Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jd0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH1 GLY 50.A O no hydrogen 2.823 N/A ALA 8.A N ARG 53.A O no hydrogen 2.948 N/A ILE 9.A N PHE 106.A O no hydrogen 2.819 N/A VAL 10.A N VAL 55.A O no hydrogen 2.858 N/A LEU 11.A N SER 108.A O no hydrogen 2.954 N/A ALA 12.A N VAL 57.A O no hydrogen 2.652 N/A SER 13.A OG.B SER 59.A OG.B no hydrogen 2.949 N/A LEU 19.A N GLY 16.A O no hydrogen 3.108 N/A ARG 20.A N LYS 17.A O no hydrogen 3.042 N/A VAL 22.A N LEU 19.A O no hydrogen 2.899 N/A THR 23.A N LEU 19.A O no hydrogen 2.830 N/A THR 23.A OG1 LEU 19.A O no hydrogen 3.453 N/A THR 23.A OG1 GLY 24.A O no hydrogen 3.563 N/A THR 23.A OG1 VAL 26.A O no hydrogen 2.893 N/A GLY 24.A N ARG 20.A O no hydrogen 2.753 N/A VAL 26.A N THR 23.A O no hydrogen 3.229 N/A LYS 28.A NZ ASP 111.A OD2 no hydrogen 2.753 N/A LYS 28.A NZ ILE 222.A O no hydrogen 2.777 N/A PHE 30.A N PRO 27.A O no hydrogen 2.966 N/A TYR 31.A N LYS 28.A O no hydrogen 2.998 N/A PHE 33.A N CYS 36.A O no hydrogen 3.051 N/A CYS 36.A N PHE 33.A O no hydrogen 3.248 N/A CYS 36.A SG TYR 41.A OH no hydrogen 3.763 N/A GLU 37.A N GLU 37.A OE1.A no hydrogen 2.664 N/A LEU 38.A N TYR 31.A O no hydrogen 3.008 N/A VAL 39.A N VAL 29.A O no hydrogen 2.941 N/A LYS 40.A N GLU 37.A O no hydrogen 2.960 N/A LYS 40.A NZ GLU 37.A OE1.A no hydrogen 2.847 N/A LYS 40.A NZ GLU 37.A OE2.A no hydrogen 3.271 N/A LYS 40.A NZ ASP 72.A OD2 no hydrogen 2.760 N/A LYS 40.A NZ CYS 245.A OXT no hydrogen 2.686 N/A TYR 41.A N LEU 38.A O no hydrogen 3.036 N/A TYR 41.A OH PHE 33.A O no hydrogen 2.748 N/A MET 43.A N VAL 39.A O no hydrogen 3.441 N/A ILE 44.A N LYS 40.A O no hydrogen 2.797 N/A SER 45.A N TYR 41.A O no hydrogen 3.067 N/A SER 45.A OG PHE 114.A O no hydrogen 2.603 N/A LEU 46.A N PRO 42.A O no hydrogen 2.924 N/A MET 47.A N MET 43.A O no hydrogen 2.813 N/A LYS 48.A N ILE 44.A O no hydrogen 2.783 N/A LYS 48.A NZ ILE 239.A O no hydrogen 2.678 N/A LYS 48.A NZ GLU 241.A O no hydrogen 2.710 N/A ASN 49.A N LEU 46.A O no hydrogen 2.842 N/A ASN 49.A ND2 SER 45.A O no hydrogen 2.927 N/A ASN 49.A ND2 PRO 116.A O no hydrogen 2.953 N/A GLY 50.A N MET 47.A O no hydrogen 2.962 N/A VAL 51.A N LEU 46.A O no hydrogen 3.116 N/A GLU 52.A N ARG 6.A O no hydrogen 2.747 N/A ARG 53.A N ARG 6.A O no hydrogen 3.045 N/A ARG 53.A NH1 TYR 99.A O no hydrogen 3.017 N/A ARG 53.A NH2 TYR 99.A O no hydrogen 3.076 N/A PHE 54.A N GLU 76.A O no hydrogen 3.091 N/A VAL 55.A N ALA 8.A O no hydrogen 2.876 N/A LEU 56.A N ILE 78.A O no hydrogen 2.958 N/A VAL 57.A N VAL 10.A O no hydrogen 2.851 N/A VAL 58.A N VAL 80.A O no hydrogen 2.924 N/A SER 59.A OG.B SER 13.A OG.B no hydrogen 2.949 N/A GLU 60.A N ASN 82.A O no hydrogen 2.817 N/A GLY 61.A