Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4otw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N LEU 77.A O no hydrogen 3.201 N/A PHE 6.A N LEU 79.A O no hydrogen 2.596 N/A LYS 7.A N GLU 10.A OE2 no hydrogen 3.182 N/A GLU 10.A N LYS 7.A O no hydrogen 2.882 N/A LEU 11.A N GLU 8.A O no hydrogen 3.245 N/A ARG 12.A N VAL 29.A O no hydrogen 3.098 N/A LEU 14.A N LYS 27.A O no hydrogen 2.920 N/A LYS 15.A N LYS 27.A O no hydrogen 3.370 N/A LEU 17.A N VAL 25.A O no hydrogen 2.860 N/A GLY 18.A N VAL 25.A O no hydrogen 3.414 N/A SER 19.A OG GLY 20.A O no hydrogen 3.312 N/A GLY 20.A N SER 19.A OG no hydrogen 2.603 N/A THR 24.A N VAL 45.A O no hydrogen 3.067 N/A VAL 25.A N GLY 18.A O no hydrogen 2.738 N/A HIS 26.A N ILE 43.A O no hydrogen 2.546 N/A LYS 27.A N LYS 15.A O no hydrogen 2.758 N/A GLY 28.A N VAL 41.A O no hydrogen 2.878 N/A VAL 29.A N ARG 12.A O no hydrogen 2.792 N/A TRP 30.A N ILE 39.A O no hydrogen 2.608 N/A ILE 31.A N GLU 10.A O no hydrogen 2.824 N/A SER 36.A OG GLU 35.A O no hydrogen 2.856 N/A ILE 39.A N TRP 30.A O no hydrogen 2.905 N/A VAL 41.A N GLY 28.A O no hydrogen 2.855 N/A CYS 42.A N THR 89.A O no hydrogen 2.821 N/A CYS 42.A SG HIS 26.A O no hydrogen 3.601 N/A ILE 43.A N HIS 26.A O no hydrogen 2.737 N/A LYS 44.A N LEU 87.A O no hydrogen 2.767 N/A LYS 44.A NZ ASP 154.A OD2 no hydrogen 2.539 N/A VAL 45.A N THR 24.A O no hydrogen 2.891 N/A ILE 46.A N LEU 85.A O no hydrogen 2.815 N/A GLY 51.A N ASP 48.A OD2 no hydrogen 3.023 N/A ARG 52.A N ASP 48.A O no hydrogen 2.930 N/A ARG 52.A NH2 GLU 47.A OE1 no hydrogen 3.051 N/A GLN 53.A N ASP 48.A OD1 no hydrogen 2.830 N/A PHE 55.A N GLY 82.A O no hydrogen 2.981 N/A HIS 61.A NE2 GLY 156.A O no hydrogen 2.901 N/A MET 62.A N THR 59.A OG1 no hydrogen 3.202 N/A LEU 63.A N THR 59.A O no hydrogen 3.300 N/A ALA 64.A N ASP 60.A O no hydrogen 2.855 N/A ILE 65.A N HIS 61.A O no hydrogen 3.072 N/A GLY 66.A N MET 62.A O no hydrogen 3.150 N/A SER 67.A N ALA 64.A O no hydrogen 3.286 N/A SER 67.A OG ALA 64.A O no hydrogen 3.166 N/A ASP 69.A N TYR 126.A OH no hydrogen 2.885 N/A HIS 72.A N HIS 70.A ND1 no hydrogen 3.083 N/A HIS 72.A ND1 VAL 150.A O no hydrogen 2.916 N/A ILE 73.A N HIS 70.A O no hydrogen 3.295 N/A VAL 74.A N VAL 152.A O no hydrogen 2.917 N/A LEU 77.A N VAL 88.A O no hydrogen 2.697 N/A GLY 78.A N VAL 88.A O no hydrogen 3.308 N/A LEU 79.A N ARG 4.A O no hydrogen 3.043 N/A CYS 80.A N GLN 86.A O no hydrogen 2.982 N/A CYS 80.A SG PHE 6.A O no hydrogen 3.442 N/A CYS 80.A SG PRO 81.A O no hydrogen 4.019 N/A GLY 82.A N PHE 55.A O no hydrogen 3.067 N/A LEU 85.A N ILE 46.A O no hydrogen 2.924 N/A GLN 86.A N CYS 80.A O no hydrogen 3.138 N/A GLN 86.A NE2 GLU 8.A OE1 no