Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hjt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASP 52.A OD2 no hydrogen 2.841 N/A VAL 5.A N ASP 25.A O no hydrogen 2.900 N/A VAL 6.A N LEU 53.A O no hydrogen 2.899 N/A THR 7.A N ARG 27.A O no hydrogen 2.890 N/A THR 7.A OG1 ARG 27.A O no hydrogen 3.110 N/A SER 8.A N VAL 55.A O no hydrogen 3.067 N/A SER 8.A OG GLU 62.A OE2 no hydrogen 2.498 N/A MET 12.A N PHE 9.A O no hydrogen 3.212 N/A TYR 13.A N PHE 9.A O no hydrogen 3.070 N/A ALA 14.A N TYR 10.A O no hydrogen 2.904 N/A MET 15.A N PRO 11.A O no hydrogen 3.329 N/A THR 16.A N MET 12.A O no hydrogen 3.038 N/A LYS 17.A N TYR 13.A O no hydrogen 2.933 N/A LYS 17.A NZ GLY 21.A O no hydrogen 2.933 N/A GLU 18.A N ALA 14.A O no hydrogen 2.872 N/A VAL 19.A N MET 15.A O no hydrogen 3.063 N/A SER 20.A N THR 16.A O no hydrogen 2.797 N/A GLY 21.A N LYS 17.A O no hydrogen 2.841 N/A ASN 24.A N SER 20.A OG no hydrogen 3.086 N/A ASN 24.A ND2 TYR 126.A OH no hydrogen 3.090 N/A ASP 25.A N MET 3.A O no hydrogen 3.372 N/A ARG 27.A N VAL 5.A O no hydrogen 3.248 N/A ARG 27.A NH1 ASP 25.A OD1 no hydrogen 3.162 N/A ILE 29.A N THR 7.A O no hydrogen 2.902 N/A GLN 30.A N SER 8.A O no hydrogen 2.959 N/A GLY 32.A N GLN 30.A OE1 no hydrogen 3.452 N/A SER 41.A N ASP 44.A OD2 no hydrogen 2.799 N/A ASP 44.A N SER 41.A OG no hydrogen 3.250 N/A VAL 45.A N SER 41.A O no hydrogen 3.085 N/A ALA 46.A N VAL 42.A O no hydrogen 3.145 N/A ALA 47.A N ASN 43.A O no hydrogen 3.012 N/A ILE 48.A N ASP 44.A O no hydrogen 3.084 N/A TYR 49.A N VAL 45.A O no hydrogen 2.946 N/A ASP 50.A N ALA 46.A O no hydrogen 2.903 N/A ALA 51.A N ILE 48.A O no hydrogen 3.417 N/A ASP 52.A N SER 4.A O no hydrogen 2.935 N/A LEU 53.A N SER 4.A O no hydrogen 3.199 N/A PHE 54.A N ASN 75.A O no hydrogen 2.683 N/A VAL 55.A N VAL 6.A O no hydrogen 2.751 N/A TYR 56.A N PHE 77.A O no hydrogen 3.214 N/A HIS 57.A N GLU 62.A OE2 no hydrogen 2.644 N/A HIS 57.A ND1 GLU 107.A OE2 no hydrogen 2.724 N/A HIS 57.A NE2 PRO 95.A O no hydrogen 2.785 N/A SER 58.A N GLU 62.A OE1 no hydrogen 3.093 N/A SER 58.A OG THR 60.A OG1 no hydrogen 2.248 N/A HIS 59.A ND1 GLU 78.A OE2 no hydrogen 3.033 N/A THR 60.A N SER 58.A OG no hydrogen 2.730 N/A THR 60.A OG1 SER 58.A OG no hydrogen 2.248 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.545 N/A ALA 63.A N LEU 61.A O no hydrogen 2.668 N/A ALA 65.A N GLU 62.A O no hydrogen 3.006 N/A ARG 66.A N ALA 63.A O no hydrogen 3.338 N/A SER 72.A OG TYR 49.A O no hydrogen 2.855 N/A ASN 75.A N