Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kv1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N.A SER 1.A O no hydrogen 3.155 N/A GLU 5.A N.B SER 1.A O no hydrogen 3.170 N/A GLN 6.A N VAL 2.A O no hydrogen 3.289 N/A GLN 6.A NE2 VAL 2.A O no hydrogen 3.655 N/A LYS 7.A N GLN 3.A O no hydrogen 3.182 N/A LEU 8.A N LEU 4.A O no hydrogen 2.900 N/A VAL 9.A N GLU 5.A O.A no hydrogen 2.937 N/A VAL 9.A N GLU 5.A O.B no hydrogen 2.781 N/A GLU 10.A N GLN 6.A O no hydrogen 3.017 N/A LYS 11.A N LYS 7.A O no hydrogen 2.825 N/A PHE 12.A N LEU 8.A O no hydrogen 2.876 N/A LEU 14.A N VAL 9.A O no hydrogen 3.231 N/A LYS 15.A N ASP 227.A O no hydrogen 2.755 N/A LYS 15.A NZ PRO 204.A O no hydrogen 3.220 N/A LYS 15.A NZ ASN 205.A OD1 no hydrogen 2.777 N/A ARG 16.A N.A ASP 227.A O no hydrogen 3.269 N/A ARG 16.A N.B ASP 227.A O no hydrogen 3.255 N/A ARG 16.A NE.B GLU 5.A OE2.B no hydrogen 3.426 N/A ARG 16.A NH1.A ASN 44.A OD1 no hydrogen 3.544 N/A ALA 17.A N GLU 5.A OE2.B no hydrogen 3.082 N/A LEU 18.A N LEU 229.A O no hydrogen 2.791 N/A ILE 19.A N GLU 5.A OE1.A no hydrogen 3.009 N/A SER 20.A N.A THR 231.A O.A no hydrogen 2.871 N/A SER 20.A N.A THR 231.A O.B no hydrogen 2.879 N/A SER 20.A N.B THR 231.A O.A no hydrogen 2.868 N/A SER 20.A N.B THR 231.A O.B no hydrogen 2.876 N/A SER 20.A OG.A THR 231.A O.A no hydrogen 3.206 N/A SER 20.A OG.A THR 231.A O.B no hydrogen 3.432 N/A SER 20.A OG.B LEU 21.A O no hydrogen 3.306 N/A GLN 23.A N GLN 29.A OE1 no hydrogen 2.785 N/A GLN 23.A NE2 LEU 21.A O no hydrogen 3.059 N/A GLU 28.A N ASN 25.A OD1 no hydrogen 2.907 N/A GLN 29.A N ASN 25.A O no hydrogen 2.861 N/A GLN 29.A NE2 LEU 21.A O no hydrogen 2.948 N/A ARG 30.A N.A THR 26.A O no hydrogen 2.817 N/A ARG 30.A N.B THR 26.A O no hydrogen 2.825 N/A ARG 30.A NE.B ASN 57.A OD1 no hydrogen 3.309 N/A LYS 31.A N ASN 27.A O.A no hydrogen 3.171 N/A LYS 31.A N ASN 27.A O.B no hydrogen 3.062 N/A GLN 32.A N GLU 28.A O no hydrogen 3.094 N/A VAL 33.A N GLN 29.A O no hydrogen 3.001 N/A ALA 34.A N ARG 30.A O.A no hydrogen 2.852 N/A ALA 34.A N ARG 30.A O.B no hydrogen 2.776 N/A ALA 35.A N LYS 31.A O no hydrogen 2.992 N/A LEU 36.A N VAL 33.A O no hydrogen 3.143 N/A VAL 37.A N VAL 33.A O no hydrogen 3.135 N/A SER 38.A N.A ALA 34.A O no hydrogen 2.848 N/A SER 38.A N.B ALA 34.A O no hydrogen 2.841 N/A SER 38.A OG.A TYR 98.A OH no hydrogen 3.316 N/A SER 38.A OG.B ALA 34.A O no hydrogen 2.768 N/A SER 38.A OG.B VAL 61.A O no hydrogen 3.479 N/A SER 39.A N ALA 35.A O no hydrogen 3.203 N/A TYR 40.A N LEU 36.A O no hydrogen 3.043 N/A LEU 41.A N VAL 37.A O no