Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jlj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 ALA 91.A O no hydrogen 2.627 N/A ARG 1.A NH2 ALA 91.A O no hydrogen 2.850 N/A LYS 3.A N PRO 94.A O no hydrogen 3.049 N/A LYS 4.A N ASP 145.A OD2 no hydrogen 2.776 N/A LYS 4.A NZ SER 141.A O no hydrogen 2.951 N/A LYS 4.A NZ GLU 143.A O no hydrogen 3.140 N/A ILE 5.A N LEU 96.A O no hydrogen 2.975 N/A SER 6.A N GLY 146.A O no hydrogen 3.136 N/A SER 6.A OG GLU 8.A OE1 no hydrogen 2.830 N/A ILE 7.A N PHE 98.A O no hydrogen 2.716 N/A GLU 8.A N ILE 148.A O no hydrogen 2.791 N/A ASN 10.A ND2 LEU 177.A O no hydrogen 3.159 N/A ILE 11.A N ASN 10.A OD1 no hydrogen 2.862 N/A ALA 13.A N ASN 10.A O no hydrogen 3.101 N/A LYS 15.A NZ GLY 9.A O no hydrogen 3.407 N/A LYS 15.A NZ ASN 10.A O no hydrogen 2.827 N/A PHE 18.A N GLY 14.A O no hydrogen 2.935 N/A VAL 19.A N LYS 15.A O no hydrogen 2.831 N/A ASN 20.A N SER 16.A O no hydrogen 3.000 N/A ILE 21.A N THR 17.A O no hydrogen 3.103 N/A LEU 22.A N PHE 18.A O no hydrogen 3.055 N/A LYS 23.A N VAL 19.A O no hydrogen 3.174 N/A LEU 25.A N LEU 22.A O no hydrogen 3.137 N/A ASP 28.A N SER 26.A OG no hydrogen 2.837 N/A TRP 29.A N SER 26.A O no hydrogen 3.300 N/A GLU 30.A N VAL 95.A O no hydrogen 3.237 N/A VAL 32.A N PHE 97.A O no hydrogen 3.065 N/A ARG 38.A N GLU 34.A O no hydrogen 3.428 N/A ARG 38.A NH1 GLU 46.A OE2 no hydrogen 3.005 N/A TRP 39.A N PRO 35.A O no hydrogen 2.949 N/A SER 40.A N VAL 36.A O no hydrogen 3.252 N/A SER 40.A OG VAL 36.A O no hydrogen 2.439 N/A ASN 41.A N TRP 39.A O no hydrogen 2.624 N/A GLU 46.A N THR 44.A OG1 no hydrogen 3.174 N/A GLN 47.A NE2 ARG 38.A O no hydrogen 2.635 N/A LYS 48.A N THR 44.A O no hydrogen 3.102 N/A ASN 49.A N MET 45.A O no hydrogen 3.116 N/A ASN 49.A ND2 TYR 71.A OH no hydrogen 3.367 N/A GLY 50.A N GLU 46.A O no hydrogen 2.562 N/A GLY 51.A N GLN 47.A O no hydrogen 2.432 N/A ASN 52.A N LYS 48.A O no hydrogen 3.182 N/A VAL 53.A N ASN 49.A O no hydrogen 3.309 N/A LEU 54.A N GLY 50.A O no hydrogen 3.213 N/A GLN 55.A N GLY 51.A O no hydrogen 3.306 N/A MET 56.A N ASN 52.A O no hydrogen 2.840 N/A MET 57.A N VAL 53.A O no hydrogen 2.735 N/A TYR 58.A N LEU 54.A O no hydrogen 3.239 N/A GLU 59.A N GLN 55.A O no hydrogen 3.411 N/A LYS 60.A N MET 56.A O no hydrogen 3.038 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.602 N/A ARG 63.A N LYS 60.A O no hydrogen 3.076 N/A ARG 63.A NH1 ARG 63.A O no hydrogen 3.135 N/A TRP 64.A N LYS 60.A O no hydrogen 3.153 N/A SER 65.A N PRO 61.A O no hydrogen 3.021 N/A SER 65.A OG PRO 61.A O no hydrogen 2.690 N/A PHE 68.A N TRP 64.A O no hydrogen 2.930 N/A GLN 69.A N SER 65.A O no hydrogen 2.718 N/A