Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6w4u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A NE2 ASN 252.A O no hydrogen 2.565 N/A ARG 3.A NE ASP 203.A O no hydrogen 2.837 N/A ARG 3.A NH1 PRO 225.A O no hydrogen 3.204 N/A ARG 3.A NH1 ASP 228.A OD1 no hydrogen 2.968 N/A ARG 3.A NH2 ASP 203.A O no hydrogen 3.273 N/A LYS 5.A NZ ASP 228.A OD1 no hydrogen 2.519 N/A ILE 6.A N ASP 228.A O no hydrogen 3.016 N/A VAL 7.A N ASP 37.A O no hydrogen 2.969 N/A ALA 8.A N GLY 230.A O no hydrogen 2.936 N/A GLY 9.A N VAL 39.A O no hydrogen 2.773 N/A ASN 10.A N VAL 232.A O no hydrogen 2.872 N/A ASN 10.A ND2 HIS 95.A NE2 no hydrogen 3.508 N/A TRP 11.A N LEU 41.A O no hydrogen 3.041 N/A LYS 12.A NZ GLU 97.A OE1 no hydrogen 3.125 N/A LEU 13.A N TRP 11.A O no hydrogen 2.836 N/A HIS 14.A ND1.B LYS 12.A O no hydrogen 2.874 N/A ARG 17.A NE GLU 49.A OE2 no hydrogen 2.856 N/A ARG 17.A NH2 GLU 49.A OE1 no hydrogen 3.292 N/A PHE 19.A N SER 16.A OG no hydrogen 3.180 N/A ALA 20.A N SER 16.A O no hydrogen 3.034 N/A ASN 21.A N ARG 17.A O no hydrogen 2.925 N/A GLU 22.A N GLN 18.A O no hydrogen 2.929 N/A LEU 23.A N PHE 19.A O no hydrogen 2.903 N/A LEU 24.A N ALA 20.A O no hydrogen 2.892 N/A GLY 25.A N ASN 21.A O no hydrogen 2.833 N/A GLN 26.A N GLU 22.A O no hydrogen 3.085 N/A VAL 27.A N LEU 23.A O no hydrogen 3.008 N/A ALA 28.A N LEU 24.A O no hydrogen 2.657 N/A ALA 29.A N GLY 25.A O no hydrogen 2.809 N/A GLY 30.A N VAL 27.A O no hydrogen 3.141 N/A LEU 31.A N ALA 28.A O no hydrogen 2.976 N/A ASP 37.A N LYS 5.A O no hydrogen 2.913 N/A VAL 39.A N VAL 7.A O no hydrogen 2.883 N/A ILE 40.A N ALA 60.A O no hydrogen 2.819 N/A LEU 41.A N GLY 9.A O no hydrogen 2.777 N/A TYR 46.A N PRO 43.A O no hydrogen 3.085 N/A TYR 46.A OH GLY 15.A O no hydrogen 2.679 N/A LEU 47.A N LEU 44.A O no hydrogen 2.863 N/A LEU 50.A N TYR 46.A O no hydrogen 2.939 N/A VAL 51.A N LEU 47.A O no hydrogen 3.014 N/A GLU 52.A N GLY 48.A O no hydrogen 2.953 N/A ASP 53.A N GLU 49.A O no hydrogen 2.922 N/A PHE 54.A N LEU 50.A O no hydrogen 2.828 N/A GLY 55.A N VAL 51.A O no hydrogen 2.599 N/A THR 57.A N PHE 54.A O no hydrogen 3.045 N/A THR 57.A OG1 PHE 54.A O no hydrogen 2.685 N/A LEU 59.A N THR 57.A OG1 no hydrogen 3.091 N/A ALA 60.A N VAL 38.A O no hydrogen 3.090 N/A GLY 62.A N ILE 40.A O no hydrogen 2.991 N/A ALA 63.A N TYR 90.A O no hydrogen 3.115 N/A GLN 64.A NE2 TRP 11.A O no hydrogen 2.958 N/A GLN 64.A NE2 LEU 41.A O no hydrogen 2.864 N/A ASN 69.A N SER 67.A OG no hydrogen 3.008 N/A LYS 71.A N ASN 69.A OD1 no hydrogen 2.891 N/A GLY 72.A N ASN 69.A OD1 no hydrogen 3.211 N/A TYR 74.A N GLU 77.A OE1 no hydrogen 2.872 N/A GLU 77.A N TYR 74.A O no hydrogen 3.036 N/A CYS 79.A SG