hydrogen 2.858 N/A ASN 42.A N SER 38.A O.A no hydrogen 2.842 N/A ASN 42.A N SER 38.A O.B no hydrogen 2.867 N/A ASN 43.A N SER 39.A O no hydrogen 3.067 N/A ASN 44.A N TYR 40.A O no hydrogen 3.003 N/A ASN 44.A N LEU 41.A O no hydrogen 3.192 N/A ASN 44.A ND2 TYR 40.A O no hydrogen 2.920 N/A LEU 45.A N LEU 41.A O no hydrogen 2.940 N/A GLN 46.A NE2 ASN 43.A O no hydrogen 3.480 N/A GLY 48.A N ASN 72.A O no hydrogen 2.892 N/A VAL 50.A N ARG 74.A O.A no hydrogen 2.807 N/A VAL 50.A N ARG 74.A O.B no hydrogen 2.877 N/A ALA 51.A N PHE 137.A O no hydrogen 2.854 N/A VAL 52.A N VAL 76.A O no hydrogen 2.852 N/A GLY 53.A N LEU 139.A O no hydrogen 2.934 N/A GLN 54.A N GLY 174.A O no hydrogen 3.184 N/A GLN 54.A NE2 TYR 110.A OH no hydrogen 2.885 N/A GLY 55.A N ILE 85.A O no hydrogen 2.990 N/A ALA 59.A N GLY 55.A O no hydrogen 2.965 N/A ALA 60.A N GLN 56.A O no hydrogen 3.121 N/A VAL 61.A N VAL 58.A O no hydrogen 2.968 N/A ASP 63.A N ALA 59.A O no hydrogen 2.995 N/A HIS 64.A N VAL 61.A O no hydrogen 3.399 N/A THR 69.A N ASN 42.A OD1 no hydrogen 2.883 N/A GLN 70.A NE2 VAL 68.A O no hydrogen 3.216 N/A GLN 70.A NE2 LYS 97.A O no hydrogen 3.068 N/A ARG 71.A N TYR 98.A O no hydrogen 2.774 N/A ARG 71.A NE THR 69.A O no hydrogen 2.933 N/A ARG 71.A NH1 LEU 41.A O no hydrogen 3.291 N/A ARG 71.A NH1 ASN 42.A O no hydrogen 3.145 N/A ARG 71.A NH1 LEU 45.A O no hydrogen 2.668 N/A ARG 71.A NH2 ASN 42.A O no hydrogen 3.102 N/A ARG 71.A NH2 ASN 42.A OD1 no hydrogen 2.808 N/A ARG 71.A NH2 THR 69.A O no hydrogen 2.757 N/A ALA 73.A N ARG 71.A O no hydrogen 2.984 N/A ARG 74.A NH1.B GLU 103.A OE1.A no hydrogen 2.386 N/A ARG 74.A NH1.B GLU 103.A OE2.A no hydrogen 2.580 N/A ARG 74.A NH1.B GLU 103.A OE2.B no hydrogen 3.373 N/A ARG 74.A NH2.A GLY 48.A O no hydrogen 3.009 N/A PHE 75.A N SER 101.A O no hydrogen 2.852 N/A VAL 76.A N VAL 50.A O no hydrogen 2.813 N/A SER 77.A N GLU 103.A O.A no hydrogen 3.073 N/A SER 77.A N GLU 103.A O.B no hydrogen 3.125 N/A ALA 78.A N VAL 52.A O no hydrogen 2.943 N/A GLY 80.A N ILE 194.A O no hydrogen 3.083 N/A GLY 81.A N ALA 107.A O no hydrogen 2.867 N/A THR 82.A N.A ASN 86.A OD1 no hydrogen 3.164 N/A THR 82.A N.B ASN 86.A OD1 no hydrogen 3.222 N/A THR 82.A OG1.A ASN 86.A OD1 no hydrogen 3.050 N/A ILE 90.A N ASN 86.A O no hydrogen 3.148 N/A CYS 91.A N ALA 87.A O no hydrogen 2.832 N/A CYS 91.A SG ALA 87.A O no hydrogen 3.368 N/A ARG 92.A N ASP 88.A O no hydrogen 2.989 N/A ARG 92.A NH1 ASP 88.A OD2 no hydrogen 2.943 N/A ARG 93.A N HIS 89.A O no hydrogen 3.039 N/A ARG 93.A NE ASP 63.A OD1 no hydrogen 2.864 N/A LEU 94.A N