Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4irj_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASN 23.A O no hydrogen 2.829 N/A THR 4.A OG1 ASN 23.A O no hydrogen 3.398 N/A GLN 5.A NE2 TYR 88.A O no hydrogen 2.669 N/A GLN 5.A NE2 THR 105.A OG1 no hydrogen 2.988 N/A SER 6.A N SER 21.A O no hydrogen 3.084 N/A ARG 8.A NE GLY 104.A O no hydrogen 3.023 N/A ARG 8.A NH2 PRO 103.A O no hydrogen 3.562 N/A LYS 10.A N ARG 106.A O no hydrogen 2.939 N/A ALA 12.A N LEU 108.A O no hydrogen 2.977 N/A THR 14.A N LEU 110.A O no hydrogen 2.856 N/A THR 14.A OG1 LEU 110.A O no hydrogen 3.158 N/A GLY 15.A N ALA 80.A O no hydrogen 3.053 N/A GLY 16.A N VAL 13.A O no hydrogen 2.887 N/A VAL 18.A N LEU 77.A O no hydrogen 2.930 N/A LEU 20.A N LEU 75.A O no hydrogen 2.722 N/A SER 21.A N SER 6.A O no hydrogen 3.090 N/A SER 21.A OG SER 74.A OG no hydrogen 2.853 N/A CYS 22.A SG THR 4.A O no hydrogen 3.502 N/A ASN 23.A N THR 4.A O no hydrogen 3.028 N/A GLN 24.A N GLU 71.A O no hydrogen 2.864 N/A ASN 26.A ND2 ALA 2.A O no hydrogen 3.453 N/A HIS 28.A ND1 SER 92.A OG no hydrogen 2.847 N/A ASN 30.A N GLY 93.A O no hydrogen 3.229 N/A ASN 30.A ND2 ASP 94.A O no hydrogen 2.631 N/A MET 31.A N SER 48.A O no hydrogen 2.880 N/A TYR 32.A N ALA 91.A O no hydrogen 2.799 N/A TRP 33.A N HIS 46.A O no hydrogen 2.978 N/A TRP 33.A NE1 PHE 73.A O no hydrogen 3.088 N/A TYR 34.A N PHE 89.A O no hydrogen 2.594 N/A TYR 34.A OH GLN 99.A OE1 no hydrogen 2.699 N/A ARG 35.A N ARG 43.A O no hydrogen 3.015 N/A ARG 35.A NE ASP 37.A OD2 no hydrogen 2.754 N/A ARG 35.A NE SER 86.A OG no hydrogen 3.191 N/A ARG 35.A NH1 SER 83.A O no hydrogen 3.029 N/A ARG 35.A NH2 ASP 37.A OD1 no hydrogen 3.280 N/A ARG 35.A NH2 SER 83.A O no hydrogen 2.677 N/A GLN 36.A N VAL 87.A O no hydrogen 2.819 N/A HIS 40.A N ASP 37.A O no hydrogen 2.776 N/A ARG 43.A N ARG 35.A O no hydrogen 3.200 N/A ILE 45.A N TRP 33.A O no hydrogen 2.826 N/A HIS 46.A ND1 GLU 55.A O no hydrogen 3.253 N/A HIS 46.A NE2 TYR 63.A O no hydrogen 2.946 N/A TYR 47.A N GLU 55.A O no hydrogen 2.831 N/A SER 48.A N MET 31.A O no hydrogen 2.791 N/A SER 48.A OG SER 53.A O no hydrogen 2.486 N/A GLY 52.A N ARG 67.A O no hydrogen 2.844 N/A SER 53.A N GLY 50.A O no hydrogen 2.871 N/A SER 53.A OG GLU 55.A OE2 no hydrogen 3.452 N/A GLU 55.A N TYR 47.A O no hydrogen 2.585 N/A GLY 57.A N ILE 45.A O no hydrogen 2.838 N/A ASP 58.A N LEU 44.A O no hydrogen 2.725 N/A ILE 59.A N LEU 44.A O no hydrogen 3.141 N/A TYR 63.A N PRO 60.A O no hydrogen 3.046 N/A TYR 63.A OH TYR 88.A OH no hydrogen 2.709 N/A LYS 64.A N ILE 76.A O no hydrogen 3.082 