Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rwt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N ASP 234.A O no hydrogen 2.805 N/A PHE 2.A N ALA 233.A O no hydrogen 2.953 N/A LEU 3.A N TYR 27.A O no hydrogen 3.147 N/A GLU 4.A N TYR 231.A O no hydrogen 2.782 N/A GLY 5.A N THR 25.A O no hydrogen 2.762 N/A ARG 6.A N MET 229.A O no hydrogen 3.022 N/A ARG 6.A NH1 GLY 5.A O no hydrogen 2.598 N/A SER 7.A N LEU 23.A O no hydrogen 3.026 N/A SER 7.A OG THR 227.A O no hydrogen 3.526 N/A MET 9.A N CYS 21.A O no hydrogen 3.079 N/A LEU 11.A N LEU 19.A O no hydrogen 2.891 N/A LYS 12.A N GLY 222.A O no hydrogen 2.917 N/A LEU 13.A N GLY 17.A O no hydrogen 3.115 N/A VAL 14.A N LYS 219.A O no hydrogen 2.878 N/A HIS 18.A NE2 GLU 224.A OE2 no hydrogen 3.214 N/A LEU 19.A N LEU 11.A O no hydrogen 2.988 N/A CYS 21.A N MET 9.A O no hydrogen 3.146 N/A ASN 22.A N THR 178.A O no hydrogen 2.990 N/A ASN 22.A ND2 ASP 8.A OD1 no hydrogen 3.218 N/A ASN 22.A ND2 ASP 8.A OD2 no hydrogen 3.308 N/A LEU 23.A N SER 7.A O no hydrogen 2.734 N/A LYS 24.A N VAL 176.A O no hydrogen 3.369 N/A LYS 24.A NZ ASN 22.A OD1 no hydrogen 3.110 N/A THR 25.A N GLY 5.A O no hydrogen 3.002 N/A THR 25.A OG1 TYR 27.A OH no hydrogen 3.416 N/A THR 26.A N GLU 174.A O no hydrogen 2.855 N/A THR 26.A OG1 GLU 4.A OE2 no hydrogen 3.545 N/A TYR 27.A N LEU 3.A O no hydrogen 2.582 N/A TYR 27.A OH GLU 228.A OE2 no hydrogen 2.657 N/A ARG 28.A N THR 172.A O no hydrogen 3.047 N/A ARG 28.A NE GLU 174.A OE1 no hydrogen 3.418 N/A ARG 28.A NH2 GLU 174.A OE1 no hydrogen 2.946 N/A SER 29.A OG SER 166.A OG no hydrogen 2.973 N/A LYS 30.A N GLY 170.A O no hydrogen 3.065 N/A LYS 30.A NZ GLU 169.A O no hydrogen 3.225 N/A LYS 30.A NZ ASP 190.A OD1 no hydrogen 3.186 N/A LYS 30.A NZ ASP 190.A OD2 no hydrogen 3.177 N/A LYS 30.A NZ THR 191.A O no hydrogen 3.558 N/A LYS 31.A N SER 29.A OG no hydrogen 3.261 N/A LYS 31.A NZ GLN 165.A O no hydrogen 3.283 N/A LYS 31.A NZ PHE 167.A O no hydrogen 3.454 N/A ASN 35.A N PRO 32.A O no hydrogen 3.227 N/A LEU 36.A N ALA 33.A O no hydrogen 3.321 N/A LYS 37.A N GLN 165.A OE1 no hydrogen 2.965 N/A TYR 42.A N LEU 230.A O no hydrogen 2.916 N/A TYR 42.A OH HIS 155.A NE2 no hydrogen 2.966 N/A TYR 43.A N ARG 69.A O no hydrogen 3.050 N/A VAL 44.A N GLU 228.A O no hydrogen 2.851 N/A ASP 45.A N VAL 67.A O no hydrogen 2.971 N/A ARG 46.A N SER 226.A O no hydrogen 3.095 N/A ARG 46.A NE GLU 64.A