THR 70.A N PHE 66.A O no hydrogen 2.799 N/A THR 70.A OG1 PHE 66.A O no hydrogen 3.004 N/A THR 70.A OG1 THR 67.A O no hydrogen 2.679 N/A TYR 71.A N THR 67.A O no hydrogen 2.995 N/A ALA 72.A N PHE 68.A O no hydrogen 2.789 N/A CYS 73.A N GLN 69.A O no hydrogen 3.268 N/A CYS 73.A SG ASP 105.A OD2 no hydrogen 3.614 N/A LEU 74.A N THR 70.A O no hydrogen 3.282 N/A SER 75.A N TYR 71.A O no hydrogen 3.008 N/A SER 75.A OG TYR 71.A O no hydrogen 2.772 N/A ARG 76.A N ALA 72.A O no hydrogen 2.934 N/A ARG 76.A NE ASP 105.A OD1 no hydrogen 3.177 N/A ARG 76.A NE ASP 105.A OD2 no hydrogen 2.617 N/A ARG 76.A NH1 GLU 34.A OE1 no hydrogen 2.926 N/A ARG 76.A NH1 ASP 105.A OD1 no hydrogen 2.833 N/A ARG 76.A NH2 GLU 99.A O no hydrogen 2.605 N/A ILE 77.A N CYS 73.A O no hydrogen 2.980 N/A ARG 78.A N LEU 74.A O no hydrogen 2.944 N/A ALA 79.A N SER 75.A O no hydrogen 3.310 N/A GLN 80.A N ARG 76.A O no hydrogen 2.892 N/A LEU 81.A N ILE 77.A O no hydrogen 2.984 N/A ALA 82.A N ARG 78.A O no hydrogen 2.775 N/A SER 83.A N ALA 79.A O no hydrogen 3.121 N/A LEU 84.A N GLN 80.A O no hydrogen 3.284 N/A ASN 85.A N LEU 81.A O no hydrogen 2.966 N/A GLY 86.A N ALA 82.A O no hydrogen 3.166 N/A ALA 91.A N LEU 88.A O no hydrogen 3.076 N/A LYS 93.A N ASP 28.A OD2 no hydrogen 2.653 N/A VAL 95.A N ASP 28.A O no hydrogen 3.121 N/A LEU 96.A N LYS 3.A O no hydrogen 2.753 N/A PHE 97.A N GLU 30.A O no hydrogen 2.899 N/A PHE 98.A N ILE 5.A O no hydrogen 2.660 N/A GLU 99.A N VAL 32.A O no hydrogen 2.972 N/A ARG 100.A N ILE 7.A O no hydrogen 2.934 N/A ARG 100.A NH1 GLU 34.A OE2 no hydrogen 2.854 N/A ARG 100.A NH2 GLY 9.A O no hydrogen 2.850 N/A SER 101.A N SER 104.A OG no hydrogen 2.692 N/A SER 101.A OG GLU 8.A OE1 no hydrogen 2.431 N/A SER 101.A OG SER 104.A OG no hydrogen 3.314 N/A TYR 103.A OH TYR 199.A OH no hydrogen 2.353 N/A SER 104.A N SER 101.A OG no hydrogen 3.369 N/A SER 104.A OG GLU 8.A OE1 no hydrogen 2.896 N/A SER 104.A OG GLU 8.A OE2 no hydrogen 2.549 N/A SER 104.A OG SER 101.A O no hydrogen 3.278 N/A SER 104.A OG SER 101.A OG no hydrogen 3.314 N/A ASP 105.A N SER 101.A O no hydrogen 2.978 N/A ARG 106.A N VAL 102.A O no hydrogen 3.115 N/A ARG 106.A NH1 HIS 131.A ND1 no hydrogen 3.261 N/A ARG 106.A NH1 ASP 132.A OD1 no hydrogen 2.618 N/A TYR 107.A N TYR 103.A O no hydrogen 2.724 N/A ILE 108.A N SER 104.A O no hydrogen 3.010 N/A PHE 109.A N SER 104.A O no hydrogen 3.158 N/A ALA 110.A N ASP 105.A O no hydrogen 2.894 N/A SER 111.A N ARG 106.A O no hydrogen 2.968 N/A ASN 112.A N ILE 108.A O no hydrogen 3.170 N/A LEU 113.A N PHE 109.A O no hydrogen 3.147 N/A TYR 114.A N ALA 110.A O no hydrogen 3.139 N/A GLU 115.A N SER 111.A O no hydrogen 2.909 