Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5jjm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N GLU 170.A OE2 no hydrogen 3.053 N/A PHE 6.A N GLU 170.A OE1 no hydrogen 2.807 N/A LEU 10.A N PHE 6.A O no hydrogen 2.805 N/A GLU 11.A N LEU 7.A O no hydrogen 2.957 N/A ALA 12.A N ASN 8.A O no hydrogen 3.078 N/A ILE 13.A N VAL 9.A O no hydrogen 2.982 N/A ALA 20.A N ASP 100.A OD1 no hydrogen 2.803 N/A GLY 21.A N ASP 100.A OD2 no hydrogen 2.524 N/A HIS 22.A N ASP 100.A OD2 no hydrogen 3.251 N/A HIS 22.A ND1 SER 36.A OG no hydrogen 2.602 N/A ASN 24.A ND2 ASP 100.A O no hydrogen 2.732 N/A ASN 25.A N ASP 23.A OD1 no hydrogen 3.127 N/A GLN 26.A N ASP 23.A O no hydrogen 3.249 N/A GLN 26.A NE2 ASP 23.A O no hydrogen 3.135 N/A SER 29.A N PRO 27.A O no hydrogen 2.751 N/A ALA 32.A N SER 29.A OG no hydrogen 3.195 N/A LEU 33.A N SER 29.A O no hydrogen 3.035 N/A LEU 34.A N PHE 30.A O no hydrogen 3.083 N/A SER 35.A N ALA 31.A O no hydrogen 3.066 N/A SER 35.A OG ALA 31.A O no hydrogen 2.971 N/A SER 35.A OG ASP 223.A OD1 no hydrogen 3.387 N/A SER 36.A N ALA 32.A O no hydrogen 3.171 N/A SER 36.A OG HIS 22.A ND1 no hydrogen 2.602 N/A SER 36.A OG ALA 32.A O no hydrogen 3.358 N/A LEU 37.A N LEU 33.A O no hydrogen 2.932 N/A ASN 38.A N LEU 34.A O no hydrogen 2.915 N/A ASN 38.A ND2 ASP 223.A O no hydrogen 3.150 N/A GLU 39.A N SER 35.A O no hydrogen 3.089 N/A LEU 40.A N SER 36.A O no hydrogen 2.893 N/A GLY 41.A N LEU 37.A O no hydrogen 2.677 N/A GLU 42.A N ASN 38.A O no hydrogen 3.093 N/A GLU 42.A N GLU 39.A O no hydrogen 3.167 N/A ARG 43.A N GLU 39.A O no hydrogen 3.205 N/A ARG 43.A NE GLU 39.A OE2 no hydrogen 2.848 N/A ARG 43.A NH1 CYS 19.A O no hydrogen 2.981 N/A ARG 43.A NH2 GLU 39.A OE2 no hydrogen 3.519 N/A GLN 44.A N LEU 40.A O no hydrogen 2.898 N/A LEU 45.A N GLY 41.A O no hydrogen 2.854 N/A VAL 46.A N GLU 42.A O no hydrogen 3.445 N/A HIS 47.A ND1 ARG 43.A O no hydrogen 3.077 N/A VAL 48.A N GLN 44.A O no hydrogen 2.800 N/A VAL 49.A N LEU 45.A O no hydrogen 2.938 N/A LYS 50.A N VAL 46.A O no hydrogen 3.225 N/A TRP 51.A N HIS 47.A O no hydrogen 2.974 N/A ALA 52.A N VAL 48.A O no hydrogen 2.695 N/A LYS 53.A N VAL 49.A O no hydrogen 2.937 N/A ALA 54.A N TRP 51.A O no hydrogen 3.009 N/A LEU 55.A N ALA 52.A O no hydrogen 2.989 N/A PHE 58.A N LEU 55.A O no hydrogen 3.037 N/A ASN 60.A N GLY 57.A O no hydrogen 3.080 N/A LEU 61.A N PHE 58.A O no hydrogen 3.176 N/A