Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3isg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ILE 30.A O no hydrogen 3.010 N/A THR 2.A OG1 ILE 30.A O no hydrogen 3.452 N/A ILE 4.A N GLN 32.A O no hydrogen 3.010 N/A SER 5.A N ASP 3.A OD1 no hydrogen 3.023 N/A SER 5.A OG ASP 3.A OD1 no hydrogen 2.546 N/A VAL 7.A N ILE 4.A O no hydrogen 2.938 N/A ALA 8.A N ILE 4.A O no hydrogen 2.743 N/A SER 9.A N SER 5.A O no hydrogen 2.676 N/A SER 9.A OG SER 5.A O no hydrogen 2.778 N/A PHE 12.A N ALA 8.A O no hydrogen 3.049 N/A PHE 12.A N SER 9.A O no hydrogen 3.007 N/A GLU 13.A N PRO 10.A O no hydrogen 3.313 N/A THR 15.A N PHE 12.A O no hydrogen 2.822 N/A THR 15.A OG1 PHE 12.A O no hydrogen 2.697 N/A GLU 16.A N THR 222.A O no hydrogen 2.680 N/A CYS 18.A N ALA 220.A O no hydrogen 2.760 N/A CYS 18.A SG ALA 220.A O no hydrogen 3.736 N/A PHE 19.A N PHE 33.A O no hydrogen 3.125 N/A LEU 20.A N VAL 218.A O no hydrogen 2.806 N/A LEU 21.A N ALA 31.A O no hydrogen 2.817 N/A TYR 22.A N VAL 216.A O no hydrogen 2.751 N/A TYR 22.A OH GLU 29.A OE2 no hydrogen 2.619 N/A ASP 23.A N ALA 28.A O no hydrogen 2.737 N/A ALA 24.A N LYS 214.A O no hydrogen 2.930 N/A SER 25.A OG ASP 23.A OD2 no hydrogen 2.825 N/A THR 26.A N ASP 23.A OD2 no hydrogen 3.029 N/A THR 26.A OG1 ASP 23.A OD2 no hydrogen 2.813 N/A ASN 27.A N ASP 23.A O no hydrogen 2.998 N/A ALA 28.A N THR 26.A OG1 no hydrogen 3.268 N/A ILE 30.A N LEU 21.A O no hydrogen 2.717 N/A ALA 31.A N LEU 21.A O no hydrogen 3.133 N/A GLN 32.A N THR 2.A O no hydrogen 2.906 N/A PHE 33.A N PHE 19.A O no hydrogen 2.771 N/A ASN 34.A ND2 GLU 16.A OE2 no hydrogen 2.711 N/A ASN 34.A ND2 GLY 17.A O no hydrogen 2.907 N/A LYS 35.A NZ GLU 29.A OE2 no hydrogen 2.644 N/A LYS 35.A NZ GLU 145.A OE2 no hydrogen 2.578 N/A LYS 37.A N ASN 34.A OD1 no hydrogen 3.111 N/A LYS 37.A NZ THR 222.A OG1 no hydrogen 2.654 N/A CYS 38.A N ASN 34.A O no hydrogen 3.000 N/A CYS 38.A SG PHE 33.A O no hydrogen 3.570 N/A CYS 38.A SG ASN 34.A O no hydrogen 3.234 N/A ALA 39.A N LYS 35.A O no hydrogen 3.043 N/A ALA 39.A N ALA 36.A O no hydrogen 3.224 N/A THR 40.A N LYS 37.A O no hydrogen 3.064 N/A THR 40.A OG1 ALA 36.A O no hydrogen 3.016 N/A GLN 41.A NE2 GLU 146.A OE1 no hydrogen 3.195 N/A GLN 41.A NE2 GLU 146.A OE2 no hydrogen 2.836 N/A MET 42.A N ILE 142.A O no hydrogen 2.926 N/A SER 46.A OG SER 92.A OG.A no hydrogen 2.689 N/A THR 47.A N PRO 44.A O no hydrogen 2.958 N/A THR 47.A OG1 PRO 44.A O no hydrogen 2.649 N/A PHE 48.A N ASP 45.A O no hydrogen 2.853 N/A LEU 51.A N PHE 48.A O no hydrogen 2.803 N/A SER 52.A OG THR 169.A OG1 no hydrogen 2.683 