LYS 71.A O no hydrogen 4.043 N/A LEU 83.A N CYS 79.A O no hydrogen 3.367 N/A VAL 84.A N ALA 80.A O no hydrogen 2.988 N/A GLU 85.A N ALA 81.A O no hydrogen 2.881 N/A VAL 86.A N MET 82.A O no hydrogen 3.011 N/A GLY 87.A N VAL 84.A O no hydrogen 2.998 N/A ALA 88.A N LEU 83.A O no hydrogen 2.956 N/A ARG 89.A N PHE 61.A O no hydrogen 2.807 N/A TYR 90.A N PHE 61.A O no hydrogen 3.190 N/A GLY 91.A N VAL 122.A O no hydrogen 3.019 N/A LEU 92.A N ALA 63.A O no hydrogen 2.890 N/A VAL 93.A N VAL 124.A O no hydrogen 2.886 N/A SER 96.A N GLU 167.A OE2 no hydrogen 2.688 N/A SER 96.A OG GLU 167.A OE1 no hydrogen 2.483 N/A GLU 97.A N HIS 95.A ND1 no hydrogen 3.013 N/A ARG 98.A N HIS 95.A O no hydrogen 2.887 N/A ARG 98.A NE GLU 104.A OE1 no hydrogen 2.753 N/A ARG 98.A NH2 GLU 104.A OE1 no hydrogen 3.533 N/A ARG 99.A N HIS 95.A O no hydrogen 2.934 N/A ARG 99.A NE GLY 94.A O no hydrogen 2.805 N/A ARG 99.A NH1 SER 106.A OG no hydrogen 2.844 N/A ARG 99.A NH2 CYS 126.A O no hydrogen 2.949 N/A GLN 100.A N SER 96.A O no hydrogen 2.931 N/A TYR 101.A N GLU 97.A O no hydrogen 2.821 N/A HIS 102.A N ARG 98.A O no hydrogen 3.005 N/A GLU 104.A N ARG 98.A O no hydrogen 3.255 N/A LEU 108.A N SER 105.A OG no hydrogen 2.931 N/A VAL 109.A N SER 105.A O no hydrogen 2.927 N/A ALA 110.A N SER 106.A O no hydrogen 2.936 N/A ARG 111.A N GLU 107.A O no hydrogen 3.138 N/A ARG 111.A NE GLU 107.A OE1 no hydrogen 3.160 N/A ARG 111.A NE GLU 107.A OE2 no hydrogen 2.768 N/A ARG 111.A NH2 GLU 107.A OE1 no hydrogen 2.803 N/A LYS 112.A N LEU 108.A O no hydrogen 2.898 N/A LYS 112.A NZ ASP 65.A OD1 no hydrogen 2.772 N/A LYS 112.A NZ ASP 65.A OD2 no hydrogen 3.380 N/A LYS 112.A NZ VAL 66.A O no hydrogen 2.891 N/A PHE 113.A N VAL 109.A O no hydrogen 2.780 N/A ALA 114.A N ALA 110.A O no hydrogen 2.965 N/A ALA 115.A N ARG 111.A O no hydrogen 2.924 N/A ALA 116.A N LYS 112.A O no hydrogen 2.922 N/A GLN 117.A N PHE 113.A O no hydrogen 2.908 N/A GLN 117.A NE2 GLY 158.A O no hydrogen 2.522 N/A HIS 118.A N ALA 114.A O no hydrogen 2.918 N/A HIS 118.A ND1 GLU 70.A OE1 no hydrogen 2.806 N/A ALA 119.A N ALA 115.A O no hydrogen 3.258 N/A ALA 119.A N ALA 116.A O no hydrogen 3.221 N/A GLY 120.A N ALA 116.A O no hydrogen 3.216 N/A GLY 120.A N GLN 117.A O no hydrogen 2.942 N/A LEU 121.A N ALA 116.A O no hydrogen 2.951 N/A VAL 122.A N ARG 89.A O no hydrogen 2.781 N/A VAL 124.A N GLY 91.A O no hydrogen 2.821 N/A LEU 125.A N VAL 163.A O no hydrogen 2.807 N/A CYS 126.A N VAL 93.A O no hydrogen 2.953 N/A VAL 127.A N ALA 165.A O no hydrogen 2.969 N/A GLY 128.A N GLN 146.A OE1 no hydrogen 2.854 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.818 N/A THR 130.A N GLN 133.A OE1 no hydrogen 2.872 N/A