Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dr1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 8.A N SER 5.A OG no hydrogen 3.256 N/A GLN 8.A NE2 SER 5.A OG no hydrogen 2.921 N/A MET 9.A N SER 5.A O no hydrogen 3.095 N/A GLN 10.A N ASP 6.A O no hydrogen 2.980 N/A ILE 11.A N GLU 7.A O no hydrogen 3.160 N/A ILE 12.A N GLN 8.A O no hydrogen 3.092 N/A ASN 13.A N MET 9.A O no hydrogen 2.991 N/A SER 14.A N GLN 10.A O no hydrogen 3.095 N/A SER 14.A OG GLN 10.A O no hydrogen 3.313 N/A LEU 15.A N ILE 11.A O no hydrogen 2.977 N/A VAL 16.A N ILE 12.A O no hydrogen 3.007 N/A GLU 17.A N ASN 13.A O no hydrogen 2.987 N/A ALA 18.A N SER 14.A O no hydrogen 2.895 N/A HIS 19.A N LEU 15.A O no hydrogen 2.876 N/A HIS 19.A NE2 GLN 93.A OE1 no hydrogen 2.551 N/A HIS 20.A N VAL 16.A O no hydrogen 3.087 N/A HIS 20.A NE2 GLU 143.A OE1 no hydrogen 3.057 N/A HIS 20.A NE2 GLU 143.A OE2 no hydrogen 2.725 N/A LYS 21.A N GLU 17.A O no hydrogen 2.956 N/A LYS 21.A NZ GLU 17.A OE1 no hydrogen 3.360 N/A THR 22.A N HIS 19.A O no hydrogen 2.995 N/A THR 22.A OG1 ALA 18.A O no hydrogen 2.771 N/A THR 22.A OG1 HIS 19.A O no hydrogen 3.477 N/A TYR 23.A OH TYR 27.A OH no hydrogen 2.717 N/A SER 26.A N ASP 24.A OD1 no hydrogen 2.497 N/A SER 26.A OG ASP 24.A OD1 no hydrogen 2.611 N/A SER 26.A OG ASP 24.A OD2 no hydrogen 2.460 N/A SER 26.A OG SER 28.A OG no hydrogen 3.217 N/A TYR 27.A N ASP 24.A O no hydrogen 3.254 N/A TYR 27.A OH TYR 23.A OH no hydrogen 2.717 N/A SER 28.A N ASP 24.A OD2 no hydrogen 3.020 N/A SER 28.A N SER 26.A OG no hydrogen 3.277 N/A SER 28.A OG ASP 24.A OD2 no hydrogen 3.250 N/A SER 28.A OG SER 26.A OG no hydrogen 3.217 N/A PHE 30.A N TYR 27.A O no hydrogen 3.368 N/A ARG 32.A N ASP 29.A O no hydrogen 3.075 N/A PHE 33.A N PHE 30.A O no hydrogen 3.038 N/A ARG 34.A N ASP 48.A OD2 no hydrogen 2.830 N/A ARG 34.A NE ASP 48.A OD1 no hydrogen 3.462 N/A ARG 34.A NE ASP 48.A OD2 no hydrogen 3.048 N/A ARG 34.A NH1 GLN 227.A O no hydrogen 2.937 N/A ARG 34.A NH2 ASP 48.A OD1 no hydrogen 3.001 N/A ARG 34.A NH2 GLN 227.A O no hydrogen 2.670 N/A ARG 38.A NH1 LYS 110.A O no hydrogen 2.672 N/A SER 41.A N ARG 39.A O no hydrogen 2.916 N/A SER 41.A OG VAL 37.A O no hydrogen 2.772 N/A MET 42.A N LYS 118.A O no hydrogen 2.914 N/A LEU 43.A N LEU 40.A O no hydrogen 3.419 N/A HIS 45.A ND1 ARG 34.A O no hydrogen 2.735 N/A HIS 45.A NE2 TYR 111.A OH no hydrogen 2.710 N/A LEU 46.A N MET 42.A O no hydrogen 2.939 N/A ALA 47.A N LEU 43.A O no hydrogen 2.840 N/A ASP 48.A N PRO 44.A O no hydrogen 3.227 N/A LEU 49.A N HIS 45.A O no hydrogen 2.939 N/A VAL 50.A N LEU 46.A O no hydrogen 2.853 N/A SER 51.A N ALA 47.A O no hydrogen 2.911 N/A SER 51.A OG THR 229.A OG1 no hydrogen 2.775 N/A TYR 52.A N ASP 48.A O no hydrogen 3.019 N/A TYR 52.A OH ASP 29.A OD2 no hydrogen 2.706 N/A SER 53.A N LEU 49.A O no hydrogen 2.983 N/A SER 53.A OG LEU 49.A O no hydrogen 