Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1icu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 1.A O no hydrogen 3.284 N/A ALA 6.A N ILE 2.A O no hydrogen 2.969 N/A LEU 7.A N ILE 3.A O no hydrogen 2.931 N/A LYS 8.A N SER 4.A O no hydrogen 2.914 N/A ARG 9.A N VAL 5.A O no hydrogen 3.037 N/A HIS 10.A NE2 ASP 197.A OD2 no hydrogen 2.583 N/A THR 12.A N ALA 160.A O no hydrogen 3.069 N/A LYS 13.A N ASP 197.A OD1 no hydrogen 2.921 N/A ASP 16.A N HIS 192.A O no hydrogen 2.849 N/A SER 18.A N ASP 16.A OD1 no hydrogen 2.875 N/A SER 18.A OG ASP 16.A OD1 no hydrogen 2.640 N/A LYS 19.A N ASP 16.A O no hydrogen 2.959 N/A LYS 20.A NZ ALA 17.A O no hydrogen 3.306 N/A LEU 21.A N SER 78.A OG no hydrogen 2.966 N/A THR 22.A N GLN 25.A OE1 no hydrogen 2.913 N/A GLN 25.A N THR 22.A OG1 no hydrogen 3.082 N/A GLN 25.A NE2 LEU 156.A O no hydrogen 3.622 N/A ALA 26.A N THR 22.A O no hydrogen 2.956 N/A GLU 27.A N PRO 23.A O no hydrogen 3.128 N/A GLU 27.A N GLU 24.A O no hydrogen 2.946 N/A GLN 28.A N GLU 24.A O no hydrogen 2.798 N/A ILE 29.A N GLN 25.A O no hydrogen 2.935 N/A LYS 30.A N GLU 27.A O no hydrogen 3.191 N/A LYS 30.A NZ GLU 27.A OE1 no hydrogen 3.171 N/A LYS 30.A NZ GLU 27.A OE2 no hydrogen 3.062 N/A THR 31.A N GLU 27.A O no hydrogen 3.269 N/A THR 31.A OG1 GLU 27.A O no hydrogen 3.298 N/A LEU 32.A N GLN 28.A O no hydrogen 3.171 N/A LEU 33.A N ILE 29.A O no hydrogen 3.203 N/A GLN 34.A N LYS 30.A O no hydrogen 3.039 N/A TYR 35.A N THR 31.A O no hydrogen 2.912 N/A SER 36.A OG PRO 37.A O no hydrogen 3.085 N/A SER 39.A N GLN 141.A OE1 no hydrogen 2.922 N/A THR 40.A OG1 SER 39.A O no hydrogen 2.548 N/A ASN 41.A N SER 38.A O no hydrogen 2.805 N/A ASN 41.A ND2 GLU 101.A OE1 no hydrogen 2.839 N/A SER 42.A N SER 39.A O no hydrogen 2.905 N/A SER 42.A OG SER 39.A O no hydrogen 2.669 N/A GLN 43.A N SER 38.A OG no hydrogen 2.962 N/A TRP 45.A N GLN 43.A O no hydrogen 2.860 N/A HIS 46.A N CYS 84.A O no hydrogen 3.064 N/A ILE 48.A N VAL 82.A O no hydrogen 3.079 N/A ALA 50.A N VAL 80.A O no hydrogen 2.765 N/A GLU 54.A N GLU 54.A OE1 no hydrogen 2.524 N/A GLY 55.A N THR 52.A OG1 no hydrogen 2.874 N/A LYS 56.A N THR 52.A O no hydrogen 2.938 N/A LYS 56.A NZ GLU 53.A OE2 no hydrogen 3.130 N/A LYS 56.A NZ ALA 77.A O no hydrogen 2.752 N/A ALA 57.A N GLU 53.A O no hydrogen 3.062 N/A ARG 58.A N GLU 54.A