ILE 90.A O no hydrogen 2.835 N/A ALA 95.A N CYS 91.A O no hydrogen 2.800 N/A LYS 96.A N ARG 92.A O no hydrogen 3.102 N/A LYS 97.A N ARG 93.A O no hydrogen 3.000 N/A LYS 97.A NZ SER 38.A OG.A no hydrogen 2.699 N/A LYS 97.A NZ SER 38.A OG.B no hydrogen 3.060 N/A LYS 97.A NZ VAL 61.A O no hydrogen 2.883 N/A LYS 97.A NZ HIS 64.A O no hydrogen 3.139 N/A TYR 98.A N LEU 94.A O no hydrogen 2.894 N/A TYR 98.A OH SER 38.A O.A no hydrogen 2.984 N/A TYR 98.A OH SER 38.A O.B no hydrogen 2.959 N/A GLY 100.A N ALA 95.A O no hydrogen 3.003 N/A SER 101.A N ALA 73.A O no hydrogen 2.930 N/A GLU 103.A N.A PHE 75.A O no hydrogen 2.810 N/A GLU 103.A N.B PHE 75.A O no hydrogen 2.798 N/A THR 104.A OG1 ASP 88.A OD1 no hydrogen 2.769 N/A ALA 107.A N LEU 105.A O no hydrogen 2.963 N/A ALA 109.A N GLY 81.A O no hydrogen 2.767 N/A TYR 110.A OH HIS 149.A NE2 no hydrogen 2.573 N/A VAL 111.A N ARG 192.A O no hydrogen 2.914 N/A SER 115.A N ASP 113.A OD1.A no hydrogen 2.965 N/A LEU 116.A N ASP 113.A O.A no hydrogen 2.932 N/A LEU 116.A N ASP 113.A O.B no hydrogen 3.105 N/A LEU 116.A N ASP 113.A OD2.A no hydrogen 3.082 N/A ARG 117.A N ASP 113.A O.A no hydrogen 3.076 N/A ARG 117.A N ASP 113.A O.B no hydrogen 3.119 N/A ARG 117.A NE VAL 193.A O.A no hydrogen 3.006 N/A ARG 117.A NE VAL 193.A O.B no hydrogen 2.993 N/A SER 118.A N PRO 114.A O no hydrogen 2.893 N/A ALA 119.A N SER 115.A O no hydrogen 3.114 N/A PHE 120.A N LEU 116.A O no hydrogen 3.078 N/A HIS 122.A N PHE 120.A O no hydrogen 3.093 N/A THR 124.A N HIS 122.A ND1 no hydrogen 2.888 N/A LYS 126.A N HIS 122.A O no hydrogen 2.862 N/A GLU 127.A N ALA 123.A O no hydrogen 3.036 N/A THR 128.A OG1 GLU 103.A OE1.B no hydrogen 2.905 N/A THR 128.A OG1 THR 104.A O no hydrogen 3.408 N/A LEU 129.A N ILE 125.A O no hydrogen 3.011 N/A SER 130.A N.A LYS 126.A O no hydrogen 2.878 N/A SER 130.A N.B LYS 126.A O no hydrogen 2.893 N/A SER 130.A OG.B LYS 126.A O no hydrogen 3.287 N/A GLN 131.A N GLU 127.A O no hydrogen 3.033 N/A ALA 132.A N THR 128.A O no hydrogen 2.935 N/A ARG 133.A N LEU 129.A O no hydrogen 2.941 N/A ARG 133.A NE ASP 199.A OD1 no hydrogen 2.910 N/A LYS 134.A N SER 130.A O.A no hydrogen 3.209 N/A LYS 134.A N SER 130.A O.B no hydrogen 3.127 N/A ALA 135.A N ALA 132.A O no hydrogen 3.122 N/A GLU 136.A N GLU 136.A OE2 no hydrogen 2.803 N/A PHE 137.A N ALA 49.A O no hydrogen 3.262 N/A ALA 138.A N ASN 205.A O no hydrogen 2.939 N/A LEU 139.A N ALA 51.A O no hydrogen 2.848 N/A VAL 140.A N VAL 207.A O no hydrogen 2.937 N/A GLY 143.A N ASP 172.A O no hydrogen 2.827 N/A GLU 146.A N ASP 144.A O.A no hydrogen 