Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nia_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N SER 1.A OG no hydrogen 3.039 N/A THR 5.A N SER 1.A O no hydrogen 3.205 N/A THR 5.A OG1 SER 1.A O no hydrogen 3.361 N/A PHE 6.A N GLU 2.A O no hydrogen 3.025 N/A LYS 7.A N LYS 3.A O no hydrogen 2.996 N/A THR 8.A N LEU 4.A O no hydrogen 2.837 N/A THR 8.A OG1 LEU 4.A O no hydrogen 2.887 N/A ASP 9.A N THR 5.A O no hydrogen 2.840 N/A LEU 10.A N PHE 6.A O no hydrogen 3.029 N/A GLU 11.A N LYS 7.A O no hydrogen 2.966 N/A LYS 12.A N THR 8.A O no hydrogen 2.891 N/A LYS 12.A NZ GLU 16.A OE1.A no hydrogen 2.887 N/A LYS 12.A NZ GLU 16.A OE1.B no hydrogen 3.042 N/A LEU 13.A N ASP 9.A O no hydrogen 3.199 N/A GLU 14.A N LEU 10.A O no hydrogen 2.992 N/A ARG 15.A N GLU 11.A O no hydrogen 2.896 N/A GLU 16.A N LYS 12.A O no hydrogen 2.897 N/A LYS 17.A N LEU 13.A O no hydrogen 2.883 N/A ALA 19.A N GLU 14.A O no hydrogen 2.938 N/A GLN 20.A N THR 240.A O no hydrogen 2.898 N/A ILE 21.A N GLU 14.A OE2 no hydrogen 2.784 N/A GLY 22.A N TYR 238.A O no hydrogen 2.721 N/A VAL 23.A N HIS 36.A O no hydrogen 2.801 N/A ALA 24.A N ALA 236.A O no hydrogen 2.931 N/A ILE 25.A N ALA 34.A O no hydrogen 2.872 N/A VAL 26.A N ALA 234.A O no hydrogen 2.965 N/A ASP 27.A N GLU 31.A O no hydrogen 2.923 N/A GLN 29.A N ASP 27.A OD1 no hydrogen 2.934 N/A GLY 30.A N ASP 27.A O no hydrogen 2.806 N/A GLU 31.A N ASP 27.A OD1 no hydrogen 2.916 N/A VAL 33.A N ILE 25.A O no hydrogen 2.757 N/A ALA 34.A N ILE 25.A O no hydrogen 3.282 N/A HIS 36.A N VAL 23.A O no hydrogen 2.857 N/A ARG 37.A NE GLU 14.A OE2 no hydrogen 2.827 N/A ARG 37.A NH1 GLN 40.A OE1 no hydrogen 2.846 N/A ARG 37.A NH2 GLU 14.A OE1 no hydrogen 3.493 N/A GLN 40.A N ARG 37.A O no hydrogen 3.116 N/A GLN 40.A NE2 GLN 20.A OE1 no hydrogen 2.904 N/A ARG 41.A NH1 VAL 136.A O no hydrogen 2.936 N/A ARG 41.A NH1 THR 157.A OG1 no hydrogen 2.925 N/A ARG 41.A NH2 VAL 136.A O no hydrogen 3.489 N/A PHE 42.A N THR 158.A O no hydrogen 2.967 N/A MET 44.A N ASP 156.A O no hydrogen 2.964 N/A CYS 45.A SG.A THR 214.A O no hydrogen 3.807 N/A CYS 45.A SG.B ALA 43.A O no hydrogen 3.966 N/A SER 46.A OG SER 107.A OG no hydrogen 3.134 N/A THR 47.A N MET 44.A O no hydrogen 3.128 N/A THR 47.A OG1 MET 44.A O no hydrogen 2.679 N/A THR 47.A OG1 TYR 238.A OH no hydrogen 2.794 N/A PHE 48.A N CYS 45.A O no hydrogen 3.223 N/A LYS 49.A N SER 46.A O no hydrogen 3.034 