Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4niy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASP 169.A OD1 no hydrogen 2.663 N/A ILE 1.A N ASP 169.A OD2 no hydrogen 3.309 N/A VAL 2.A N LYS 164.A O no hydrogen 3.034 N/A TYR 5.A N CYS 130.A O no hydrogen 3.122 N/A CYS 7.A N LEU 128.A O no hydrogen 3.231 N/A CYS 7.A SG LEU 128.A O no hydrogen 3.614 N/A ASN 10.A ND2 GLY 51.A O no hydrogen 3.060 N/A THR 11.A N GLY 8.A O no hydrogen 3.239 N/A THR 11.A OG1 CYS 7.A O no hydrogen 2.973 N/A THR 11.A OG1 GLY 8.A O no hydrogen 2.760 N/A GLN 15.A N VAL 12.A O no hydrogen 3.150 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.127 N/A VAL 16.A N GLY 27.A O no hydrogen 3.163 N/A SER 17.A N ARG 49.A O no hydrogen 3.181 N/A SER 17.A OG HIS 23.A ND1 no hydrogen 2.675 N/A LEU 18.A N CYS 25.A O no hydrogen 2.898 N/A ASN 19.A N GLN 47.A O no hydrogen 2.936 N/A SER 20.A N TYR 22.A O no hydrogen 3.083 N/A SER 20.A OG GLU 43.A OE2 no hydrogen 2.979 N/A GLY 21.A N ASN 19.A OD1 no hydrogen 3.067 N/A HIS 23.A ND1 SER 17.A OG no hydrogen 2.675 N/A HIS 23.A NE2 GLY 168.A O no hydrogen 2.884 N/A PHE 24.A N LEU 18.A O no hydrogen 3.077 N/A CYS 25.A SG PHE 24.A O no hydrogen 3.360 N/A CYS 25.A SG SER 170.A O no hydrogen 3.739 N/A GLY 26.A N SER 170.A O no hydrogen 2.531 N/A SER 28.A N VAL 36.A O no hydrogen 2.924 N/A LEU 29.A N TYR 14.A O no hydrogen 2.851 N/A ILE 30.A N TRP 34.A O no hydrogen 3.062 N/A GLN 33.A N ASN 31.A OD1 no hydrogen 2.755 N/A GLN 33.A NE2 LEU 90.A O no hydrogen 2.925 N/A TRP 34.A N ASN 31.A O no hydrogen 3.498 N/A VAL 35.A N ILE 88.A O no hydrogen 2.727 N/A VAL 36.A N SER 28.A O no hydrogen 2.902 N/A SER 37.A N MET 86.A O no hydrogen 2.920 N/A SER 37.A OG GLY 26.A O no hydrogen 2.999 N/A HIS 40.A N ASP 84.A OD1 no hydrogen 2.792 N/A HIS 40.A ND1 ASP 84.A OD2 no hydrogen 2.666 N/A HIS 40.A NE2 SER 170.A OG no hydrogen 2.572 N/A CYS 41.A N ALA 38.A O no hydrogen 3.192 N/A TYR 42.A N ALA 39.A O no hydrogen 3.113 N/A GLN 47.A N ASN 19.A O no hydrogen 2.728 N/A VAL 48.A N ILE 65.A O no hydrogen 2.860 N/A ARG 49.A N SER 17.A O no hydrogen 2.920 N/A ARG 49.A NE GLN 47.A OE1 no hydrogen 2.975 N/A ARG 49.A NH2 GLN 47.A OE1 no hydrogen 3.206 N/A LEU 50.A N GLN 63.A O no hydrogen 2.949 N/A ASN 54.A N GLU 59.A OE1 no hydrogen 3.013 N/A ILE 55.A N ASP 126.A O no hydrogen 3.193 N/A ASN 56.A N ASN 54.A OD1 no hydrogen 2.994 N/A VAL 57.A N ASN 54.A OD1 no hydrogen 3.172 N/A GLU 59.A N GLU 62.A OE2 no hydrogen 2.957 N/A GLY 60.A N GLU 62.A OE1 no hydrogen 2.886 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.708 N/A GLN 63.A N LEU 50.A O no hydrogen 3.241 N/A GLN 63.A NE2 SER 95.A O no hydrogen 2.717 N/A ILE 65.A N VAL 48.A O no hydrogen 3.109 N/A ALA 67.A N ILE 46.A O no hydrogen 3.158 N/A SER 68.A N