Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1esi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ PRO 2.A O no hydrogen 2.613 N/A LYS 1.A NZ TYR 21.A OH no hydrogen 2.899 N/A ALA 5.A N ASP 249.A OD2 no hydrogen 2.968 N/A ALA 6.A N ASP 249.A OD1 no hydrogen 2.894 N/A GLY 8.A N LEU 238.A O no hydrogen 3.387 N/A GLY 9.A N LYS 23.A O no hydrogen 2.782 N/A TYR 10.A N THR 236.A O no hydrogen 3.000 N/A TYR 10.A OH THR 19.A OG1 no hydrogen 2.724 N/A ALA 11.A N TYR 21.A O no hydrogen 3.099 N/A MET 12.A N ILE 234.A O no hydrogen 2.979 N/A ASN 13.A N THR 18.A O no hydrogen 2.780 N/A ASN 14.A N THR 232.A O no hydrogen 2.769 N/A ASN 14.A ND2 SER 160.A OG no hydrogen 2.704 N/A GLY 15.A N ASN 13.A OD1 no hydrogen 2.650 N/A THR 16.A N ASN 13.A OD1 no hydrogen 3.158 N/A THR 16.A OG1 THR 18.A OG1 no hydrogen 2.764 N/A GLY 17.A N ASN 13.A O no hydrogen 2.720 N/A THR 18.A N THR 16.A OG1 no hydrogen 3.308 N/A THR 18.A OG1 THR 16.A OG1 no hydrogen 2.764 N/A THR 19.A OG1 TYR 10.A OH no hydrogen 2.724 N/A LEU 20.A N ALA 11.A O no hydrogen 2.776 N/A TYR 21.A N ALA 11.A O no hydrogen 3.221 N/A TYR 21.A OH PRO 2.A O no hydrogen 3.326 N/A LYS 23.A N GLY 9.A O no hydrogen 2.962 N/A LYS 23.A NZ ALA 6.A O no hydrogen 2.772 N/A THR 27.A N ALA 24.A O no hydrogen 3.196 N/A ARG 28.A NE ASN 134.A OD1 no hydrogen 2.983 N/A ARG 28.A NH2 HIS 133.A O no hydrogen 3.182 N/A ARG 28.A NH2 ASN 134.A OD1 no hydrogen 3.404 N/A ARG 29.A N SER 150.A O no hydrogen 2.848 N/A ARG 29.A NH2 VAL 7.A O no hydrogen 3.431 N/A THR 31.A N ASN 148.A O no hydrogen 3.236 N/A THR 31.A OG1 GLY 32.A O no hydrogen 3.496 N/A THR 31.A OG1 THR 35.A OG1 no hydrogen 2.522 N/A THR 31.A OG1 ASN 148.A O no hydrogen 3.511 N/A SER 33.A N SER 214.A O no hydrogen 3.005 N/A SER 33.A OG SER 214.A O no hydrogen 3.440 N/A THR 34.A N THR 31.A O no hydrogen 3.270 N/A THR 34.A OG1 THR 31.A O no hydrogen 2.884 N/A THR 35.A N GLY 32.A O no hydrogen 3.241 N/A THR 35.A OG1 THR 31.A OG1 no hydrogen 2.522 N/A THR 35.A OG1 GLY 32.A O no hydrogen 3.207 N/A LYS 36.A N SER 33.A O no hydrogen 3.056 N/A LYS 36.A NZ SER 94.A O no hydrogen 3.038 N/A LYS 36.A NZ SER 94.A OG no hydrogen 3.076 N/A ILE 37.A N THR 34.A O no hydrogen 3.028 N/A MET 38.A N THR 35.A O no hydrogen 2.867 N/A THR 39.A N THR 35.A O no hydrogen 3.270 N/A THR 39.A OG1 THR 35.A O no hydrogen 3.493 N/A THR 39.A OG1 PHE 140.A O no hydrogen 2.480 N/A ALA 40.A N LYS 36.A O no hydrogen 2.979 N/A LYS 41.A N ILE 37.A O no hydrogen 3.067 N/A LYS 41.A NZ SER 161.A OG no hydrogen 2.871 N/A VAL 42.A N MET 38.A O no hydrogen 2.888 N/A VAL 43.A