2.703 N/A GLU 146.A N ASP 144.A O.B no hydrogen 3.091 N/A GLU 146.A N ASP 144.A OD2.A no hydrogen 2.961 N/A ASN 147.A ND2 ASP 144.A O.A no hydrogen 3.432 N/A ASN 147.A ND2 ASP 144.A O.B no hydrogen 3.039 N/A ASN 147.A ND2 ASP 172.A OD1 no hydrogen 2.645 N/A SER 148.A N ASP 145.A O.A no hydrogen 3.080 N/A SER 148.A OG ASP 145.A O.A no hydrogen 2.786 N/A SER 148.A OG ASP 145.A O.B no hydrogen 3.037 N/A HIS 149.A NE2 TYR 110.A OH no hydrogen 2.573 N/A LYS 151.A N SER 148.A O no hydrogen 2.937 N/A LEU 152.A N HIS 149.A O no hydrogen 2.775 N/A GLY 153.A N VAL 150.A O no hydrogen 2.875 N/A THR 156.A N GLU 159.A OE1 no hydrogen 3.130 N/A LYS 158.A NZ GLU 162.A OE1 no hydrogen 3.464 N/A LYS 158.A NZ GLU 162.A OE2 no hydrogen 2.823 N/A GLU 159.A N THR 156.A OG1 no hydrogen 2.831 N/A PHE 160.A N THR 156.A O no hydrogen 2.920 N/A VAL 161.A N PRO 157.A O no hydrogen 2.999 N/A GLU 162.A N LYS 158.A O no hydrogen 3.039 N/A ALA 163.A N GLU 159.A O no hydrogen 2.846 N/A ARG 164.A N PHE 160.A O no hydrogen 3.406 N/A LEU 165.A N VAL 161.A O no hydrogen 2.868 N/A ASN 166.A N GLU 162.A O no hydrogen 2.742 N/A ASP 167.A N GLU 162.A O no hydrogen 3.330 N/A ILE 169.A N ALA 163.A O no hydrogen 3.130 N/A VAL 170.A N PHE 179.A O no hydrogen 2.895 N/A ASP 172.A N GLY 143.A O no hydrogen 3.018 N/A ILE 173.A N ASP 177.A O no hydrogen 2.891 N/A GLY 174.A N GLY 141.A O no hydrogen 2.952 N/A GLY 175.A N ASP 172.A OD2 no hydrogen 2.885 N/A PHE 176.A N ILE 173.A O no hydrogen 3.241 N/A ASP 177.A N ILE 173.A O no hydrogen 3.423 N/A PHE 178.A N ASP 177.A OD1 no hydrogen 2.804 N/A PHE 179.A N GLY 171.A O no hydrogen 3.113 N/A LYS 180.A N THR 184.A O no hydrogen 3.114 N/A GLY 183.A N LYS 180.A O no hydrogen 2.990 N/A THR 184.A N ASP 182.A OD1 no hydrogen 3.034 N/A THR 184.A OG1 ASP 182.A OD1 no hydrogen 2.580 N/A ARG 190.A NE.B ASP 177.A OD1 no hydrogen 2.586 N/A ARG 190.A NH1.B ALA 186.A O no hydrogen 2.453 N/A ARG 190.A NH2.B ASP 177.A OD1 no hydrogen 2.910 N/A ARG 190.A NH2.B ALA 186.A O no hydrogen 2.948 N/A GLY 191.A N LEU 189.A O no hydrogen 3.057 N/A ARG 192.A NH1 PHE 154.A O no hydrogen 2.927 N/A ARG 192.A NH1 GLU 159.A OE1 no hydrogen 3.402 N/A ARG 192.A NH2 GLU 159.A OE2 no hydrogen 3.170 N/A VAL 193.A N.A ARG 190.A O.A no hydrogen 3.159 N/A VAL 193.A N.A ARG 190.A O.B no hydrogen 3.416 N/A VAL 193.A N.B ARG 190.A O.A no hydrogen 3.173 N/A VAL 193.A N.B ARG 190.A O.B no hydrogen 3.430 N/A ILE 194.A N ALA 109.A O no hydrogen 2.832 N/A LEU 196.A N ALA 78.A O no hydrogen 2.932 N/A GLU 197.A N ASP 199.A OD2 no hydrogen 2.887 N/A ASP 