ASP 64.A N HIS 62.A ND1 no hydrogen 2.902 N/A GLN 66.A N HIS 62.A O no hydrogen 2.941 N/A GLN 66.A NE2 LEU 61.A O no hydrogen 2.968 N/A MET 67.A N VAL 63.A O no hydrogen 3.374 N/A ALA 68.A N ASP 64.A O no hydrogen 2.921 N/A VAL 69.A N ASP 65.A O no hydrogen 2.776 N/A ILE 70.A N GLN 66.A O no hydrogen 3.109 N/A GLN 71.A N MET 67.A O no hydrogen 2.903 N/A TYR 72.A N ALA 68.A O no hydrogen 2.943 N/A SER 73.A N VAL 69.A O no hydrogen 2.897 N/A SER 73.A OG VAL 69.A O no hydrogen 2.750 N/A TRP 74.A N ILE 70.A O no hydrogen 3.228 N/A LEU 77.A N SER 73.A O no hydrogen 3.079 N/A MET 78.A N TRP 74.A O no hydrogen 2.857 N/A VAL 79.A N MET 75.A O no hydrogen 2.875 N/A PHE 80.A N GLY 76.A O no hydrogen 2.933 N/A ALA 81.A N LEU 77.A O no hydrogen 3.138 N/A MET 82.A N MET 78.A O no hydrogen 3.163 N/A GLY 83.A N VAL 79.A O no hydrogen 3.183 N/A TRP 84.A N PHE 80.A O no hydrogen 3.330 N/A TRP 84.A N ALA 81.A O no hydrogen 3.102 N/A ARG 85.A N ALA 81.A O no hydrogen 2.986 N/A ARG 85.A NE TYR 96.A O no hydrogen 3.111 N/A ARG 85.A NH2 PHE 97.A O no hydrogen 2.787 N/A SER 86.A N MET 82.A O no hydrogen 2.755 N/A SER 86.A OG MET 82.A O no hydrogen 2.755 N/A SER 86.A OG MET 94.A O no hydrogen 3.543 N/A PHE 87.A N GLY 83.A O no hydrogen 2.952 N/A THR 88.A N TRP 84.A O no hydrogen 2.960 N/A THR 88.A OG1 TRP 84.A O no hydrogen 3.341 N/A ASN 89.A N ARG 85.A O no hydrogen 3.182 N/A ASN 89.A ND2 ARG 85.A O no hydrogen 3.034 N/A VAL 90.A N SER 86.A O no hydrogen 3.182 N/A SER 92.A N SER 86.A O no hydrogen 2.981 N/A SER 92.A OG SER 124.A OG no hydrogen 2.910 N/A ARG 93.A N VAL 90.A O no hydrogen 3.226 N/A LEU 95.A N PHE 103.A O no hydrogen 2.997 N/A TYR 96.A N SER 86.A OG no hydrogen 2.606 N/A ALA 98.A N LEU 101.A O no hydrogen 3.238 N/A LEU 101.A N ALA 98.A O no hydrogen 2.912 N/A PHE 103.A N LEU 95.A O no hydrogen 2.869 N/A ARG 107.A N ASN 104.A OD1 no hydrogen 2.972 N/A ARG 107.A NE ASP 28.A OD1 no hydrogen 2.947 N/A ARG 107.A NH1 VAL 102.A O no hydrogen 2.591 N/A ARG 107.A NH2 ASN 24.A OD1 no hydrogen 2.884 N/A ARG 107.A NH2 ASP 28.A OD1 no hydrogen 3.371 N/A MET 108.A N ASN 104.A O no hydrogen 3.000 N/A HIS 109.A N GLU 105.A O no hydrogen 2.974 N/A LYS 110.A N TYR 106.A O no hydrogen 2.993 N/A LYS 110.A NZ ASP 28.A O no hydrogen 3.191 N/A SER 111.A N ARG 107.A O no hydrogen 2.935 N/A SER 111.A OG MET 108.A O no hydrogen 3.031 N/A ARG 112.A N HIS 109.A O no hydrogen 3.134 