N/A LYS 49.A NZ SER 46.A OG no hydrogen 3.072 N/A LYS 49.A NZ SER 107.A OG no hydrogen 2.922 N/A LYS 49.A NZ ASN 109.A OD1 no hydrogen 2.767 N/A PHE 50.A N THR 47.A O no hydrogen 3.269 N/A LEU 52.A N PHE 48.A O no hydrogen 2.916 N/A ALA 53.A N LYS 49.A O no hydrogen 2.979 N/A ALA 54.A N PHE 50.A O no hydrogen 3.018 N/A LEU 55.A N PRO 51.A O no hydrogen 2.883 N/A VAL 56.A N LEU 52.A O no hydrogen 2.979 N/A PHE 57.A N ALA 53.A O no hydrogen 2.900 N/A GLU 58.A N ALA 54.A O no hydrogen 2.840 N/A ARG 59.A N LEU 55.A O no hydrogen 3.125 N/A ARG 59.A NH2 ILE 119.A O no hydrogen 2.814 N/A ILE 60.A N VAL 56.A O no hydrogen 2.939 N/A ASP 61.A N PHE 57.A O no hydrogen 2.734 N/A SER 62.A N GLU 58.A O no hydrogen 2.964 N/A SER 62.A OG GLU 58.A O no hydrogen 2.874 N/A SER 62.A OG GLU 58.A OE1 no hydrogen 2.688 N/A GLY 63.A N ILE 60.A O no hydrogen 3.171 N/A THR 64.A N ARG 59.A O no hydrogen 2.903 N/A THR 64.A OG1 ARG 59.A O no hydrogen 3.399 N/A ARG 66.A N GLU 65.A OE1 no hydrogen 3.059 N/A ARG 66.A NE ASP 68.A OD1 no hydrogen 2.933 N/A ARG 66.A NH2 ASP 68.A OD1 no hydrogen 3.414 N/A ARG 66.A NH2 ASP 68.A OD2 no hydrogen 2.877 N/A ARG 69.A N ARG 66.A O no hydrogen 3.210 N/A ARG 69.A NE GLU 65.A OE1 no hydrogen 2.713 N/A LEU 71.A N MET 94.A O no hydrogen 2.783 N/A TYR 73.A N GLY 92.A O no hydrogen 3.056 N/A TYR 73.A OH THR 85.A O no hydrogen 2.731 N/A MET 77.A N GLY 74.A O no hydrogen 2.995 N/A ILE 78.A N PRO 75.A O no hydrogen 3.091 N/A VAL 79.A N SER 82.A OG no hydrogen 3.307 N/A TRP 81.A NE1 LEU 106.A O no hydrogen 2.742 N/A SER 82.A OG VAL 79.A O no hydrogen 2.766 N/A ALA 84.A N ASP 108.A OD2 no hydrogen 2.750 N/A THR 85.A N ASP 108.A OD2 no hydrogen 2.907 N/A THR 85.A OG1 ASP 108.A OD1 no hydrogen 2.694 N/A THR 85.A OG1 ASP 108.A OD2 no hydrogen 3.211 N/A GLU 86.A N SER 82.A O no hydrogen 2.952 N/A ARG 87.A N PRO 83.A O no hydrogen 3.335 N/A PHE 88.A N ALA 84.A O no hydrogen 2.946 N/A LEU 89.A N GLU 86.A O no hydrogen 3.308 N/A SER 91.A OG PHE 88.A O no hydrogen 2.678 N/A GLY 92.A N PHE 88.A O no hydrogen 3.219 N/A MET 94.A N LEU 71.A O no hydrogen 3.146 N/A THR 95.A N GLU 98.A OE1 no hydrogen 2.910 N/A VAL 96.A N ARG 69.A O no hydrogen 2.903 N/A LEU 97.A N GLY 67.A O no hydrogen 3.062 N/A GLU 98.A N THR 95.A OG1 no hydrogen 2.941 N/A ALA 99.A N THR 95.A O no hydrogen 2.859 N/A ALA 100.A N VAL 96.A O no hydrogen 2.894 N/A GLN 101.A N LEU 97.A O no hydrogen 2.923 