Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7umw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N GLU 31.A OE1 no hydrogen 3.239 N/A LEU 4.A N GLU 31.A O no hydrogen 3.033 N/A SER 5.A N GLY 2.A O no hydrogen 3.168 N/A SER 5.A OG GLY 2.A O no hydrogen 2.635 N/A LYS 7.A N LEU 4.A O no hydrogen 2.958 N/A ARG 8.A N ASP 86.A OD2 no hydrogen 2.979 N/A ARG 8.A NE GLU 34.A OE2 no hydrogen 3.241 N/A ILE 9.A N GLU 34.A O no hydrogen 2.986 N/A LEU 10.A N GLY 87.A O no hydrogen 3.089 N/A VAL 11.A N ALA 36.A O no hydrogen 2.805 N/A THR 12.A N VAL 89.A O no hydrogen 3.060 N/A THR 12.A OG1 VAL 89.A O no hydrogen 2.687 N/A ALA 15.A N SER 19.A OG no hydrogen 3.009 N/A SER 16.A N SER 19.A OG no hydrogen 3.099 N/A LEU 18.A N SER 16.A OG no hydrogen 2.930 N/A SER 19.A N SER 16.A O no hydrogen 2.926 N/A SER 19.A OG SER 16.A O no hydrogen 3.161 N/A TYR 22.A N SER 19.A O no hydrogen 3.146 N/A GLY 23.A N SER 19.A O no hydrogen 3.342 N/A ILE 24.A N ILE 20.A O no hydrogen 2.902 N/A ALA 25.A N ALA 21.A O no hydrogen 2.822 N/A GLN 26.A N TYR 22.A O no hydrogen 2.995 N/A ALA 27.A N GLY 23.A O no hydrogen 3.135 N/A MET 28.A N ILE 24.A O no hydrogen 2.939 N/A HIS 29.A N ALA 25.A O no hydrogen 2.893 N/A ARG 30.A N GLN 26.A O no hydrogen 2.808 N/A ARG 30.A NH1 GLU 31.A OE2 no hydrogen 2.949 N/A ARG 30.A NH1 ASN 227.A OD1 no hydrogen 3.011 N/A ARG 30.A NH2 ASN 227.A OD1 no hydrogen 2.448 N/A GLU 31.A N ALA 27.A O no hydrogen 2.989 N/A GLU 31.A N MET 28.A O no hydrogen 3.150 N/A GLY 32.A N HIS 29.A O no hydrogen 2.945 N/A ALA 33.A N MET 28.A O no hydrogen 3.015 N/A GLU 34.A N LYS 7.A O no hydrogen 2.917 N/A ALA 36.A N ILE 9.A O no hydrogen 3.218 N/A PHE 37.A N ILE 59.A O no hydrogen 2.837 N/A THR 38.A N VAL 11.A O no hydrogen 3.244 N/A TYR 39.A N LEU 61.A O no hydrogen 2.873 N/A LEU 44.A N ASN 41.A O no hydrogen 3.195 N/A LEU 44.A N ASN 41.A OD1 no hydrogen 3.063 N/A ARG 47.A NH1 ALA 15.A O no hydrogen 2.903 N/A VAL 48.A N LEU 44.A O no hydrogen 3.130 N/A GLU 49.A N LYS 45.A O no hydrogen 2.889 N/A GLU 50.A N GLY 46.A O no hydrogen 3.141 N/A PHE 51.A N ARG 47.A O no hydrogen 2.975 N/A ALA 52.A N VAL 48.A O no hydrogen 2.761 N/A ALA 53.A N GLU 49.A O no hydrogen 2.971 N/A GLN 54.A N GLU 50.A O no hydrogen 2.977 N/A LEU 55.A N PHE 51.A O no hydrogen 3.144 N/A GLY 56.A N ALA 53.A O no hydrogen 3.067 N/A SER 57.A N ALA 52.A O no hydrogen 2.796 N/A SER 57.A OG LEU 35.A O no hydrogen 2.624 N/A ILE 59.A N SER 57.A OG no hydrogen 3.148 N/A LEU 61.A N PHE 37.A O no hydrogen 2.879 N/A CYS 63.A N TYR 39.A O no hydrogen 2.895 N/A ASP 64.A N SER 70.A OG no hydrogen 2.773 N/A ALA 66.A N ASP 64.A OD1 no hydrogen 3.047 N/A GLU 67.A N ASP 64.A O no hydrogen 3.012 N/A SER 70.A OG ASP 64.A O no hydrogen 3.512 N/A ILE 71.A N GLU 67.A O no hydrogen 3.206 N/A ASP 72.A N ASP 68.A O no hydrogen 