N/A LEU 53.A N ILE 49.A O no hydrogen 3.137 N/A MET 54.A N ALA 50.A O no hydrogen 2.955 N/A ALA 55.A N LEU 51.A O no hydrogen 2.736 N/A PHE 56.A N SER 52.A O no hydrogen 2.900 N/A ASP 57.A N LEU 53.A O no hydrogen 2.773 N/A ALA 58.A N MET 54.A O no hydrogen 2.712 N/A GLU 59.A N PHE 56.A O no hydrogen 2.968 N/A ILE 60.A N ALA 55.A O no hydrogen 2.950 N/A ILE 61.A N ALA 55.A O no hydrogen 3.388 N/A ASP 62.A N THR 65.A OG1 no hydrogen 2.635 N/A GLN 63.A NE2 ASN 168.A O no hydrogen 3.513 N/A GLN 63.A NE2 ASN 168.A OD1 no hydrogen 3.598 N/A GLN 63.A NE2 ASN 172.A OD1 no hydrogen 2.826 N/A LYS 64.A N ASP 62.A OD2 no hydrogen 2.873 N/A THR 65.A N ASP 62.A O no hydrogen 2.880 N/A THR 65.A OG1 ASP 62.A O no hydrogen 2.934 N/A PHE 67.A N HIS 83.A O no hydrogen 2.659 N/A TRP 69.A N ASN 82.A OD1 no hydrogen 2.847 N/A TRP 69.A NE1 THR 72.A O no hydrogen 2.765 N/A THR 72.A N ASP 70.A OD1 no hydrogen 2.876 N/A THR 72.A OG1 ASP 70.A OD1 no hydrogen 2.607 N/A THR 72.A OG1 ASP 70.A OD2 no hydrogen 3.248 N/A LYS 74.A N ASN 80.A OD1 no hydrogen 2.715 N/A LYS 74.A NZ ASP 70.A OD2 no hydrogen 2.671 N/A TRP 79.A N MET 76.A O no hydrogen 2.865 N/A TRP 79.A NE1 PHE 91.A O no hydrogen 2.775 N/A ASN 80.A N GLU 77.A O no hydrogen 2.845 N/A ASN 80.A ND2 GLU 77.A OE2 no hydrogen 2.989 N/A SER 81.A OG ILE 78.A O no hydrogen 3.243 N/A SER 81.A OG ASN 82.A O no hydrogen 3.465 N/A SER 81.A OG HIS 83.A NE2 no hydrogen 3.158 N/A HIS 83.A N PHE 67.A O no hydrogen 3.026 N/A HIS 83.A ND1 THR 87.A OG1 no hydrogen 2.645 N/A HIS 83.A NE2 ILE 78.A O no hydrogen 2.775 N/A THR 84.A N THR 87.A OG1 no hydrogen 2.964 N/A LYS 86.A NZ GLU 171.A O no hydrogen 3.439 N/A LYS 86.A NZ ASN 172.A O no hydrogen 3.196 N/A LYS 86.A NZ TYR 174.A O no hydrogen 2.758 N/A THR 87.A N THR 84.A OG1 no hydrogen 3.062 N/A THR 87.A OG1 HIS 83.A ND1 no hydrogen 2.645 N/A THR 87.A OG1 THR 84.A O no hydrogen 3.442 N/A TRP 88.A N THR 84.A O no hydrogen 2.718 N/A TRP 88.A NE1 SER 97.A OG no hydrogen 2.749 N/A MET 89.A N PRO 85.A O no hydrogen 3.267 N/A GLN 90.A N LYS 86.A O no hydrogen 2.870 N/A PHE 91.A N THR 87.A O no hydrogen 2.785 N/A SER 92.A N MET 89.A O no hydrogen 3.178 N/A SER 92.A OG.A SER 46.A OG no hydrogen 2.689 N/A VAL 93.A N TRP 88.A O no hydrogen 2.861 N/A TRP 95.A NE1 TRP 79.A O no hydrogen 2.730 N/A VAL 96.A N VAL 93.A O no hydrogen 2.951 N/A SER 97.A N VAL 93.A O no hydrogen 3.329 N/A GLN 98.A N VAL 94.A O no hydrogen 2.878 N/A GLN 98.A NE2 THR 132.A O no hydrogen 2.849 N/A GLU 99.A N TRP 95.A O no hydrogen 2.967 N/A ILE 100.A N VAL 96.A O no hydrogen 2.868 N/A THR 101.A N SER 97.A