N THR 39.A O no hydrogen 3.201 N/A LEU 44.A N ALA 40.A O no hydrogen 2.949 N/A ALA 45.A N VAL 42.A O no hydrogen 3.086 N/A GLN 46.A N VAL 43.A O no hydrogen 3.086 N/A GLN 46.A NE2 VAL 42.A O no hydrogen 2.852 N/A LEU 49.A N GLN 46.A O no hydrogen 3.229 N/A ASP 52.A N ASN 50.A OD1 no hydrogen 3.044 N/A ALA 53.A N ASN 50.A O no hydrogen 2.964 N/A VAL 55.A N VAL 81.A O no hydrogen 2.680 N/A ILE 57.A N ASP 79.A O no hydrogen 2.811 N/A TYR 61.A N GLN 58.A O no hydrogen 3.142 N/A TYR 61.A OH ASP 104.A OD2 no hydrogen 2.509 N/A SER 62.A OG GLN 58.A O no hydrogen 3.542 N/A SER 62.A OG LYS 59.A O no hydrogen 2.772 N/A ASP 63.A N LYS 59.A O no hydrogen 2.913 N/A TYR 64.A N ALA 60.A O no hydrogen 2.947 N/A TYR 64.A OH ASP 141.A OD1 no hydrogen 3.216 N/A TYR 64.A OH ASP 141.A OD2 no hydrogen 2.564 N/A VAL 66.A N SER 62.A O no hydrogen 3.417 N/A ALA 67.A N ASP 63.A O no hydrogen 2.847 N/A ASN 68.A N TYR 64.A O no hydrogen 2.944 N/A ASN 68.A ND2 TYR 64.A O no hydrogen 2.842 N/A ASN 69.A N VAL 66.A O no hydrogen 3.156 N/A ALA 70.A N VAL 65.A O no hydrogen 2.974 N/A ALA 73.A N ASP 97.A OD1 no hydrogen 3.318 N/A ALA 73.A N ASP 97.A OD2 no hydrogen 2.862 N/A LEU 75.A N ASP 97.A OD1 no hydrogen 3.124 N/A GLY 78.A N ILE 57.A O no hydrogen 2.945 N/A ASP 79.A N ILE 76.A O no hydrogen 3.042 N/A LYS 80.A N VAL 182.A O no hydrogen 2.644 N/A LYS 80.A NZ GLY 78.A O no hydrogen 3.096 N/A LYS 80.A NZ THR 183.A O no hydrogen 3.331 N/A VAL 81.A N VAL 55.A O no hydrogen 2.859 N/A VAL 83.A N ALA 53.A O no hydrogen 2.840 N/A ARG 84.A N LEU 51.A O no hydrogen 3.016 N/A ARG 84.A NH2 ASP 52.A OD2 no hydrogen 3.114 N/A GLN 85.A N THR 82.A OG1 no hydrogen 3.078 N/A LEU 86.A N THR 82.A O no hydrogen 3.086 N/A LEU 87.A N VAL 83.A O no hydrogen 3.067 N/A LEU 87.A N ARG 84.A O no hydrogen 3.032 N/A TYR 88.A N ARG 84.A O no hydrogen 3.278 N/A GLY 89.A N GLN 85.A O no hydrogen 2.947 N/A LEU 90.A N LEU 86.A O no hydrogen 2.833 N/A MET 91.A N LEU 87.A O no hydrogen 3.013 N/A LEU 92.A N TYR 88.A O no hydrogen 2.822 N/A GLY 95.A N GLY 89.A O no hydrogen 2.889 N/A GLY 95.A N LEU 90.A O no hydrogen 3.307 N/A CYS 96.A N SER 71.A O no hydrogen 2.994 N/A CYS 96.A SG ASP 141.A OD2 no hydrogen 3.424 N/A ALA 98.A N ASP 97.A OD2 no hydrogen 3.024 N/A ALA 99.A N GLY 95.A O no hydrogen 3.087 N/A TYR 100.A N CYS 96.A O no hydrogen 3.211 N/A ALA 101.A N ASP 97.A O no hydrogen 3.145 N/A LEU 102.A N ALA 98.A O no hydrogen 3.044 N/A ALA 103.A N ALA 99.A O no hydrogen 2.987 N/A ASP 104.A N TYR 100.A O no hydrogen 2.930 N/A LYS 105.A N ALA 101.A O no hydrogen 2.984 N/A TYR 106.A N