Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jvg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 93.A OE1 no hydrogen 3.480 N/A HIS 2.A N LEU 94.A O no hydrogen 2.963 N/A LEU 4.A N CYS 92.A O no hydrogen 3.020 N/A LYS 5.A N LEU 25.A O no hydrogen 2.747 N/A LEU 6.A N ILE 90.A O no hydrogen 2.744 N/A LEU 7.A N LEU 23.A O no hydrogen 2.732 N/A HIS 8.A N SER 88.A O no hydrogen 2.883 N/A HIS 8.A ND1 SER 88.A OG no hydrogen 2.835 N/A PHE 9.A N GLY 21.A O no hydrogen 2.873 N/A ALA 10.A N PHE 86.A O no hydrogen 2.783 N/A THR 11.A N LEU 19.A O no hydrogen 2.982 N/A PHE 12.A N PHE 84.A O no hydrogen 2.788 N/A GLN 13.A N SER 17.A O no hydrogen 2.949 N/A ASN 14.A N SER 17.A O no hydrogen 3.498 N/A THR 16.A N ASN 14.A OD1 no hydrogen 2.847 N/A THR 16.A OG1 ASN 14.A OD1 no hydrogen 3.427 N/A SER 17.A N ASN 14.A O no hydrogen 3.510 N/A SER 17.A OG GLN 13.A OE1 no hydrogen 3.093 N/A LEU 19.A N THR 11.A O no hydrogen 3.062 N/A GLY 21.A N PHE 9.A O no hydrogen 2.835 N/A LEU 23.A N LEU 7.A O no hydrogen 2.839 N/A GLY 24.A N GLY 32.A O no hydrogen 2.976 N/A LEU 25.A N LYS 5.A O no hydrogen 2.680 N/A LEU 26.A N VAL 29.A O no hydrogen 2.900 N/A GLY 27.A N MET 3.A O no hydrogen 2.993 N/A VAL 29.A N LEU 26.A O no hydrogen 2.857 N/A MET 31.A N GLY 24.A O no hydrogen 2.825 N/A SER 33.A N ARG 42.A O no hydrogen 3.031 N/A SER 33.A OG TYR 44.A OH no hydrogen 2.750 N/A LEU 34.A N GLY 22.A O no hydrogen 2.921 N/A ASP 35.A N ASN 40.A O no hydrogen 3.063 N/A ARG 37.A N ASP 35.A OD2 no hydrogen 3.263 N/A THR 38.A N ASP 35.A OD2 no hydrogen 3.099 N/A GLY 39.A N ASP 35.A O no hydrogen 2.621 N/A ASN 40.A N THR 38.A OG1 no hydrogen 3.145 N/A ARG 42.A N SER 33.A O no hydrogen 2.819 N/A TYR 43.A OH GLU 61.A OE2 no hydrogen 2.463 N/A TYR 44.A N MET 31.A O no hydrogen 2.764 N/A ARG 45.A NE ASP 171.A OD2 no hydrogen 2.606 N/A ARG 45.A NH2 ASP 171.A OD1 no hydrogen 2.992 N/A TRP 47.A NE1 ASP 171.A OD2 no hydrogen 2.749 N/A LEU 48.A N ARG 45.A O no hydrogen 3.271 N/A SER 51.A N LEU 48.A O no hydrogen 2.877 N/A SER 51.A OG LEU 48.A O no hydrogen 2.777 N/A LYS 54.A NZ ASP 58.A OD1 no hydrogen 3.305 N/A TRP 57.A N PRO 53.A O no hydrogen 3.184 N/A ASP 58.A N LYS 54.A O no hydrogen 2.839 N/A VAL 59.A N GLY 55.A O no hydrogen 3.106 N/A ILE 60.A N ASP 56.A O no hydrogen 2.907 N/A GLU 61.A N TRP 57.A O no hydrogen 2.772 N/A SER 62.A N ASP 58.A O no hydrogen 3.052 N/A SER 63.A N VAL 59.A O no hydrogen 2.854 N/A SER 63.A OG VAL 59.A O no hydrogen 2.848 N/A ILE 64.A N ILE 60.A O no hydrogen 2.862 N/A LYS 65.A N GLU 61.A O no hydrogen 2.857 N/A SER 66.A N SER 62.A O no hydrogen 2.961 N/A SER 66.A OG SER 62.A O no hydrogen 2.844 N/A