N GLU 81.A OE1 no hydrogen 2.712 N/A TYR 62.A N SER 59.A O no hydrogen 3.148 N/A ARG 63.A NE.B ASP 64.A OD1.B no hydrogen 3.131 N/A ARG 63.A NH1.A VAL 79.A O no hydrogen 2.709 N/A ARG 63.A NH2.A GLU 81.A OE2 no hydrogen 3.136 N/A ARG 63.A NH2.B ASP 64.A OD1.B no hydrogen 2.612 N/A GLY 66.A N TYR 62.A O no hydrogen 3.074 N/A GLU 67.A N ARG 63.A O no hydrogen 2.802 N/A LYS 68.A N ASP 64.A O no hydrogen 2.932 N/A VAL 69.A N LEU 65.A O no hydrogen 3.045 N/A LEU 70.A N GLY 66.A O no hydrogen 3.139 N/A ASN 71.A N GLU 67.A O no hydrogen 2.866 N/A ASP 72.A N LYS 68.A O no hydrogen 2.757 N/A LEU 73.A N VAL 69.A O no hydrogen 3.110 N/A GLY 74.A N ASN 71.A O no hydrogen 3.051 N/A VAL 75.A N LEU 70.A O no hydrogen 3.229 N/A ILE 78.A N PHE 54.A O no hydrogen 2.994 N/A VAL 80.A N LEU 56.A O no hydrogen 2.866 N/A ASN 82.A N VAL 58.A O no hydrogen 2.606 N/A LYS 84.A N ASN 82.A OD1 no hydrogen 2.787 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 3.026 N/A LEU 87.A N LYS 84.A O no hydrogen 2.862 N/A GLY 88.A N VAL 85.A O no hydrogen 3.223 N/A ALA 90.A N ILE 193.A O no hydrogen 2.963 N/A TYR 91.A N GLY 88.A O no hydrogen 3.062 N/A SER 92.A N GLY 88.A O no hydrogen 3.326 N/A SER 92.A OG SER 13.A OG.A no hydrogen 3.026 N/A PHE 93.A N ASN 89.A O no hydrogen 2.971 N/A PHE 94.A N ALA 90.A O no hydrogen 2.921 N/A LEU 95.A N TYR 91.A O no hydrogen 2.925 N/A SER 96.A N PHE 93.A O no hydrogen 2.978 N/A SER 96.A OG PHE 93.A O no hydrogen 2.644 N/A SER 96.A OG TYR 181.A OH no hydrogen 2.759 N/A GLU 97.A N PHE 94.A O no hydrogen 3.280 N/A TYR 99.A N SER 96.A O no hydrogen 2.910 N/A VAL 100.A N GLU 97.A O no hydrogen 3.365 N/A GLU 101.A N GLU 7.A OE1 no hydrogen 3.165 N/A GLU 101.A N GLU 7.A OE2 no hydrogen 2.894 N/A SER 102.A OG.A GLU 7.A OE1 no hydrogen 2.613 N/A SER 102.A OG.B LYS 104.A O no hydrogen 3.070 N/A SER 102.A OG.C GLU 7.A OE1 no hydrogen 2.864 N/A SER 102.A OG.C LYS 104.A O no hydrogen 3.291 N/A PHE 105.A N MET 176.A O no hydrogen 2.943 N/A PHE 106.A N GLU 7.A O no hydrogen 3.048 N/A LEU 107.A N PHE 174.A O no hydrogen 2.885 N/A SER 108.A N ILE 9.A O no hydrogen 2.838 N/A SER 108.A OG CYS 109.A O no hydrogen 2.822 N/A CYS 109.A N GLY 172.A O no hydrogen 2.929 N/A CYS 109.A SG GLY 172.A O no hydrogen 3.754 N/A GLY 110.A N LEU 11.A O no hydrogen 2.729 N/A SER 112.A N CYS 109.A O no hydrogen 3.348 N/A SER 112.A OG THR 171.A O no hydrogen 2.783 N/A LEU 113.A N THR 220.A O no hydrogen 2.843 N/A ALA 118.A N PRO 115.A O no hydrogen 3.041 N/A LEU 119.A N PRO 116.A O no hydrogen 3.152 N/A LYS 120.A N SER 117.A O no hydrogen 3.131 N/A SER 121.A OG.A ASP 213.A O no hydrogen 2.821 N/A ALA 122.A N LEU 119.A O no hydrogen 2.902 N/A HIS 129.A N ILE 208.A O no hydrogen 2.846 N/A ILE 130.A N ILE 208.A