OE2 no hydrogen 2.862 N/A ARG 46.A NH1 GLU 228.A OE1 no hydrogen 2.865 N/A ARG 46.A NH2 GLU 228.A OE1 no hydrogen 3.481 N/A ARG 47.A N VAL 65.A O no hydrogen 3.002 N/A GLU 49.A N HIS 63.A O no hydrogen 3.000 N/A ARG 50.A NH1 GLU 53.A OE2 no hydrogen 3.509 N/A ARG 50.A NH2 GLU 57.A OE1 no hydrogen 3.505 N/A ILE 51.A N GLU 61.A O no hydrogen 2.859 N/A LYS 52.A N GLU 61.A O no hydrogen 3.423 N/A ALA 54.A N TYR 59.A O no hydrogen 3.133 N/A THR 58.A N ASP 55.A O no hydrogen 3.022 N/A THR 58.A OG1 ASP 55.A O no hydrogen 2.878 N/A TYR 59.A N ALA 54.A O no hydrogen 3.254 N/A VAL 60.A N ILE 129.A O no hydrogen 3.199 N/A GLU 61.A N LYS 52.A O no hydrogen 3.104 N/A GLN 62.A N MET 127.A O no hydrogen 2.872 N/A GLN 62.A NE2 ALA 145.A O no hydrogen 3.516 N/A HIS 63.A N GLU 49.A O no hydrogen 3.015 N/A GLU 64.A N GLN 125.A O no hydrogen 3.111 N/A VAL 65.A N ARG 47.A O no hydrogen 3.213 N/A ALA 66.A N GLY 123.A O no hydrogen 2.695 N/A VAL 67.A N ASP 45.A O no hydrogen 2.813 N/A ALA 68.A N ASN 154.A O no hydrogen 3.164 N/A ARG 69.A N TYR 43.A O no hydrogen 2.813 N/A ARG 69.A NE ASP 45.A OD2 no hydrogen 2.890 N/A ARG 69.A NH2 ASP 45.A OD1 no hydrogen 2.970 N/A SER 75.A OG LEU 77.A O no hydrogen 2.844 N/A THR 83.A OG1 GLY 82.A O no hydrogen 2.449 N/A GLY 85.A N GLY 158.A O no hydrogen 2.220 N/A MET 95.A N GLY 118.A O no hydrogen 3.418 N/A MET 97.A N GLY 116.A O no hydrogen 2.926 N/A LYS 98.A N LEU 198.A O no hydrogen 2.824 N/A LEU 99.A N SER 114.A O no hydrogen 2.795 N/A TYR 100.A N TYR 200.A O no hydrogen 3.029 N/A TYR 100.A OH GLU 102.A OE1 no hydrogen 3.262 N/A MET 101.A N CYS 112.A O no hydrogen 2.713 N/A GLY 103.A N PHE 110.A O no hydrogen 3.349 N/A THR 104.A N ILE 204.A O no hydrogen 3.164 N/A VAL 105.A N HIS 108.A O no hydrogen 3.110 N/A ASN 106.A N GLY 206.A O no hydrogen 2.896 N/A ASN 106.A ND2 PHE 209.A O no hydrogen 2.951 N/A HIS 108.A N VAL 105.A O no hydrogen 3.363 N/A HIS 108.A ND1 HIS 109.A O no hydrogen 2.848 N/A PHE 110.A N GLY 103.A O no hydrogen 3.191 N/A LYS 111.A N GLU 133.A O no hydrogen 3.133 N/A LYS 111.A NZ GLU 133.A OE1 no hydrogen 3.042 N/A CYS 112.A N MET 101.A O no hydrogen 2.912 N/A THR 113.A N LYS 130.A O no hydrogen 2.983 N/A SER 114.A N LEU 99.A O no hydrogen 3.023 N/A GLU 115.A N ARG 128.A O no hydrogen 3.189 N/A GLY 116.A N MET 97.A O no hydrogen 3.010 N/A GLY 118.A N MET 95.A O no hydrogen 3.362 N/A LYS 119.A N THR 124.A