O no hydrogen 2.780 N/A THR 101.A OG1 SER 97.A O no hydrogen 3.392 N/A THR 101.A OG1 GLN 98.A O no hydrogen 3.101 N/A THR 101.A OG1 LEU 131.A O no hydrogen 2.605 N/A GLN 102.A N GLN 98.A O no hydrogen 3.169 N/A LYS 103.A N GLU 99.A O no hydrogen 3.025 N/A ILE 104.A N ILE 100.A O no hydrogen 2.827 N/A GLY 105.A N THR 101.A O no hydrogen 2.745 N/A ILE 109.A N GLY 105.A O no hydrogen 2.932 N/A LYS 110.A N LEU 106.A O no hydrogen 2.785 N/A ASN 111.A N ASN 107.A O no hydrogen 2.956 N/A TYR 112.A N LYS 108.A O no hydrogen 2.826 N/A TYR 112.A OH ASP 57.A OD1 no hydrogen 2.477 N/A LEU 113.A N ILE 109.A O no hydrogen 2.793 N/A LYS 114.A N LYS 110.A O no hydrogen 3.113 N/A ASP 115.A N ASN 111.A O no hydrogen 2.909 N/A PHE 116.A N TYR 112.A O no hydrogen 2.757 N/A ASP 117.A N LYS 114.A O no hydrogen 2.926 N/A TYR 118.A N LEU 113.A O no hydrogen 2.886 N/A ASN 120.A N LYS 141.A O no hydrogen 2.825 N/A ASN 120.A ND2 SER 139.A O no hydrogen 2.844 N/A GLN 121.A N TYR 118.A O no hydrogen 2.889 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 2.976 N/A SER 124.A N ASP 122.A OD2 no hydrogen 2.977 N/A SER 124.A OG ASP 122.A OD2 no hydrogen 2.522 N/A GLY 125.A N SER 139.A OG no hydrogen 2.729 N/A ASP 126.A N ASN 129.A OD1 no hydrogen 2.611 N/A THR 132.A N ASN 129.A O no hydrogen 3.036 N/A THR 132.A OG1 ASN 129.A O no hydrogen 3.466 N/A GLU 133.A N GLY 130.A O no hydrogen 3.175 N/A ALA 134.A N GLY 130.A O no hydrogen 2.883 N/A LEU 136.A N GLU 133.A O no hydrogen 2.904 N/A GLU 137.A N ASP 45.A OD1 no hydrogen 2.883 N/A SER 139.A OG ASP 122.A O no hydrogen 2.662 N/A SER 139.A OG ASP 122.A OD2 no hydrogen 3.556 N/A LEU 140.A N ALA 134.A O no hydrogen 2.960 N/A LYS 141.A N ASN 120.A OD1 no hydrogen 2.880 N/A ILE 142.A N MET 42.A O no hydrogen 2.784 N/A SER 143.A N GLU 146.A OE2 no hydrogen 2.861 N/A GLU 145.A N CYS 38.A O no hydrogen 2.899 N/A GLU 146.A N SER 143.A OG no hydrogen 2.938 N/A GLN 147.A N SER 143.A O no hydrogen 2.770 N/A GLN 147.A NE2 THR 47.A OG1 no hydrogen 2.925 N/A ILE 148.A N PRO 144.A O no hydrogen 2.811 N/A GLN 149.A N GLU 145.A O no hydrogen 3.113 N/A GLN 149.A NE2 ASN 27.A OD1 no hydrogen 2.739 N/A PHE 150.A N GLU 146.A O no hydrogen 2.869 N/A LEU 151.A N GLN 147.A O no hydrogen 2.778 N/A ARG 152.A N ILE 148.A O no hydrogen 2.810 N/A ARG 152.A NE ALA 24.A O no hydrogen 2.741 N/A ARG 152.A NH1 GLN 149.A OE1 no hydrogen 2.852 N/A ARG 152.A NH2 ALA 24.A O no hydrogen 2.850 N/A ARG 152.A NH2 SER 25.A O no hydrogen 3.227 N/A LYS 153.A N GLN 149.A O no hydrogen 2.937 N/A ILE 154.A N PHE 150.A O no hydrogen 2.953 N/A ILE 155.A N LEU 