O no hydrogen 3.226 N/A LYS 131.A N VAL 175.A O no hydrogen 2.845 N/A LYS 131.A NZ SER 124.A O no hydrogen 3.221 N/A LYS 131.A NZ ASP 126.A OD1 no hydrogen 2.775 N/A LEU 132.A N LYS 210.A O no hydrogen 2.927 N/A GLY 133.A N VAL 173.A O no hydrogen 2.772 N/A VAL 134.A N PHE 212.A O no hydrogen 2.901 N/A SER 135.A N PHE 169.A O no hydrogen 3.049 N/A ARG 137.A N SER 135.A OG no hydrogen 2.806 N/A ARG 137.A NE ASP 139.A OD1 no hydrogen 2.888 N/A ARG 137.A NH1 ASN 216.A O no hydrogen 2.765 N/A ARG 137.A NH2 ASP 139.A OD2 no hydrogen 2.828 N/A GLU 144.A N ASP 142.A OD1 no hydrogen 2.924 N/A LYS 145.A N ASP 142.A O no hydrogen 2.832 N/A LYS 145.A NZ ASP 142.A OD2 no hydrogen 2.969 N/A LYS 145.A NZ SER 224.A OG no hydrogen 2.653 N/A LYS 145.A NZ ASP 227.A OD1 no hydrogen 3.030 N/A LYS 145.A NZ ASP 227.A OD2 no hydrogen 2.669 N/A LYS 148.A N GLY 160.A O no hydrogen 2.824 N/A LYS 148.A NZ PRO 143.A O no hydrogen 3.176 N/A VAL 149.A N TYR 168.A O no hydrogen 2.818 N/A LEU 150.A N LYS 158.A O no hydrogen 2.899 N/A VAL 151.A N ASN 167.A OD1 no hydrogen 2.816 N/A ASN 152.A N ARG 155.A O no hydrogen 2.946 N/A ARG 155.A N ASN 152.A O no hydrogen 2.928 N/A ARG 155.A NH2 ASN 152.A OD1 no hydrogen 2.723 N/A ARG 155.A NH2 GLU 153.A OE1.A no hydrogen 3.148 N/A ILE 156.A N VAL 209.A O no hydrogen 2.963 N/A VAL 157.A N LEU 150.A O no hydrogen 2.745 N/A LYS 158.A N LEU 150.A O no hydrogen 3.482 N/A ILE 159.A N GLN 200.A OE1 no hydrogen 2.935 N/A GLY 160.A N LYS 148.A O no hydrogen 2.985 N/A LYS 161.A NZ GLU 144.A O no hydrogen 3.323 N/A LYS 161.A NZ LYS 145.A O no hydrogen 2.718 N/A ASN 167.A N VAL 149.A O no hydrogen 2.984 N/A ASN 167.A ND2 VAL 151.A O no hydrogen 2.943 N/A TYR 168.A N VAL 149.A O no hydrogen 3.150 N/A PHE 169.A N SER 135.A O no hydrogen 2.759 N/A ASP 170.A N SER 147.A O no hydrogen 2.968 N/A THR 171.A N GLY 133.A O no hydrogen 3.123 N/A THR 171.A OG1 GLY 133.A O no hydrogen 2.789 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 2.783 N/A VAL 173.A N THR 171.A OG1 no hydrogen 3.290 N/A PHE 174.A N LEU 107.A O no hydrogen 2.844 N/A VAL 175.A N LYS 131.A O no hydrogen 2.704 N/A MET 176.A N PHE 105.A O no hydrogen 2.796 N/A THR 177.A N HIS 129.A O no hydrogen 3.197 N/A THR 177.A OG1 HIS 129.A O no hydrogen 2.967 N/A LYS 178.A N GLU 103.A O no hydrogen 3.028 N/A LYS 178.A NZ SER 102.A O no hydrogen 3.521 N/A VAL 180.A N THR 177.A O no hydrogen 2.996 N/A TYR 181.A N LYS 178.A O no hydrogen 3.090 N/A TYR 181.A OH SER 96.A OG no hydrogen 2.759 N/A SER 182.A N LYS 179.A O no hydrogen 3.000 N/A SER 182.A OG LYS 179.A O no hydrogen 2.646 N/A LEU 183.A N VAL 180.A O no hydrogen 2.963 N/A LYS 184.A N TYR 181.A O no hydrogen 3.040 N/A LYS 184.A NZ.A GLU 97.A OE1 no hydrogen 2.854 N/A SER 