2.828 N/A ILE 54.A N VAL 50.A O no hydrogen 2.911 N/A GLN 55.A N SER 51.A O no hydrogen 3.172 N/A LYS 56.A N TYR 52.A O no hydrogen 3.051 N/A VAL 57.A N SER 53.A O no hydrogen 2.633 N/A ILE 58.A N ILE 54.A O no hydrogen 2.879 N/A GLY 59.A N GLN 55.A O no hydrogen 3.254 N/A PHE 60.A N LYS 56.A O no hydrogen 3.070 N/A ALA 61.A N VAL 57.A O no hydrogen 2.925 N/A LYS 62.A N ILE 58.A O no hydrogen 2.981 N/A MET 63.A N PHE 60.A O no hydrogen 2.772 N/A ILE 64.A N ALA 61.A O no hydrogen 2.927 N/A PHE 67.A N ILE 64.A O no hydrogen 3.181 N/A ASP 69.A N GLY 66.A O no hydrogen 2.961 N/A LEU 70.A N PHE 67.A O no hydrogen 2.909 N/A THR 71.A OG1 ASP 74.A OD2 no hydrogen 2.984 N/A ASP 74.A N THR 71.A OG1 no hydrogen 3.229 N/A GLN 75.A N THR 71.A O no hydrogen 2.907 N/A GLN 75.A NE2 LEU 70.A O no hydrogen 2.817 N/A ILE 76.A N ALA 72.A O no hydrogen 2.775 N/A ALA 77.A N GLU 73.A O no hydrogen 2.748 N/A LEU 78.A N ASP 74.A O no hydrogen 2.783 N/A LEU 79.A N GLN 75.A O no hydrogen 2.767 N/A LYS 80.A N ILE 76.A O no hydrogen 2.684 N/A LYS 80.A NZ GLY 237.A O no hydrogen 3.505 N/A SER 81.A N ALA 77.A O no hydrogen 3.085 N/A SER 81.A OG ALA 77.A O no hydrogen 2.668 N/A SER 81.A OG LEU 78.A O no hydrogen 3.274 N/A SER 82.A N LEU 78.A O no hydrogen 2.894 N/A SER 82.A OG LEU 78.A O no hydrogen 2.798 N/A ALA 83.A N LEU 79.A O no hydrogen 2.645 N/A GLU 85.A N SER 82.A O no hydrogen 2.626 N/A ILE 86.A N SER 82.A O no hydrogen 2.977 N/A ILE 87.A N ALA 83.A O no hydrogen 3.018 N/A MET 88.A N ILE 84.A O no hydrogen 3.125 N/A LEU 89.A N GLU 85.A O no hydrogen 2.939 N/A ARG 90.A N ILE 86.A O no hydrogen 2.955 N/A ARG 90.A NH2 THR 22.A O no hydrogen 2.657 N/A SER 91.A N ILE 87.A O no hydrogen 3.027 N/A SER 91.A OG MET 88.A O no hydrogen 2.584 N/A SER 91.A OG GLN 133.A OE1 no hydrogen 3.479 N/A ASN 92.A N LEU 89.A O no hydrogen 3.173 N/A ASN 92.A ND2 GLN 133.A O no hydrogen 2.986 N/A ASN 92.A ND2 GLN 133.A OE1 no hydrogen 3.376 N/A GLN 93.A N ARG 90.A O no hydrogen 3.192 N/A SER 94.A N SER 91.A O no hydrogen 2.721 N/A SER 94.A OG SER 91.A O no hydrogen 2.923 N/A PHE 95.A N SER 91.A O no hydrogen 3.154 N/A PHE 95.A N ASN 92.A O no hydrogen 2.944 N/A SER 96.A N SER 101.A O no hydrogen 2.595 N/A SER 96.A OG ASP 99.A OD2 no hydrogen 3.071 N/A SER 101.A N SER 96.A O no hydrogen 3.278 N/A SER 101.A OG ASP 99.A OD1 no hydrogen 2.375 N/A TRP 102.A N TYR 111.A O no hydrogen 3.182 N/A TRP 102.A NE1 SER 91.A OG no hydrogen 3.090 N/A SER 103.A N SER 94.A O no hydrogen 2.949 N/A CYS 104.A N PHE 109.A O no hydrogen 2.838 N/A LYS 110.A NZ SER 101.A OG no hydrogen 3.330 N/A TYR 111.A N TRP 102.A O no hydrogen 2.738 N/A TYR 111.A OH HIS 45.A NE2 no hydrogen 2.710 N/A CYS 112.A N ASP 115.A OD2 no hydrogen 2.595 N/A VAL 116.A N CYS 112.A O no hydrogen 3.452 N/A THR 117.A N ILE 113.A O no hydrogen 3.167 N/A THR 117.A N ASN 114.A O no hydrogen 2.921 N/A THR 117.A