N/A SER 116.A N ASN 112.A O no hydrogen 3.074 N/A SER 116.A OG.A ASN 112.A O no hydrogen 3.460 N/A SER 116.A OG.B ASN 112.A O no hydrogen 3.474 N/A SER 116.A OG.B LEU 113.A O no hydrogen 3.445 N/A GLU 117.A N TYR 114.A O no hydrogen 3.168 N/A SER 118.A N LEU 113.A O no hydrogen 2.869 N/A ASN 120.A N GLU 123.A OE1 no hydrogen 2.747 N/A GLU 123.A N ASN 120.A OD1 no hydrogen 2.808 N/A TRP 124.A N ASN 120.A O no hydrogen 2.993 N/A THR 125.A N GLU 121.A O no hydrogen 2.916 N/A THR 125.A OG1 GLU 121.A O no hydrogen 3.453 N/A ILE 126.A N THR 122.A O no hydrogen 2.794 N/A TYR 127.A N GLU 123.A O no hydrogen 2.873 N/A GLN 128.A N TRP 124.A O no hydrogen 2.977 N/A GLN 128.A NE2 TRP 124.A O no hydrogen 3.354 N/A ASP 129.A N THR 125.A O no hydrogen 3.148 N/A TRP 130.A N ILE 126.A O no hydrogen 2.915 N/A HIS 131.A N TYR 127.A O no hydrogen 2.714 N/A HIS 131.A NE2 VAL 102.A O no hydrogen 2.902 N/A ASP 132.A N GLN 128.A O no hydrogen 2.880 N/A TRP 133.A N ASP 129.A O no hydrogen 2.991 N/A MET 134.A N TRP 130.A O no hydrogen 2.866 N/A ASN 135.A N HIS 131.A O no hydrogen 3.095 N/A ASN 135.A ND2 HIS 131.A O no hydrogen 3.003 N/A GLN 137.A N TRP 133.A O no hydrogen 2.828 N/A PHE 138.A N MET 134.A O no hydrogen 3.064 N/A GLY 139.A N ASN 135.A O no hydrogen 2.834 N/A LEU 142.A N GLY 139.A O no hydrogen 2.885 N/A GLU 143.A N GLN 140.A O no hydrogen 3.169 N/A LEU 144.A N TYR 199.A OH no hydrogen 3.082 N/A ASP 145.A N LYS 4.A O no hydrogen 2.680 N/A ILE 147.A N PRO 204.A O no hydrogen 2.938 N/A ILE 148.A N SER 6.A O no hydrogen 2.827 N/A TYR 149.A N LEU 206.A O no hydrogen 2.717 N/A TYR 149.A OH GLU 185.A OE2 no hydrogen 2.799 N/A LEU 150.A N GLU 8.A O no hydrogen 2.849 N/A GLN 151.A N LEU 208.A O no hydrogen 2.610 N/A THR 153.A N ASN 211.A OD1 no hydrogen 2.783 N/A THR 153.A OG1 THR 156.A OG1 no hydrogen 3.322 N/A GLU 155.A N GLU 155.A OE2 no hydrogen 2.545 N/A THR 156.A N THR 153.A OG1 no hydrogen 3.016 N/A THR 156.A OG1 THR 153.A OG1 no hydrogen 3.322 N/A CYS 157.A N THR 153.A O no hydrogen 3.319 N/A CYS 157.A SG ILE 11.A O no hydrogen 3.280 N/A CYS 157.A SG THR 153.A O no hydrogen 3.739 N/A LEU 158.A N PRO 154.A O no hydrogen 3.368 N/A HIS 159.A N GLU 155.A O no hydrogen 3.167 N/A ARG 160.A N THR 156.A O no hydrogen 2.774 N/A ARG 160.A NH1 ALA 13.A O no hydrogen 3.278 N/A ARG 160.A NH1 VAL 210.A O no hydrogen 2.397 N/A ARG 160.A NH2 VAL 210.A O no hydrogen 2.998 N/A ILE 161.A N CYS 157.A O no hydrogen 2.735 N/A TYR 162.A N LEU 158.A O no hydrogen 3.097 N/A LEU 163.A N HIS 159.A O no hydrogen 2.837 N/A ARG 164.A N ARG 160.A O no hydrogen 2.999 N/A ARG 164.A N ILE 161.A O no hydrogen 3.145 N/A ARG 164.A NE GLU 169.A OE1 no