N/A SER 66.A N SER 74.A O no hydrogen 2.966 N/A ARG 67.A NE SER 69.A O no hydrogen 2.978 N/A ARG 67.A NH1 ASN 29.A O no hydrogen 2.947 N/A ARG 67.A NH1 SER 48.A OG no hydrogen 2.962 N/A ARG 67.A NH2 HIS 28.A O no hydrogen 3.134 N/A ARG 67.A NH2 ASN 29.A O no hydrogen 3.189 N/A ARG 67.A NH2 GLN 70.A O no hydrogen 3.074 N/A GLN 70.A NE2 ASN 29.A OD1 no hydrogen 2.756 N/A GLU 71.A N SER 69.A OG no hydrogen 3.278 N/A ASN 72.A N SER 69.A O no hydrogen 3.380 N/A PHE 73.A N CYS 22.A O no hydrogen 2.960 N/A SER 74.A N SER 66.A O no hydrogen 2.930 N/A SER 74.A OG LEU 20.A O no hydrogen 3.292 N/A SER 74.A OG SER 21.A OG no hydrogen 2.853 N/A LEU 75.A N LEU 20.A O no hydrogen 2.681 N/A ILE 76.A N LYS 64.A O no hydrogen 2.830 N/A LEU 77.A N VAL 18.A O no hydrogen 2.714 N/A ALA 80.A N GLY 16.A O no hydrogen 2.832 N/A THR 81.A OG1 LEU 79.A O no hydrogen 3.130 N/A GLN 84.A N THR 81.A O no hydrogen 2.686 N/A GLN 84.A NE2 GLY 62.A O no hydrogen 3.026 N/A THR 85.A N PRO 82.A O no hydrogen 3.113 N/A THR 85.A OG1 PRO 82.A O no hydrogen 2.935 N/A SER 86.A N LEU 107.A O no hydrogen 3.102 N/A SER 86.A OG GLN 36.A O no hydrogen 2.955 N/A SER 86.A OG ASP 37.A OD1 no hydrogen 2.578 N/A VAL 87.A N GLN 36.A O no hydrogen 3.420 N/A TYR 88.A N THR 105.A O no hydrogen 2.744 N/A TYR 88.A OH TYR 63.A OH no hydrogen 2.709 N/A TYR 88.A OH GLN 84.A O no hydrogen 2.410 N/A PHE 89.A N TYR 34.A O no hydrogen 2.835 N/A CYS 90.A N GLN 5.A OE1 no hydrogen 3.413 N/A CYS 90.A SG TYR 32.A O no hydrogen 3.635 N/A ALA 91.A N TYR 32.A O no hydrogen 2.924 N/A SER 92.A N TYR 100.A O no hydrogen 3.077 N/A SER 92.A OG HIS 28.A ND1 no hydrogen 2.847 N/A GLY 93.A N ASN 30.A O no hydrogen 2.920 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.713 N/A GLY 96.A N ASP 94.A OD1 no hydrogen 2.635 N/A TYR 100.A N SER 92.A O no hydrogen 2.803 N/A GLY 102.A N CYS 90.A O no hydrogen 2.571 N/A GLY 104.A N GLN 5.A OE1 no hydrogen 2.860 N/A THR 105.A N TYR 88.A O no hydrogen 2.980 N/A THR 105.A OG1 PRO 7.A O no hydrogen 2.840 N/A ARG 106.A N ARG 8.A O no hydrogen 2.995 N/A LEU 107.A N SER 86.A O no hydrogen 2.867 N/A LEU 108.A N LYS 10.A O no hydrogen 2.886 N/A VAL 109.A N THR 85.A OG1 no hydrogen 2.798 N/A LEU 110.A N ALA 12.A O no hydrogen 2.935 N/A ARG 114.A N ASP 112.A OD1 no hydrogen 3.334 N/A ARG 114.A NE ASP 112.A OD2 no hydrogen 2.972 N/A VAL 116.A N LEU 113.A O no hydrogen 3.118 N/A THR 117.A N TYR 147.A O no hydrogen 2.899 N/A THR 117.A OG1 ASN 115.A O no hydrogen 2.919 N/A LYS 120.A N THR 144.A O no hydrogen 2.745 N/A SER 122.A N LEU 142.A O no hydrogen 2.968 N/A