THR 130.A OG1 GLU 132.A OE1 no hydrogen 3.423 N/A GLU 132.A N GLU 132.A OE1 no hydrogen 2.576 N/A GLN 133.A N THR 130.A OG1 no hydrogen 3.309 N/A ARG 134.A N THR 130.A O no hydrogen 2.845 N/A ARG 134.A NH1 GLU 129.A OE2 no hydrogen 2.618 N/A GLU 135.A N LEU 131.A O no hydrogen 2.833 N/A ALA 136.A N GLU 132.A O no hydrogen 3.170 N/A ALA 136.A N GLN 133.A O no hydrogen 3.184 N/A GLY 137.A N ARG 134.A O no hydrogen 2.966 N/A GLN 138.A N GLN 133.A O no hydrogen 3.003 N/A GLN 138.A NE2 ALA 136.A O no hydrogen 3.189 N/A THR 139.A OG1 GLU 129.A OE2 no hydrogen 2.623 N/A VAL 142.A N GLN 138.A O no hydrogen 2.812 N/A ILE 143.A N THR 139.A O no hydrogen 3.024 N/A ALA 144.A N GLU 140.A O no hydrogen 2.784 N/A SER 145.A N ALA 141.A O no hydrogen 2.980 N/A SER 145.A OG VAL 142.A O no hydrogen 2.692 N/A GLN 146.A N VAL 142.A O no hydrogen 3.014 N/A GLN 146.A N ILE 143.A O no hydrogen 2.963 N/A GLN 146.A NE2 GLY 128.A O no hydrogen 3.209 N/A LEU 147.A N ILE 143.A O no hydrogen 2.978 N/A ALA 148.A N ALA 144.A O no hydrogen 2.857 N/A LEU 151.A N LEU 147.A O no hydrogen 2.932 N/A GLU 152.A N ALA 148.A O no hydrogen 2.822 N/A LEU 153.A N PRO 149.A O no hydrogen 3.133 N/A LEU 153.A N VAL 150.A O no hydrogen 3.023 N/A VAL 154.A N VAL 150.A O no hydrogen 2.959 N/A GLY 155.A N LEU 151.A O no hydrogen 2.751 N/A GLY 158.A N VAL 154.A O no hydrogen 3.115 N/A GLY 158.A N GLY 155.A O no hydrogen 3.269 N/A PHE 159.A N ALA 156.A O no hydrogen 2.890 N/A ALA 160.A N ALA 157.A O no hydrogen 3.107 N/A VAL 163.A N PRO 123.A O no hydrogen 2.947 N/A VAL 164.A N PRO 206.A O no hydrogen 3.030 N/A ALA 165.A N LEU 125.A O no hydrogen 2.810 N/A TYR 166.A N VAL 208.A O no hydrogen 2.856 N/A TYR 166.A OH GLU 129.A OE1 no hydrogen 2.621 N/A TYR 166.A OH GLU 129.A OE2 no hydrogen 3.327 N/A GLU 167.A N VAL 127.A O no hydrogen 2.704 N/A VAL 169.A N GLU 167.A O no hydrogen 2.862 N/A TRP 170.A N GLU 129.A O no hydrogen 3.059 N/A TRP 170.A NE1 TYR 166.A OH no hydrogen 3.228 N/A ALA 171.A N PRO 168.A O no hydrogen 2.845 N/A ILE 172.A N PRO 168.A O no hydrogen 2.905 N/A GLY 173.A N VAL 169.A O no hydrogen 2.993 N/A THR 174.A OG1 TRP 170.A O no hydrogen 2.769 N/A THR 174.A OG1 ALA 171.A O no hydrogen 3.394 N/A GLY 175.A N ALA 171.A O no hydrogen 2.810 N/A ARG 176.A N THR 174.A OG1 no hydrogen 3.099 N/A THR 179.A N GLN 182.A OE1 no hydrogen 2.827 N/A LYS 180.A NZ GLU 181.A OE2 no hydrogen 3.161 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.841 N/A GLN 182.A N THR 179.A OG1 no hydrogen 2.919 N/A ALA 183.A N THR 179.A O no hydrogen 3.092 N/A GLN 184.A N LYS 180.A O no hydrogen 2.932 N/A GLN 184.A NE2 ASP 226.A OD2 no hydrogen 2.642 N/A GLN 185.A N GLU 181.A O no hydrogen 