N/A MET 113.A N SER 111.A OG no hydrogen 3.140 N/A GLN 116.A N GLN 116.A OE1 no hydrogen 2.800 N/A CYS 117.A N MET 113.A O no hydrogen 2.968 N/A CYS 117.A SG MET 113.A O no hydrogen 3.264 N/A VAL 118.A N TYR 114.A O no hydrogen 2.934 N/A ARG 119.A N SER 115.A O no hydrogen 3.058 N/A ARG 119.A NH1 GLU 205.A OE2 no hydrogen 2.966 N/A MET 120.A N GLN 116.A O no hydrogen 2.955 N/A ARG 121.A N CYS 117.A O no hydrogen 2.846 N/A ARG 121.A NH1 SER 92.A O no hydrogen 3.166 N/A HIS 122.A N VAL 118.A O no hydrogen 2.958 N/A LEU 123.A N ARG 119.A O no hydrogen 3.054 N/A SER 124.A N MET 120.A O no hydrogen 2.706 N/A SER 124.A OG GLY 83.A O no hydrogen 2.795 N/A SER 124.A OG SER 92.A OG no hydrogen 2.910 N/A GLN 125.A N ARG 121.A O no hydrogen 2.866 N/A GLU 126.A N HIS 122.A O no hydrogen 2.966 N/A PHE 127.A N SER 124.A O no hydrogen 3.016 N/A TRP 129.A N GLN 125.A O no hydrogen 2.886 N/A LEU 130.A N GLU 126.A O no hydrogen 2.758 N/A GLN 131.A N GLY 128.A O no hydrogen 3.089 N/A ILE 132.A N PHE 127.A O no hydrogen 2.746 N/A THR 133.A N GLU 136.A OE1 no hydrogen 2.770 N/A GLU 136.A N THR 133.A OG1 no hydrogen 3.066 N/A PHE 137.A N THR 133.A O no hydrogen 2.989 N/A LEU 138.A N PRO 134.A O no hydrogen 3.243 N/A CYS 139.A N GLN 135.A O no hydrogen 3.140 N/A CYS 139.A SG GLN 135.A O no hydrogen 3.408 N/A MET 140.A N GLU 136.A O no hydrogen 2.920 N/A LYS 141.A N PHE 137.A O no hydrogen 2.982 N/A LYS 141.A NZ GLU 14.A OE1 no hydrogen 3.454 N/A LYS 141.A NZ GLU 14.A OE2 no hydrogen 2.635 N/A ALA 142.A N LEU 138.A O no hydrogen 3.335 N/A LEU 143.A N CYS 139.A O no hydrogen 3.132 N/A LEU 144.A N LYS 141.A O no hydrogen 2.856 N/A PHE 146.A N LEU 143.A O no hydrogen 2.929 N/A SER 147.A OG LEU 144.A O no hydrogen 2.972 N/A ILE 149.A N LYS 245.A O no hydrogen 3.062 N/A VAL 151.A N LYS 243.A O no hydrogen 2.989 N/A GLY 153.A N PRO 150.A O no hydrogen 2.842 N/A LEU 154.A N GLN 157.A OE1 no hydrogen 2.883 N/A LYS 155.A N ASP 65.A OD1 no hydrogen 2.899 N/A ASN 156.A N.A ASP 65.A OD2 no hydrogen 2.830 N/A ASN 156.A N.B ASP 65.A OD2 no hydrogen 2.900 N/A GLN 157.A NE2 ASP 161.A OD1 no hydrogen 3.405 N/A PHE 159.A N ASN 156.A OD1.B no hydrogen 2.728 N/A PHE 160.A N ASN 156.A O.A no hydrogen 3.079 N/A PHE 160.A N ASN 156.A O.B no hydrogen 3.154 N/A ASP 161.A N GLN 157.A O no hydrogen 3.073 N/A GLU 162.A N LYS 158.A O no hydrogen 3.171 N/A LEU 163.A N PHE 159.A O no hydrogen 3.073 N/A