hydrogen 3.057 N/A ARG 164.A NH2 GLU 169.A OE1 no hydrogen 2.540 N/A GLY 165.A N TYR 162.A O no hydrogen 2.827 N/A ARG 166.A NH1 GLU 169.A OE2 no hydrogen 3.056 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.457 N/A GLU 169.A N ARG 166.A O no hydrogen 3.291 N/A GLN 170.A N ASN 167.A O no hydrogen 3.276 N/A GLN 170.A NE2 ILE 161.A O no hydrogen 3.660 N/A GLN 170.A NE2 ARG 166.A O no hydrogen 2.550 N/A ILE 172.A N GLU 169.A O no hydrogen 2.971 N/A LEU 177.A N PRO 173.A O no hydrogen 3.355 N/A GLU 178.A N LEU 174.A O no hydrogen 2.829 N/A LYS 179.A N GLU 175.A O no hydrogen 2.902 N/A LEU 180.A N TYR 176.A O no hydrogen 3.179 N/A HIS 181.A N LEU 177.A O no hydrogen 2.654 N/A TYR 182.A N GLU 178.A O no hydrogen 2.754 N/A LYS 183.A N LYS 179.A O no hydrogen 2.927 N/A LYS 183.A NZ SER 111.A OG no hydrogen 3.232 N/A LYS 183.A NZ GLU 115.A OE1 no hydrogen 2.275 N/A HIS 184.A N LEU 180.A O no hydrogen 2.986 N/A HIS 184.A ND1 LEU 180.A O no hydrogen 2.946 N/A GLU 185.A N HIS 181.A O no hydrogen 2.937 N/A SER 186.A N TYR 182.A O no hydrogen 3.086 N/A TRP 187.A N LYS 183.A O no hydrogen 3.265 N/A LEU 188.A N HIS 184.A O no hydrogen 2.818 N/A LEU 189.A N GLU 185.A O no hydrogen 3.120 N/A HIS 190.A N GLU 185.A O no hydrogen 2.981 N/A ARG 191.A NH2 VAL 203.A O no hydrogen 2.674 N/A THR 192.A OG1 SER 186.A O no hydrogen 2.891 N/A LEU 193.A N SER 186.A O no hydrogen 3.050 N/A ASN 196.A N TYR 107.A OH no hydrogen 3.118 N/A PHE 197.A N THR 195.A OG1 no hydrogen 2.880 N/A TYR 199.A OH TYR 103.A OH no hydrogen 2.353 N/A LEU 200.A N PHE 197.A O no hydrogen 2.741 N/A GLN 201.A N ASP 198.A O no hydrogen 3.122 N/A GLU 202.A N TYR 199.A O no hydrogen 3.351 N/A VAL 203.A N LEU 200.A O no hydrogen 2.595 N/A LEU 206.A N ILE 147.A O no hydrogen 2.691 N/A LEU 208.A N TYR 149.A O no hydrogen 2.828 N/A VAL 210.A N GLN 151.A O no hydrogen 2.935 N/A ASN 211.A N ASP 209.A OD2 no hydrogen 3.022 N/A ASN 211.A ND2 ASP 209.A OD1 no hydrogen 3.256 N/A LYS 217.A N PHE 214.A O no hydrogen 3.012 N/A LYS 217.A NZ GLU 212.A OE2 no hydrogen 3.133 N/A VAL 222.A N TYR 218.A O no hydrogen 3.027 N/A GLU 223.A N GLU 219.A O no hydrogen 2.881 N/A LYS 224.A N SER 220.A O no hydrogen 3.187 N/A VAL 225.A N LEU 221.A O no hydrogen 3.122 N/A LYS 226.A N VAL 222.A O no hydrogen 2.978 N/A GLU 227.A N GLU 223.A O no hydrogen 3.077 N/A PHE 228.A N LYS 224.A O no hydrogen 3.066 N/A LEU 229.A N VAL 225.A O no hydrogen 2.879 N/A SER 230.A N LYS 226.A O no hydrogen 3.241 N/A SER 230.A OG GLU 227.A O no hydrogen 2.833 N/A THR 231.A N GLU 227.A O no hydrogen 3.206 N/A THR 231.A OG1 PHE 228.A O no hydrogen 2.601 N/A LEU 232.A N LEU 229.A O no hydrogen 3.275 N/A