Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p61_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 222.A OD1 no hydrogen 2.779 N/A ARG 2.A NH1 GLN 197.A O no hydrogen 2.844 N/A PHE 5.A N ASP 222.A O no hydrogen 2.907 N/A VAL 6.A N GLU 36.A O no hydrogen 2.871 N/A GLY 7.A N PHE 224.A O no hydrogen 2.838 N/A GLY 8.A N.A VAL 38.A O no hydrogen 2.765 N/A GLY 8.A N.B VAL 38.A O no hydrogen 2.744 N/A ASN 9.A N VAL 226.A O no hydrogen 2.806 N/A TRP 10.A N GLY 40.A O no hydrogen 3.023 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.976 N/A LYS 11.A NZ GLU 95.A OE2 no hydrogen 2.722 N/A ASN 13.A ND2 TRP 10.A O no hydrogen 2.866 N/A ASP 15.A N SER 18.A OG no hydrogen 3.006 N/A LYS 17.A NZ GLU 21.A OE2.A no hydrogen 2.535 N/A SER 18.A N ASP 15.A OD1 no hydrogen 2.825 N/A SER 18.A OG ASP 15.A O no hydrogen 3.452 N/A SER 18.A OG ASP 15.A OD1 no hydrogen 3.105 N/A LEU 19.A N ASP 15.A O no hydrogen 2.819 N/A GLY 20.A N LYS 16.A O no hydrogen 2.813 N/A GLU 21.A N LYS 17.A O no hydrogen 3.068 N/A LEU 22.A N.A SER 18.A O no hydrogen 3.080 N/A LEU 22.A N.B SER 18.A O no hydrogen 3.059 N/A ILE 23.A N LEU 19.A O no hydrogen 2.859 N/A HIS 24.A N GLY 20.A O no hydrogen 2.885 N/A THR 25.A N GLU 21.A O no hydrogen 3.016 N/A THR 25.A OG1 GLU 21.A O no hydrogen 3.100 N/A LEU 26.A N LEU 22.A O.A no hydrogen 3.184 N/A LEU 26.A N LEU 22.A O.B no hydrogen 3.013 N/A ASN 27.A N ILE 23.A O no hydrogen 2.879 N/A ASN 27.A ND2 LYS 52.A O no hydrogen 2.890 N/A GLY 28.A N HIS 24.A O no hydrogen 3.124 N/A GLY 28.A N THR 25.A O no hydrogen 3.187 N/A ALA 29.A N LEU 26.A O no hydrogen 3.250 N/A SER 32.A N ASN 240.A OD1 no hydrogen 2.790 N/A SER 32.A OG HIS 243.A NE2 no hydrogen 2.811 N/A ASP 34.A N SER 32.A OG no hydrogen 3.172 N/A THR 35.A N SER 32.A O no hydrogen 3.194 N/A THR 35.A OG1 ILE 239.A O no hydrogen 2.839 N/A GLU 36.A N PHE 4.A O no hydrogen 2.801 N/A VAL 38.A N VAL 6.A O no hydrogen 2.960 N/A CYS 39.A N GLY 58.A O no hydrogen 2.876 N/A GLY 40.A N GLY 8.A O.A no hydrogen 2.831 N/A GLY 40.A N GLY 8.A O.B no hydrogen 2.537 N/A ALA 41.A N ALA 60.A O no hydrogen 3.077 N/A TYR 45.A N PRO 42.A O no hydrogen 2.829 N/A LEU 46.A N SER 43.A O no hydrogen 3.216 N/A ALA 49.A N TYR 45.A O no hydrogen 2.798 N/A ARG 50.A N LEU 46.A O no hydrogen 2.962 N/A ARG 50.A NE ARG 50.A O no hydrogen 2.838 N/A ARG 50.A NH1 ILE 57.A O no hydrogen 2.807 N/A ARG 50.A NH2 LEU 53.A O no hydrogen 2.933 N/A ARG 50.A NH2 ASP 54.A O no hydrogen 2.986 N/A ARG 50.A NH2 ILE 57.A O no hydrogen 3.013 N/A GLN 51.A N ASP 47.A O no hydrogen 2.951 N/A GLN 51.A NE2 ASP 47.A OD1 no hydrogen 2.815 N/A LYS 52.A N PHE 48.A O no hydrogen 3.038 N/A LYS 52.A N ALA 49.A O no hydrogen 3.286 N/A LEU 53.A N ALA 49.A O no hydrogen 2.923 N/A ASP 54.A N ASN 27.A OD1 no hydrogen 2.901 N/A LYS 56.A N ASP 54.A OD1 no hydrogen 2.904 N/A ILE 