hydrogen 2.994 N/A GLN 86.A NE2 GLU 8.A OE2 no hydrogen 3.366 N/A LEU 87.A N LYS 44.A O no hydrogen 2.671 N/A VAL 88.A N GLY 78.A O no hydrogen 2.909 N/A THR 89.A N CYS 42.A O no hydrogen 3.013 N/A THR 89.A OG1 GLN 90.A O no hydrogen 2.896 N/A GLY 95.A N LEU 92.A O no hydrogen 2.989 N/A LEU 97.A N VAL 142.A O no hydrogen 2.671 N/A ASP 99.A N SER 96.A OG no hydrogen 3.409 N/A HIS 100.A N SER 96.A O no hydrogen 3.144 N/A VAL 101.A N LEU 97.A O no hydrogen 2.980 N/A ARG 102.A N LEU 98.A O no hydrogen 3.110 N/A ARG 102.A NE GLY 201.A O no hydrogen 2.847 N/A ARG 102.A NH2 GLY 201.A O no hydrogen 3.021 N/A GLN 103.A N ASP 99.A O no hydrogen 3.219 N/A GLN 103.A N HIS 100.A O no hydrogen 3.213 N/A HIS 104.A N HIS 100.A O no hydrogen 3.155 N/A ARG 105.A N VAL 101.A O no hydrogen 2.951 N/A ALA 107.A N HIS 104.A O no hydrogen 3.023 N/A LEU 108.A N ARG 105.A O no hydrogen 3.107 N/A GLN 111.A NE2 GLN 111.A O no hydrogen 3.588 N/A GLN 111.A NE2 ASN 115.A OD1 no hydrogen 3.273 N/A GLN 111.A NE2 ALA 262.A O no hydrogen 2.953 N/A LEU 113.A N GLY 109.A O no hydrogen 3.475 N/A LEU 114.A N PRO 110.A O no hydrogen 3.192 N/A ASN 115.A N GLN 111.A O no hydrogen 2.848 N/A TRP 116.A N LEU 112.A O no hydrogen 2.756 N/A TRP 116.A NE1 SER 148.A O no hydrogen 3.106 N/A GLY 117.A N LEU 113.A O no hydrogen 3.297 N/A VAL 118.A N LEU 114.A O no hydrogen 3.007 N/A GLN 119.A N ASN 115.A O no hydrogen 3.005 N/A GLN 119.A NE2 SER 148.A O no hydrogen 3.166 N/A ILE 120.A N TRP 116.A O no hydrogen 3.069 N/A ALA 121.A N GLY 117.A O no hydrogen 3.280 N/A LYS 122.A N VAL 118.A O no hydrogen 2.899 N/A GLY 123.A N GLN 119.A O no hydrogen 2.961 N/A MET 124.A N ILE 120.A O no hydrogen 2.801 N/A TYR 125.A N ALA 121.A O no hydrogen 2.687 N/A TYR 126.A N LYS 122.A O no hydrogen 2.816 N/A LEU 127.A N GLY 123.A O no hydrogen 3.050 N/A GLU 128.A N MET 124.A O no hydrogen 2.899 N/A GLU 129.A N TYR 125.A O no hydrogen 2.991 N/A HIS 130.A N TYR 126.A O no hydrogen 3.288 N/A HIS 130.A N LEU 127.A O no hydrogen 3.197 N/A HIS 130.A ND1 TYR 126.A O no hydrogen 2.996 N/A GLY 131.A N GLU 128.A O no hydrogen 3.028 N/A MET 132.A N LEU 127.A O no hydrogen 2.880 N/A HIS 134.A N ASP 186.A OD2 no hydrogen 2.770 N/A HIS 134.A NE2 ALA 153.A O no hydrogen 2.602 N/A ARG 135.A N ASP 186.A OD1 no hydrogen 3.070 N/A ARG 135.A NH1 ASP 159.A OD1 no hydrogen 2.698 N/A ASN 136.A N HIS 134.A ND1 no hydrogen 3.005 N/A ASN 136.A ND2 ASP 154.A OD1 no hydrogen 3.046 N/A ALA 139.A N GLU 196.A OE1 no hydrogen 2.824 N/A ARG 140.A NH1 ASP 99.A OD1 no hydrogen 2.926 N/A ARG 140.A NH1 ASP 99.A OD2 no hydrogen 3.557 N/A ARG 140.A NH2 ASP 99.A OD2 no hydrogen 2.820 N/A ASN 141.A N ALA 138.A O no hydrogen 