LEU 102.A O no hydrogen 2.808 N/A GLY 107.A N ALA 103.A O no hydrogen 2.859 N/A SER 108.A N SER 118.A OG no hydrogen 2.789 N/A ARG 112.A NE ASP 104.A OD2 no hydrogen 2.892 N/A ALA 114.A N THR 111.A OG1 no hydrogen 3.146 N/A ARG 115.A N THR 111.A O no hydrogen 2.886 N/A ARG 115.A NE ASP 104.A O no hydrogen 2.888 N/A ARG 115.A NE ASP 104.A OD1 no hydrogen 2.860 N/A ARG 115.A NH1 GLY 109.A O no hydrogen 3.155 N/A ARG 115.A NH2 ASP 104.A OD1 no hydrogen 2.884 N/A VAL 116.A N ARG 112.A O no hydrogen 2.896 N/A LYS 117.A N ALA 113.A O no hydrogen 3.178 N/A SER 118.A N ALA 114.A O no hydrogen 3.034 N/A PHE 119.A N ARG 115.A O no hydrogen 2.919 N/A ILE 120.A N VAL 116.A O no hydrogen 3.038 N/A GLY 121.A N LYS 117.A O no hydrogen 3.123 N/A LYS 122.A N SER 118.A O no hydrogen 3.021 N/A LYS 122.A NZ GLN 46.A OE1 no hydrogen 3.169 N/A LYS 122.A NZ TYR 106.A O no hydrogen 3.217 N/A MET 123.A N PHE 119.A O no hydrogen 3.033 N/A ASN 124.A N ILE 120.A O no hydrogen 3.146 N/A ASN 124.A ND2 PHE 137.A O no hydrogen 2.755 N/A THR 125.A N GLY 121.A O no hydrogen 2.946 N/A THR 125.A OG1 GLY 121.A O no hydrogen 2.906 N/A ALA 126.A N LYS 122.A O no hydrogen 2.854 N/A ALA 127.A N MET 123.A O no hydrogen 3.138 N/A THR 128.A N ASN 124.A O no hydrogen 2.968 N/A THR 128.A OG1 ASN 124.A O no hydrogen 3.177 N/A ASN 129.A N THR 125.A O no hydrogen 2.810 N/A LEU 130.A N ALA 126.A O no hydrogen 3.187 N/A LEU 130.A N ALA 127.A O no hydrogen 3.007 N/A GLY 131.A N THR 128.A O no hydrogen 2.786 N/A LEU 132.A N ALA 127.A O no hydrogen 3.168 N/A ASN 134.A N ASP 154.A OD1 no hydrogen 3.116 N/A THR 135.A OG1 SER 150.A OG no hydrogen 2.713 N/A THR 135.A OG1 ASP 154.A OD1 no hydrogen 2.730 N/A HIS 136.A N TYR 149.A O no hydrogen 2.977 N/A HIS 136.A NE2 ASP 138.A OD1 no hydrogen 2.703 N/A PHE 137.A N ASN 124.A OD1 no hydrogen 2.835 N/A ASP 138.A N ASN 148.A OD1 no hydrogen 2.842 N/A SER 139.A N ASN 148.A OD1 no hydrogen 3.088 N/A SER 139.A OG ASP 141.A OD1 no hydrogen 3.502 N/A SER 139.A OG ASN 148.A OD1 no hydrogen 2.961 N/A GLY 142.A N SER 139.A OG no hydrogen 2.850 N/A ILE 143.A N ASP 141.A OD1 no hydrogen 2.871 N/A GLY 144.A N ASP 141.A OD1 no hydrogen 2.748 N/A ALA 147.A N ASP 138.A OD2 no hydrogen 2.743 N/A TYR 149.A N HIS 136.A O no hydrogen 3.080 N/A SER 150.A N ARG 29.A O no hydrogen 3.034 N/A SER 150.A OG THR 135.A OG1 no hydrogen 2.713 N/A THR 151.A OG1 ALA 25.A O no hydrogen 3.300 N/A ARG 153.A N ALA 25.A O no hydrogen 3.071 N/A ARG 153.A NE ASP 26.A OD1 no hydrogen 2.821 N/A ARG 153.A NE ASP 26.A OD2 no hydrogen 3.085 N/A ARG 153.A NH2 ASP 26.A OD2 