TYR 67.A N SER 63.A O no hydrogen 2.857 N/A TYR 67.A OH SER 88.A OG no hydrogen 2.553 N/A VAL 68.A N ILE 64.A O no hydrogen 2.998 N/A ARG 69.A N LYS 65.A O no hydrogen 3.033 N/A ASP 70.A N SER 66.A O no hydrogen 2.777 N/A PHE 71.A N TYR 67.A O no hydrogen 2.865 N/A SER 72.A N VAL 68.A O no hydrogen 3.105 N/A SER 72.A OG VAL 68.A O no hydrogen 3.339 N/A ARG 73.A N ARG 69.A O no hydrogen 3.078 N/A LEU 74.A N ASP 70.A O no hydrogen 2.814 N/A VAL 75.A N PHE 71.A O no hydrogen 3.172 N/A GLN 76.A N SER 72.A O no hydrogen 3.101 N/A MET 77.A N ARG 73.A O no hydrogen 3.013 N/A TYR 78.A N LEU 74.A O no hydrogen 2.994 N/A THR 79.A N VAL 75.A O no hydrogen 3.089 N/A THR 79.A OG1 VAL 75.A O no hydrogen 3.365 N/A PHE 84.A N PHE 12.A O no hydrogen 3.297 N/A VAL 85.A N GLU 109.A OE2.A no hydrogen 3.092 N/A PHE 86.A N ALA 10.A O no hydrogen 2.972 N/A GLN 87.A N ALA 107.A O no hydrogen 3.061 N/A SER 88.A N HIS 8.A O no hydrogen 2.875 N/A SER 88.A OG HIS 8.A ND1 no hydrogen 2.835 N/A SER 88.A OG TYR 67.A OH no hydrogen 2.553 N/A SER 89.A N ASP 105.A O no hydrogen 2.962 N/A ILE 90.A N LEU 6.A O no hydrogen 2.839 N/A GLY 91.A N PHE 103.A O no hydrogen 2.988 N/A CYS 92.A N LEU 4.A O no hydrogen 3.116 N/A GLU 93.A N ARG 101.A O no hydrogen 2.668 N/A LEU 94.A N HIS 2.A O no hydrogen 2.784 N/A GLN 95.A N THR 99.A O no hydrogen 2.963 N/A GLN 95.A NE2 GLU 93.A OE1 no hydrogen 2.885 N/A GLY 98.A N GLN 95.A O no hydrogen 3.049 N/A THR 99.A OG1 ASN 97.A OD1 no hydrogen 3.555 N/A ARG 101.A N GLU 93.A O no hydrogen 2.902 N/A ARG 101.A NE GLU 93.A OE2 no hydrogen 3.290 N/A ARG 101.A NH2 GLU 93.A OE2 no hydrogen 3.336 N/A PHE 103.A N GLY 91.A O no hydrogen 3.020 N/A ASP 105.A N SER 89.A O no hydrogen 3.030 N/A ILE 106.A N LEU 114.A O no hydrogen 2.826 N/A ALA 107.A N GLN 87.A O no hydrogen 2.706 N/A TYR 108.A N GLN 111.A O no hydrogen 2.957 N/A GLU 109.A N VAL 85.A O no hydrogen 3.102 N/A GLN 111.A N TYR 108.A O no hydrogen 3.053 N/A PHE 113.A N ILE 106.A O no hydrogen 2.655 N/A LEU 114.A N ILE 106.A O no hydrogen 3.033 N/A ARG 115.A N ASP 124.A O no hydrogen 2.942 N/A ARG 115.A NE ASP 105.A OD2 no hydrogen 2.696 N/A ARG 115.A NH2 ASP 105.A OD2 no hydrogen 3.278 N/A PHE 116.A N PHE 104.A O no hydrogen 2.875 N/A ASN 117.A N THR 122.A O no hydrogen 2.704 N/A ALA 120.A N ASN 117.A OD1 no hydrogen 3.363 N/A GLY 121.A N LEU 118.A O no hydrogen 3.261 N/A THR 122.A N ASN 117.A O no hydrogen 3.224 N/A TRP 123.A NE1 ASN 146.A OD1 no hydrogen 2.810 N/A ASP 124.A N ARG 115.A O no hydrogen 2.638 N/A GLN 125.A NE2 GLN 127.A O no hydrogen 2.857 N/A MET 126.A N PHE 113.A O no hydrogen 3.050 N/A GLN 127.A N SER 132.A OG no hydrogen 3.217 