Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ws0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N PRO 2.A O no hydrogen 3.020 N/A LEU 6.A N LEU 3.A O no hydrogen 2.721 N/A VAL 7.A N LEU 3.A O no hydrogen 2.826 N/A GLU 8.A N PHE 50.A O no hydrogen 2.923 N/A GLY 10.A N GLU 8.A OE2 no hydrogen 3.131 N/A TRP 11.A N GLU 8.A OE1 no hydrogen 2.902 N/A ALA 12.A N GLU 8.A O no hydrogen 2.786 N/A ALA 13.A N ARG 9.A O no hydrogen 3.016 N/A ALA 14.A N GLY 10.A O no hydrogen 2.950 N/A LEU 15.A N TRP 11.A O no hydrogen 2.928 N/A GLU 16.A N ALA 13.A O no hydrogen 3.480 N/A VAL 18.A N LEU 15.A O no hydrogen 2.885 N/A ALA 19.A N GLU 16.A O no hydrogen 3.167 N/A VAL 22.A N VAL 18.A O no hydrogen 3.059 N/A ALA 23.A N ALA 19.A O no hydrogen 3.036 N/A HIS 24.A N ASP 20.A O no hydrogen 2.857 N/A MET 25.A N GLN 21.A O no hydrogen 2.930 N/A GLY 26.A N VAL 22.A O no hydrogen 3.105 N/A GLN 27.A N ALA 23.A O no hydrogen 2.962 N/A PHE 28.A N HIS 24.A O no hydrogen 2.894 N/A LEU 29.A N MET 25.A O no hydrogen 2.786 N/A ARG 30.A N GLY 26.A O no hydrogen 3.081 N/A ALA 31.A N GLN 27.A O no hydrogen 2.822 N/A GLU 32.A N PHE 28.A O no hydrogen 3.013 N/A ILE 33.A N LEU 29.A O no hydrogen 3.037 N/A ALA 34.A N ARG 30.A O no hydrogen 2.992 N/A ALA 35.A N ALA 31.A O no hydrogen 2.999 N/A GLY 36.A N ILE 33.A O no hydrogen 2.964 N/A ARG 37.A N GLU 32.A O no hydrogen 2.817 N/A ARG 37.A NE GLU 32.A OE1 no hydrogen 3.046 N/A ARG 37.A NE GLU 32.A OE2 no hydrogen 3.495 N/A ARG 37.A NH2 GLU 32.A OE2 no hydrogen 2.984 N/A LEU 40.A N VAL 129.A O no hydrogen 2.835 N/A ASN 45.A N ALA 42.A O no hydrogen 2.784 N/A VAL 46.A N GLY 43.A O no hydrogen 3.319 N/A ARG 48.A N ASN 45.A O no hydrogen 2.924 N/A ARG 48.A NH1 VAL 74.A O no hydrogen 3.017 N/A PHE 50.A N LEU 47.A O no hydrogen 2.906 N/A THR 51.A N ARG 48.A O no hydrogen 2.855 N/A THR 51.A OG1 ARG 48.A O no hydrogen 2.616 N/A PHE 54.A N GLU 8.A OE1 no hydrogen 3.041 N/A ASN 56.A N PRO 53.A O no hydrogen 3.038 N/A VAL 57.A N PHE 54.A O no hydrogen 3.301 N/A ARG 58.A N GLY 119.A O no hydrogen 2.772 N/A ARG 58.A NE GLU 217.A O no hydrogen 3.078 N/A ARG 58.A NH2 GLU 217.A O no hydrogen 2.945 N/A ARG 58.A NH2 PRO 218.A O no hydrogen 3.455 N/A VAL 59.A N GLY 119.A O no hydrogen 3.097 N/A LEU 60.A N VAL 161.A O no hydrogen 2.736 N/A ILE 61.A N LEU 121.A O no hydrogen 2.702 N/A VAL 62.A N ILE 163.A O no hydrogen 2.958 N/A GLY 63.A N LEU 123.A O no hydrogen 2.977 N/A TYR 67.A OH PHE 78.A O no hydrogen 2.662 N/A HIS 72.A N THR 69.A O no hydrogen 3.210 N/A SER 77.A N LEU 122.A O no hydrogen 2.959 N/A SER 77.A OG LEU 123.A O no hydrogen 3.047 N/A SER 79.A N LEU 76.A O no hydrogen 3.049 N/A SER 79.A OG GLY 110.A O no hydrogen 3.357 N/A VAL 80.A N GLY 110.A O no hydrogen 2.833 N/A VAL 84.A N ALA 81.A O no hydrogen 3.195 N/A ALA 92.A N PRO 88.A O no hydrogen 3.009 N/A ASN 93.A N ARG 89.A O no hydrogen 2.917 N/A ASN 93.A ND2 PRO 189.A O no hydrogen 2.755 N/A ILE 94.A N SER 90.A O no hydrogen 2.933 N/A PHE 95.A N LEU 91.A O no hydrogen 2.949 N/A ASP 96.A N ALA 92.A O no hydrogen 2.983 N/A GLU 97.A N ASN 93.A O no hydrogen 