2.893 N/A ASN 141.A ND2 ASN 136.A O no hydrogen 2.773 N/A VAL 142.A N ALA 139.A O no hydrogen 3.196 N/A LEU 143.A N GLN 151.A O no hydrogen 2.783 N/A LEU 144.A N GLY 95.A O no hydrogen 2.924 N/A LYS 145.A N GLN 149.A O no hydrogen 2.944 N/A LYS 145.A NZ GLN 90.A OE1 no hydrogen 3.212 N/A SER 146.A N GLN 149.A O no hydrogen 3.199 N/A SER 148.A N SER 146.A OG no hydrogen 3.042 N/A SER 148.A OG SER 146.A OG no hydrogen 3.410 N/A GLN 149.A N SER 146.A OG no hydrogen 3.219 N/A GLN 149.A NE2 SER 148.A OG no hydrogen 3.051 N/A VAL 150.A N GLN 119.A OE1 no hydrogen 2.735 N/A GLN 151.A N LEU 143.A O no hydrogen 2.782 N/A GLN 151.A NE2 ALA 71.A O no hydrogen 2.992 N/A VAL 152.A N HIS 72.A O no hydrogen 2.762 N/A ALA 153.A N ASN 141.A O no hydrogen 2.947 N/A GLY 156.A N HIS 134.A O no hydrogen 3.303 N/A ASP 159.A N GLY 156.A O no hydrogen 3.063 N/A LEU 160.A N VAL 157.A O no hydrogen 3.109 N/A LEU 161.A N ALA 158.A O no hydrogen 3.343 N/A LYS 169.A NZ PRO 204.A O no hydrogen 3.415 N/A LYS 169.A NZ TYR 205.A O no hydrogen 3.131 N/A TRP 170.A N PRO 167.A O no hydrogen 2.853 N/A TRP 170.A NE1 GLU 196.A OE1 no hydrogen 2.899 N/A MET 171.A N ILE 168.A O no hydrogen 3.227 N/A GLU 174.A N GLU 174.A OE2 no hydrogen 2.746 N/A SER 175.A N ALA 172.A O no hydrogen 2.931 N/A SER 175.A OG LYS 180.A O no hydrogen 2.642 N/A ILE 176.A N ALA 172.A O no hydrogen 3.245 N/A HIS 177.A N LEU 173.A O no hydrogen 2.850 N/A PHE 178.A N GLU 174.A O no hydrogen 2.986 N/A GLY 179.A N SER 175.A O no hydrogen 2.895 N/A THR 182.A N SER 185.A OG no hydrogen 2.833 N/A GLN 184.A N THR 182.A OG1 no hydrogen 3.029 N/A SER 185.A N THR 182.A OG1 no hydrogen 3.216 N/A SER 185.A OG THR 182.A O no hydrogen 2.864 N/A ASP 186.A N THR 182.A O no hydrogen 3.043 N/A VAL 187.A N HIS 183.A O no hydrogen 3.123 N/A TRP 188.A N GLN 184.A O no hydrogen 3.337 N/A SER 189.A N SER 185.A O no hydrogen 3.173 N/A SER 189.A OG TRP 170.A O no hydrogen 2.903 N/A SER 189.A OG SER 185.A O no hydrogen 3.134 N/A TYR 190.A N ASP 186.A O no hydrogen 2.741 N/A TYR 190.A OH GLY 117.A O no hydrogen 2.738 N/A GLY 191.A N VAL 187.A O no hydrogen 2.997 N/A VAL 192.A N TRP 188.A O no hydrogen 3.135 N/A THR 193.A N SER 189.A O no hydrogen 2.929 N/A THR 193.A OG1 SER 189.A O no hydrogen 2.685 N/A VAL 194.A N TYR 190.A O no hydrogen 2.922 N/A TRP 195.A N GLY 191.A O no hydrogen 3.071 N/A TRP 195.A NE1 ALA 224.A O no hydrogen 2.780 N/A GLU 196.A N VAL 192.A O no hydrogen 2.950 N/A LEU 197.A N THR 193.A O no hydrogen 3.068 N/A MET 198.A N VAL 194.A O no hydrogen 2.918 N/A THR 199.A N TRP 195.A O no hydrogen 3.062 N/A THR 199.A OG1 TRP 195.A O no hydrogen 2.925 N/A THR 199.A OG1 GLU 196.A O no hydrogen 3.259 