3.039 N/A VAL 186.A N GLN 182.A O no hydrogen 3.259 N/A HIS 187.A N ALA 183.A O no hydrogen 2.876 N/A HIS 187.A ND1 ASP 226.A O no hydrogen 3.015 N/A ALA 188.A N GLN 184.A O no hydrogen 2.864 N/A PHE 189.A N GLN 185.A O no hydrogen 3.207 N/A ILE 190.A N VAL 186.A O no hydrogen 2.882 N/A ARG 191.A N HIS 187.A O no hydrogen 3.025 N/A ARG 191.A NE ASP 226.A OD1 no hydrogen 2.795 N/A ARG 191.A NH1 ALA 202.A O no hydrogen 2.872 N/A ARG 191.A NH1 LEU 205.A O no hydrogen 2.661 N/A ARG 191.A NH2 ASP 226.A O no hydrogen 3.172 N/A ARG 191.A NH2 ASP 228.A OD2 no hydrogen 2.851 N/A GLY 192.A N ALA 188.A O no hydrogen 2.963 N/A GLU 193.A N PHE 189.A O no hydrogen 2.991 N/A VAL 194.A N ILE 190.A O no hydrogen 3.312 N/A ALA 195.A N ARG 191.A O no hydrogen 2.753 N/A ARG 196.A N GLY 192.A O no hydrogen 2.993 N/A ARG 196.A NH1 GLU 193.A OE2 no hydrogen 2.604 N/A ARG 196.A NH2 GLU 193.A OE2 no hydrogen 3.294 N/A ILE 197.A N VAL 194.A O no hydrogen 2.908 N/A ASP 198.A N VAL 194.A O no hydrogen 2.992 N/A ILE 201.A N ASP 198.A OD1 no hydrogen 2.888 N/A ALA 202.A N ASP 198.A O no hydrogen 2.992 N/A ASP 203.A N ALA 199.A O no hydrogen 2.839 N/A SER 204.A N ARG 200.A O no hydrogen 3.279 N/A SER 204.A N ILE 201.A O no hydrogen 3.161 N/A SER 204.A OG.A ARG 200.A O no hydrogen 3.298 N/A SER 204.A OG.A ILE 201.A O no hydrogen 2.986 N/A LEU 205.A N ALA 202.A O no hydrogen 3.217 N/A ILE 207.A N ASP 228.A OD2 no hydrogen 2.837 N/A VAL 208.A N VAL 164.A O no hydrogen 2.738 N/A TYR 209.A N GLY 229.A O no hydrogen 2.856 N/A GLY 210.A N TYR 166.A O no hydrogen 2.688 N/A LYS 214.A N ASN 217.A OD1 no hydrogen 2.778 N/A LEU 221.A N ASN 217.A O no hydrogen 3.154 N/A PHE 222.A N ALA 218.A O no hydrogen 2.875 N/A ALA 223.A N GLY 219.A O no hydrogen 2.901 N/A GLN 224.A N LEU 221.A O no hydrogen 3.097 N/A GLN 224.A NE2 GLU 220.A O no hydrogen 3.634 N/A ASP 226.A N GLN 184.A OE1 no hydrogen 2.892 N/A VAL 227.A N GLN 224.A O no hydrogen 3.212 N/A ASP 228.A N ILE 207.A O no hydrogen 2.814 N/A GLY 230.A N ILE 6.A O no hydrogen 3.010 N/A LEU 231.A N TYR 209.A O no hydrogen 2.835 N/A VAL 232.A N ALA 8.A O no hydrogen 2.731 N/A PHE 242.A N VAL 238.A O no hydrogen 2.847 N/A LEU 243.A N ALA 239.A O no hydrogen 2.824 N/A ALA 244.A N ALA 240.A O no hydrogen 2.912 N/A ILE 245.A N ASP 241.A O no hydrogen 2.968 N/A ALA 246.A N PHE 242.A O no hydrogen 2.915 N/A ARG 247.A N LEU 243.A O no hydrogen 2.841 N/A ALA 248.A N ALA 244.A O no hydrogen 3.179 N/A ALA 249.A N ILE 245.A O no hydrogen 3.192 N/A ALA 250.A N ALA 246.A O no hydrogen 3.177 N/A ALA 251.A N ARG 247.A O no hydrogen 2.793 N/A ASN 252.A N ALA 248.A O no hydrogen 2.871 N/A ASN 252.A ND2 ALA 248.A O no hydrogen 2.936 N/A