O no hydrogen 3.143 N/A ARG 58.A NE GLU 174.A OE1 no hydrogen 2.888 N/A ARG 58.A NH2 GLU 174.A O no hydrogen 3.191 N/A VAL 59.A N GLY 55.A O no hydrogen 3.138 N/A ALA 60.A N LYS 56.A O no hydrogen 2.925 N/A SER 62.A N VAL 59.A O no hydrogen 3.119 N/A SER 62.A OG VAL 59.A O no hydrogen 2.749 N/A ALA 63.A N ALA 60.A O no hydrogen 3.142 N/A TYR 67.A N ALA 64.A O no hydrogen 2.628 N/A ASN 70.A N TYR 67.A O no hydrogen 2.836 N/A ASN 70.A ND2 GLY 165.A O no hydrogen 2.876 N/A GLU 71.A N VAL 68.A O no hydrogen 3.072 N/A LYS 73.A N ASN 70.A O no hydrogen 3.141 N/A LYS 73.A NZ ASN 70.A OD1 no hydrogen 2.837 N/A MET 74.A N ASN 70.A O no hydrogen 3.422 N/A MET 74.A N GLU 71.A O no hydrogen 3.096 N/A LEU 75.A N GLU 71.A O no hydrogen 3.201 N/A ASP 76.A N ARG 72.A O no hydrogen 3.001 N/A ALA 77.A N LYS 73.A O no hydrogen 3.356 N/A SER 78.A OG HIS 79.A ND1 no hydrogen 2.809 N/A HIS 79.A N VAL 190.A O no hydrogen 3.032 N/A HIS 79.A ND1 SER 78.A OG no hydrogen 2.809 N/A VAL 80.A N ALA 50.A O no hydrogen 2.846 N/A VAL 81.A N VAL 188.A O no hydrogen 3.035 N/A VAL 82.A N ILE 48.A O no hydrogen 2.722 N/A PHE 83.A N VAL 186.A O no hydrogen 2.853 N/A CYS 84.A N HIS 46.A O no hydrogen 2.938 N/A CYS 84.A SG VAL 82.A O no hydrogen 3.943 N/A ALA 85.A N THR 183.A O no hydrogen 3.060 N/A LYS 86.A N PRO 44.A O no hydrogen 3.059 N/A LYS 86.A NZ ASP 90.A OD2 no hydrogen 2.837 N/A THR 87.A N GLY 181.A O no hydrogen 3.046 N/A MET 89.A N ASP 134.A OD2 no hydrogen 2.815 N/A TRP 93.A N ASP 90.A OD1 no hydrogen 2.900 N/A TRP 93.A NE1 SER 42.A O no hydrogen 2.916 N/A LEU 94.A N ASP 90.A O no hydrogen 3.340 N/A LYS 95.A N ASP 91.A O no hydrogen 2.967 N/A LYS 95.A NZ ASP 99.A OD1 no hydrogen 3.550 N/A LYS 95.A NZ ASP 99.A OD2 no hydrogen 2.712 N/A LEU 96.A N VAL 92.A O no hydrogen 2.885 N/A VAL 97.A N TRP 93.A O no hydrogen 2.961 N/A VAL 98.A N LEU 94.A O no hydrogen 3.233 N/A ASP 99.A N LYS 95.A O no hydrogen 2.916 N/A GLN 100.A N LEU 96.A O no hydrogen 2.964 N/A GLN 100.A NE2 ASP 104.A OD1 no hydrogen 3.460 N/A GLN 100.A NE2 ASP 104.A OD2 no hydrogen 3.005 N/A GLU 101.A N VAL 97.A O no hydrogen 2.930 N/A ASP 102.A N VAL 98.A O no hydrogen 2.901 N/A ALA 103.A N ASP 99.A O no hydrogen 2.854 N/A ASP 104.A N GLN 100.A O no hydrogen 2.827 N/A GLY 105.A N ASP 102.A O no hydrogen 2.819 N/A ARG 106.A N GLU 101.A O no