57.A N ASP 54.A O no hydrogen 2.905 N/A GLY 58.A N VAL 37.A O no hydrogen 2.856 N/A ALA 60.A N CYS 39.A O no hydrogen 2.813 N/A ALA 61.A N TRP 88.A O no hydrogen 2.941 N/A GLN 62.A NE2 LYS 11.A O no hydrogen 2.925 N/A GLN 62.A NE2 GLY 40.A O no hydrogen 3.016 N/A CYS 64.A SG TYR 65.A O no hydrogen 3.525 N/A TYR 65.A N ILE 76.A O no hydrogen 2.771 N/A PHE 72.A N GLY 70.A O no hydrogen 2.895 N/A GLU 75.A N PHE 72.A O no hydrogen 2.967 N/A SER 77.A OG PRO 68.A O no hydrogen 2.856 N/A MET 80.A N SER 77.A O no hydrogen 3.006 N/A ILE 81.A N SER 77.A O no hydrogen 3.169 N/A LYS 82.A N PRO 78.A O no hydrogen 2.903 N/A LYS 82.A NZ.A GLU 117.A O no hydrogen 2.678 N/A LYS 82.A NZ.B GLY 118.A O no hydrogen 3.106 N/A ASP 83.A N ALA 79.A O no hydrogen 2.962 N/A ILE 84.A N.A MET 80.A O no hydrogen 3.168 N/A ILE 84.A N.A ILE 81.A O no hydrogen 3.308 N/A ILE 84.A N.B MET 80.A O no hydrogen 3.220 N/A GLY 85.A N LYS 82.A O no hydrogen 2.918 N/A ALA 86.A N ILE 81.A O no hydrogen 3.162 N/A ALA 87.A N VAL 59.A O no hydrogen 3.279 N/A TRP 88.A N VAL 59.A O no hydrogen 3.309 N/A VAL 89.A N GLY 120.A O no hydrogen 2.947 N/A ILE 90.A N ALA 61.A O no hydrogen 2.807 N/A LEU 91.A N ILE 122.A O no hydrogen 2.905 N/A SER 94.A N GLU 163.A OE1 no hydrogen 2.834 N/A SER 94.A OG GLU 163.A OE2 no hydrogen 2.938 N/A GLU 95.A N HIS 93.A ND1 no hydrogen 3.063 N/A ARG 96.A NE GLU 102.A OE2 no hydrogen 2.888 N/A ARG 96.A NH2 GLU 102.A OE2 no hydrogen 3.418 N/A ARG 97.A N HIS 93.A O no hydrogen 3.036 N/A ARG 97.A NE GLY 92.A O no hydrogen 2.887 N/A ARG 97.A NH1 ASP 104.A OD1 no hydrogen 2.708 N/A ARG 97.A NH2 CYS 124.A O no hydrogen 2.831 N/A HIS 98.A N SER 94.A O no hydrogen 2.865 N/A VAL 99.A N GLU 95.A O no hydrogen 2.927 N/A PHE 100.A N GLU 95.A O no hydrogen 3.396 N/A GLU 102.A N ARG 96.A O no hydrogen 3.009 N/A LEU 106.A N SER 103.A OG no hydrogen 3.075 N/A ILE 107.A N SER 103.A O no hydrogen 2.935 N/A GLY 108.A N ASP 104.A O no hydrogen 2.895 N/A GLN 109.A N GLU 105.A O no hydrogen 2.992 N/A LYS 110.A N LEU 106.A O no hydrogen 2.906 N/A LYS 110.A NZ ASN 63.A OD1 no hydrogen 2.910 N/A LYS 110.A NZ CYS 64.A O no hydrogen 3.027 N/A LYS 110.A NZ GLU 102.A OE1 no hydrogen 3.040 N/A LYS 110.A NZ GLU 102.A OE2 no hydrogen 3.132 N/A VAL 111.A N ILE 107.A O no hydrogen 2.923 N/A ALA 112.A N GLY 108.A O no hydrogen 3.009 N/A HIS 113.A N GLN 109.A O no hydrogen 3.081 N/A ALA 114.A N LYS 110.A O no hydrogen 2.862 N/A LEU 115.A N VAL 111.A O no hydrogen 3.011 N/A ALA 116.A N ALA 112.A O no hydrogen 3.011 N/A GLU 117.A N HIS 113.A O no hydrogen 2.994 N/A GLY 118.A N LEU 115.A O no hydrogen 3.017 N/A LEU 119.A N ALA 114.A O no hydrogen 3.035 N/A GLY 120.A N ALA 87.A O no hydrogen 2.794 N/A VAL 121.A N LYS 157.A O no hydrogen 2.870 N/A ILE 122.A N VAL 89.A O no hydrogen 2.883 N/A ALA 123.A N VAL 159.A O no hydrogen 