2.936 N/A THR 73.A N ALA 69.A O no hydrogen 2.894 N/A THR 73.A OG1 ALA 69.A O no hydrogen 2.906 N/A MET 74.A N SER 70.A O no hydrogen 3.048 N/A PHE 75.A N ILE 71.A O no hydrogen 3.128 N/A ALA 76.A N ASP 72.A O no hydrogen 2.943 N/A GLU 77.A N THR 73.A O no hydrogen 2.897 N/A LEU 78.A N MET 74.A O no hydrogen 2.810 N/A GLY 79.A N PHE 75.A O no hydrogen 2.846 N/A LYS 80.A N GLU 77.A O no hydrogen 3.185 N/A LYS 80.A NZ GLU 77.A OE2 no hydrogen 3.073 N/A VAL 81.A N LEU 78.A O no hydrogen 3.041 N/A TRP 82.A N LEU 78.A O no hydrogen 2.691 N/A PHE 85.A N MET 134.A O no hydrogen 2.871 N/A ASP 86.A N ARG 8.A O no hydrogen 2.947 N/A VAL 89.A N LEU 10.A O no hydrogen 2.752 N/A HIS 90.A N LEU 142.A O no hydrogen 2.712 N/A HIS 90.A ND1 THR 143.A OG1 no hydrogen 2.878 N/A HIS 90.A NE2 SER 123.A OG no hydrogen 2.825 N/A SER 91.A N THR 12.A OG1 no hydrogen 2.987 N/A PHE 94.A N SER 120.A OG no hydrogen 3.046 N/A GLN 99.A N PRO 96.A O no hydrogen 2.771 N/A GLN 99.A NE2 ASP 98.A OD1 no hydrogen 3.453 N/A GLN 99.A NE2 ALA 107.A O no hydrogen 3.134 N/A LEU 100.A N GLY 97.A O no hydrogen 3.030 N/A GLY 102.A N ASN 155.A OD1 no hydrogen 2.836 N/A ASN 106.A N ASP 103.A OD1 no hydrogen 2.910 N/A ALA 107.A N ASP 103.A O no hydrogen 2.898 N/A VAL 108.A N TYR 104.A O no hydrogen 2.935 N/A GLY 112.A N THR 109.A OG1 no hydrogen 3.058 N/A PHE 113.A N THR 109.A O no hydrogen 2.821 N/A LYS 114.A N ARG 110.A O no hydrogen 2.828 N/A ILE 115.A N GLU 111.A O no hydrogen 2.944 N/A ALA 116.A N GLY 112.A O no hydrogen 2.975 N/A HIS 117.A N PHE 113.A O no hydrogen 3.042 N/A HIS 117.A ND1 PHE 113.A O no hydrogen 2.856 N/A ASP 118.A N LYS 114.A O no hydrogen 2.833 N/A ILE 119.A N ILE 115.A O no hydrogen 2.895 N/A SER 120.A N ALA 116.A O no hydrogen 2.951 N/A SER 120.A OG ALA 116.A O no hydrogen 2.866 N/A SER 121.A N HIS 117.A O no hydrogen 2.901 N/A SER 121.A OG SER 165.A OG no hydrogen 2.794 N/A TYR 122.A N HIS 117.A O no hydrogen 2.972 N/A SER 123.A N ASP 118.A O no hydrogen 3.138 N/A SER 123.A OG HIS 90.A NE2 no hydrogen 2.825 N/A SER 123.A OG ILE 119.A O no hydrogen 2.599 N/A PHE 124.A N SER 121.A O no hydrogen 3.153 N/A ALA 126.A N TYR 122.A O no hydrogen 2.845 N/A MET 127.A N SER 123.A O no hydrogen 3.027 N/A ALA 128.A N PHE 124.A O no hydrogen 3.191 N/A LYS 129.A N VAL 125.A O no hydrogen 2.828 N/A ALA 130.A N ALA 126.A O no hydrogen 3.171 N/A CYS 131.A N MET 127.A O no hydrogen 3.155 N/A CYS 131.A SG MET 127.A O no hydrogen 3.437 N/A CYS 131.A SG ALA 128.A O no hydrogen 3.988 N/A ARG 132.A NE GLU 180.A OE2 no hydrogen 2.703 N/A ARG 132.A NH2 GLU 180.A OE1 no hydrogen 2.735 N/A ARG 132.A NH2 GLU 180.A OE2 no hydrogen 3.534 N/A MET 134.A N CYS 131.A O no hydrogen 2.859 N/A LEU 135.A N ARG 132.A O no hydrogen 3.353 N/A ASN 136.A N PHE 85.A O no hydrogen 2.892 N/A ASN 136.A ND2 ASP 86.A