hydrogen 3.061 N/A ALA 112.A N THR 109.A OG1 no hydrogen 3.112 N/A LYS 113.A N THR 109.A O no hydrogen 3.131 N/A LYS 113.A NZ ASP 99.A OD2 no hydrogen 2.931 N/A LYS 113.A NZ ASP 102.A OD2 no hydrogen 3.366 N/A ALA 114.A N PRO 110.A O no hydrogen 2.972 N/A ALA 115.A N GLU 111.A O no hydrogen 2.774 N/A ASN 116.A N ALA 112.A O no hydrogen 2.995 N/A ASP 117.A N LYS 113.A O no hydrogen 3.009 N/A LYS 118.A N ALA 114.A O no hydrogen 2.820 N/A GLY 119.A N ALA 115.A O no hydrogen 2.964 N/A ARG 120.A N ASN 116.A O no hydrogen 2.989 N/A ARG 120.A NE THR 40.A O no hydrogen 2.850 N/A ARG 120.A NH1 ASN 116.A OD1 no hydrogen 2.863 N/A ARG 120.A NH2 THR 40.A O no hydrogen 3.039 N/A ARG 120.A NH2 ASN 116.A OD1 no hydrogen 3.061 N/A LYS 121.A N ASP 117.A O no hydrogen 2.996 N/A LYS 121.A NZ ASP 91.A OD2 no hydrogen 3.418 N/A PHE 122.A N LYS 118.A O no hydrogen 3.070 N/A PHE 122.A N GLY 119.A O no hydrogen 3.281 N/A ALA 124.A N ARG 120.A O no hydrogen 2.947 N/A ASP 125.A N LYS 121.A O no hydrogen 2.772 N/A MET 126.A N PHE 122.A O no hydrogen 3.094 N/A HIS 127.A N PHE 123.A O no hydrogen 3.256 N/A HIS 127.A ND1 ASP 133.A OD2 no hydrogen 2.832 N/A ARG 128.A N ALA 124.A O no hydrogen 2.819 N/A ARG 128.A NH1 ASP 91.A OD1 no hydrogen 3.120 N/A ARG 128.A NH1 ASP 125.A OD1 no hydrogen 3.072 N/A ARG 128.A NH2 MET 89.A O no hydrogen 2.750 N/A ARG 128.A NH2 ASP 91.A OD1 no hydrogen 2.748 N/A LYS 129.A N ASP 125.A O no hydrogen 2.659 N/A ASP 130.A N ASP 125.A O no hydrogen 3.131 N/A LEU 131.A N MET 126.A O no hydrogen 2.865 N/A ASP 133.A N HIS 127.A O no hydrogen 3.109 N/A TRP 137.A N ASP 133.A O no hydrogen 2.948 N/A MET 138.A N ASP 134.A O no hydrogen 3.201 N/A ALA 139.A N ALA 135.A O no hydrogen 3.014 N/A LYS 140.A N GLU 136.A O no hydrogen 2.887 N/A LYS 140.A NZ GLU 136.A OE2 no hydrogen 3.418 N/A GLN 141.A N TRP 137.A O no hydrogen 3.352 N/A GLN 141.A NE2 TRP 137.A O no hydrogen 3.112 N/A VAL 142.A N MET 138.A O no hydrogen 3.108 N/A TYR 143.A N ALA 139.A O no hydrogen 3.070 N/A TYR 143.A OH GLU 164.A OE2 no hydrogen 2.609 N/A LEU 144.A N LYS 140.A O no hydrogen 3.066 N/A ASN 145.A N GLN 141.A O no hydrogen 3.025 N/A ASN 145.A ND2 LEU 33.A O no hydrogen 3.012 N/A VAL 146.A N VAL 142.A O no hydrogen 2.928 N/A GLY 147.A N TYR 143.A O no hydrogen 2.980 N/A ASN 148.A N LEU 144.A O no hydrogen 3.070 N/A