Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gsq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N ASP 56.A OD1 no hydrogen 3.282 N/A PRO 1.A N ASP 56.A OD2 no hydrogen 2.521 N/A LYS 2.A N ASP 56.A OD1 no hydrogen 2.925 N/A LYS 2.A NZ GLU 27.A O no hydrogen 3.293 N/A LYS 2.A NZ GLU 27.A OE1 no hydrogen 2.542 N/A THR 4.A N ASP 54.A O no hydrogen 2.779 N/A LEU 5.A N THR 29.A O no hydrogen 3.248 N/A HIS 6.A N VAL 52.A O no hydrogen 2.912 N/A TYR 7.A N ARG 31.A O no hydrogen 3.266 N/A LEU 10.A N PHE 8.A O no hydrogen 2.688 N/A MET 11.A N PHE 202.A O no hydrogen 2.918 N/A GLY 12.A N PHE 202.A OXT no hydrogen 2.571 N/A ARG 13.A N TYR 7.A OH no hydrogen 3.445 N/A ARG 13.A NH1 ASN 99.A OD1 no hydrogen 2.901 N/A ARG 13.A NH2 ASN 99.A OD1 no hydrogen 3.023 N/A ALA 14.A N MET 11.A O no hydrogen 3.231 N/A GLU 15.A N MET 11.A O no hydrogen 3.013 N/A CYS 17.A SG ALA 14.A O no hydrogen 4.041 N/A CYS 17.A SG SER 63.A O no hydrogen 3.683 N/A ARG 18.A N ALA 14.A O no hydrogen 3.260 N/A ARG 18.A NE ASP 30.A OD1 no hydrogen 3.183 N/A ARG 18.A NH1 LEU 10.A O no hydrogen 2.617 N/A ARG 18.A NH1 GLU 15.A OE1 no hydrogen 2.960 N/A ARG 18.A NH2 LEU 10.A O no hydrogen 3.016 N/A ARG 18.A NH2 ASP 30.A OD1 no hydrogen 3.170 N/A PHE 19.A N GLU 15.A O no hydrogen 3.160 N/A VAL 20.A N LEU 16.A O no hydrogen 3.132 N/A LEU 21.A N CYS 17.A O no hydrogen 3.208 N/A ALA 22.A N ARG 18.A O no hydrogen 3.025 N/A ALA 23.A N PHE 19.A O no hydrogen 2.978 N/A HIS 24.A N LEU 21.A O no hydrogen 2.727 N/A HIS 24.A ND1 GLU 26.A OE2 no hydrogen 2.540 N/A GLY 25.A N ALA 22.A O no hydrogen 2.421 N/A THR 29.A N TYR 3.A O no hydrogen 3.148 N/A ARG 31.A N THR 29.A O no hydrogen 3.090 N/A VAL 33.A N TYR 7.A O no hydrogen 2.646 N/A ASP 37.A N GLU 34.A O no hydrogen 2.992 N/A TRP 38.A N GLU 34.A O no hydrogen 3.304 N/A ASN 40.A N ASP 37.A O no hydrogen 2.879 N/A LEU 41.A N TRP 38.A O no hydrogen 2.765 N/A LYS 42.A N TRP 38.A O no hydrogen 2.828 N/A THR 44.A N LEU 41.A O no hydrogen 3.259 N/A MET 45.A N LYS 42.A O no hydrogen 3.204 N/A SER 47.A OG TYR 46.A O no hydrogen 2.728 N/A SER 47.A OG ALA 49.A O no hydrogen 2.939 N/A ASN 48.A N MET 45.A O no hydrogen 2.849 N/A ASN 48.A ND2 LYS 42.A O no hydrogen 2.700 N/A VAL 52.A N HIS 6.A O no hydrogen 3.326 N/A LEU 53.A N MET 60.A O no hydrogen 2.828 N/A ASP 54.A N THR 4.A O no hydrogen 2.783 N/A ILE 55.A N THR 58.A O no hydrogen 2.940 N/A ASP 56.A N LYS 2.A O no hydrogen 3.016 N/A GLY 57.A N ASP 54.A OD1 no hydrogen 3.013 N/A THR 58.A N ILE 55.A O no hydrogen 2.859 N/A MET 60.A N LEU 53.A O no hydrogen 2.563 N/A ILE 66.A N GLN 62.A O no hydrogen 2.913 N/A ALA 67.A N SER 63.A O no hydrogen 2.980 N/A ARG 68.A N CYS 65.A O no hydrogen 3.306 N/A ARG 68.A NH2 GLU 92.A OE1 no hydrogen 3.427 N/A HIS 69.A N CYS 65.A O no hydrogen 3.195 N/A LEU 70.A N ILE 66.A O no hydrogen 2.944 N/A ALA 71.A N ALA 67.A O no hydrogen 3.039 N/A ARG 72.A N ARG 68.A O no