OG1 ILE 113.A O no hydrogen 3.067 N/A LYS 118.A N ASN 114.A O no hydrogen 3.196 N/A LYS 118.A N ASP 115.A O no hydrogen 2.856 N/A ALA 119.A N VAL 116.A O no hydrogen 3.165 N/A GLY 120.A N THR 117.A O no hydrogen 3.087 N/A HIS 121.A N VAL 116.A O no hydrogen 3.364 N/A HIS 121.A ND1 GLN 214.A OE1 no hydrogen 2.695 N/A THR 122.A N GLN 214.A OE1 no hydrogen 2.893 N/A GLU 124.A N THR 122.A OG1 no hydrogen 3.155 N/A LEU 125.A N THR 122.A O no hydrogen 3.014 N/A LEU 126.A N THR 122.A O no hydrogen 3.022 N/A GLU 127.A N LEU 123.A O no hydrogen 2.772 N/A LEU 129.A N LEU 125.A O no hydrogen 2.961 N/A VAL 130.A N LEU 126.A O no hydrogen 3.072 N/A LYS 131.A N GLU 127.A O no hydrogen 3.249 N/A PHE 132.A N PRO 128.A O no hydrogen 2.752 N/A GLN 133.A N LEU 129.A O no hydrogen 2.749 N/A GLN 133.A NE2 MET 88.A O no hydrogen 3.083 N/A VAL 134.A N VAL 130.A O no hydrogen 2.759 N/A GLY 135.A N LYS 131.A O no hydrogen 2.999 N/A LEU 136.A N PHE 132.A O no hydrogen 2.865 N/A LYS 137.A N GLN 133.A O no hydrogen 2.862 N/A LYS 137.A NZ ASN 92.A O no hydrogen 3.087 N/A LYS 137.A NZ PHE 95.A O no hydrogen 2.831 N/A LYS 138.A N VAL 134.A O no hydrogen 2.973 N/A LEU 139.A N LEU 136.A O no hydrogen 3.116 N/A LYS 140.A N LYS 137.A O no hydrogen 2.960 N/A HIS 142.A N GLU 145.A OE1 no hydrogen 2.711 N/A HIS 142.A ND1 TYR 182.A OH no hydrogen 2.763 N/A GLU 144.A N GLU 144.A OE1 no hydrogen 2.656 N/A HIS 146.A N HIS 142.A O no hydrogen 2.921 N/A VAL 147.A N GLU 143.A O no hydrogen 2.906 N/A LEU 148.A N GLU 144.A O no hydrogen 3.206 N/A LEU 149.A N GLU 145.A O no hydrogen 3.044 N/A MET 150.A N HIS 146.A O no hydrogen 3.364 N/A ALA 151.A N VAL 147.A O no hydrogen 3.074 N/A ILE 152.A N LEU 148.A O no hydrogen 2.751 N/A CYS 153.A N LEU 149.A O no hydrogen 2.941 N/A CYS 153.A SG GLU 85.A OE2 no hydrogen 3.168 N/A LEU 154.A N MET 150.A O no hydrogen 3.110 N/A LEU 155.A N ALA 151.A O no hydrogen 3.340 N/A SER 156.A OG CYS 153.A O no hydrogen 2.704 N/A ARG 159.A N PRO 157.A O no hydrogen 2.860 N/A ARG 159.A NH1 GLU 85.A OE1 no hydrogen 3.200 N/A ARG 159.A NH1 GLU 85.A OE2 no hydrogen 3.015 N/A ARG 159.A NH2 GLU 85.A OE2 no hydrogen 2.769 N/A ARG 159.A NH2 CYS 153.A O no hydrogen 2.580 N/A VAL 162.A N ARG 159.A O no hydrogen 3.110 N/A GLN 163.A N ASP 74.A OD1 no hydrogen 2.605 N/A HIS 165.A N GLN 163.A O no hydrogen 2.391 N/A VAL 166.A N ASP 164.A OD1 no hydrogen 3.250 N/A ARG 167.A N ASP 164.A OD1 no hydrogen 2.834 N/A ALA 170.A N VAL 166.A O no hydrogen 3.116 N/A LEU 171.A N ARG 167.A O no hydrogen 3.186 N/A GLN 172.A N ILE 168.A O no hydrogen 3.017 N/A GLN 172.A NE2 ILE 152.A O no hydrogen 3.177 N/A ASP 173.A N GLU 169.A O no hydrogen 3.139 N/A ARG 174.A N ALA 170.A O no hydrogen 2.927 N/A LEU 175.A N LEU 171.A O no hydrogen 3.101 N/A CYS 176.A N GLN 172.A O no hydrogen 2.828 N/A CYS 176.A SG GLN 172.A O no hydrogen 3.277 N/A ASP 177.A N ASP 173.A