N/A PHE 200.A N LEU 197.A O no hydrogen 2.783 N/A GLY 201.A N GLU 196.A O no hydrogen 2.715 N/A ALA 202.A N THR 199.A OG1 no hydrogen 3.210 N/A LEU 208.A N TYR 205.A O no hydrogen 3.150 N/A ARG 209.A N GLU 212.A OE1 no hydrogen 2.904 N/A GLU 212.A N ARG 209.A O no hydrogen 3.115 N/A VAL 213.A N LEU 210.A O no hydrogen 3.286 N/A LEU 216.A N GLU 212.A O no hydrogen 3.158 N/A LEU 217.A N VAL 213.A O no hydrogen 3.112 N/A GLU 218.A N PRO 214.A O no hydrogen 2.957 N/A LYS 219.A N ASP 215.A O no hydrogen 3.211 N/A GLY 220.A N LEU 217.A O no hydrogen 2.844 N/A GLU 221.A N LEU 216.A O no hydrogen 2.923 N/A ARG 222.A NE TRP 241.A O no hydrogen 3.012 N/A ARG 222.A NH1 LEU 217.A O no hydrogen 2.769 N/A ARG 222.A NH1 GLU 221.A O no hydrogen 2.884 N/A ARG 222.A NH2 TRP 241.A O no hydrogen 2.956 N/A GLN 225.A NE2 CYS 229.A O no hydrogen 2.861 N/A CYS 229.A N PRO 226.A O no hydrogen 3.288 N/A THR 230.A N TYR 268.A O no hydrogen 3.064 N/A THR 230.A OG1 TYR 268.A O no hydrogen 2.867 N/A TYR 234.A N THR 230.A O no hydrogen 3.292 N/A TYR 234.A OH LEU 223.A O no hydrogen 2.579 N/A MET 235.A N ILE 231.A O no hydrogen 2.889 N/A VAL 236.A N VAL 233.A O no hydrogen 3.039 N/A MET 237.A N VAL 233.A O no hydrogen 3.431 N/A VAL 238.A N TYR 234.A O no hydrogen 3.010 N/A LYS 239.A N MET 235.A O no hydrogen 3.061 N/A CYS 240.A SG VAL 236.A O no hydrogen 3.446 N/A TRP 241.A N VAL 238.A O no hydrogen 3.180 N/A MET 242.A N LYS 239.A O no hydrogen 3.353 N/A GLU 245.A N GLU 245.A OE2 no hydrogen 3.014 N/A ASN 246.A N ASP 244.A OD1 no hydrogen 3.107 N/A ILE 247.A N ASP 244.A O no hydrogen 3.103 N/A ARG 248.A NE MET 242.A O no hydrogen 2.788 N/A ARG 248.A NH1 GLU 174.A OE1 no hydrogen 2.797 N/A ARG 248.A NH1 GLN 184.A O no hydrogen 2.947 N/A ARG 248.A NH2 GLU 174.A OE1 no hydrogen 3.375 N/A ARG 248.A NH2 GLU 174.A OE2 no hydrogen 2.806 N/A ARG 248.A NH2 MET 242.A O no hydrogen 3.068 N/A GLU 253.A N THR 250.A OG1 no hydrogen 3.071 N/A LEU 254.A N THR 250.A O no hydrogen 2.907 N/A ALA 255.A N PHE 251.A O no hydrogen 2.786 N/A ASN 256.A N LYS 252.A O no hydrogen 3.007 N/A GLU 257.A N GLU 253.A O no hydrogen 2.844 N/A PHE 258.A N LEU 254.A O no hydrogen 3.151 N/A THR 259.A N ALA 255.A O no hydrogen 2.902 N/A THR 259.A OG1 ALA 255.A O no hydrogen 2.869 N/A ARG 260.A N ASN 256.A O no hydrogen 3.048 N/A MET 261.A N GLU 257.A O no hydrogen 3.014 N/A ALA 262.A N PHE 258.A O no hydrogen 2.943 N/A ARG 263.A N ARG 260.A O no hydrogen 3.401 N/A ASP 264.A N MET 261.A O no hydrogen 3.201 N/A ARG 267.A N ASP 264.A O no hydrogen 3.120 N/A TYR 268.A N PRO 265.A O no hydrogen 2.886 N/A LEU 269.A N PRO 265.A O no hydrogen 2.861 N/A VAL 270.A N ILE 228.A O no hydrogen 2.817 N/A