186.A N LEU 183.A O no hydrogen 2.934 N/A SER 186.A OG.A LEU 183.A O no hydrogen 3.509 N/A SER 186.A OG.B LEU 183.A O no hydrogen 2.505 N/A SER 188.A OG THR 190.A OG1 no hydrogen 3.223 N/A TRP 189.A NE1 LYS 184.A O no hydrogen 2.775 N/A THR 190.A OG1 SER 188.A OG no hydrogen 3.223 N/A ILE 193.A N LEU 87.A O no hydrogen 2.873 N/A SER 194.A OG.A ASP 192.A OD1 no hydrogen 3.526 N/A LEU 195.A N ASN 89.A OD1.A no hydrogen 2.858 N/A HIS 197.A N SER 194.A O no hydrogen 3.064 N/A HIS 197.A N SER 194.A OG.B no hydrogen 3.205 N/A VAL 198.A N SER 194.A O no hydrogen 3.263 N/A LEU 199.A N LEU 195.A O no hydrogen 3.040 N/A GLN 200.A N TYR 196.A O no hydrogen 2.929 N/A GLN 200.A NE2 ASP 204.A OD1 no hydrogen 2.872 N/A LYS 201.A N HIS 197.A O no hydrogen 2.834 N/A LYS 201.A NZ SER 186.A O no hydrogen 3.527 N/A ALA 202.A N VAL 198.A O no hydrogen 2.867 N/A VAL 203.A N LEU 199.A O no hydrogen 2.936 N/A ASP 204.A N GLN 200.A O no hydrogen 2.883 N/A THR 205.A N ALA 202.A O no hydrogen 3.294 N/A THR 205.A OG1 LYS 201.A O no hydrogen 2.952 N/A THR 205.A OG1 ALA 202.A O no hydrogen 3.431 N/A GLY 206.A N VAL 203.A O no hydrogen 3.130 N/A MET 207.A N ALA 202.A O no hydrogen 2.952 N/A ILE 208.A N HIS 129.A ND1 no hydrogen 2.979 N/A LYS 210.A N ILE 130.A O no hydrogen 2.890 N/A LYS 210.A NZ GLU 127.A O no hydrogen 2.787 N/A VAL 211.A N ASN 154.A O no hydrogen 2.892 N/A PHE 212.A N LEU 132.A O no hydrogen 2.800 N/A PHE 214.A N VAL 134.A O no hydrogen 2.868 N/A GLY 215.A N ASP 213.A OD1 no hydrogen 2.806 N/A ALA 217.A N PHE 214.A O no hydrogen 3.303 N/A TRP 219.A NE1 ARG 137.A O no hydrogen 2.812 N/A THR 220.A N LEU 113.A O no hydrogen 2.938 N/A THR 220.A OG1 LEU 140.A O no hydrogen 3.541 N/A THR 220.A OG1 GLU 221.A O no hydrogen 3.461 N/A ILE 222.A N ASP 111.A O no hydrogen 2.951 N/A ASP 223.A N ASP 227.A OD2 no hydrogen 2.838 N/A SER 224.A N ASP 227.A OD2 no hydrogen 2.878 N/A SER 224.A OG ASP 227.A OD2 no hydrogen 3.476 N/A ASP 227.A N SER 224.A O no hydrogen 2.912 N/A LEU 228.A N PRO 225.A O no hydrogen 3.174 N/A VAL 232.A N ASN 229.A OD1 no hydrogen 2.932 N/A TYR 233.A N ASN 229.A O no hydrogen 2.929 N/A GLU 234.A N SER 230.A O no hydrogen 2.923 N/A LEU 235.A N LYS 231.A O no hydrogen 2.992 N/A MET 236.A N VAL 232.A O no hydrogen 2.827 N/A SER 237.A N TYR 233.A O no hydrogen 2.923 N/A SER 237.A OG.B ASP 34.A OD2 no hydrogen 3.210 N/A SER 237.A OG.B TYR 233.A O no hydrogen 3.208 N/A LYS 238.A N GLU 234.A O no hydrogen 2.918 N/A ILE 239.A N LEU 235.A O no hydrogen 2.914 N/A LYS 240.A N MET 236.A O no hydrogen 3.029 N/A LYS 240.A NZ ASP 34.A O no hydrogen 2.852 N/A GLU 241.A N LYS 238.A O no hydrogen 3.189 N/A VAL 243.A N LYS 240.A O no hydrogen 3.047 N/A CYS 245.A SG GLY 35.A O no hydrogen 3.489 N/A