O no hydrogen 2.950 N/A TYR 121.A OH ILE 91.A O no hydrogen 2.744 N/A GLU 122.A N LYS 119.A O no hydrogen 3.076 N/A GLY 123.A N PRO 120.A O no hydrogen 3.098 N/A THR 124.A N LYS 119.A O no hydrogen 3.339 N/A GLN 125.A N GLU 64.A O no hydrogen 3.022 N/A GLN 125.A NE2 SER 149.A O no hydrogen 3.152 N/A THR 126.A N GLU 117.A O no hydrogen 3.026 N/A MET 127.A N GLN 62.A O no hydrogen 2.826 N/A ARG 128.A N GLU 115.A O no hydrogen 3.110 N/A ARG 128.A NE GLU 115.A OE2 no hydrogen 2.979 N/A ARG 128.A NH2 GLU 115.A OE1 no hydrogen 3.514 N/A ARG 128.A NH2 GLU 117.A OE1 no hydrogen 2.785 N/A ILE 129.A N VAL 60.A O no hydrogen 2.904 N/A LYS 130.A N THR 113.A O no hydrogen 2.769 N/A VAL 131.A N THR 58.A O no hydrogen 2.843 N/A VAL 132.A N LYS 111.A O no hydrogen 2.832 N/A GLU 133.A N LYS 111.A O no hydrogen 3.458 N/A ALA 140.A N VAL 215.A O no hydrogen 2.676 N/A PHE 141.A N GLU 57.A OE1 no hydrogen 3.054 N/A ILE 143.A N ALA 140.A O no hydrogen 3.379 N/A LEU 144.A N PHE 141.A O no hydrogen 2.922 N/A ALA 145.A N ASP 142.A O no hydrogen 2.918 N/A SER 147.A N LEU 144.A O no hydrogen 2.786 N/A PHE 148.A N ALA 145.A O no hydrogen 3.458 N/A SER 149.A OG TYR 200.A OH no hydrogen 2.426 N/A LYS 150.A NZ TYR 27.A OH no hydrogen 3.149 N/A PHE 152.A N SER 149.A O no hydrogen 3.293 N/A ASN 154.A N ALA 66.A O no hydrogen 3.330 N/A HIS 155.A ND1 ILE 153.A O no hydrogen 2.743 N/A HIS 155.A NE2 TYR 42.A OH no hydrogen 2.966 N/A GLY 158.A N THR 156.A O no hydrogen 2.314 N/A LYS 164.A N ASP 161.A OD1 no hydrogen 3.247 N/A LYS 164.A NZ PRO 120.A O no hydrogen 3.438 N/A LYS 164.A NZ THR 151.A O no hydrogen 3.111 N/A LYS 164.A NZ ASP 161.A OD2 no hydrogen 2.712 N/A GLN 165.A N ASP 161.A O no hydrogen 3.043 N/A GLN 165.A NE2 LYS 37.A O no hydrogen 3.227 N/A GLN 165.A NE2 ASP 161.A O no hydrogen 3.626 N/A SER 166.A OG SER 29.A OG no hydrogen 2.973 N/A SER 166.A OG PHE 162.A O no hydrogen 2.726 N/A GLU 169.A N GLU 169.A OE2 no hydrogen 2.480 N/A GLY 170.A N SER 166.A O no hydrogen 3.450 N/A PHE 171.A N THR 191.A O no hydrogen 3.168 N/A THR 172.A N ARG 28.A O no hydrogen 2.953 N/A TRP 173.A N GLN 189.A O no hydrogen 3.103 N/A GLU 174.A N THR 26.A O no hydrogen 3.200 N/A ARG 175.A N ALA 187.A O no hydrogen 2.973 N/A ARG 175.A NE THR 25.A OG1 no hydrogen 2.938 N/A ARG 175.A NH2 TYR 27.A OH no hydrogen 3.399 N/A VAL 176.A N LYS 24.A O no hydrogen 2.946 N/A THR 177.A N LEU 185.A O no