O no hydrogen 2.996 N/A ASP 177.A N ARG 174.A O no hydrogen 3.243 N/A VAL 178.A N ARG 174.A O no hydrogen 3.293 N/A LEU 179.A N LEU 175.A O no hydrogen 3.000 N/A GLN 180.A N CYS 176.A O no hydrogen 2.992 N/A ALA 181.A N ASP 177.A O no hydrogen 2.695 N/A TYR 182.A N VAL 178.A O no hydrogen 2.868 N/A TYR 182.A OH HIS 142.A ND1 no hydrogen 2.763 N/A ILE 183.A N LEU 179.A O no hydrogen 3.060 N/A ARG 184.A N GLN 180.A O no hydrogen 3.127 N/A ILE 185.A N ALA 181.A O no hydrogen 2.912 N/A GLN 186.A N TYR 182.A O no hydrogen 2.637 N/A HIS 187.A N ILE 183.A O no hydrogen 3.172 N/A GLY 190.A N HIS 187.A O no hydrogen 3.078 N/A LYS 196.A N LEU 192.A O no hydrogen 3.003 N/A MET 197.A N LEU 193.A O no hydrogen 2.739 N/A ILE 198.A N TYR 194.A O no hydrogen 2.951 N/A GLN 199.A N ALA 195.A O no hydrogen 3.031 N/A LYS 200.A N LYS 196.A O no hydrogen 3.230 N/A LEU 201.A N MET 197.A O no hydrogen 3.356 N/A ALA 202.A N ILE 198.A O no hydrogen 3.443 N/A ASP 203.A N GLN 199.A O no hydrogen 3.081 N/A LEU 204.A N LYS 200.A O no hydrogen 2.935 N/A LEU 204.A N LEU 201.A O no hydrogen 3.070 N/A ARG 205.A N LEU 201.A O no hydrogen 3.343 N/A ARG 205.A N ALA 202.A O no hydrogen 3.257 N/A ARG 205.A NH1 ASP 158.A O no hydrogen 3.478 N/A ARG 205.A NH2 ASP 158.A OD1 no hydrogen 2.424 N/A LEU 207.A N ASP 203.A O no hydrogen 3.248 N/A ASN 208.A N LEU 204.A O no hydrogen 2.691 N/A ASN 208.A ND2 SER 81.A O no hydrogen 2.803 N/A ASN 208.A ND2 GLU 85.A OE1 no hydrogen 3.086 N/A GLU 209.A N ARG 205.A O no hydrogen 2.832 N/A GLU 210.A N SER 206.A O no hydrogen 2.944 N/A HIS 211.A N LEU 207.A O no hydrogen 2.886 N/A SER 212.A N ASN 208.A O no hydrogen 2.765 N/A SER 212.A OG ASN 208.A O no hydrogen 3.122 N/A SER 212.A OG ASN 208.A OD1 no hydrogen 3.220 N/A LYS 213.A N GLU 209.A O no hydrogen 3.088 N/A GLN 214.A N GLU 210.A O no hydrogen 2.946 N/A GLN 214.A NE2 GLU 210.A OE2 no hydrogen 2.805 N/A TYR 215.A N HIS 211.A O no hydrogen 2.636 N/A ARG 216.A N SER 212.A O no hydrogen 2.840 N/A SER 217.A N LYS 213.A O no hydrogen 3.271 N/A SER 217.A OG LYS 213.A O no hydrogen 2.803 N/A LEU 218.A N GLN 214.A O no hydrogen 3.346 N/A SER 219.A N TYR 215.A O no hydrogen 2.685 N/A PHE 220.A N ARG 216.A O no hydrogen 3.050 N/A GLN 221.A N LEU 218.A O no hydrogen 3.106 N/A GLU 223.A N GLU 223.A OE1 no hydrogen 2.628 N/A HIS 224.A N GLN 221.A O no hydrogen 2.779 N/A SER 225.A N GLN 221.A O no hydrogen 2.873 N/A SER 225.A OG PRO 222.A O no hydrogen 3.395 N/A MET 226.A N PRO 222.A O no hydrogen 3.051 N/A GLN 227.A N HIS 224.A O no hydrogen 2.832 N/A LEU 228.A N SER 225.A O no hydrogen 3.137 N/A THR 229.A OG1 SER 51.A OG no hydrogen 2.775 N/A VAL 232.A N THR 229.A OG1 no hydrogen 3.329 N/A LEU 233.A N THR 229.A O no hydrogen 2.999 N/A GLU 234.A N PRO 230.A O no hydrogen 2.944 N/A VAL 235.A N LEU 231.A O no hydrogen 2.821 N/A PHE 236.A N VAL 232.A O no hydrogen 2.922 N/A