no hydrogen 2.855 N/A ASP 154.A N THR 151.A OG1 no hydrogen 2.988 N/A LEU 155.A N THR 151.A O no hydrogen 2.884 N/A THR 156.A N PRO 152.A O no hydrogen 3.220 N/A THR 156.A OG1 PRO 152.A O no hydrogen 2.656 N/A THR 156.A OG1 THR 236.A OG1 no hydrogen 2.988 N/A LYS 157.A N ARG 153.A O no hydrogen 3.161 N/A ILE 158.A N ASP 154.A O no hydrogen 3.026 N/A ALA 159.A N LEU 155.A O no hydrogen 2.940 N/A SER 160.A N THR 156.A O no hydrogen 2.877 N/A SER 161.A N LYS 157.A O no hydrogen 3.008 N/A ALA 162.A N ILE 158.A O no hydrogen 2.936 N/A MET 163.A N ALA 159.A O no hydrogen 2.810 N/A LYS 164.A N SER 161.A O no hydrogen 3.130 N/A ASN 165.A N ALA 162.A O no hydrogen 3.034 N/A PHE 168.A N ASN 165.A OD1 no hydrogen 2.953 N/A ARG 169.A N ASN 165.A O no hydrogen 3.008 N/A ARG 169.A NH1 MET 163.A O no hydrogen 2.867 N/A THR 170.A N SER 166.A O no hydrogen 3.070 N/A THR 170.A OG1 SER 166.A O no hydrogen 3.002 N/A VAL 171.A N THR 167.A O no hydrogen 2.957 N/A VAL 172.A N PHE 168.A O no hydrogen 2.995 N/A LYS 173.A N ARG 169.A O no hydrogen 3.292 N/A THR 174.A N VAL 171.A O no hydrogen 3.131 N/A THR 174.A OG1 THR 170.A O no hydrogen 2.726 N/A TYR 177.A N TRP 194.A O no hydrogen 2.906 N/A THR 178.A OG1 THR 193.A OG1 no hydrogen 3.078 N/A LYS 180.A NZ THR 178.A O no hydrogen 3.550 N/A THR 181.A N ARG 189.A O no hydrogen 2.877 N/A THR 181.A OG1 ASP 79.A OD1 no hydrogen 2.770 N/A VAL 182.A N LYS 80.A O no hydrogen 3.278 N/A THR 183.A N SER 187.A O no hydrogen 2.883 N/A THR 183.A OG1 THR 185.A OG1 no hydrogen 3.097 N/A THR 183.A OG1 SER 187.A OG no hydrogen 3.255 N/A THR 185.A N THR 183.A OG1 no hydrogen 3.185 N/A THR 185.A OG1 THR 183.A OG1 no hydrogen 3.097 N/A GLY 186.A N THR 183.A O no hydrogen 3.141 N/A SER 187.A OG THR 183.A OG1 no hydrogen 3.255 N/A ARG 189.A N THR 181.A O no hydrogen 2.659 N/A ARG 189.A NE ASP 79.A OD1 no hydrogen 2.805 N/A ARG 189.A NH2 ASP 79.A OD2 no hydrogen 2.987 N/A MET 191.A N ALA 179.A O no hydrogen 2.934 N/A THR 193.A OG1 THR 178.A OG1 no hydrogen 3.078 N/A TRP 194.A N TYR 177.A O no hydrogen 2.781 N/A TRP 194.A NE1 ALA 73.A O no hydrogen 2.975 N/A ASN 196.A N LYS 175.A O no hydrogen 2.779 N/A ASN 196.A ND2 VAL 172.A O no hydrogen 3.588 N/A ASN 196.A ND2 THR 174.A O no hydrogen 2.949 N/A THR 197.A N LEU 92.A O no hydrogen 3.121 N/A THR 197.A OG1 LEU 92.A O no hydrogen 3.322 N/A THR 197.A OG1 THR 212.A OG1 no hydrogen 2.672 N/A ASN 198.A N ASN 196.A OD1 no hydrogen 2.992 N/A LEU 200.A N ASN 198.A OD1 no hydrogen 3.137 N/A LEU 201.A N ASN 198.A O no hydrogen 3.297 N/A SER 202.A N GLY 199.A O no hydrogen 3.224 