrogen 2.822 N/A GLY 72.A N GLY 66.A O no hydrogen 2.923 N/A ALA 73.A N GLN 39.A OE1 no hydrogen 2.852 N/A ARG 75.A N VAL 84.A O no hydrogen 2.572 N/A ARG 75.A NH2 GLU 70.A O no hydrogen 2.582 N/A LYS 77.A N GLY 82A.A O no hydrogen 2.767 N/A GLY 80.A N LYS 77.A O no hydrogen 2.827 N/A ALA 81.A N PRO 78.A O no hydrogen 3.197 N/A LEU 83.A N GLY 11.A O no hydrogen 3.082 N/A VAL 84.A N ARG 75.A O no hydrogen 2.859 N/A ASN 86.A N ALA 73.A O no hydrogen 2.630 N/A ASN 86.A ND2 GLY 72.A O no hydrogen 3.101 N/A TYR 88.A N ASN 86.A OD1 no hydrogen 2.587 N/A ARG 89.A N ASN 86.A O no hydrogen 2.866 N/A ARG 89.A NH1 ASN 86.A O no hydrogen 2.830 N/A TRP 90.A N LEU 71.A O no hydrogen 2.780 N/A ASN 91.A ND2 GLU 40.A O no hydrogen 2.813 N/A LYS 92.A N ARG 89.A O no hydrogen 3.045 N/A LYS 92.A NZ GLU 87.A O no hydrogen 3.126 N/A VAL 93.A N TRP 90.A O no hydrogen 2.998 N/A ALA 94.A N TRP 90.A O no hydrogen 3.164 N/A ASN 95.A N PRO 49.A O no hydrogen 2.682 N/A ASN 95.A ND2 GLN 46.A OE1 no hydrogen 2.942 N/A ASN 95.A ND2 ALA 48.A O no hydrogen 2.848 N/A ASN 95.A ND2 PRO 49.A O no hydrogen 3.268 N/A VAL 96.A N GLN 39.A O no hydrogen 2.742 N/A LEU 97.A N VAL 51.A O no hydrogen 2.744 N/A PHE 98.A N LEU 37.A O no hydrogen 2.633 N/A ASP 100.A N PHE 35.A O no hydrogen 3.065 N/A GLY 104.A N SER 108.A O no hydrogen 2.907 N/A VAL 105.A N PRO 102.A O no hydrogen 2.758 N/A PHE 107.A N ASP 100.A OD2 no hydrogen 2.867 N/A SER 108.A N VAL 105.A O no hydrogen 2.870 N/A SER 108.A OG ASP 100.A O no hydrogen 2.452 N/A SER 108.A OG VAL 105.A O no hydrogen 3.475 N/A TYR 109.A N SER 33.A O no hydrogen 2.826 N/A THR 110.A OG1 THR 112.A O no hydrogen 3.159 N/A THR 110.A OG1 ASP 115.A OD2 no hydrogen 2.447 N/A ASN 111.A N GLY 31.A O no hydrogen 2.808 N/A THR 112.A N THR 110.A OG1 no hydrogen 3.008 N/A THR 112.A OG1 ALA 30.A O no hydrogen 2.609 N/A ASP 115.A N THR 112.A O no hydrogen 2.668 N/A ILE 116.A N SER 113.A O no hydrogen 3.252 N/A TYR 117.A N SER 114.A O no hydrogen 2.803 N/A THR 118.A N ASP 115.A O no hydrogen 2.941 N/A THR 118.A OG1 SER 114.A O no hydrogen 2.591 N/A THR 118.A OG1 ASP 115.A O no hydrogen 2.806 N/A ARG 123.A NH1 ASP 115.A O no hydrogen 2.787 N/A ARG 123.A NH2 THR 118.A OG1 no hydrogen 2.718 N/A THR 124.A N GLY 120B.A O no hydrogen 3.104 N/A THR 124.A OG1 GLY 120B.A O no hydrogen 2.658 N/A ALA 125.A N ASP 121C.A O no hydrogen 3.028 N/A HIS 126.A N ASN 122.A O no hydrogen 2.805 N/A ASP 127.A N ARG 123.A O no hydrogen 2.652 N/A SER 128.A N THR 124.A O no hydrogen 2.987 N/A SER 128.A OG THR 124.A O no hydrogen 2.899 N/A TYR 129.A N ALA 125.A O no hydrogen 2.966 N/A ALA 130.A N HIS 126.A O no hydrogen 2.976 N/A PHE 131.A N ASP 127.A O no hydrogen 2.884 N/A LEU 132.A N SER 128.A O no hydrogen 2.897 N/A ALA 133.A N TYR 129.A O no hydrogen 3.079 N/A LYS 134.A N ALA 130.A O no hydrogen 3.081 N/A TRP 135.A N PHE 131.A O no hydrogen 2.629 N/A PHE 136.A N LEU 132.A O no hydrogen 2.815 N/A