ASP 52.A O no hydrogen 3.048 N/A PHE 77.A N PHE 54.A O no hydrogen 3.047 N/A ALA 79.A N TYR 56.A O no hydrogen 2.982 N/A SER 80.A N HIS 57.A O no hydrogen 3.032 N/A SER 80.A OG HIS 57.A O no hydrogen 2.589 N/A LYS 81.A N GLU 78.A O no hydrogen 3.097 N/A ASP 86.A N TYR 165.A OH no hydrogen 2.874 N/A VAL 88.A N LEU 92.A O no hydrogen 2.721 N/A ASP 94.A N ASP 86.A O no hydrogen 2.979 N/A HIS 96.A N ASP 94.A OD1 no hydrogen 3.189 N/A HIS 96.A ND1 ASP 94.A OD1 no hydrogen 2.700 N/A HIS 96.A NE2 HIS 36.A NE2 no hydrogen 3.267 N/A THR 97.A N PRO 95.A O no hydrogen 2.632 N/A THR 97.A OG1 PRO 95.A O no hydrogen 3.515 N/A TRP 98.A NE1 PRO 233.A O no hydrogen 2.805 N/A THR 99.A OG1 HIS 96.A O no hydrogen 3.262 N/A THR 99.A OG1 ALA 162.A O no hydrogen 3.382 N/A ASP 100.A N THR 97.A O no hydrogen 2.916 N/A VAL 102.A N ASP 100.A OD1 no hydrogen 2.981 N/A ALA 104.A N ASP 100.A O no hydrogen 2.814 N/A GLY 105.A N PRO 101.A O no hydrogen 2.832 N/A GLU 106.A N VAL 102.A O no hydrogen 2.841 N/A GLU 107.A N ALA 104.A O no hydrogen 3.180 N/A ALA 108.A N ALA 104.A O no hydrogen 3.030 N/A VAL 109.A N GLY 105.A O no hydrogen 3.194 N/A ASN 110.A N GLU 106.A O no hydrogen 3.412 N/A ILE 111.A N GLU 107.A O no hydrogen 3.155 N/A ALA 112.A N ALA 108.A O no hydrogen 3.227 N/A LYS 113.A N VAL 109.A O no hydrogen 3.122 N/A GLU 114.A N ASN 110.A O no hydrogen 3.281 N/A LEU 115.A N ILE 111.A O no hydrogen 2.757 N/A GLY 116.A N ALA 112.A O no hydrogen 2.698 N/A HIS 117.A N LYS 113.A O no hydrogen 2.596 N/A LEU 118.A N GLU 114.A O no hydrogen 3.184 N/A ASP 119.A N LEU 115.A O no hydrogen 3.139 N/A HIS 122.A N ASP 119.A O no hydrogen 2.991 N/A HIS 122.A ND1 ASP 119.A OD2 no hydrogen 2.814 N/A LYS 123.A N PRO 120.A O no hydrogen 3.307 N/A TYR 126.A N HIS 122.A O no hydrogen 3.431 N/A TYR 126.A OH ASN 24.A OD1 no hydrogen 3.414 N/A TYR 126.A OH ASP 119.A OD2 no hydrogen 2.891 N/A THR 127.A N LYS 123.A O no hydrogen 3.290 N/A THR 127.A OG1 LYS 123.A O no hydrogen 2.950 N/A THR 127.A OG1 ASP 124.A O no hydrogen 3.054 N/A LYS 128.A N ASP 124.A O no hydrogen 2.637 N/A LYS 129.A N SER 125.A O no hydrogen 3.088 N/A LYS 129.A NZ SER 20.A O no hydrogen 3.517 N/A LYS 129.A NZ SER 125.A OG no hydrogen 3.108 N/A ALA 130.A N TYR 126.A O no hydrogen 2.923 N/A LYS 131.A N THR 127.A O no hydrogen 3.115 N/A PHE 133.A N LYS 129.A O no hydrogen 3.040 N/A LYS 134.A N ALA 130.A O no hydrogen 3.147 N/A LYS 135.A N LYS 131.A O no hydrogen 2.912 N/A GLU 136.A N ALA 132.A O no hydrogen 2.793 N/A ALA 137.A