ARG 164.A N PHE 160.A O no hydrogen 2.886 N/A MET 165.A N ASP 161.A O no hydrogen 3.177 N/A ASN 166.A N GLU 162.A O no hydrogen 3.190 N/A TYR 167.A N LEU 163.A O no hydrogen 3.136 N/A TYR 167.A OH PRO 56.A O no hydrogen 2.636 N/A ILE 168.A N ARG 164.A O no hydrogen 2.982 N/A LYS 169.A N MET 165.A O no hydrogen 2.777 N/A GLU 170.A N ASN 166.A O no hydrogen 2.891 N/A LEU 171.A N TYR 167.A O no hydrogen 3.069 N/A ASP 172.A N ILE 168.A O no hydrogen 2.960 N/A ARG 173.A N LYS 169.A O no hydrogen 2.985 N/A ARG 173.A NE GLU 170.A OE2 no hydrogen 3.076 N/A ARG 173.A NH2 GLU 170.A OE2 no hydrogen 2.925 N/A ILE 174.A N GLU 170.A O no hydrogen 3.204 N/A ILE 175.A N LEU 171.A O no hydrogen 3.090 N/A ALA 176.A N ASP 172.A O no hydrogen 2.935 N/A CYS 177.A N ARG 173.A O no hydrogen 3.105 N/A CYS 177.A SG CYS 2.A O no hydrogen 3.370 N/A CYS 177.A SG ARG 173.A O no hydrogen 3.869 N/A ARG 179.A N ALA 176.A O no hydrogen 3.295 N/A ARG 179.A NH1 ILE 175.A O no hydrogen 2.826 N/A THR 183.A OG1 ASN 181.A OD1 no hydrogen 3.227 N/A SER 184.A N ASN 181.A O no hydrogen 3.153 N/A SER 186.A OG THR 183.A O no hydrogen 3.382 N/A ARG 187.A N THR 183.A O no hydrogen 3.480 N/A ARG 187.A NH2 THR 183.A OG1 no hydrogen 2.853 N/A ARG 188.A N SER 184.A O no hydrogen 3.050 N/A ARG 188.A NE GLU 136.A OE2 no hydrogen 2.985 N/A ARG 188.A NH1 LEU 130.A O no hydrogen 2.625 N/A ARG 188.A NH1 GLN 191.A OE1 no hydrogen 3.344 N/A ARG 188.A NH2 LEU 130.A O no hydrogen 2.936 N/A ARG 188.A NH2 GLN 131.A O no hydrogen 3.038 N/A ARG 188.A NH2 GLU 136.A OE1 no hydrogen 2.712 N/A ARG 188.A NH2 GLU 136.A OE2 no hydrogen 3.433 N/A PHE 189.A N CYS 185.A O no hydrogen 2.911 N/A TYR 190.A N SER 186.A O no hydrogen 2.940 N/A GLN 191.A N ARG 187.A O no hydrogen 3.097 N/A LEU 192.A N ARG 188.A O no hydrogen 2.841 N/A THR 193.A N PHE 189.A O no hydrogen 2.878 N/A THR 193.A OG1 PHE 189.A O no hydrogen 3.192 N/A THR 193.A OG1 TYR 190.A O no hydrogen 3.479 N/A THR 193.A OG1 HIS 250.A NE2 no hydrogen 2.813 N/A LYS 194.A N TYR 190.A O no hydrogen 3.018 N/A LEU 195.A N GLN 191.A O no hydrogen 3.173 N/A LEU 196.A N LEU 192.A O no hydrogen 2.926 N/A ASP 197.A N THR 193.A O no hydrogen 2.836 N/A SER 198.A N LYS 194.A O no hydrogen 3.078 N/A SER 198.A OG LEU 195.A O no hydrogen 2.646 N/A VAL 199.A N LEU 196.A O no hydrogen 3.076 N/A GLN 200.A N ASP 197.A O no hydrogen 3.089 N/A GLN 200.A NE2 SER 147.A OG no hydrogen 