3.122 N/A TYR 98.A N ILE 94.A O no hydrogen 2.814 N/A THR 99.A N PHE 95.A O no hydrogen 2.885 N/A THR 99.A OG1 ASP 96.A O no hydrogen 3.236 N/A ALA 100.A N ASP 96.A O no hydrogen 2.889 N/A ASP 101.A N GLU 97.A O no hydrogen 2.889 N/A LEU 102.A N TYR 98.A O no hydrogen 2.944 N/A GLY 103.A N THR 99.A O no hydrogen 2.842 N/A SER 108.A N PRO 224.A OXT no hydrogen 2.653 N/A SER 108.A OG PRO 224.A O no hydrogen 2.472 N/A SER 108.A OG PRO 224.A OXT no hydrogen 3.312 N/A ASP 111.A N ASN 109.A OD1 no hydrogen 2.988 N/A LEU 112.A N SER 79.A OG no hydrogen 2.857 N/A THR 113.A N ASP 111.A OD1 no hydrogen 2.976 N/A THR 113.A OG1 ASP 111.A OD1 no hydrogen 2.882 N/A TRP 115.A N LEU 112.A O no hydrogen 2.892 N/A TRP 115.A NE1 TRP 221.A O no hydrogen 2.883 N/A ALA 116.A N LEU 112.A O no hydrogen 3.261 N/A GLN 117.A N THR 113.A O no hydrogen 2.850 N/A ARG 118.A N TRP 115.A O no hydrogen 3.091 N/A ARG 118.A NH1 ASP 220.A O no hydrogen 2.727 N/A ARG 118.A NH1 ARG 222.A O no hydrogen 2.859 N/A GLY 119.A N ALA 116.A O no hydrogen 3.370 N/A VAL 120.A N TRP 115.A O no hydrogen 3.149 N/A LEU 121.A N VAL 59.A O no hydrogen 2.777 N/A LEU 123.A N ILE 61.A O no hydrogen 2.773 N/A ARG 125.A N GLY 63.A O no hydrogen 2.843 N/A ARG 125.A NH1 GLU 143.A O no hydrogen 2.893 N/A ARG 125.A NH1 THR 146.A OG1 no hydrogen 3.078 N/A VAL 126.A N GLN 64.A O no hydrogen 3.055 N/A THR 128.A OG1 HIS 137.A ND1 no hydrogen 2.744 N/A VAL 129.A N LEU 40.A O no hydrogen 2.972 N/A ARG 130.A N SER 136.A OG no hydrogen 2.831 N/A SER 132.A N PRO 68.A O no hydrogen 2.802 N/A ASN 133.A N ARG 130.A O no hydrogen 3.038 N/A ASN 133.A ND2 PRO 131.A O no hydrogen 2.923 N/A SER 136.A N ASN 133.A O no hydrogen 3.128 N/A SER 136.A OG ASN 133.A O no hydrogen 2.541 N/A HIS 137.A ND1 THR 128.A OG1 no hydrogen 2.744 N/A ARG 138.A N ALA 135.A O no hydrogen 3.158 N/A ARG 138.A NE ASP 65.A OD1 no hydrogen 3.226 N/A ARG 138.A NE ASP 65.A OD2 no hydrogen 3.223 N/A ARG 138.A NH1 ASP 168.A OD1 no hydrogen 2.702 N/A ARG 138.A NH2 GLN 64.A O no hydrogen 3.206 N/A ARG 138.A NH2 ASP 65.A OD1 no hydrogen 3.037 N/A ARG 138.A NH2 ASP 168.A OD2 no hydrogen 2.986 N/A GLY 139.A N GLU 143.A OE2 no hydrogen 2.976 N/A LYS 140.A N HIS 137.A O no hydrogen 3.275 N/A TRP 142.A NE1 THR 128.A OG1 no hydrogen 2.841 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.875 N/A THR 146.A N TRP 142.A O no hydrogen 2.837 N/A THR 146.A OG1 ARG 125.A O no hydrogen 2.625 N/A THR 146.A OG1 TRP 142.A O no hydrogen 3.518 N/A GLU 147.A N GLU 143.A O no hydrogen 2.815 N/A CYS 148.A N ALA 144.A O no hydrogen 3.020 N/A CYS 148.A SG ALA 14.A O no hydrogen 3.454 N/A ALA 149.A N VAL 145.A O no hydrogen 2.984 N/A ILE 150.A N THR 146.A O no hydrogen 3.059 N/A ARG 151.A N GLU 147.A O no hydrogen 2.983 N/A ARG 151.A NE GLU 147.A OE2 no hydrogen 2.706 N/A ARG 151.A NH1 GLU 147.A OE2 no hydrogen 3.258 N/A ALA 152.A N CYS 148.A O no hydrogen 2.929 N/A LEU 153.A N ALA 149.A O no hydrogen 2.975 N/A ALA 154.A N ILE 150.A O no hydrogen 2.968 N/A ALA 155.A N ARG 151.A O no hydrogen 2.902 N/A ARG 156.A N LEU 153.A O no hydrogen 3.197 N/A ARG 156.A