hydrogen 2.889 N/A GLU 73.A N HIS 69.A O no hydrogen 2.961 N/A PHE 74.A N LEU 70.A O no hydrogen 3.120 N/A PHE 74.A N ALA 71.A O no hydrogen 3.251 N/A LEU 76.A N ALA 71.A O no hydrogen 2.933 N/A LYS 79.A N GLU 83.A OE1 no hydrogen 3.511 N/A GLU 83.A N THR 80.A O no hydrogen 2.752 N/A LYS 84.A N THR 80.A O no hydrogen 3.119 N/A LYS 84.A NZ GLY 78.A O no hydrogen 2.523 N/A LYS 84.A NZ LYS 79.A O no hydrogen 3.471 N/A TYR 85.A N SER 81.A O no hydrogen 2.825 N/A ARG 86.A N LEU 82.A O no hydrogen 2.951 N/A ARG 86.A NE GLU 89.A OE1 no hydrogen 2.981 N/A ARG 86.A NH2 GLU 89.A OE1 no hydrogen 3.111 N/A VAL 87.A N GLU 83.A O no hydrogen 2.587 N/A ASP 88.A N LYS 84.A O no hydrogen 3.296 N/A GLU 89.A N TYR 85.A O no hydrogen 2.983 N/A ILE 90.A N ARG 86.A O no hydrogen 3.147 N/A THR 91.A N VAL 87.A O no hydrogen 3.274 N/A THR 91.A OG1 VAL 87.A O no hydrogen 2.560 N/A GLU 92.A N ASP 88.A O no hydrogen 2.851 N/A THR 93.A N GLU 89.A O no hydrogen 3.060 N/A THR 93.A OG1 GLU 89.A O no hydrogen 2.477 N/A LEU 94.A N ILE 90.A O no hydrogen 2.901 N/A GLN 95.A N THR 91.A O no hydrogen 2.789 N/A ASP 96.A N THR 93.A O no hydrogen 3.323 N/A PHE 98.A N LEU 94.A O no hydrogen 3.427 N/A ASN 99.A N GLN 95.A O no hydrogen 2.878 N/A ASP 100.A N ASP 96.A O no hydrogen 3.080 N/A VAL 101.A N ILE 97.A O no hydrogen 3.194 N/A VAL 101.A N PHE 98.A O no hydrogen 2.871 N/A VAL 102.A N PHE 98.A O no hydrogen 3.304 N/A LYS 103.A N ASN 99.A O no hydrogen 3.460 N/A LYS 105.A N VAL 101.A O no hydrogen 3.099 N/A LYS 105.A NZ HIS 166.A ND1 no hydrogen 2.864 N/A PHE 106.A N VAL 102.A O no hydrogen 2.800 N/A ALA 107.A N ILE 104.A O no hydrogen 2.846 N/A LYS 112.A N GLU 109.A O no hydrogen 3.251 N/A LYS 112.A N ALA 110.A O no hydrogen 3.062 N/A LYS 112.A NZ ILE 104.A O no hydrogen 2.704 N/A LYS 112.A NZ LYS 105.A O no hydrogen 3.110 N/A LYS 112.A NZ ALA 107.A O no hydrogen 2.478 N/A GLN 116.A N LYS 112.A O no hydrogen 2.605 N/A GLN 117.A N GLU 113.A O no hydrogen 2.989 N/A ASN 118.A N ALA 114.A O no hydrogen 3.101 N/A TYR 119.A N VAL 115.A O no hydrogen 2.954 N/A TYR 119.A OH THR 167.A OG1 no hydrogen 2.648 N/A GLU 120.A N GLN 116.A O no hydrogen 3.134 N/A LYS 121.A N GLN 117.A O no hydrogen 3.132 N/A SER 122.A N ASN 118.A O no hydrogen 3.287 N/A SER 122.A OG ASP 100.A OD2 no hydrogen 3.187 N/A SER 122.A OG ASN 118.A O no hydrogen 2.973 N/A CYS 123.A N TYR 119.A O no hydrogen 2.996 N/A CYS 123.A SG TYR 119.A O no hydrogen 4.043 N/A LYS 124.A N GLU 120.A O no hydrogen 3.063 N/A ARG 125.A N LYS 121.A O no hydrogen 3.365 N/A ARG 125.A N SER 122.A O no hydrogen 3.005 N/A LEU 126.A N SER 122.A O no hydrogen 2.721 N/A ALA 127.A N CYS 123.A O no hydrogen 2.855 N/A LEU 130.A N LEU 126.A O no hydrogen 2.714 N/A GLU 131.A N ALA 127.A O no hydrogen 2.867 N/A GLY 132.A N PRO 128.A O no hydrogen 2.751 N/A LEU 133.A N PHE 129.A O no hydrogen 2.932 N/A LEU 134.A N LEU 130.A O no hydrogen 2.896 N/A VAL 135.A