GLU 137.A N ALA 133.A O no hydrogen 3.238 N/A GLU 137.A N LYS 134.A O no hydrogen 2.958 N/A ARG 138.A N LYS 134.A O no hydrogen 3.064 N/A ARG 138.A NH1 ASP 4.A OD2 no hydrogen 2.587 N/A ARG 138.A NH1 TYR 23.A O no hydrogen 2.894 N/A ARG 138.A NH2 TYR 23.A O no hydrogen 3.086 N/A PHE 139.A N TRP 135.A O no hydrogen 2.781 N/A HIS 141.A N HIS 141.A ND1 no hydrogen 2.674 N/A TYR 142.A N PHE 139.A O no hydrogen 2.942 N/A TYR 142.A OH GLU 40.A OE2 no hydrogen 2.381 N/A LYS 143.A N PRO 140.A O no hydrogen 3.044 N/A LYS 143.A NZ GLU 137.A OE1 no hydrogen 3.271 N/A LYS 143.A NZ GLU 137.A OE2 no hydrogen 2.984 N/A TYR 144.A N VAL 173.A O no hydrogen 2.696 N/A ARG 145.A N TYR 142.A O no hydrogen 3.121 N/A ARG 145.A NH1 ALA 48.A O no hydrogen 2.873 N/A ARG 145.A NH2 HIS 141.A O no hydrogen 3.132 N/A PHE 147.A N ASN 175.A O no hydrogen 2.682 N/A TYR 148.A N LEU 50.A O no hydrogen 2.940 N/A ILE 149.A N GLY 178.A O no hydrogen 3.043 N/A ALA 150.A N LEU 52.A O no hydrogen 2.786 N/A GLY 151.A N MET 180.A O no hydrogen 3.312 N/A SER 153.A N GLY 182.A O no hydrogen 3.023 N/A TYR 154.A OH ASP 121C.A OD1 no hydrogen 2.779 N/A ALA 155.A N GLU 152.A O no hydrogen 2.932 N/A GLY 156.A N SER 153.A O no hydrogen 2.778 N/A HIS 157.A N TYR 154.A O no hydrogen 2.629 N/A HIS 157.A ND1 ASP 121C.A OD2 no hydrogen 2.882 N/A TYR 158.A N TYR 154.A O no hydrogen 3.351 N/A VAL 159.A N ALA 155.A O no hydrogen 2.811 N/A GLU 161.A N HIS 157.A O no hydrogen 2.917 N/A LEU 162.A N TYR 158.A O no hydrogen 2.857 N/A SER 163.A N VAL 159.A O no hydrogen 2.772 N/A SER 163.A OG VAL 159.A O no hydrogen 2.801 N/A GLN 164.A N PRO 160.A O no hydrogen 2.929 N/A LEU 165.A N GLU 161.A O no hydrogen 3.254 N/A VAL 166.A N LEU 162.A O no hydrogen 2.810 N/A HIS 167.A N SER 163.A O no hydrogen 2.889 N/A ARG 168.A N GLN 164.A O no hydrogen 2.815 N/A SER 169.A N LEU 165.A O no hydrogen 2.633 N/A SER 169.A OG TYR 129.A OH no hydrogen 3.253 N/A SER 169.A OG VAL 166.A O no hydrogen 2.647 N/A LYS 170.A N HIS 167.A O no hydrogen 3.417 N/A ASN 171.A N SER 169.A OG no hydrogen 2.874 N/A ASN 171.A ND2 TYR 129.A OH no hydrogen 3.495 N/A VAL 173.A N ASN 171.A OD1 no hydrogen 2.578 N/A ASN 175.A ND2 TYR 144.A O no hydrogen 3.592 N/A LYS 177.A N PHE 147.A O no hydrogen 2.453 N/A MET 180.A N ILE 149.A O no hydrogen 2.992 N/A GLY 182.A N GLY 151.A O no hydrogen 2.871 N/A LEU 185.A N SER 153.A O no hydrogen 3.144 N/A ILE 186.A N ASP 191.A OD2 no hydrogen 2.796 N/A ASP 187.A N ASP 191.A OD2 no hydrogen 2.871 N/A HIS 190.A N ASP 187.A OD1 no hydrogen 3.228 N/A HIS 190.A ND1 ASP 187.A OD1 no hydrogen 2.973 N/A ASP 191.A N ASP 187.A O no hydrogen 2.762 N/A TYR 192.A N ASP 188.A O no hydrogen 2.844 N/A TYR 192.A OH SER 221.A O no hydrogen 2.868 N/A VAL 193.A N TYR 189.A O no hydrogen 3.063 N/A GLY 194.A N HIS 190.A O no hydrogen 2.903 N/A THR 195.A N ASP 191.A O no hydrogen 2.770 N/A THR 195.A OG1 ASP 191.A O no hydrogen 2.521 N/A PHE 