2.982 N/A ALA 203.A N VAL 199.A O no hydrogen 2.978 N/A ARG 204.A N GLN 200.A O no hydrogen 3.005 N/A ARG 204.A NH1 ILE 239.A O no hydrogen 3.373 N/A ARG 204.A NH2 LEU 240.A O no hydrogen 3.532 N/A GLU 205.A N PRO 201.A O no hydrogen 3.027 N/A LEU 206.A N ILE 202.A O no hydrogen 2.832 N/A HIS 207.A N ALA 203.A O no hydrogen 2.812 N/A GLN 208.A N ARG 204.A O no hydrogen 3.020 N/A GLN 208.A NE2 ASP 212.A OD1 no hydrogen 2.708 N/A GLN 208.A NE2 ASP 212.A OD2 no hydrogen 3.308 N/A PHE 209.A N GLU 205.A O no hydrogen 2.965 N/A THR 210.A N LEU 206.A O no hydrogen 2.869 N/A PHE 211.A N HIS 207.A O no hydrogen 2.965 N/A ASP 212.A N GLN 208.A O no hydrogen 2.892 N/A LEU 213.A N PHE 209.A O no hydrogen 2.994 N/A LEU 214.A N THR 210.A O no hydrogen 2.768 N/A ILE 215.A N PHE 211.A O no hydrogen 3.245 N/A LYS 216.A N LEU 213.A O no hydrogen 3.280 N/A SER 217.A N LEU 214.A O no hydrogen 3.263 N/A SER 217.A OG LEU 214.A O no hydrogen 2.876 N/A MET 219.A N LYS 216.A O no hydrogen 2.824 N/A VAL 220.A N SER 217.A O no hydrogen 3.272 N/A VAL 222.A N SER 217.A O no hydrogen 3.065 N/A ASP 223.A N SER 35.A OG no hydrogen 3.080 N/A MET 228.A N GLU 42.A OE1 no hydrogen 2.973 N/A ALA 229.A N PRO 225.A O no hydrogen 2.996 N/A GLU 230.A N GLU 226.A O no hydrogen 2.935 N/A ILE 231.A N MET 227.A O no hydrogen 3.042 N/A ILE 232.A N MET 228.A O no hydrogen 2.935 N/A SER 233.A N ALA 229.A O no hydrogen 2.891 N/A SER 233.A OG ALA 229.A O no hydrogen 2.749 N/A SER 233.A OG GLU 230.A O no hydrogen 3.140 N/A VAL 234.A N GLU 230.A O no hydrogen 3.325 N/A GLN 235.A N ILE 231.A O no hydrogen 2.850 N/A LYS 238.A N GLN 235.A O no hydrogen 2.882 N/A LYS 238.A NZ GLN 235.A OE1 no hydrogen 2.958 N/A ILE 239.A N VAL 236.A O no hydrogen 2.890 N/A LEU 240.A N VAL 236.A O no hydrogen 2.935 N/A SER 241.A N PRO 237.A O no hydrogen 2.911 N/A SER 241.A OG PRO 237.A O no hydrogen 2.941 N/A SER 241.A OG LYS 238.A O no hydrogen 3.416 N/A GLY 242.A N ILE 239.A O no hydrogen 3.251 N/A VAL 244.A N LYS 238.A O no hydrogen 3.296 N/A LYS 245.A N ILE 149.A O no hydrogen 3.143 N/A LYS 245.A NZ GLY 242.A O no hydrogen 3.539 N/A ILE 247.A N SER 147.A O no hydrogen 2.773 N/A PHE 249.A N ASP 197.A OD1 no hydrogen 2.966 N/A HIS 250.A N ASP 197.A OD2 no hydrogen 3.081 N/A HIS 250.A NE2 THR 193.A OG1 no hydrogen 2.813 N/A GLN 252.A NE2 HIS 250.A O no hydrogen 3.008 N/A GLN 252.A NE2 THR 251.A O no hydrogen 3.514 N/A