N/A GLN 101.A NE2 GLN 105.A OE1 no hydrogen 2.878 N/A ALA 102.A N GLU 98.A O no hydrogen 2.967 N/A ALA 103.A N ALA 99.A O no hydrogen 2.863 N/A VAL 104.A N ALA 100.A O no hydrogen 2.986 N/A GLN 105.A N GLN 101.A O no hydrogen 2.827 N/A GLN 105.A NE2 TRP 187.A O no hydrogen 2.979 N/A LEU 106.A N ALA 102.A O no hydrogen 3.002 N/A ASP 108.A N ALA 102.A O no hydrogen 3.157 N/A ASN 109.A N TRP 81.A O no hydrogen 2.930 N/A ASN 109.A ND2 GLU 80.A O no hydrogen 2.949 N/A ASN 109.A ND2 TRP 81.A O no hydrogen 3.344 N/A GLY 110.A N SER 82.A OG no hydrogen 2.889 N/A ALA 111.A N ASP 108.A OD1 no hydrogen 2.853 N/A THR 112.A N ASP 108.A O no hydrogen 3.214 N/A THR 112.A OG1 ASP 108.A O no hydrogen 2.811 N/A ASN 113.A N ASN 109.A O no hydrogen 2.981 N/A ASN 113.A ND2 GLU 143.A O no hydrogen 2.975 N/A LEU 114.A N GLY 110.A O no hydrogen 2.905 N/A LEU 115.A N ALA 111.A O no hydrogen 2.987 N/A LEU 116.A N THR 112.A O no hydrogen 2.862 N/A ARG 117.A N ASN 113.A O no hydrogen 2.942 N/A GLU 118.A N LEU 114.A O no hydrogen 3.217 N/A ILE 119.A N LEU 115.A O no hydrogen 2.882 N/A GLY 120.A N LEU 116.A O no hydrogen 3.098 N/A GLY 121.A N LEU 116.A O no hydrogen 2.737 N/A MET 125.A N GLY 121.A O no hydrogen 3.095 N/A THR 126.A N PRO 122.A O no hydrogen 2.906 N/A THR 126.A OG1 PRO 122.A O no hydrogen 3.090 N/A THR 126.A OG1 LEU 139.A O no hydrogen 2.910 N/A GLN 127.A N ALA 123.A O no hydrogen 2.953 N/A TYR 128.A N ALA 124.A O no hydrogen 2.992 N/A PHE 129.A N MET 125.A O no hydrogen 3.132 N/A ARG 130.A N THR 126.A O no hydrogen 3.042 N/A ARG 130.A NH1 ASP 134.A O no hydrogen 2.806 N/A ARG 130.A NH1 SER 137.A O no hydrogen 2.776 N/A ARG 130.A NH2 SER 137.A O no hydrogen 3.171 N/A LYS 131.A N GLN 127.A O no hydrogen 2.865 N/A ILE 132.A N TYR 128.A O no hydrogen 3.071 N/A ILE 132.A N PHE 129.A O no hydrogen 3.218 N/A GLY 133.A N ARG 130.A O no hydrogen 3.047 N/A ASP 134.A N PHE 129.A O no hydrogen 2.949 N/A VAL 136.A N ASP 134.A OD1 no hydrogen 2.839 N/A SER 137.A N ASP 134.A OD1 no hydrogen 2.859 N/A SER 137.A OG ASP 134.A OD1 no hydrogen 3.375 N/A SER 137.A OG ASP 134.A OD2 no hydrogen 2.584 N/A SER 137.A OG THR 158.A OG1 no hydrogen 2.677 N/A ARG 138.A N THR 157.A O no hydrogen 3.049 N/A ARG 138.A NE ASP 140.A OD2 no hydrogen 2.913 N/A ARG 138.A NH2 ASP 140.A OD1 no hydrogen 2.945 N/A ARG 138.A NH2 ASP 140.A OD2 no hydrogen 3.561 N/A LEU 139.A N THR 126.A OG1 no hydrogen 