PHE 124.A N VAL 140.A O no hydrogen 2.581 N/A GLU 130.A N SER 127.A OG no hydrogen 3.028 N/A ILE 131.A N SER 127.A O no hydrogen 2.943 N/A SER 132.A N LYS 128.A O no hydrogen 3.236 N/A SER 132.A OG LYS 128.A O no hydrogen 3.321 N/A SER 132.A OG ALA 129.A O no hydrogen 3.032 N/A HIS 133.A N ALA 129.A O no hydrogen 3.237 N/A HIS 133.A N GLU 130.A O no hydrogen 3.001 N/A THR 134.A N GLU 130.A O no hydrogen 2.878 N/A THR 134.A OG1 GLU 130.A O no hydrogen 2.690 N/A THR 134.A OG1 LYS 136.A O no hydrogen 3.292 N/A GLN 135.A N ILE 131.A O no hydrogen 2.817 N/A LYS 136.A N THR 134.A OG1 no hydrogen 3.141 N/A ALA 137.A N VAL 192.A O no hydrogen 2.791 N/A THR 138.A N GLU 130.A OE1 no hydrogen 2.988 N/A THR 138.A OG1 GLU 130.A OE1 no hydrogen 3.339 N/A THR 138.A OG1 GLU 130.A OE2 no hydrogen 2.523 N/A LEU 139.A N LEU 190.A O no hydrogen 2.924 N/A VAL 140.A N PHE 124.A O no hydrogen 2.996 N/A CYS 141.A N SER 188.A O no hydrogen 2.919 N/A CYS 141.A SG SER 122.A O no hydrogen 3.729 N/A LEU 142.A N SER 122.A O no hydrogen 2.877 N/A ALA 143.A N LEU 186.A O no hydrogen 2.825 N/A THR 144.A N LYS 120.A O no hydrogen 2.961 N/A GLY 145.A N GLU 175.A OE2 no hydrogen 2.929 N/A GLY 145.A N TYR 184.A O no hydrogen 2.996 N/A TYR 147.A N THR 117.A O no hydrogen 3.002 N/A HIS 150.A ND1 ASN 9.A OD1 no hydrogen 2.603 N/A VAL 151.A N ASP 149.A O no hydrogen 3.143 N/A GLU 152.A N GLN 209.A O no hydrogen 3.020 N/A SER 154.A N GLN 207.A O no hydrogen 2.711 N/A SER 154.A OG GLN 207.A O no hydrogen 3.406 N/A TRP 155.A NE1 SER 188.A OG no hydrogen 3.049 N/A TRP 156.A N ARG 205.A O no hydrogen 2.798 N/A TRP 156.A NE1 SER 154.A OG no hydrogen 3.023 N/A VAL 157.A N LYS 160.A O no hydrogen 2.777 N/A ASN 158.A N HIS 203.A O no hydrogen 2.934 N/A ASN 158.A ND2 ASN 202.A OD1 no hydrogen 2.957 N/A LYS 160.A N VAL 157.A O no hydrogen 3.252 N/A VAL 162.A N TRP 155.A O no hydrogen 2.904 N/A CYS 167.A N ARG 189.A O no hydrogen 3.146 N/A THR 168.A OG1 SER 188.A OG no hydrogen 2.906 N/A ASP 169.A N SER 187.A O no hydrogen 3.258 N/A LEU 173.A N SER 185.A O no hydrogen 2.957 N/A GLU 175.A N ARG 183.A O no hydrogen 2.874 N/A ASP 181.A N ASN 180.A OD1 no hydrogen 2.938 N/A SER 182.A OG ARG 183.A O no hydrogen 2.887 N/A TYR 184.A N PHE 146.A O no hydrogen 2.874 N/A SER 185.A N LEU 173.A O no hydrogen 2.719 N/A SER 185.A OG GLU 175.A OE2 no hydrogen 2.652 N/A LEU 186.A N ALA 143.A O no hydrogen 2.815 N/A SER 187.A N ASP 169.A OD2 no hydrogen 3.122 N/A SER 187.A OG ASP 169.A OD1 no hydrogen 3.068 N/A SER 187.A OG ASP 169.A OD2 no hydrogen 2.602 N/A SER 188.A N CYS 141.A O