NE LEU 153.A O no hydrogen 3.064 N/A ARG 156.A NH1 VAL 57.A O no hydrogen 2.774 N/A ARG 156.A NH2 VAL 57.A O no hydrogen 2.839 N/A ALA 157.A N ALA 154.A O no hydrogen 3.080 N/A LEU 160.A N ASN 180.A O no hydrogen 2.868 N/A VAL 161.A N ARG 58.A O no hydrogen 3.076 N/A ALA 162.A N VAL 182.A O no hydrogen 2.868 N/A ILE 163.A N LEU 60.A O no hydrogen 2.756 N/A LEU 164.A N ILE 184.A O no hydrogen 2.822 N/A TRP 165.A N VAL 62.A O no hydrogen 3.157 N/A GLY 166.A N SER 186.A O no hydrogen 2.885 N/A ARG 167.A N GLN 64.A OE1 no hydrogen 3.137 N/A ALA 169.A N GLY 166.A O no hydrogen 3.178 N/A THR 171.A N ASP 168.A O no hydrogen 3.117 N/A LEU 172.A N ASP 168.A O no hydrogen 2.917 N/A LEU 172.A N ALA 169.A O no hydrogen 3.023 N/A LYS 173.A N ALA 169.A O no hydrogen 2.904 N/A LYS 173.A NZ GLU 185.A OE2 no hydrogen 3.301 N/A MET 175.A N LEU 172.A O no hydrogen 2.982 N/A LEU 176.A N LYS 173.A O no hydrogen 2.830 N/A ALA 177.A N PRO 174.A O no hydrogen 3.292 N/A ASN 180.A ND2 ALA 157.A O no hydrogen 2.964 N/A CYS 181.A N ALA 178.A O no hydrogen 3.113 N/A CYS 181.A SG.A ALA 154.A O no hydrogen 3.710 N/A CYS 181.A SG.A GLY 179.A O no hydrogen 3.737 N/A CYS 181.A SG.B LEU 176.A O no hydrogen 3.254 N/A VAL 182.A N LEU 160.A O no hydrogen 3.046 N/A ILE 184.A N ALA 162.A O no hydrogen 2.833 N/A SER 186.A N LEU 164.A O no hydrogen 3.016 N/A SER 186.A OG PRO 187.A O no hydrogen 2.897 N/A SER 190.A N HIS 188.A ND1 no hydrogen 3.055 N/A SER 190.A OG SER 193.A OG no hydrogen 3.072 N/A SER 193.A N SER 190.A O no hydrogen 3.080 N/A SER 193.A OG HIS 188.A O no hydrogen 2.573 N/A SER 193.A OG SER 190.A O no hydrogen 3.450 N/A SER 193.A OG SER 190.A OG no hydrogen 3.072 N/A ALA 194.A N SER 190.A O no hydrogen 2.885 N/A ARG 196.A N SER 193.A O no hydrogen 2.946 N/A PHE 198.A N ALA 194.A O no hydrogen 2.971 N/A PHE 199.A N ALA 194.A O no hydrogen 3.099 N/A GLY 200.A N GLU 97.A OE1 no hydrogen 2.727 N/A SER 201.A N PHE 198.A O no hydrogen 3.112 N/A SER 201.A OG PHE 198.A O no hydrogen 2.615 N/A ARG 202.A N GLU 97.A OE2 no hydrogen 2.886 N/A ARG 202.A NH2 GLU 97.A OE2 no hydrogen 2.592 N/A SER 205.A N ASP 101.A OD2 no hydrogen 3.002 N/A SER 205.A OG ASP 101.A OD1 no hydrogen 2.575 N/A SER 205.A OG ASP 101.A OD2 no hydrogen 3.473 N/A ARG 206.A N ARG 202.A O no hydrogen 3.254 N/A ALA 207.A N PRO 203.A O no hydrogen 3.026 N/A ASN 208.A N PHE 204.A O no hydrogen 3.221 N/A ASN 208.A ND2 ILE 219.A O no hydrogen 2.988 N/A GLU 209.A N SER 205.A O no hydrogen 2.977 N/A LEU 210.A N ARG 206.A O no hydrogen 2.910 N/A LEU 211.A N ALA 207.A O no hydrogen 2.956 N/A VAL 212.A N ASN 208.A O no hydrogen 3.128 N/A GLY 213.A N GLU 209.A O no hydrogen 2.883 N/A MET 214.A N LEU 210.A O no hydrogen 3.070 N/A MET 214.A N LEU 211.A O no hydrogen 2.872 N/A GLY 215.A N VAL 212.A O no hydrogen 2.804 N/A ALA 216.A N LEU 211.A O no hydrogen 2.937 N/A ILE 219.A N ASN 208.A OD1 no hydrogen 2.638 N/A TRP 221.A NE1 PHE 204.A O no hydrogen 3.029 N/A ARG 222.A N ASP 220.A OD1 no hydrogen 2.990 N/A ARG 222.A NE LEU 223.A O no hydrogen 3.400 N/A LEU 223.A N TYR 98.A OH no hydrogen 2.965 N/A