N/A GLN 127.A NE2 TYR 108.A O no hydrogen 3.346 N/A GLN 127.A NE2 GLN 111.A O no hydrogen 3.230 N/A GLN 127.A NE2 ASN 112.A O no hydrogen 3.117 N/A ASN 129.A ND2 GLN 127.A OE1 no hydrogen 3.034 N/A SER 132.A N ASN 129.A OD1 no hydrogen 2.943 N/A SER 132.A OG PHE 113.A O no hydrogen 2.805 N/A SER 132.A OG GLN 127.A O no hydrogen 3.414 N/A ALA 133.A N ASN 129.A O no hydrogen 3.100 N/A LYS 134.A N GLN 130.A O no hydrogen 2.835 N/A LYS 134.A NZ TYR 78.A O no hydrogen 3.079 N/A ALA 135.A N LEU 131.A O no hydrogen 3.010 N/A GLU 136.A N SER 132.A O no hydrogen 2.985 N/A HIS 137.A N ALA 133.A O no hydrogen 3.173 N/A HIS 137.A ND1 ALA 133.A O no hydrogen 2.786 N/A LEU 138.A N LYS 134.A O no hydrogen 2.939 N/A MET 139.A N ALA 135.A O no hydrogen 2.954 N/A ALA 140.A N GLU 136.A O no hydrogen 2.782 N/A ASN 141.A N HIS 137.A O no hydrogen 3.259 N/A ASN 141.A N LEU 138.A O no hydrogen 3.167 N/A ALA 142.A N MET 139.A O no hydrogen 3.143 N/A SER 143.A N ASN 141.A O no hydrogen 3.046 N/A ASN 146.A N ALA 142.A O no hydrogen 2.992 N/A ASN 146.A ND2 MET 139.A O no hydrogen 2.958 N/A GLU 147.A N SER 143.A O no hydrogen 2.904 N/A VAL 148.A N THR 144.A O no hydrogen 3.030 N/A ILE 149.A N LEU 145.A O no hydrogen 2.746 N/A GLN 150.A N ASN 146.A O no hydrogen 3.136 N/A GLN 150.A NE2 LEU 118.A O no hydrogen 3.033 N/A LEU 152.A N VAL 148.A O no hydrogen 2.995 N/A LEU 153.A N ILE 149.A O no hydrogen 2.880 N/A ASN 154.A N GLN 150.A O no hydrogen 2.975 N/A ASP 155.A N VAL 151.A O no hydrogen 2.939 N/A THR 156.A N VAL 151.A O no hydrogen 3.078 N/A CYS 157.A N LEU 152.A O no hydrogen 2.725 N/A ASP 159.A N ASP 155.A O no hydrogen 2.827 N/A ILE 160.A N THR 156.A O no hydrogen 2.971 N/A LEU 161.A N CYS 157.A O no hydrogen 2.847 N/A ARG 162.A N VAL 158.A O no hydrogen 2.848 N/A LEU 163.A N ASP 159.A O no hydrogen 3.233 N/A PHE 164.A N ILE 160.A O no hydrogen 2.763 N/A ILE 165.A N LEU 161.A O no hydrogen 2.828 N/A GLN 166.A N ARG 162.A O no hydrogen 3.310 N/A ALA 167.A N LEU 163.A O no hydrogen 2.843 N/A GLY 168.A N PHE 164.A O no hydrogen 2.762 N/A LYS 169.A NZ GLN 166.A O no hydrogen 3.139 N/A LEU 172.A N GLY 168.A O no hydrogen 3.105 N/A GLU 173.A N LYS 169.A O no hydrogen 2.846 N/A ARG 174.A N ASP 171.A O no hydrogen 3.252 N/A ARG 174.A NH1 LEU 231.A O no hydrogen 3.010 N/A ARG 174.A NH2 LEU 231.A O no hydrogen 2.972 N/A VAL 176.A N TYR 199.A O no hydrogen 2.756 N/A MET 179.A N THR 196.A O no hydrogen 2.759 N/A VAL 181.A N ARG 194.A O no hydrogen 2.938 N/A PHE 183.A N VAL 192.A O no hydrogen 3.120 N/A ARG 185.A N LEU 190.A O no hydrogen 2.815 N/A LEU 189.A N VAL 241.A O no hydrogen 2.755 N/A LEU 190.A N ARG 185.A O no hydrogen 