151.A O no hydrogen 2.959 N/A ASN 156.A N ARG 152.A O no hydrogen 2.786 N/A ASN 156.A ND2 ALA 24.A O no hydrogen 2.734 N/A HIS 157.A N ILE 154.A O no hydrogen 2.896 N/A HIS 157.A ND1 ASN 163.A OD1 no hydrogen 2.651 N/A HIS 157.A NE2 GLU 167.A OE2 no hydrogen 2.503 N/A ASN 158.A N LYS 153.A O no hydrogen 2.703 N/A VAL 161.A N LEU 159.A O no hydrogen 2.745 N/A LYS 162.A N ASP 57.A OD2 no hydrogen 2.729 N/A LYS 162.A NZ ASP 57.A O no hydrogen 2.658 N/A ALA 165.A N LYS 162.A O no hydrogen 2.850 N/A ILE 166.A N LYS 162.A O no hydrogen 3.167 N/A GLU 167.A N ASN 163.A O no hydrogen 2.862 N/A ASN 168.A N SER 164.A O no hydrogen 2.734 N/A THR 169.A N ALA 165.A O no hydrogen 3.067 N/A THR 169.A OG1 SER 52.A OG no hydrogen 2.683 N/A THR 169.A OG1 ALA 165.A O no hydrogen 2.780 N/A ILE 170.A N ILE 166.A O no hydrogen 2.852 N/A GLU 171.A N GLU 167.A O no hydrogen 2.785 N/A ASN 172.A N ASN 168.A O no hydrogen 2.978 N/A ASN 172.A ND2 GLN 63.A OE1 no hydrogen 2.822 N/A MET 173.A N THR 169.A O no hydrogen 3.136 N/A MET 173.A N ILE 170.A O no hydrogen 2.861 N/A TYR 174.A N GLU 171.A O no hydrogen 2.972 N/A TYR 174.A OH ASP 177.A OD1 no hydrogen 2.577 N/A LEU 175.A N LEU 184.A O no hydrogen 2.785 N/A GLN 176.A N LEU 184.A O no hydrogen 3.377 N/A GLN 176.A NE2 ASP 177.A O no hydrogen 3.052 N/A LEU 178.A N THR 182.A O no hydrogen 2.626 N/A ASP 179.A N ASN 244.A OD1 no hydrogen 2.877 N/A ASN 180.A ND2 ASN 247.A OD1 no hydrogen 2.963 N/A ASN 180.A ND2 LEU 248.A OXT no hydrogen 2.772 N/A SER 181.A N LEU 178.A O no hydrogen 2.843 N/A THR 182.A N ASN 180.A OD1 no hydrogen 3.037 N/A THR 182.A OG1 ASN 180.A OD1 no hydrogen 2.847 N/A THR 182.A OG1 LEU 248.A O no hydrogen 3.161 N/A THR 182.A OG1 LEU 248.A OXT no hydrogen 2.323 N/A LYS 183.A N ILE 208.A O no hydrogen 2.757 N/A LYS 183.A NZ ASP 177.A OD1 no hydrogen 2.768 N/A LYS 183.A NZ ASP 177.A OD2 no hydrogen 3.142 N/A LEU 184.A N GLN 176.A O no hydrogen 2.753 N/A TYR 185.A N PHE 206.A O no hydrogen 2.770 N/A GLY 186.A N MET 173.A O no hydrogen 2.774 N/A LYS 187.A N GLU 204.A O no hydrogen 2.742 N/A LYS 187.A NZ SER 92.A OG.A no hydrogen 2.896 N/A LYS 187.A NZ SER 92.A OG.B no hydrogen 2.217 N/A LYS 187.A NZ THR 188.A O no hydrogen 2.725 N/A LYS 187.A NZ THR 188.A OG1 no hydrogen 3.404 N/A GLY 189.A N TRP 202.A O no hydrogen 2.929 N/A GLY 191.A N ASN 200.A O no hydrogen 2.990 N/A THR 193.A N LEU 198.A O no hydrogen 2.777 N/A THR 193.A OG1.A LEU 198.A O no hydrogen 3.526 N/A THR 193.A OG1.B LEU 198.A O no hydrogen 3.178 N/A ARG 196.A N THR 193.A O no hydrogen 3.119 N/A GLN 199.A N GLY 223.A O no hydrogen 