LYS 89.A O no hydrogen 2.745 N/A SER 68.A OG LYS 89.A O no hydrogen 3.183 N/A LYS 69.A NZ ASN 216.A O no hydrogen 3.161 N/A LYS 69.A NZ ASN 216.A OD1 no hydrogen 3.218 N/A ILE 71.A N LEU 87.A O no hydrogen 2.713 N/A HIS 73.A N ILE 85.A O no hydrogen 3.174 N/A SER 75.A N HIS 73.A ND1 no hydrogen 3.069 N/A TYR 76.A N HIS 73.A O no hydrogen 2.893 N/A ASN 77.A N ASN 82.A O no hydrogen 3.074 N/A ASN 79.A N ASN 77.A OD1 no hydrogen 2.990 N/A THR 80.A N ASN 77.A OD1 no hydrogen 3.292 N/A ASN 82.A N THR 80.A OG1 no hydrogen 3.352 N/A ASN 83.A ND2 SER 75.A O no hydrogen 2.777 N/A ILE 85.A N ASN 83.A O no hydrogen 2.940 N/A MET 86.A N SER 37.A O no hydrogen 2.698 N/A LEU 87.A N ILE 71.A O no hydrogen 2.919 N/A ILE 88.A N VAL 35.A O no hydrogen 2.764 N/A LYS 89.A N LYS 69.A O no hydrogen 2.948 N/A LYS 89.A NZ ASN 216.A O no hydrogen 2.736 N/A LEU 90.A N GLN 33.A O no hydrogen 2.742 N/A LYS 91.A N SER 66.A O no hydrogen 2.832 N/A ALA 94.A N SER 32.A O no hydrogen 2.847 N/A SER 95.A N GLN 63.A OE1 no hydrogen 3.069 N/A ASN 97.A N VAL 100.A O no hydrogen 3.174 N/A ARG 99.A N ASN 97.A OD1 no hydrogen 2.782 N/A VAL 100.A N ASN 97.A OD1 no hydrogen 3.119 N/A ALA 101.A N PRO 13.A O no hydrogen 3.360 N/A ILE 103.A N LEU 29.A O no hydrogen 2.838 N/A SER 108.A OG CYS 109.A O no hydrogen 3.514 N/A GLY 113.A N ILE 135.A O no hydrogen 2.766 N/A THR 114.A OG1 SER 111.A O no hydrogen 2.911 N/A CYS 116.A N ALA 133.A O no hydrogen 2.857 N/A LEU 117.A N VAL 175.A O no hydrogen 2.645 N/A ILE 118.A N LEU 131.A O no hydrogen 2.752 N/A SER 119.A OG GLN 15.A OE1 no hydrogen 2.654 N/A GLY 120.A N LYS 129.A O no hydrogen 3.271 N/A TRP 121.A NE1 ASP 53.A O no hydrogen 3.125 N/A GLY 122.A N ASP 169.A OD2 no hydrogen 2.831 N/A HIS 123.A N GLN 167.A O no hydrogen 3.323 N/A HIS 123.A NE2 HIS 124.A NE2 no hydrogen 2.941 N/A VAL 127.A N ASP 126.A OD1 no hydrogen 2.625 N/A LYS 129.A N GLY 120.A O no hydrogen 3.090 N/A LYS 129.A NZ THR 6.A OG1 no hydrogen 2.705 N/A CYS 130.A N TYR 5.A O no hydrogen 2.771 N/A ALA 133.A N CYS 116.A O no hydrogen 2.877 N/A ILE 135.A N THR 114.A O no hydrogen 2.982 N/A LEU 136.A N CYS 155.A O no hydrogen 3.020 N/A SER 137.A OG SER 140.A OG no hydrogen 2.771 N/A SER 140.A N SER 137.A OG no hydrogen 3.288 N/A SER 140.A OG SER 137.A OG no hydrogen 2.771 N/A CYS 141.A N SER 137.A O no hydrogen 3.109 N/A LYS 142.A N ASP 138.A O no hydrogen 3.032 N/A SER 143.A N SER 139.A O no hydrogen 2.967 N/A SER 143.A OG SER 139.A O no hydrogen 2.658 N/A ALA 144.A N SER 140.A O no hydrogen 3.118 N/A TYR 145.A N CYS 141.A O no hydrogen 3.133 N/A TYR 145.A OH PRO 196.A O no hydrogen 2.653 N/A GLN 148.A N TYR 145.A O no hydrogen 3.085 N/A THR 150.A OG1 ASN 82.A OD1 no hydrogen 2.595 N/A ASN 152.A N THR 150.A OG1 no hydrogen 3.169 N/A ASN 