199.A N GLU 197.A O no hydrogen 2.960 N/A LEU 200.A N GLU 197.A O no hydrogen 3.274 N/A ARG 201.A NE GLU 198.A OE1 no hydrogen 3.357 N/A ARG 201.A NH1 THR 223.A O no hydrogen 2.739 N/A ARG 201.A NH2 THR 223.A O no hydrogen 3.045 N/A GLN 202.A N.A ASP 199.A O no hydrogen 3.123 N/A GLN 202.A N.B ASP 199.A O no hydrogen 3.105 N/A GLN 202.A NE2.A ARG 133.A O no hydrogen 2.724 N/A GLN 202.A NE2.A ASP 199.A O no hydrogen 2.801 N/A ILE 203.A N LEU 200.A O no hydrogen 3.203 N/A ASN 205.A ND2 GLU 136.A O no hydrogen 3.167 N/A VAL 206.A N ASP 227.A OD2 no hydrogen 2.832 N/A VAL 207.A N ALA 138.A O no hydrogen 2.801 N/A ALA 208.A N VAL 228.A O no hydrogen 2.838 N/A SER 210.A OG.B ASN 57.A OD1 no hydrogen 3.100 N/A ARG 213.A NH1.A ASP 144.A OD1.A no hydrogen 3.083 N/A LYS 214.A N GLU 211.A O no hydrogen 2.854 N/A LYS 214.A NZ GLU 146.A OE1 no hydrogen 2.629 N/A LYS 214.A NZ GLU 211.A OE1 no hydrogen 3.413 N/A LYS 214.A NZ GLU 211.A OE2 no hydrogen 2.677 N/A ALA 215.A N SER 212.A O no hydrogen 3.007 N/A SER 217.A OG ASP 144.A OD1.B no hydrogen 2.515 N/A SER 217.A OG VAL 170.A O no hydrogen 2.674 N/A ILE 218.A N LYS 214.A O no hydrogen 3.148 N/A ALA 220.A N SER 217.A O no hydrogen 2.976 N/A LEU 221.A N ILE 218.A O no hydrogen 2.927 N/A ARG 222.A NH1 LEU 181.A O no hydrogen 3.011 N/A THR 223.A N ALA 220.A O no hydrogen 3.122 N/A THR 223.A OG1 ALA 220.A O no hydrogen 2.702 N/A GLY 224.A N LEU 221.A O no hydrogen 3.133 N/A VAL 225.A N THR 223.A OG1 no hydrogen 3.160 N/A ASP 227.A N VAL 206.A O no hydrogen 2.912 N/A VAL 228.A N VAL 206.A O no hydrogen 2.882 N/A LEU 229.A N ARG 16.A O.A no hydrogen 3.021 N/A LEU 229.A N ARG 16.A O.B no hydrogen 3.248 N/A ALA 230.A N ALA 208.A O no hydrogen 2.906 N/A THR 231.A N.A LEU 18.A O no hydrogen 3.006 N/A THR 231.A N.B LEU 18.A O no hydrogen 2.999 N/A THR 231.A OG1.B ALA 209.A O no hydrogen 2.751 N/A VAL 233.A N SER 20.A O.A no hydrogen 2.864 N/A VAL 233.A N SER 20.A O.B no hydrogen 2.880 N/A SER 234.A N ASP 22.A OD1 no hydrogen 2.966 N/A SER 234.A OG ASP 22.A OD1 no hydrogen 3.470 N/A SER 234.A OG ASP 22.A OD2 no hydrogen 2.767 N/A CYS 235.A N SER 232.A OG no hydrogen 3.027 N/A CYS 235.A SG SER 232.A OG no hydrogen 3.430 N/A ALA 236.A N SER 232.A O no hydrogen 2.988 N/A LEU 238.A N CYS 235.A O no hydrogen 2.925 N/A LEU 239.A N ALA 236.A O no hydrogen 3.039 N/A LEU 241.A N ALA 237.A O no hydrogen 2.845 N/A ALA 242.A N LEU 238.A O no hydrogen 2.923 N/A GLU 243.A N LEU 239.A O no hydrogen 2.952 N/A ASN 244.A N ASN 240.A O no hydrogen 3.027 N/A ASN 244.A ND2 ASN 240.A O no hydrogen 2.928 N/A