2.963 N/A ASP 140.A N ASP 156.A OD1 no hydrogen 2.635 N/A ARG 141.A N ASP 156.A OD1 no hydrogen 2.943 N/A ARG 141.A NE ASP 156.A OD2 no hydrogen 2.716 N/A ARG 141.A NH2 ASP 156.A OD2 no hydrogen 2.924 N/A GLU 143.A N ASN 113.A OD1 no hydrogen 2.958 N/A MET 146.A N LYS 142.A O no hydrogen 3.037 N/A ASN 147.A N PRO 144.A O no hydrogen 3.036 N/A ASN 147.A ND2 GLU 143.A OE2 no hydrogen 2.928 N/A ASP 148.A N GLU 145.A O no hydrogen 3.113 N/A ASP 153.A N THR 150.A O no hydrogen 3.002 N/A ARG 155.A N ASP 153.A OD1 no hydrogen 2.971 N/A ARG 155.A NE ASP 153.A OD1 no hydrogen 3.109 N/A ARG 155.A NE ASP 153.A OD2 no hydrogen 3.114 N/A ARG 155.A NH2 ASP 153.A OD2 no hydrogen 2.834 N/A ASP 156.A N ASP 140.A OD2 no hydrogen 2.940 N/A THR 157.A OG1 LEU 154.A O no hydrogen 2.610 N/A THR 158.A N PHE 42.A O no hydrogen 2.956 N/A THR 158.A OG1 SER 137.A OG no hydrogen 2.677 N/A THR 158.A OG1 THR 159.A O no hydrogen 3.349 N/A ILE 161.A N MET 38.A O no hydrogen 2.935 N/A ALA 162.A N THR 159.A OG1 no hydrogen 3.168 N/A MET 163.A N THR 159.A O no hydrogen 2.963 N/A ALA 164.A N PRO 160.A O no hydrogen 2.913 N/A ARG 165.A N ILE 161.A O no hydrogen 3.075 N/A ARG 165.A NE.A GLY 30.A O no hydrogen 2.747 N/A ARG 165.A NH2.A GLY 30.A O no hydrogen 3.121 N/A ARG 165.A NH2.B GLY 30.A O no hydrogen 2.838 N/A THR 166.A N ALA 162.A O no hydrogen 2.985 N/A THR 166.A OG1 ASP 134.A OD2 no hydrogen 2.743 N/A THR 166.A OG1 ALA 162.A O no hydrogen 3.379 N/A VAL 167.A N MET 163.A O no hydrogen 2.851 N/A ALA 168.A N ALA 164.A O no hydrogen 2.990 N/A LYS 169.A N ARG 165.A O no hydrogen 2.910 N/A LYS 169.A NZ ILE 132.A O no hydrogen 3.299 N/A VAL 170.A N THR 166.A O no hydrogen 2.968 N/A LEU 171.A N VAL 167.A O no hydrogen 2.931 N/A TYR 172.A N ALA 168.A O no hydrogen 2.692 N/A TYR 172.A OH TYR 233.A O no hydrogen 3.308 N/A GLY 173.A N LYS 169.A O no hydrogen 3.082 N/A THR 177.A N ASP 61.A OD2 no hydrogen 3.021 N/A THR 177.A OG1 ASP 61.A OD1 no hydrogen 3.008 N/A THR 177.A OG1 ASP 61.A OD2 no hydrogen 3.565 N/A THR 177.A OG1 SER 180.A OG no hydrogen 3.262 N/A SER 180.A N THR 177.A OG1 no hydrogen 3.149 N/A SER 180.A OG ASP 61.A OD1 no hydrogen 2.711 N/A SER 180.A OG THR 177.A OG1 no hydrogen 3.262 N/A THR 181.A N THR 177.A O no hydrogen 2.806 N/A THR 181.A OG1 THR 177.A O no hydrogen 2.677 N/A HIS 182.A N SER 178.A O no hydrogen 2.889 N/A THR 183.A N THR 179.A O no hydrogen 3.000 N/A THR 183.A