N PHE 133.A O no hydrogen 2.992 N/A GLU 138.A N LYS 134.A O no hydrogen 3.126 N/A GLN 139.A N LYS 135.A O no hydrogen 3.107 N/A LEU 140.A N GLU 136.A O no hydrogen 3.092 N/A THR 141.A N ALA 137.A O no hydrogen 3.006 N/A THR 141.A OG1 ALA 137.A O no hydrogen 2.724 N/A GLU 142.A N GLU 138.A O no hydrogen 2.767 N/A GLU 143.A N GLN 139.A O no hydrogen 2.895 N/A TYR 144.A N LEU 140.A O no hydrogen 2.997 N/A TYR 144.A OH GLU 253.A OE2 no hydrogen 2.649 N/A THR 145.A N THR 141.A O no hydrogen 2.773 N/A THR 145.A OG1 THR 141.A O no hydrogen 2.803 N/A THR 145.A OG1 GLU 142.A O no hydrogen 2.987 N/A GLN 146.A N GLU 142.A O no hydrogen 3.275 N/A LYS 147.A N GLU 143.A O no hydrogen 3.163 N/A LYS 147.A NZ GLU 143.A OE1 no hydrogen 3.175 N/A LYS 147.A NZ GLU 253.A OE2 no hydrogen 3.110 N/A PHE 148.A N TYR 144.A O no hydrogen 2.856 N/A LYS 149.A N GLN 146.A O no hydrogen 3.228 N/A LYS 150.A N LYS 147.A O no hydrogen 3.232 N/A VAL 151.A N PHE 148.A O no hydrogen 3.251 N/A PHE 156.A N LYS 173.A O no hydrogen 2.863 N/A THR 158.A N LEU 175.A O no hydrogen 2.968 N/A THR 158.A OG1 HIS 160.A O no hydrogen 2.866 N/A GLN 159.A N PHE 207.A O no hydrogen 2.907 N/A HIS 160.A ND1 GLU 209.A OE2 no hydrogen 2.508 N/A THR 161.A N SER 178.A O no hydrogen 2.944 N/A THR 161.A N GLY 179.A O no hydrogen 2.959 N/A THR 161.A OG1 SER 178.A O no hydrogen 3.109 N/A ALA 162.A N HIS 160.A O no hydrogen 2.767 N/A SER 164.A OG ASP 94.A OD2 no hydrogen 2.846 N/A TYR 165.A OH ASP 94.A O no hydrogen 2.499 N/A ALA 167.A N PHE 163.A O no hydrogen 2.899 N/A LYS 168.A N SER 164.A O no hydrogen 3.050 N/A LYS 168.A NZ ASP 86.A OD2 no hydrogen 2.877 N/A ARG 169.A N TYR 165.A O no hydrogen 2.911 N/A ARG 169.A NE ASP 100.A OD1 no hydrogen 2.407 N/A ARG 169.A NE ASP 100.A OD2 no hydrogen 2.951 N/A PHE 170.A N LEU 166.A O no hydrogen 3.289 N/A PHE 170.A N ALA 167.A O no hydrogen 3.320 N/A GLY 171.A N LYS 168.A O no hydrogen 3.369 N/A LEU 172.A N ALA 167.A O no hydrogen 2.697 N/A LYS 173.A N LYS 154.A O no hydrogen 2.731 N/A LEU 175.A N PHE 156.A O no hydrogen 2.977 N/A ILE 177.A N THR 158.A O no hydrogen 2.988 N/A SER 178.A N GLN 159.A O no hydrogen 2.942 N/A GLY 179.A N GLN 184.A O no hydrogen 2.832 N/A GLU 183.A N SER 181.A OG no hydrogen 3.196 N/A GLN 184.A N SER 181.A O no hydrogen 3.026 N/A GLU 185.A N GLU 183.A O no hydrogen 2.777 N/A LEU 191.A N SER 187.A O no hydrogen 2.949 N/A LYS 192.A N PRO 188.A O no hydrogen 3.213 N/A GLU 193.A N ARG 189.A O no hydrogen 3.183 N/A ILE 194.A N GLN 190.A