2.822 N/A CYS 124.A N LEU 91.A O no hydrogen 2.866 N/A CYS 124.A SG LEU 91.A O no hydrogen 3.807 N/A CYS 124.A SG ILE 122.A O no hydrogen 3.965 N/A ILE 125.A N ALA 161.A O no hydrogen 2.880 N/A GLY 126.A N GLN 144.A OE1 no hydrogen 2.725 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.741 N/A LYS 128.A N GLU 131.A OE1 no hydrogen 2.734 N/A LYS 128.A NZ HIS 98.A ND1 no hydrogen 3.184 N/A ARG 132.A N LYS 128.A O no hydrogen 3.075 N/A ARG 132.A NE GLU 127.A OE2 no hydrogen 2.717 N/A ARG 132.A NH2 TYR 162.A OH no hydrogen 2.659 N/A GLU 133.A N LEU 129.A O no hydrogen 2.926 N/A ALA 134.A N ASP 130.A O no hydrogen 2.933 N/A GLY 135.A N ARG 132.A O no hydrogen 3.073 N/A ILE 136.A N GLU 131.A O no hydrogen 3.021 N/A THR 137.A OG1 GLU 127.A OE2 no hydrogen 2.699 N/A VAL 140.A N ILE 136.A O no hydrogen 3.093 N/A VAL 141.A N THR 137.A O no hydrogen 2.941 N/A PHE 142.A N GLU 138.A O no hydrogen 2.959 N/A GLU 143.A N LYS 139.A O no hydrogen 3.129 N/A GLN 144.A N VAL 140.A O no hydrogen 3.024 N/A GLN 144.A NE2 GLY 126.A O no hydrogen 3.041 N/A THR 145.A N VAL 141.A O no hydrogen 2.889 N/A THR 145.A OG1 VAL 141.A O no hydrogen 2.733 N/A LYS 146.A N PHE 142.A O no hydrogen 2.872 N/A ALA 147.A N GLU 143.A O no hydrogen 3.236 N/A ILE 148.A N GLN 144.A O no hydrogen 3.219 N/A ALA 149.A N THR 145.A O no hydrogen 2.769 N/A ASP 150.A N LYS 146.A O no hydrogen 2.956 N/A ASN 151.A N ILE 148.A O no hydrogen 2.828 N/A ASN 151.A ND2 ALA 147.A O no hydrogen 2.816 N/A VAL 152.A N ALA 149.A O no hydrogen 3.134 N/A SER 156.A N ASP 154.A OD1 no hydrogen 2.958 N/A SER 156.A OG ASP 154.A OD1 no hydrogen 3.173 N/A SER 156.A OG ASP 154.A OD2 no hydrogen 2.682 N/A VAL 158.A N TRP 155.A O no hydrogen 3.032 N/A VAL 159.A N VAL 121.A O no hydrogen 2.900 N/A LEU 160.A N ARG 200.A O no hydrogen 2.971 N/A ALA 161.A N ALA 123.A O no hydrogen 2.829 N/A TYR 162.A N ILE 202.A O no hydrogen 2.906 N/A TYR 162.A OH GLU 127.A OE1 no hydrogen 2.797 N/A TYR 162.A OH GLU 127.A OE2 no hydrogen 3.289 N/A GLU 163.A N ILE 125.A O no hydrogen 2.780 N/A THR 170.A N ALA 167.A O no hydrogen 2.995 N/A GLN 175.A N THR 172.A OG1 no hydrogen 3.073 N/A ALA 176.A N THR 172.A O no hydrogen 3.085 N/A GLN 177.A N PRO 173.A O no hydrogen 2.924 N/A GLN 177.A NE2 GLU 181.A OE2 no hydrogen 3.125 N/A GLN 177.A NE2 ASP 220.A OD2 no hydrogen 2.830 N/A GLU 178.A N GLN 174.A O no hydrogen 2.946 N/A VAL 179.A N GLN 175.A O no hydrogen 3.301 N/A HIS 180.A N ALA 176.A O no hydrogen 2.959 N/A HIS 180.A ND1 ASP 220.A O no hydrogen 3.110 N/A GLU 181.A N GLN 177.A O no hydrogen 2.884 N/A LYS 182.A N GLU 178.A O no hydrogen 3.190 N/A LYS 182.A NZ GLU 138.A OE1.A no hydrogen 3.196 N/A LYS 182.A NZ GLU 138.A OE2.B no hydrogen 2.742 N/A LEU 183.A N VAL 179.A O no hydrogen 2.894 N/A ARG 184.A N HIS 180.A O no hydrogen 2.932 N/A ARG 184.A NE ASP 220.A OD1 