2.789 N/A GLN 199.A NE2 GLY 226.A O no hydrogen 2.871 N/A GLN 199.A NE2 ASN 228.A O no hydrogen 2.693 N/A ASN 200.A N GLY 191.A O no hydrogen 2.750 N/A ASN 200.A ND2 GLU 137.A OE1 no hydrogen 2.830 N/A GLY 201.A N LEU 221.A O no hydrogen 2.744 N/A TRP 202.A N GLY 189.A O no hydrogen 2.693 N/A TRP 202.A NE1 ALA 43.A O no hydrogen 2.710 N/A PHE 203.A N SER 219.A O no hydrogen 2.705 N/A GLU 204.A N LYS 187.A O no hydrogen 3.024 N/A GLY 205.A N PHE 217.A O no hydrogen 2.910 N/A PHE 206.A N TYR 185.A O no hydrogen 2.739 N/A ILE 207.A N TYR 215.A O no hydrogen 2.882 N/A ILE 208.A N LYS 183.A O no hydrogen 2.893 N/A SER 209.A N HIS 213.A O no hydrogen 2.774 N/A SER 209.A OG SER 211.A OG no hydrogen 2.952 N/A SER 211.A N SER 209.A OG no hydrogen 3.226 N/A SER 211.A OG SER 209.A OG no hydrogen 2.952 N/A GLY 212.A N SER 209.A O no hydrogen 2.769 N/A HIS 213.A N SER 209.A OG no hydrogen 2.917 N/A HIS 213.A NE2 ASP 23.A OD1 no hydrogen 2.321 N/A TYR 215.A N ILE 207.A O no hydrogen 2.808 N/A VAL 216.A N TYR 22.A O no hydrogen 2.835 N/A PHE 217.A N GLY 205.A O no hydrogen 2.894 N/A VAL 218.A N LEU 20.A O no hydrogen 2.861 N/A SER 219.A N PHE 203.A O no hydrogen 2.685 N/A SER 219.A OG ALA 235.A O no hydrogen 2.764 N/A ALA 220.A N CYS 18.A O no hydrogen 2.990 N/A LEU 221.A N GLY 201.A O no hydrogen 2.788 N/A THR 222.A N GLU 16.A O no hydrogen 2.842 N/A THR 222.A OG1 ASN 200.A OD1 no hydrogen 2.708 N/A GLY 223.A N GLN 199.A O no hydrogen 2.850 N/A GLY 226.A N ASN 224.A OD1 no hydrogen 3.205 N/A THR 230.A N GLN 199.A OE1 no hydrogen 2.878 N/A THR 230.A OG1 ASN 228.A O no hydrogen 3.496 N/A SER 231.A N GLN 199.A OE1 no hydrogen 3.020 N/A SER 231.A OG GLN 199.A OE1 no hydrogen 3.558 N/A SER 231.A OG ASN 200.A O no hydrogen 2.646 N/A LYS 234.A N THR 230.A O no hydrogen 2.883 N/A LYS 234.A NZ LEU 11.A O no hydrogen 3.123 N/A ALA 235.A N SER 231.A O no hydrogen 2.792 N/A LYS 236.A N SER 232.A O no hydrogen 2.785 N/A LYS 237.A N ILE 233.A O no hydrogen 2.803 N/A ASN 238.A N LYS 234.A O no hydrogen 2.829 N/A ASN 238.A ND2 LEU 11.A O no hydrogen 2.774 N/A ALA 239.A N ALA 235.A O no hydrogen 2.899 N/A ILE 240.A N LYS 236.A O no hydrogen 2.851 N/A THR 241.A N LYS 237.A O no hydrogen 2.861 N/A THR 241.A OG1 LYS 237.A O no hydrogen 2.935 N/A ILE 242.A N ASN 238.A O no hydrogen 2.857 N/A LEU 243.A N ALA 239.A O no hydrogen 2.706 N/A ASN 244.A N ILE 240.A O no hydrogen 2.835 N/A THR 245.A N THR 241.A O no hydrogen 3.008 N/A THR 245.A OG1 THR 241.A O no hydrogen 2.763 N/A LEU 246.A N ILE 242.A O no hydrogen 2.822 N/A ASN 247.A N LEU 243.A O no hydrogen 3.091 N/A