OG1 THR 179.A O no hydrogen 3.118 N/A ILE 184.A N SER 180.A O no hydrogen 3.071 N/A GLU 185.A N THR 181.A O no hydrogen 2.930 N/A ARG 186.A N HIS 182.A O no hydrogen 2.924 N/A TRP 187.A N THR 183.A O no hydrogen 3.069 N/A LEU 188.A N ILE 184.A O no hydrogen 2.938 N/A ILE 189.A N GLU 185.A O no hydrogen 3.013 N/A GLY 190.A N ARG 186.A O no hydrogen 2.963 N/A ASN 191.A N LEU 188.A O no hydrogen 3.411 N/A ASN 191.A ND2.A THR 193.A OG1 no hydrogen 3.269 N/A ASN 191.A ND2.A GLU 210.A OE2 no hydrogen 3.195 N/A ASN 191.A ND2.B LEU 188.A O no hydrogen 2.808 N/A ASN 191.A ND2.B GLU 210.A OE2 no hydrogen 2.437 N/A GLN 192.A N GLN 105.A O no hydrogen 2.851 N/A THR 193.A N ASN 191.A OD1.B no hydrogen 2.971 N/A THR 193.A OG1 ASN 191.A OD1.A no hydrogen 3.123 N/A THR 193.A OG1 ASN 191.A OD1.B no hydrogen 3.390 N/A THR 193.A OG1 THR 212.A OG1 no hydrogen 2.748 N/A THR 197.A N GLY 194.A O no hydrogen 3.242 N/A THR 197.A OG1 GLY 194.A O no hydrogen 3.213 N/A THR 197.A OG1 ASP 222.A OD2 no hydrogen 2.745 N/A LEU 198.A N ASP 222.A OD2 no hydrogen 2.956 N/A ARG 199.A NH1 ILE 189.A O no hydrogen 2.942 N/A ARG 199.A NH2 ILE 189.A O no hydrogen 3.086 N/A ARG 199.A NH2 GLU 210.A OE2 no hydrogen 3.144 N/A ALA 200.A N THR 197.A O no hydrogen 2.989 N/A GLY 201.A N LEU 198.A O no hydrogen 2.872 N/A PHE 202.A N ARG 199.A O no hydrogen 3.228 N/A TRP 206.A N PRO 203.A O no hydrogen 3.176 N/A GLY 209.A N PHE 225.A O no hydrogen 3.105 N/A GLU 210.A N LEU 188.A O no hydrogen 3.253 N/A LYS 211.A N ILE 223.A O no hydrogen 2.757 N/A LYS 211.A NZ SER 107.A OG no hydrogen 2.910 N/A LYS 211.A NZ THR 212.A O no hydrogen 2.802 N/A THR 212.A OG1 THR 193.A OG1 no hydrogen 2.748 N/A GLY 213.A N ASN 221.A O no hydrogen 2.874 N/A CYS 215.A N GLY 219.A O no hydrogen 2.992 N/A CYS 215.A SG ALA 43.A O no hydrogen 3.870 N/A ALA 216.A N ASN 147.A O no hydrogen 2.978 N/A ASN 217.A ND2 ASN 149.A O no hydrogen 2.884 N/A GLY 219.A N CYS 215.A O no hydrogen 3.136 N/A ARG 220.A N THR 239.A O no hydrogen 2.921 N/A ARG 220.A NE ASP 250.A OD2 no hydrogen 2.828 N/A ARG 220.A NH1 GLY 213.A O no hydrogen 3.366 N/A ARG 220.A NH2 ASP 250.A OD2 no hydrogen 2.824 N/A ASN 221.A N GLY 213.A O no hydrogen 2.882 N/A ASN 221.A ND2 ALA 43.A O no hydrogen 3.104 N/A ASN 221.A ND2 MET 44.A O no hydrogen 3.422 N/A ASP 222.A N VAL 237.A O no hydrogen 2.846 N/A ILE 223.A N LYS 211.A O no hydrogen 3.037 N/A GLY 224.A N VAL 235.A O