no hydrogen 2.807 N/A ARG 184.A NH1 ALA 196.A O no hydrogen 2.868 N/A ARG 184.A NH1 THR 199.A O no hydrogen 2.817 N/A ARG 184.A NH2 ASP 220.A O no hydrogen 3.062 N/A ARG 184.A NH2 ASP 222.A OD2 no hydrogen 2.780 N/A GLY 185.A N GLU 181.A O no hydrogen 3.023 N/A TRP 186.A N LYS 182.A O no hydrogen 2.916 N/A LEU 187.A N LEU 183.A O no hydrogen 2.987 N/A LYS 188.A N ARG 184.A O no hydrogen 2.916 N/A SER 189.A N GLY 185.A O no hydrogen 3.325 N/A HIS 190.A N TRP 186.A O no hydrogen 2.873 N/A VAL 191.A N LEU 187.A O no hydrogen 2.843 N/A SER 192.A N LEU 187.A O no hydrogen 3.078 N/A VAL 195.A N SER 192.A OG no hydrogen 3.051 N/A ALA 196.A N SER 192.A O no hydrogen 3.031 N/A GLN 197.A N ASP 193.A O no hydrogen 2.975 N/A SER 198.A N ALA 194.A O no hydrogen 3.028 N/A SER 198.A OG ALA 194.A O no hydrogen 2.860 N/A THR 199.A N VAL 195.A O no hydrogen 2.999 N/A THR 199.A OG1 VAL 195.A O no hydrogen 2.670 N/A ARG 200.A NH1 LYS 3.A O no hydrogen 2.823 N/A ARG 200.A NH1 GLU 36.A OE1 no hydrogen 2.882 N/A ARG 200.A NH2 GLU 36.A OE1 no hydrogen 2.982 N/A ILE 201.A N ASP 222.A OD2 no hydrogen 2.869 N/A ILE 202.A N LEU 160.A O no hydrogen 2.733 N/A TYR 203.A N GLY 223.A O no hydrogen 2.863 N/A GLY 204.A N TYR 162.A O no hydrogen 2.731 N/A GLY 209.A N GLU 234.A OE2 no hydrogen 2.831 N/A GLY 210.A N THR 208.A OG1 no hydrogen 3.241 N/A ASN 211.A N THR 208.A O no hydrogen 3.340 N/A ASN 211.A N THR 208.A OG1 no hydrogen 3.228 N/A ASN 211.A ND2 THR 208.A O no hydrogen 3.179 N/A CYS 212.A SG GLY 209.A O no hydrogen 3.517 N/A CYS 212.A SG ASP 237.A O no hydrogen 3.928 N/A LYS 213.A NZ HIS 243.A O no hydrogen 2.719 N/A LEU 215.A N ASN 211.A O no hydrogen 3.197 N/A ALA 216.A N CYS 212.A O no hydrogen 2.848 N/A SER 217.A N LYS 213.A O no hydrogen 3.041 N/A SER 217.A OG GLU 214.A O no hydrogen 2.734 N/A GLN 218.A N LEU 215.A O no hydrogen 3.096 N/A GLN 218.A NE2 GLU 214.A O no hydrogen 3.033 N/A ASP 220.A N GLN 177.A OE1 no hydrogen 2.851 N/A VAL 221.A N GLN 218.A O no hydrogen 3.317 N/A ASP 222.A N ILE 201.A O no hydrogen 2.931 N/A PHE 224.A N PHE 5.A O no hydrogen 2.898 N/A LEU 225.A N TYR 203.A O no hydrogen 2.929 N/A VAL 226.A N GLY 7.A O no hydrogen 2.757 N/A SER 230.A N GLY 227.A O no hydrogen 2.929 N/A SER 230.A OG ASN 9.A O no hydrogen 3.291 N/A SER 230.A OG GLY 227.A O no hydrogen 2.750 N/A LEU 231.A N GLY 228.A O no hydrogen 3.116 N/A LYS 232.A N ALA 229.A O no hydrogen 2.995 N/A PHE 235.A N LYS 232.A O no hydrogen 3.161 N/A VAL 236.A N PRO 233.A O no hydrogen 3.287 N/A ILE 238.A N GLU 234.A O no hydrogen 3.033 N/A ILE 239.A N PHE 235.A O no hydrogen 2.959 N/A ASN 240.A N VAL 236.A O no hydrogen 3.120 N/A ASN 240.A ND2 LYS 30.A O no hydrogen 2.932 N/A ALA 241.A N ILE 238.A O no hydrogen 3.098 N/A LYS 242.A NZ ALA 216.A O no hydrogen 3.407 N/A HIS 243.A N ASN 240.A O no hydrogen 2.989 N/A