no hydrogen 2.885 N/A SER 188.A OG CYS 167.A O no hydrogen 2.996 N/A SER 188.A OG THR 168.A OG1 no hydrogen 2.906 N/A ARG 189.A N CYS 167.A O no hydrogen 2.830 N/A ARG 189.A NH1 SER 187.A OG no hydrogen 2.627 N/A LEU 190.A N LEU 139.A O no hydrogen 3.110 N/A ARG 191.A N GLY 165.A O no hydrogen 2.912 N/A ARG 191.A NE GLU 130.A OE2 no hydrogen 3.294 N/A ARG 191.A NH1 GLU 130.A OE2 no hydrogen 3.337 N/A VAL 192.A N ALA 137.A O no hydrogen 2.933 N/A SER 193.A OG THR 195.A OG1 no hydrogen 3.242 N/A ALA 194.A N GLN 135.A O no hydrogen 3.056 N/A THR 195.A OG1 SER 193.A OG no hydrogen 3.242 N/A PHE 196.A N SER 193.A O no hydrogen 2.765 N/A PHE 196.A N SER 193.A OG no hydrogen 3.355 N/A TRP 197.A N SER 193.A O no hydrogen 3.198 N/A GLN 198.A N ALA 194.A O no hydrogen 2.872 N/A ARG 201.A N ASN 199.A OD1 no hydrogen 3.312 N/A ASN 202.A N ASN 199.A O no hydrogen 3.033 N/A ASN 202.A ND2 PHE 196.A O no hydrogen 3.042 N/A HIS 203.A N ASN 158.A OD1 no hydrogen 2.755 N/A PHE 204.A N ALA 235.A O no hydrogen 2.812 N/A ARG 205.A N TRP 156.A O no hydrogen 2.886 N/A ARG 205.A NH2 SER 232.A OG no hydrogen 3.098 N/A CYS 206.A N ALA 233.A O no hydrogen 2.852 N/A GLN 207.A N SER 154.A O no hydrogen 2.842 N/A VAL 208.A N VAL 231.A O no hydrogen 2.974 N/A GLN 209.A N GLU 152.A O no hydrogen 2.919 N/A PHE 210.A N GLN 229.A O no hydrogen 2.825 N/A TYR 211.A N HIS 150.A O no hydrogen 2.997 N/A TYR 211.A OH GLU 152.A OE1 no hydrogen 3.116 N/A GLY 212.A N THR 228.A OG1 no hydrogen 3.274 N/A LEU 213.A N PRO 226.A O no hydrogen 3.056 N/A SER 214.A N ASP 217.A OD2 no hydrogen 2.657 N/A ASN 216.A N SER 214.A OG no hydrogen 3.031 N/A ASP 217.A N SER 214.A O no hydrogen 2.932 N/A TRP 219.A NE1 ARG 223.A O no hydrogen 2.816 N/A GLN 221.A NE2 ARG 114.A O no hydrogen 3.097 N/A ARG 223.A NE GLN 221.A OE1 no hydrogen 3.260 N/A ARG 223.A NH1 VAL 116.A O no hydrogen 2.835 N/A ARG 223.A NH2 ARG 114.A O no hydrogen 2.954 N/A ARG 223.A NH2 VAL 116.A O no hydrogen 2.730 N/A LYS 225.A NZ SER 214.A O no hydrogen 3.294 N/A LYS 225.A NZ ASP 217.A O no hydrogen 2.735 N/A VAL 227.A N LYS 225.A O no hydrogen 2.513 N/A THR 228.A N LEU 213.A O no hydrogen 2.970 N/A THR 228.A OG1 LEU 213.A O no hydrogen 3.051 N/A GLN 229.A N PHE 210.A O no hydrogen 3.059 N/A VAL 231.A N VAL 208.A O no hydrogen 3.060 N/A ALA 233.A N CYS 206.A O no hydrogen 2.951 N/A ALA 235.A N PHE 204.A O no hydrogen 2.911 N/A GLY 237.A N ASN 202.A O no hydrogen 2.970 N/A ARG 238.A N TRP 197.A O no hydrogen 3.134 N/A ARG 238.A NE TRP 236.A O no hydrogen 3.050 N/A ARG 238.A NH2 TRP 236.A O no hydrogen 2.890 N/A