N GLU 131.A O no hydrogen 2.870 N/A SER 136.A N GLY 132.A O no hydrogen 2.943 N/A SER 136.A OG LEU 133.A O no hydrogen 2.476 N/A ASN 137.A N LEU 133.A O no hydrogen 3.327 N/A ASN 137.A N LEU 134.A O no hydrogen 2.670 N/A ASN 137.A ND2 PHE 143.A O no hydrogen 2.675 N/A ASN 137.A ND2 GLY 146.A O no hydrogen 2.823 N/A GLY 140.A N ASN 137.A O no hydrogen 2.824 N/A PHE 144.A N ASP 153.A OD1 no hydrogen 2.965 N/A THR 150.A N ASP 153.A OD2 no hydrogen 3.357 N/A THR 150.A OG1 ASP 153.A OD2 no hydrogen 3.373 N/A LEU 151.A N LEU 76.A O no hydrogen 2.821 N/A ALA 152.A N THR 150.A OG1 no hydrogen 3.311 N/A ASP 153.A N THR 150.A O no hydrogen 3.195 N/A HIS 155.A N LEU 151.A O no hydrogen 3.031 N/A HIS 155.A NE2 GLN 95.A OE1 no hydrogen 2.616 N/A CYS 156.A N ALA 152.A O no hydrogen 2.954 N/A TYR 157.A N ASP 153.A O no hydrogen 3.362 N/A VAL 158.A N LEU 154.A O no hydrogen 2.686 N/A ALA 159.A N HIS 155.A O no hydrogen 2.834 N/A GLU 161.A N VAL 158.A O no hydrogen 3.497 N/A LEU 164.A N LEU 160.A O no hydrogen 2.816 N/A LYS 165.A N GLU 161.A O no hydrogen 2.933 N/A HIS 166.A N VAL 162.A O no hydrogen 2.948 N/A HIS 166.A NE2 GLN 116.A OE1 no hydrogen 2.814 N/A THR 167.A N PRO 163.A O no hydrogen 2.669 N/A THR 167.A OG1 TYR 119.A OH no hydrogen 2.648 N/A LEU 170.A N THR 167.A O no hydrogen 2.934 N/A LYS 172.A N GLU 169.A O no hydrogen 2.498 N/A LYS 172.A NZ ASP 173.A OD2 no hydrogen 3.498 N/A CYS 174.A N LEU 171.A O no hydrogen 2.806 N/A LYS 176.A N GLU 131.A OE2 no hydrogen 3.163 N/A LYS 176.A NZ GLY 139.A O no hydrogen 3.295 N/A LYS 176.A NZ ASP 141.A OD1 no hydrogen 2.629 N/A ILE 177.A N GLU 131.A OE1 no hydrogen 3.021 N/A VAL 178.A N CYS 174.A O no hydrogen 3.297 N/A ALA 179.A N PRO 175.A O no hydrogen 3.048 N/A LEU 180.A N LYS 176.A O no hydrogen 2.961 N/A ARG 181.A N ILE 177.A O no hydrogen 2.772 N/A ARG 181.A NE CYS 156.A O no hydrogen 3.451 N/A ARG 181.A NH2 TYR 157.A O no hydrogen 2.968 N/A LYS 182.A N VAL 178.A O no hydrogen 3.297 N/A ARG 183.A N ALA 179.A O no hydrogen 2.925 N/A ARG 183.A NH2 GLY 142.A O no hydrogen 2.862 N/A VAL 184.A N LEU 180.A O no hydrogen 2.901 N/A ALA 185.A N ARG 181.A O no hydrogen 2.972 N/A GLU 186.A N LYS 182.A O no hydrogen 3.102 N/A GLU 186.A N ARG 183.A O no hydrogen 3.007 N/A CYS 187.A N VAL 184.A O no hydrogen 3.008 N/A ILE 190.A N CYS 187.A O no hydrogen 3.208 N/A ALA 191.A N CYS 187.A O no hydrogen 2.666 N/A ALA 192.A N PRO 188.A O no hydrogen 2.843 N/A TYR 193.A N LYS 189.A O no hydrogen 3.384 N/A TYR 193.A OH GLU 15.A OE2 no hydrogen 2.723 N/A LEU 194.A N ILE 190.A O no hydrogen 2.638 N/A LYS 195.A N ALA 192.A O no hydrogen 2.943 N/A LYS 196.A N ALA 192.A O no hydrogen 2.935 N/A ARG 197.A N TYR 193.A O no hydrogen 2.815 N/A ARG 197.A NE GLU 15.A OE2 no hydrogen 2.898 N/A ARG 197.A NH1 GLU 161.A OE1 no hydrogen 3.081 N/A ARG 197.A NH2 GLU 15.A OE2 no hydrogen 2.805 N/A ARG 197.A NH2 GLU 161.A OE2 no hydrogen 2.559 N/A