3.017 N/A LEU 191.A N LEU 239.A O no hydrogen 2.681 N/A VAL 192.A N PHE 183.A O no hydrogen 2.925 N/A CYS 193.A N SER 237.A O no hydrogen 2.705 N/A ARG 194.A N VAL 181.A O no hydrogen 2.911 N/A VAL 195.A N LEU 235.A O no hydrogen 2.842 N/A THR 196.A N MET 179.A O no hydrogen 2.777 N/A PHE 198.A N TYR 233.A O no hydrogen 3.353 N/A TYR 199.A N VAL 176.A O no hydrogen 3.027 N/A TYR 199.A OH ASP 28.A OD1 no hydrogen 2.631 N/A ALA 204.A N GLN 251.A O no hydrogen 3.034 N/A THR 206.A N ARG 249.A O no hydrogen 2.916 N/A TRP 207.A NE1 SER 237.A OG no hydrogen 3.089 N/A LEU 208.A N ALA 247.A O no hydrogen 2.815 N/A ARG 209.A N ARG 212.A O no hydrogen 2.740 N/A ASP 210.A N GLY 245.A O no hydrogen 2.922 N/A ARG 212.A N ARG 209.A O no hydrogen 2.918 N/A VAL 214.A N TRP 207.A O no hydrogen 2.901 N/A ALA 219.A N SER 217.A OG no hydrogen 3.107 N/A LEU 220.A N SER 217.A O no hydrogen 3.156 N/A SER 221.A N THR 238.A O no hydrogen 2.946 N/A THR 222.A OG1 GLY 223.A O no hydrogen 3.496 N/A GLY 223.A N ARG 236.A O no hydrogen 2.907 N/A LEU 226.A N GLN 234.A O no hydrogen 2.714 N/A ASN 228.A N THR 232.A O no hydrogen 2.831 N/A ASN 228.A ND2 THR 196.A OG1 no hydrogen 3.269 N/A ASN 228.A ND2 THR 232.A OG1 no hydrogen 2.967 N/A THR 232.A OG1 ASP 230.A OD1 no hydrogen 2.686 N/A TYR 233.A N PHE 198.A O no hydrogen 2.843 N/A TYR 233.A OH ASP 28.A OD2 no hydrogen 2.504 N/A GLN 234.A N LEU 226.A O no hydrogen 2.887 N/A GLN 234.A NE2 ASN 228.A OD1 no hydrogen 2.675 N/A LEU 235.A N VAL 195.A O no hydrogen 2.798 N/A SER 237.A N CYS 193.A O no hydrogen 2.814 N/A SER 237.A OG SER 221.A O no hydrogen 3.494 N/A THR 238.A N SER 221.A O no hydrogen 2.835 N/A LEU 239.A N LEU 191.A O no hydrogen 2.795 N/A LEU 240.A N ALA 219.A O no hydrogen 2.966 N/A VAL 241.A N LEU 189.A O no hydrogen 2.781 N/A HIS 244.A ND1 ASP 210.A OD2 no hydrogen 3.067 N/A GLY 245.A N ASP 210.A OD1 no hydrogen 3.200 N/A ALA 247.A N LEU 208.A O no hydrogen 3.070 N/A CYS 248.A N VAL 261.A O no hydrogen 2.896 N/A ARG 249.A N THR 206.A O no hydrogen 2.729 N/A ARG 249.A NE THR 206.A OG1 no hydrogen 3.242 N/A ARG 249.A NH2 THR 206.A OG1 no hydrogen 3.142 N/A VAL 250.A N LEU 259.A O no hydrogen 2.778 N/A GLN 251.A N ALA 204.A O no hydrogen 2.837 N/A HIS 252.A ND1 SER 254.A OG no hydrogen 2.693 N/A HIS 252.A NE2 PRO 200.A O no hydrogen 2.808 N/A SER 254.A N HIS 252.A ND1 no hydrogen 3.108 N/A SER 254.A OG HIS 252.A ND1 no hydrogen 2.693 N/A LEU 255.A N HIS 252.A O no hydrogen 2.931 N/A GLY 256.A N CYS 253.A O no hydrogen 3.010 N/A LEU 259.A N VAL 250.A O no hydrogen 2.822 N/A VAL 261.A N CYS 248.A O no hydrogen 2.922 N/A TRP 263.A N TYR 246.A O no hydrogen 2.741 N/A