PHE 149.A N ASN 145.A O no hydrogen 2.833 N/A LEU 150.A N VAL 146.A O no hydrogen 2.938 N/A LEU 151.A N GLY 147.A O no hydrogen 3.450 N/A GLY 152.A N ASN 148.A O no hydrogen 3.022 N/A VAL 153.A N PHE 149.A O no hydrogen 2.835 N/A ALA 154.A N LEU 150.A O no hydrogen 3.267 N/A ALA 155.A N LEU 151.A O no hydrogen 2.976 N/A LEU 156.A N GLY 152.A O no hydrogen 3.107 N/A LEU 156.A N VAL 153.A O no hydrogen 3.074 N/A GLY 157.A N ALA 154.A O no hydrogen 2.938 N/A LEU 158.A N VAL 153.A O no hydrogen 3.003 N/A ASP 159.A N GLY 191.A O no hydrogen 2.831 N/A VAL 161.A N PRO 189.A O no hydrogen 3.255 N/A ILE 163.A N VAL 187.A O no hydrogen 2.808 N/A PHE 166.A N GLU 164.A O no hydrogen 2.903 N/A ASP 167.A N SER 62.A O no hydrogen 2.865 N/A ILE 170.A N ASP 167.A OD1 no hydrogen 3.202 N/A LEU 171.A N ASP 167.A O no hydrogen 3.066 N/A ASP 172.A N ALA 168.A O no hydrogen 2.770 N/A ALA 173.A N ALA 169.A O no hydrogen 3.101 N/A GLU 174.A N ILE 170.A O no hydrogen 3.041 N/A PHE 175.A N LEU 171.A O no hydrogen 3.308 N/A PHE 175.A N ASP 172.A O no hydrogen 3.332 N/A GLY 176.A N ALA 173.A O no hydrogen 3.045 N/A LEU 177.A N ASP 172.A O no hydrogen 2.817 N/A GLY 181.A N LYS 178.A O no hydrogen 3.269 N/A TYR 182.A N LEU 177.A O no hydrogen 3.060 N/A THR 183.A N ALA 85.A O no hydrogen 3.094 N/A THR 183.A OG1 ASP 172.A OD1 no hydrogen 2.741 N/A SER 184.A N ASP 172.A OD2 no hydrogen 2.873 N/A SER 184.A OG ASP 172.A OD2 no hydrogen 2.839 N/A LEU 185.A N PHE 83.A O no hydrogen 2.915 N/A VAL 187.A N ILE 163.A O no hydrogen 3.050 N/A VAL 188.A N VAL 81.A O no hydrogen 2.763 N/A VAL 190.A N HIS 79.A O no hydrogen 2.664 N/A GLY 191.A N ASP 159.A O no hydrogen 2.875 N/A HIS 193.A N ASP 159.A OD1 no hydrogen 2.934 N/A HIS 193.A ND1 ASP 159.A OD1 no hydrogen 2.521 N/A SER 194.A N ALA 14.A O no hydrogen 2.904 N/A GLU 196.A N SER 194.A OG no hydrogen 3.251 N/A ASP 197.A N SER 194.A O no hydrogen 2.977 N/A ASN 199.A N ASP 197.A OD1 no hydrogen 3.253 N/A ASN 199.A ND2 SER 11.A O no hydrogen 2.900 N/A ALA 200.A N ASP 197.A O no hydrogen 3.052 N/A LYS 204.A NZ ARG 9.A O no hydrogen 2.691 N/A ARG 206.A NH1 SER 205.A O no hydrogen 2.905 N/A ILE 211.A N PRO 208.A O no hydrogen 3.100 N/A THR 212.A N PRO 208.A O no hydrogen 3.318 N/A THR 212.A OG1 PRO 208.A O no hydrogen 3.374 N/A LEU 213.A N GLN 209.A O no hydrogen 2.918 N/A