OD1 no hydrogen 2.922 N/A GLY 138.A N GLY 181.A O no hydrogen 2.807 N/A SER 139.A OG ASN 136.A O no hydrogen 2.801 N/A ALA 140.A N ASP 86.A O no hydrogen 3.113 N/A LEU 141.A N ARG 183.A O no hydrogen 2.762 N/A LEU 142.A N PHE 88.A O no hydrogen 3.147 N/A THR 143.A N ASN 185.A O no hydrogen 3.224 N/A THR 143.A OG1 HIS 90.A ND1 no hydrogen 2.878 N/A THR 143.A OG1 HIS 90.A O no hydrogen 3.369 N/A SER 145.A N ILE 187.A O no hydrogen 2.764 N/A SER 145.A OG GLU 167.A OE1 no hydrogen 2.652 N/A ALA 149.A N TYR 146.A O no hydrogen 2.837 N/A GLU 150.A N LEU 147.A O no hydrogen 2.875 N/A ARG 151.A N LEU 147.A O no hydrogen 3.082 N/A ARG 151.A NH1 SER 252.A O no hydrogen 3.148 N/A ARG 151.A NH2 SER 252.A O no hydrogen 2.798 N/A TYR 156.A N ILE 153.A O no hydrogen 3.255 N/A ASN 157.A ND2 GLN 99.A O no hydrogen 2.951 N/A ASN 157.A ND2 GLY 102.A O no hydrogen 3.009 N/A MET 159.A N TYR 156.A O no hydrogen 3.056 N/A GLY 160.A N ASN 157.A O no hydrogen 2.883 N/A ALA 162.A N VAL 158.A O no hydrogen 3.003 N/A LYS 163.A N MET 159.A O no hydrogen 2.866 N/A LYS 163.A NZ LEU 144.A O no hydrogen 2.818 N/A ALA 164.A N GLY 160.A O no hydrogen 2.958 N/A SER 165.A N LEU 161.A O no hydrogen 2.913 N/A SER 165.A OG SER 121.A OG no hydrogen 2.794 N/A LEU 166.A N ALA 162.A O no hydrogen 2.925 N/A GLU 167.A N LYS 163.A O no hydrogen 2.903 N/A ALA 168.A N ALA 164.A O no hydrogen 3.102 N/A ASN 169.A N SER 165.A O no hydrogen 2.777 N/A ASN 169.A ND2 SER 121.A O no hydrogen 2.871 N/A VAL 170.A N LEU 166.A O no hydrogen 2.887 N/A ARG 171.A N GLU 167.A O no hydrogen 3.273 N/A TYR 172.A N ALA 168.A O no hydrogen 2.903 N/A MET 173.A N ASN 169.A O no hydrogen 2.842 N/A ALA 174.A N VAL 170.A O no hydrogen 2.852 N/A ASN 175.A N ARG 171.A O no hydrogen 2.942 N/A ALA 176.A N TYR 172.A O no hydrogen 3.030 N/A MET 177.A N MET 173.A O no hydrogen 2.834 N/A GLY 178.A N ALA 174.A O no hydrogen 2.964 N/A GLU 180.A N MET 177.A O no hydrogen 3.367 N/A GLY 181.A N GLY 178.A O no hydrogen 3.009 N/A VAL 182.A N MET 177.A O no hydrogen 3.129 N/A ARG 183.A N SER 139.A O no hydrogen 2.982 N/A ARG 183.A NH1 LEU 232.A O no hydrogen 3.340 N/A ARG 183.A NH1 ILE 240.A O no hydrogen 2.954 N/A ARG 183.A NH2 LEU 232.A O no hydrogen 3.378 N/A VAL 184.A N SER 241.A OG no hydrogen 3.217 N/A ASN 185.A N LEU 141.A O no hydrogen 3.042 N/A ASN 185.A ND2 ILE 240.A O no hydrogen 3.043 N/A ALA 186.A N GLU 243.A O no hydrogen 2.837 N/A ILE 187.A N THR 143.A O no hydrogen 3.050 N/A SER 188.A N VAL 245.A O no hydrogen 2.800 N/A ALA 189.A N SER 145.A O no hydrogen 3.210 N/A GLY 190.A N VAL 247.A O no hydrogen 3.033 N/A THR 194.A N ILE 192.A O no hydrogen 2.961 N/A ALA 196.A N THR 194.A OG1 no hydrogen 2.897 N/A ALA 197.A N THR 194.A O no hydrogen 2.987 N/A SER 198.A N LEU 195.A O no hydrogen 3.116 N/A SER 198.A OG LEU 195.A O no