hydrogen 3.003 N/A THR 178.A N ASN 22.A O no hydrogen 2.868 N/A TYR 179.A N GLY 183.A O no hydrogen 3.047 N/A GLU 180.A N ILE 20.A O no hydrogen 3.035 N/A GLY 182.A N TYR 179.A O no hydrogen 3.322 N/A VAL 184.A N VAL 207.A O no hydrogen 3.012 N/A LEU 185.A N THR 177.A O no hydrogen 3.018 N/A THR 186.A N ARG 205.A O no hydrogen 3.291 N/A THR 186.A OG1 ARG 205.A O no hydrogen 3.500 N/A ALA 187.A N ARG 175.A O no hydrogen 3.008 N/A THR 188.A N LYS 203.A O no hydrogen 3.138 N/A GLN 189.A N TRP 173.A O no hydrogen 2.886 N/A ASP 190.A N ASN 201.A O no hydrogen 2.805 N/A THR 191.A N PHE 171.A O no hydrogen 2.871 N/A THR 191.A OG1 GLN 189.A OE1 no hydrogen 2.984 N/A SER 192.A N ILE 199.A O no hydrogen 3.323 N/A GLN 194.A N CYS 197.A O no hydrogen 3.166 N/A CYS 197.A N GLN 194.A O no hydrogen 3.353 N/A CYS 197.A SG HIS 96.A O no hydrogen 3.564 N/A CYS 197.A SG LEU 198.A O no hydrogen 4.004 N/A LEU 198.A N HIS 96.A O no hydrogen 2.920 N/A ILE 199.A N SER 192.A O no hydrogen 3.088 N/A TYR 200.A N LYS 98.A O no hydrogen 2.801 N/A TYR 200.A OH SER 149.A OG no hydrogen 2.426 N/A ASN 201.A N ASP 190.A O no hydrogen 2.931 N/A ASN 201.A ND2 TYR 100.A O no hydrogen 3.409 N/A VAL 202.A N TYR 100.A O no hydrogen 3.090 N/A LYS 203.A N THR 188.A O no hydrogen 2.922 N/A ILE 204.A N GLU 102.A O no hydrogen 2.969 N/A ARG 205.A N THR 186.A O no hydrogen 2.941 N/A ARG 205.A NH1 THR 104.A OG1 no hydrogen 2.926 N/A GLY 206.A N THR 104.A O no hydrogen 2.698 N/A VAL 207.A N VAL 184.A O no hydrogen 2.758 N/A ASN 208.A ND2.A GLY 182.A O no hydrogen 3.405 N/A PHE 209.A N ASN 106.A OD1 no hydrogen 3.356 N/A GLY 213.A N PRO 210.A O no hydrogen 3.364 N/A GLN 217.A N GLY 213.A O no hydrogen 3.193 N/A LYS 219.A N PRO 214.A O no hydrogen 3.234 N/A LYS 219.A NZ GLN 217.A OE1 no hydrogen 2.850 N/A THR 220.A OG1 ASP 142.A OD1 no hydrogen 2.489 N/A LEU 221.A N LYS 12.A O no hydrogen 2.790 N/A GLY 222.A N ASP 142.A OD1 no hydrogen 3.019 N/A TRP 223.A NE1 ASP 142.A O no hydrogen 3.179 N/A GLU 224.A N ALA 10.A O no hydrogen 2.957 N/A SER 226.A N ARG 46.A O no hydrogen 3.310 N/A THR 227.A OG1 ASP 45.A OD1 no hydrogen 2.960 N/A GLU 228.A N VAL 44.A O no hydrogen 2.976 N/A MET 229.A N ARG 6.A O no hydrogen 2.941 N/A LEU 230.A N TYR 42.A O no hydrogen 2.668 N/A TYR 231.A N GLU 4.A O no hydrogen 3.070 N/A TYR 231.A OH GLU 4.A OE1 no hydrogen 3.213 N/A ALA 233.A N PHE 2.A O no hydrogen 2.862 N/A