152.A ND2 ASN 82.A OD1 no hydrogen 3.323 N/A MET 153.A N THR 150.A O no hydrogen 3.314 N/A PHE 154.A N TYR 199.A O no hydrogen 3.044 N/A ALA 156.A N GLY 197.A O no hydrogen 3.156 N/A GLY 157.A N PRO 134.A O no hydrogen 3.205 N/A LYS 164.A N VAL 2.A O no hydrogen 3.404 N/A LYS 164.A NZ SER 188.A OG no hydrogen 3.379 N/A LYS 164.A NZ GLY 189.A O no hydrogen 3.371 N/A LYS 164.A NZ LYS 195.A O no hydrogen 3.444 N/A LYS 164.A NZ GLN 192A.A O no hydrogen 2.731 N/A SER 165.A OG TYR 199.A OH no hydrogen 3.002 N/A CYS 166.A N ASP 169.A OD1 no hydrogen 2.794 N/A CYS 166.A SG SER 165.A O no hydrogen 3.203 N/A ASP 169.A N CYS 166.A O no hydrogen 2.920 N/A SER 170.A OG HIS 40.A NE2 no hydrogen 2.572 N/A GLY 171.A N VAL 184.A O no hydrogen 2.940 N/A GLY 172.A N ASP 169.A O no hydrogen 3.045 N/A VAL 174.A N GLY 182.A O no hydrogen 3.293 N/A VAL 175.A N LEU 117.A O no hydrogen 2.920 N/A CYS 176.A N LYS 179.A O no hydrogen 3.101 N/A LYS 179.A N CYS 176.A O no hydrogen 3.293 N/A LEU 180.A N SER 104.A O no hydrogen 2.893 N/A GLN 181.A N VAL 174.A O no hydrogen 2.848 N/A GLN 181.A NE2 SER 108.A O no hydrogen 3.088 N/A GLY 182.A N VAL 174.A O no hydrogen 3.084 N/A VAL 184.A N GLY 172.A O no hydrogen 2.889 N/A SER 185.A N VAL 198.A O no hydrogen 3.221 N/A SER 185.A OG ASP 84.A OD2 no hydrogen 2.678 N/A TRP 186.A N VAL 198.A O no hydrogen 3.235 N/A LYS 195.A NZ ALA 144.A O no hydrogen 2.718 N/A GLY 197.A N ALA 156.A O no hydrogen 3.305 N/A VAL 198.A N TRP 186.A O no hydrogen 2.817 N/A TYR 199.A N PHE 154.A O no hydrogen 2.874 N/A TYR 199.A OH SER 165.A OG no hydrogen 3.002 N/A THR 200.A N ILE 183.A O no hydrogen 3.156 N/A THR 200.A OG1 ASP 84.A O no hydrogen 2.832 N/A LYS 201.A N ASN 152.A O no hydrogen 3.006 N/A LYS 201.A NZ SER 151.A O no hydrogen 3.081 N/A VAL 202.A N GLN 181.A O no hydrogen 2.912 N/A CYS 203.A SG ASN 204.A OD1 no hydrogen 3.836 N/A ASN 204.A N LYS 201.A O no hydrogen 3.207 N/A ASN 204.A ND2 SER 151.A O no hydrogen 3.210 N/A ASN 204.A ND2 ASN 152.A OD1 no hydrogen 2.931 N/A TYR 205.A N VAL 202.A O no hydrogen 2.876 N/A TYR 205.A OH ASN 83.A OD1 no hydrogen 2.743 N/A ILE 209.A N TYR 205.A O no hydrogen 2.836 N/A LYS 210.A N VAL 206.A O no hydrogen 3.047 N/A GLN 211.A N SER 207.A O no hydrogen 3.311 N/A THR 212.A N TRP 208.A O no hydrogen 3.120 N/A THR 212.A OG1 TRP 208.A O no hydrogen 2.663 N/A ILE 213.A N ILE 209.A O no hydrogen 2.970 N/A ALA 214.A N LYS 210.A O no hydrogen 2.907 N/A SER 215.A N GLN 211.A O no hydrogen 3.053 N/A SER 215.A N THR 212.A O no hydrogen 3.288 N/A SER 215.A OG GLN 211.A O no hydrogen 3.041 N/A SER 215.A OG GLN 211.A OE1 no hydrogen 2.716 N/A ASN 216.A N ILE 213.A O no hydrogen 3.421 N/A ASN 216.A ND2 THR 212.A O no hydrogen 2.849 N/A LYS 163A.A NZ GLY 3.A O no hydrogen 2.947 N/A