hydrogen 2.840 N/A ILE 200.A N ALA 197.A O no hydrogen 3.146 N/A MET 206.A N ASP 202.A O no hydrogen 3.093 N/A LEU 207.A N PHE 203.A O no hydrogen 2.939 N/A ALA 208.A N ARG 204.A O no hydrogen 2.976 N/A HIS 209.A N LYS 205.A O no hydrogen 2.688 N/A CYS 210.A N MET 206.A O no hydrogen 2.866 N/A GLU 211.A N LEU 207.A O no hydrogen 2.655 N/A ALA 212.A N ALA 208.A O no hydrogen 3.181 N/A ALA 212.A N HIS 209.A O no hydrogen 3.153 N/A VAL 213.A N HIS 209.A O no hydrogen 3.057 N/A VAL 213.A N CYS 210.A O no hydrogen 3.251 N/A THR 214.A N.A CYS 210.A O no hydrogen 2.943 N/A THR 214.A N.B CYS 210.A O no hydrogen 2.939 N/A THR 214.A OG1.A ASP 248.A O no hydrogen 3.159 N/A THR 214.A OG1.A GLY 249.A O no hydrogen 2.928 N/A THR 214.A OG1.B CYS 210.A O no hydrogen 3.094 N/A THR 214.A OG1.B ARG 218.A O no hydrogen 3.168 N/A ILE 216.A N GLY 249.A O no hydrogen 3.435 N/A ARG 217.A N THR 214.A O.A no hydrogen 2.939 N/A ARG 217.A N THR 214.A O.B no hydrogen 2.963 N/A ARG 217.A NH1 THR 214.A O.A no hydrogen 2.833 N/A ARG 217.A NH1 THR 214.A O.B no hydrogen 2.801 N/A ARG 218.A NH1 THR 219.A O no hydrogen 3.043 N/A ARG 218.A NH1 ASP 224.A OD2 no hydrogen 2.707 N/A ARG 218.A NH2 ASP 224.A OD1 no hydrogen 3.080 N/A ARG 218.A NH2 ASP 224.A OD2 no hydrogen 3.248 N/A THR 221.A N ASP 224.A OD2 no hydrogen 2.840 N/A THR 221.A OG1 GLU 223.A OE1 no hydrogen 3.400 N/A ASP 224.A N THR 221.A OG1 no hydrogen 2.964 N/A VAL 225.A N THR 221.A O no hydrogen 2.940 N/A GLY 226.A N ILE 222.A O no hydrogen 2.770 N/A ASN 227.A N GLU 223.A O no hydrogen 2.996 N/A SER 228.A N ASP 224.A O no hydrogen 3.231 N/A ALA 229.A N VAL 225.A O no hydrogen 2.797 N/A ALA 230.A N GLY 226.A O no hydrogen 2.889 N/A PHE 231.A N ASN 227.A O no hydrogen 3.176 N/A LEU 232.A N SER 228.A O no hydrogen 2.959 N/A CYS 233.A N ALA 229.A O no hydrogen 3.057 N/A CYS 233.A N ALA 230.A O no hydrogen 3.285 N/A CYS 233.A SG ALA 229.A O no hydrogen 3.736 N/A SER 234.A N PHE 231.A O no hydrogen 3.078 N/A SER 234.A OG PHE 231.A O no hydrogen 2.963 N/A LEU 236.A N SER 234.A OG no hydrogen 2.973 N/A SER 237.A N SER 234.A O no hydrogen 3.166 N/A SER 237.A OG PHE 231.A O no hydrogen 2.962 N/A SER 237.A OG LEU 232.A O no hydrogen 3.096 N/A SER 237.A OG SER 234.A O no hydrogen 3.074 N/A ALA 238.A N ASP 235.A O no hydrogen 3.178 N/A ILE 240.A N SER 237.A O no hydrogen 2.904 N/A GLY 242.A N VAL 184.A O no hydrogen 2.726 N/A GLU 243.A N ASN 185.A OD1 no hydrogen 2.863 N/A VAL 245.A N ALA 186.A O no hydrogen 2.873 N/A HIS 246.A NE2 GLU 150.A OE2 no hydrogen 2.638 N/A VAL 247.A N SER 188.A O no hydrogen 2.826 N/A GLY 250.A N ASP 248.A OD1 no hydrogen 3.136 N/A PHE 251.A N ASP 248.A O no hydrogen 3.181 N/A SER 252.A N ASP 248.A OD2 no hydrogen 2.839 N/A ILE 253.A N GLY 250.A O no hydrogen 3.071 N/A ALA 254.A N PHE 251.A O no hydrogen 3.246 N/A