196.A N TYR 192.A O no hydrogen 3.089 N/A GLU 197.A N VAL 193.A O no hydrogen 3.159 N/A PHE 198.A N GLY 194.A O no hydrogen 2.869 N/A TRP 199.A N THR 195.A O no hydrogen 2.896 N/A TRP 200.A N PHE 196.A O no hydrogen 2.957 N/A TRP 200.A NE1 ASP 207.A OD1 no hydrogen 2.526 N/A ASN 201.A N GLU 197.A O no hydrogen 2.870 N/A ASN 201.A ND2 GLU 197.A O no hydrogen 2.858 N/A HIS 202.A N TRP 199.A O no hydrogen 3.054 N/A HIS 202.A ND1 PHE 198.A O no hydrogen 2.681 N/A GLY 203.A N TRP 200.A O no hydrogen 3.061 N/A ILE 204.A N TRP 199.A O no hydrogen 3.036 N/A SER 206.A N GLU 239.A OE1 no hydrogen 2.721 N/A SER 206.A OG THR 209.A OG1 no hydrogen 2.993 N/A SER 206.A OG GLU 239.A OE1 no hydrogen 3.552 N/A SER 206.A OG GLU 239.A OE2 no hydrogen 2.729 N/A THR 209.A N SER 206.A OG no hydrogen 3.033 N/A THR 209.A OG1 SER 206.A OG no hydrogen 2.993 N/A THR 209.A OG1 GLU 239.A OE1 no hydrogen 3.191 N/A THR 209.A OG1 GLU 239.A OE2 no hydrogen 2.549 N/A TYR 210.A N SER 206.A O no hydrogen 2.847 N/A ARG 211.A N ASP 207.A O no hydrogen 3.104 N/A ARG 212.A N ASP 208.A O no hydrogen 2.672 N/A LEU 213.A N THR 209.A O no hydrogen 2.725 N/A LYS 214.A N TYR 210.A O no hydrogen 3.005 N/A GLU 215.A N ARG 211.A O no hydrogen 3.015 N/A ALA 216.A N ARG 212.A O no hydrogen 2.834 N/A CYS 217.A N LEU 213.A O no hydrogen 2.989 N/A ASP 220.A N CYS 217.A O no hydrogen 2.988 N/A PHE 222.A N ASP 188.A OD1 no hydrogen 2.874 N/A HIS 224.A N SER 221.A OG no hydrogen 2.825 N/A SER 226.A N ASP 220.A OD2 no hydrogen 2.591 N/A SER 226.A OG ALA 216.A O no hydrogen 3.374 N/A SER 226.A OG ASP 220.A OD2 no hydrogen 2.284 N/A CYS 229.A N SER 226.A OG no hydrogen 3.149 N/A CYS 229.A SG TYR 192.A OH no hydrogen 3.788 N/A ASP 230.A N SER 226.A O no hydrogen 2.909 N/A ALA 231.A N PRO 227.A O no hydrogen 3.015 N/A ALA 232.A N ALA 228.A O no hydrogen 2.777 N/A THR 233.A N CYS 229.A O no hydrogen 2.846 N/A THR 233.A OG1 CYS 229.A O no hydrogen 3.310 N/A THR 233.A OG1 ASP 230.A O no hydrogen 3.041 N/A ASP 234.A N ASP 230.A O no hydrogen 2.876 N/A VAL 235.A N ALA 231.A O no hydrogen 3.286 N/A ALA 236.A N ALA 232.A O no hydrogen 3.128 N/A THR 237.A N THR 233.A O no hydrogen 2.918 N/A THR 237.A OG1 THR 233.A O no hydrogen 2.893 N/A ALA 238.A N ASP 234.A O no hydrogen 3.097 N/A GLU 239.A N VAL 235.A O no hydrogen 2.748 N/A GLN 240.A N ALA 236.A O no hydrogen 2.689 N/A GLY 241.A N THR 237.A O no hydrogen 3.242 N/A ILE 243.A N GLY 241.A O no hydrogen 2.863 N/A TYR 246.A N ASP 244.A OD1 no hydrogen 2.919 N/A SER 247.A N ASP 244.A O no hydrogen 2.943 N/A SER 247.A OG THR 250.A OG1 no hydrogen 2.529 N/A THR 250.A N SER 247.A O no hydrogen 3.337 N/A THR 250.A OG1 SER 247.A O no hydrogen 3.378 N/A THR 250.A OG1 SER 247.A OG no hydrogen 2.529 N/A CYS 253.A SG ILE 255.A O no hydrogen 3.999 N/A ASP 27A.A N ARG 32.A O no hydrogen 3.198 N/A VAL 63A.A N ASP 100.A OD1 no hydrogen 3.207 N/A SER 119A.A OG ASP 115.A O no hydrogen 3.041 N/A