O no hydrogen 2.959 N/A GLN 195.A N LEU 191.A O no hydrogen 3.011 N/A ASP 196.A N LYS 192.A O no hydrogen 2.919 N/A PHE 197.A N GLU 193.A O no hydrogen 3.027 N/A VAL 198.A N ILE 194.A O no hydrogen 2.865 N/A LYS 199.A N GLN 195.A O no hydrogen 3.109 N/A GLU 200.A N ASP 196.A O no hydrogen 2.902 N/A TYR 201.A N PHE 197.A O no hydrogen 2.961 N/A ASN 202.A N LYS 199.A O no hydrogen 3.240 N/A VAL 203.A N VAL 198.A O no hydrogen 2.667 N/A ILE 206.A N LYS 227.A O no hydrogen 3.089 N/A PHE 207.A N VAL 157.A O no hydrogen 2.855 N/A ALA 208.A N LYS 229.A O no hydrogen 2.775 N/A VAL 212.A N GLU 209.A O no hydrogen 3.363 N/A LYS 215.A N ASN 213.A OD1 no hydrogen 2.964 N/A HIS 218.A N PRO 214.A O no hydrogen 2.605 N/A HIS 218.A ND1 PRO 214.A O no hydrogen 3.243 N/A ALA 219.A N LYS 215.A O no hydrogen 2.976 N/A ILE 220.A N ILE 216.A O no hydrogen 3.100 N/A ALA 221.A N ALA 217.A O no hydrogen 3.226 N/A LYS 222.A N HIS 218.A O no hydrogen 2.894 N/A SER 223.A N ALA 219.A O no hydrogen 2.996 N/A SER 223.A OG ALA 219.A O no hydrogen 3.195 N/A SER 223.A OG ILE 220.A O no hydrogen 2.916 N/A THR 224.A N ILE 220.A O no hydrogen 2.876 N/A THR 224.A OG1 ILE 220.A O no hydrogen 2.991 N/A ALA 226.A N ALA 221.A O no hydrogen 2.883 N/A LYS 227.A N LYS 204.A O no hydrogen 3.179 N/A LYS 229.A N ILE 206.A O no hydrogen 3.251 N/A LEU 231.A N ALA 208.A O no hydrogen 3.104 N/A SER 232.A N ASN 251.A OD1 no hydrogen 3.158 N/A LEU 234.A N SER 232.A OG no hydrogen 3.129 N/A ALA 237.A N SER 31.A O no hydrogen 2.781 N/A THR 243.A N GLU 246.A OE1 no hydrogen 3.129 N/A TYR 244.A N GLU 18.A OE1 no hydrogen 2.579 N/A TYR 244.A OH TRP 98.A O no hydrogen 2.563 N/A ASN 247.A N THR 243.A O no hydrogen 3.034 N/A ASN 247.A ND2 TYR 10.A OH no hydrogen 2.885 N/A ASN 247.A ND2 LYS 242.A O no hydrogen 3.600 N/A LEU 248.A N TYR 244.A O no hydrogen 3.021 N/A ARG 249.A N LEU 245.A O no hydrogen 2.764 N/A ALA 250.A N GLU 246.A O no hydrogen 2.885 N/A ASN 251.A N ASN 247.A O no hydrogen 3.262 N/A ASN 251.A ND2 ASN 247.A O no hydrogen 2.867 N/A LEU 252.A N LEU 248.A O no hydrogen 2.925 N/A GLU 253.A N ARG 249.A O no hydrogen 3.016 N/A GLU 253.A N ALA 250.A O no hydrogen 3.170 N/A VAL 254.A N ALA 250.A O no hydrogen 3.281 N/A LEU 255.A N ASN 251.A O no hydrogen 3.061 N/A TYR 256.A N LEU 252.A O no hydrogen 2.970 N/A GLN 257.A N GLU 253.A O no hydrogen 2.747 N/A GLN 257.A NE2 GLU 253.A OE1 no hydrogen 3.289 N/A GLN 258.A N VAL 254.A O no hydrogen 2.783 N/A LEU 259.A N LEU 255.A O no hydrogen 2.864 N/A