no hydrogen 2.852 N/A PHE 225.A N GLY 209.A O no hydrogen 2.906 N/A PHE 226.A N TYR 233.A O no hydrogen 3.090 N/A LYS 227.A N VAL 207.A O no hydrogen 2.834 N/A LYS 227.A NZ ASP 232.A OD1 no hydrogen 2.693 N/A ALA 228.A N ARG 231.A O no hydrogen 2.878 N/A ARG 231.A N ALA 228.A O no hydrogen 2.919 N/A ARG 231.A NE TYR 233.A OH no hydrogen 3.282 N/A TYR 233.A N PHE 226.A O no hydrogen 2.895 N/A ALA 234.A N VAL 26.A O no hydrogen 2.970 N/A VAL 235.A N GLY 224.A O no hydrogen 2.861 N/A ALA 236.A N ALA 24.A O no hydrogen 2.948 N/A VAL 237.A N ASP 222.A O no hydrogen 2.942 N/A TYR 238.A N GLY 22.A O no hydrogen 2.873 N/A TYR 238.A OH THR 47.A OG1 no hydrogen 2.794 N/A THR 239.A N ARG 220.A O no hydrogen 3.083 N/A THR 239.A N ASN 221.A OD1 no hydrogen 3.236 N/A THR 239.A OG1 ARG 220.A O no hydrogen 2.708 N/A THR 240.A N GLN 20.A O no hydrogen 3.000 N/A ALA 241.A N GLY 218.A O no hydrogen 2.870 N/A LEU 244.A N ALA 241.A O no hydrogen 3.268 N/A SER 245.A N GLU 248.A OE2 no hydrogen 2.853 N/A GLU 248.A N SER 245.A OG no hydrogen 3.051 N/A ARG 249.A N SER 245.A O no hydrogen 2.918 N/A ARG 249.A NE ALA 241.A O no hydrogen 2.929 N/A ARG 249.A NH2 ALA 241.A O no hydrogen 3.214 N/A ARG 249.A NH2 PRO 242.A O no hydrogen 3.117 N/A ASP 250.A N ALA 246.A O no hydrogen 3.074 N/A GLU 251.A N VAL 247.A O no hydrogen 2.989 N/A LEU 252.A N GLU 248.A O no hydrogen 2.843 N/A VAL 253.A N ARG 249.A O no hydrogen 3.066 N/A ALA 254.A N ASP 250.A O no hydrogen 2.984 N/A SER 255.A N GLU 251.A O no hydrogen 2.807 N/A SER 255.A OG GLU 251.A O no hydrogen 2.931 N/A VAL 256.A N LEU 252.A O no hydrogen 2.946 N/A GLY 257.A N VAL 253.A O no hydrogen 2.962 N/A GLN 258.A N ALA 254.A O no hydrogen 3.015 N/A VAL 259.A N SER 255.A O no hydrogen 3.060 N/A ILE 260.A N VAL 256.A O no hydrogen 2.887 N/A THR 261.A N GLY 257.A O no hydrogen 2.893 N/A THR 261.A OG1 GLY 201.A O no hydrogen 2.990 N/A THR 261.A OG1 GLY 257.A O no hydrogen 2.905 N/A GLN 262.A N GLN 258.A O no hydrogen 3.084 N/A LEU 263.A N VAL 259.A O no hydrogen 3.181 N/A ILE 264.A N ILE 260.A O no hydrogen 2.952 N/A LEU 265.A N THR 261.A O no hydrogen 2.913 N/A SER 266.A N GLN 262.A O no hydrogen 3.175 N/A SER 266.A N LEU 263.A O no hydrogen 3.197 N/A SER 266.A OG GLU 2.A OE1 no hydrogen 2.686 N/A SER 266.A OG LEU 263.A O no hydrogen 2.823 N/A THR 267.A N ILE 264.A O no hydrogen 3.290 N/A THR 267.A OG1 ILE 264.A O no hydrogen 2.876 N/A