N/A SER 203.A N GLY 199.A O no hydrogen 3.179 N/A SER 203.A N LEU 200.A O no hydrogen 3.261 N/A SER 203.A OG GLY 199.A O no hydrogen 3.438 N/A TYR 204.A N LEU 200.A O no hydrogen 2.857 N/A ALA 207.A N TYR 204.A O no hydrogen 3.024 N/A ILE 208.A N ALA 225.A O no hydrogen 2.756 N/A GLY 209.A N ALA 225.A O no hydrogen 3.046 N/A LYS 211.A N VAL 223.A O no hydrogen 2.910 N/A LYS 211.A NZ SER 94.A OG no hydrogen 2.832 N/A LYS 211.A NZ THR 212.A O no hydrogen 2.705 N/A THR 212.A OG1 THR 197.A OG1 no hydrogen 2.672 N/A GLY 213.A N CYS 221.A O no hydrogen 3.051 N/A SER 214.A N SER 33.A OG no hydrogen 2.814 N/A CYS 221.A N GLY 213.A O no hydrogen 2.877 N/A CYS 221.A SG ALA 218.A O no hydrogen 3.028 N/A LEU 222.A N VAL 237.A O no hydrogen 2.875 N/A VAL 223.A N LYS 211.A O no hydrogen 2.839 N/A PHE 224.A N GLY 235.A O no hydrogen 2.805 N/A ALA 225.A N GLY 209.A O no hydrogen 3.085 N/A ALA 226.A N VAL 233.A O no hydrogen 2.998 N/A THR 227.A N GLY 206.A O no hydrogen 2.841 N/A THR 227.A OG1 THR 232.A OG1 no hydrogen 2.853 N/A ARG 228.A N LYS 231.A O no hydrogen 2.893 N/A ARG 228.A NE SER 205.A O no hydrogen 2.743 N/A ARG 228.A NH2 SER 205.A O no hydrogen 2.989 N/A LYS 231.A N ARG 228.A O no hydrogen 3.085 N/A LYS 231.A NZ GLY 257.A O no hydrogen 2.932 N/A THR 232.A OG1 THR 227.A OG1 no hydrogen 2.853 N/A VAL 233.A N ALA 226.A O no hydrogen 2.975 N/A ILE 234.A N MET 12.A O no hydrogen 3.173 N/A GLY 235.A N PHE 224.A O no hydrogen 2.847 N/A THR 236.A N TYR 10.A O no hydrogen 2.816 N/A THR 236.A OG1 THR 156.A OG1 no hydrogen 2.988 N/A VAL 237.A N LEU 222.A O no hydrogen 2.816 N/A LEU 238.A N GLY 8.A O no hydrogen 2.869 N/A SER 240.A N TYR 220.A O no hydrogen 2.862 N/A SER 240.A OG ASP 249.A OD1 no hydrogen 3.190 N/A ALA 245.A N SER 242.A OG no hydrogen 3.384 N/A LEU 246.A N SER 242.A O no hydrogen 2.828 N/A GLU 247.A N ILE 243.A O no hydrogen 2.919 N/A SER 248.A N PRO 244.A O no hydrogen 3.000 N/A ASP 249.A N ALA 245.A O no hydrogen 2.885 N/A ALA 250.A N LEU 246.A O no hydrogen 3.092 N/A THR 251.A N GLU 247.A O no hydrogen 2.867 N/A THR 251.A OG1 GLU 247.A O no hydrogen 2.783 N/A LYS 252.A N SER 248.A O no hydrogen 2.904 N/A LYS 252.A NZ THR 3.A O no hydrogen 3.045 N/A ILE 253.A N ASP 249.A O no hydrogen 3.069 N/A MET 254.A N ALA 250.A O no hydrogen 2.973 N/A ASN 255.A N THR 251.A O no hydrogen 2.901 N/A TYR 256.A N LYS 252.A O no hydrogen 2.988 N/A GLY 257.A N ILE 253.A O no hydrogen 2.921 N/A PHE 258.A N MET 254.A O no hydrogen 2.945 N/A ALA 259.A N ASN 255.A O no hydrogen 3.267 N/A ALA 259.A N TYR 256.A O no hydrogen 3.129 N/A