Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jws_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASP 2.A OD1 no hydrogen 3.278 N/A ARG 4.A NH1 ASP 2.A OD1 no hydrogen 3.415 N/A ARG 4.A NH1 ASP 2.A OD2 no hydrogen 2.509 N/A ARG 6.A NE ARG 4.A O no hydrogen 3.178 N/A ARG 6.A NH2 ARG 4.A O no hydrogen 3.159 N/A LEU 8.A N ASN 33.A OD1 no hydrogen 3.203 N/A GLN 10.A N ILE 31.A O no hydrogen 2.956 N/A LYS 12.A N ARG 29.A O no hydrogen 2.879 N/A GLU 14.A N LEU 27.A O no hydrogen 2.960 N/A HIS 16.A N ARG 25.A O no hydrogen 2.879 N/A HIS 16.A NE2 GLU 14.A OE1 no hydrogen 2.798 N/A PHE 18.A N ARG 23.A O no hydrogen 3.125 N/A THR 21.A OG1 THR 21.A O no hydrogen 2.554 N/A GLU 22.A N ASN 19.A O no hydrogen 3.079 N/A ARG 23.A N PHE 18.A O no hydrogen 3.326 N/A ARG 23.A NH1 ASP 43.A OD1 no hydrogen 3.018 N/A ARG 25.A N HIS 16.A O no hydrogen 3.058 N/A ARG 25.A NE ASP 41.A OD1 no hydrogen 2.935 N/A ARG 25.A NE ASP 41.A OD2 no hydrogen 3.321 N/A ARG 25.A NH2 ASP 41.A OD2 no hydrogen 2.553 N/A LEU 26.A N SER 42.A OG no hydrogen 2.720 N/A LEU 27.A N GLU 14.A O no hydrogen 2.854 N/A GLU 28.A N PHE 40.A O no hydrogen 2.765 N/A ARG 29.A N LYS 12.A O no hydrogen 2.772 N/A CYS 30.A N VAL 38.A O no hydrogen 2.944 N/A ILE 31.A N GLN 10.A O no hydrogen 2.999 N/A TYR 32.A N GLU 35.A O no hydrogen 2.871 N/A SER 37.A N CYS 30.A O no hydrogen 2.896 N/A ARG 39.A N ARG 48.A O no hydrogen 3.197 N/A ARG 39.A NE GLU 36.A OE2 no hydrogen 2.526 N/A ARG 39.A NH2 GLU 36.A OE1 no hydrogen 2.914 N/A PHE 40.A N GLU 28.A O no hydrogen 2.729 N/A SER 42.A N LEU 26.A O no hydrogen 2.886 N/A SER 42.A OG LEU 26.A O no hydrogen 3.450 N/A ASP 43.A N ASP 41.A OD1 no hydrogen 2.930 N/A VAL 44.A N ASP 41.A O no hydrogen 2.872 N/A GLY 45.A N ASP 41.A O no hydrogen 2.864 N/A TYR 47.A N ASN 62.A OD1 no hydrogen 2.867 N/A TYR 47.A OH GLU 28.A OE1 no hydrogen 3.319 N/A TYR 47.A OH GLU 28.A OE2 no hydrogen 2.969 N/A ARG 48.A N ARG 39.A O no hydrogen 3.003 N/A ARG 48.A NE GLU 46.A OE2 no hydrogen 2.749 N/A ARG 48.A NH2 GLU 46.A OE2 no hydrogen 2.854 N/A VAL 50.A N SER 37.A O no hydrogen 2.422 N/A THR 51.A N SER 37.A O no hydrogen 3.158 N/A GLY 54.A N THR 51.A O no hydrogen 2.724 N/A ARG 55.A N GLU 52.A O no hydrogen 3.043 N/A ALA 58.A N GLY 54.A O no hydrogen 3.201 N/A GLU 59.A N ARG 55.A O no hydrogen 3.027 N/A TYR 60.A N PRO 56.A O no hydrogen 2.840 N/A TRP 61.A N ASP 57.A O no hydrogen 2.741 N/A ASN 62.A N ALA 58.A O no hydrogen 3.084 N/A ASN 62.A ND2 TYR 47.A O no hydrogen 2.847 N/A SER 63.A N TYR 60.A O no hydrogen 2.907 N/A SER 63.A OG TYR 60.A O no hydrogen 2.549 N/A GLN 64.A N TRP 61.A O no hydrogen 2.849 N/A GLN 64.A NE2 TYR 60.A O no hydrogen 3.359 N/A LYS 65.A NZ ASN 62.A O no hydrogen 3.221 N/A LEU 68.A N GLN 64.A O no hydrogen 3.074 N/A GLU 69.A N LYS 65.A O no hydrogen 2.765 N/A GLN 70.A N ASP 66.A O no hydrogen 3.337 N/A ARG 71.A N LEU 67.A O no hydrogen 3.060 N/A ARG 71.A NE GLU 28.A OE1 no hydrogen 2.633 N/A ARG 71.A NH1 GLU 28.A OE1 no hydrogen 3.103 N/A ARG 71.A NH1 GLU 28.A OE2 no hydrogen 3.021 N/A ARG 71.A NH2 GLN 70.A OE1 no hydrogen 2.995 N/A ARG 72.A N LEU 68.A O no hydrogen 2.793 N/A ARG 72.A NE GLY 45.A O no hydrogen 2.927 N/A ARG 72.A NH2 GLY 45.A O no hydrogen 2.907 N/A ALA 73.A N GLU 69.A O no hydrogen 2.922 N/A ALA 74.A N ARG 71.A O no hydrogen 3.150 N/A ASP 76.A N ALA 73.A O no hydrogen 3.052 N/A THR 77.A N ALA 73.A O no hydrogen 3.160 N/A THR 77.A OG1 ALA 73.A O no hydrogen 3.531 N/A TYR 78.A N ALA 74.A O no hydrogen 2.941 N/A CYS 79.A N ALA 74.A O no hydrogen 2.871 N/A ARG 80.A N VAL 75.A O no hydrogen 3.137 N/A ARG 80.A NE ASP 76.A OD1 no hydrogen 2.840 N/A ARG 80.A NH1 THR 21.A OG1 no hydrogen 3.228 N/A ARG 80.A NH1 GLU 22.A O no hydrogen 3.409 N/A HIS 81.A N ASP 76.A O no hydrogen 3.163 N/A ASN 82.A N TYR 78.A O no hydrogen 2.936 N/A TYR 83.A N CYS 79.A O no hydrogen 2.985 N/A GLY 84.A N ARG 80.A O no hydrogen 3.135 N/A VAL 85.A N HIS 81.A O no hydrogen 2.989 N/A GLY 86.A N ASN 82.A O no hydrogen 3.283 N/A GLU 87.A N GLY 84.A O no hydrogen 3.269 N/A THR 90.A OG1 GLY 86.A O no hydrogen 2.488 N/A VAL 91.A N THR 90.A OG1 no hydrogen 2.523 N/A GLN 92.A N GLU 87.A O no hydrogen 3.045 N/A ARG 93.A N THR 90.A O no hydrogen 3.271 N/A ARG 94.A NH1 VAL 91.A O no hydrogen 3.306 N/A ARG 94.A NH1 ARG 93.A O no hydrogen 3.177 N/A VAL 95.A N TYR 120.A O no hydrogen 2.820 N/A LYS 98.A N SER 117.A O no hydrogen 2.972 N/A THR 100.A N SER 115.A O no hydrogen 3.122 N/A TYR 102.A N VAL 113.A O no hydrogen 3.167 N/A SER 104.A N LEU 111.A O no hydrogen 2.740 N/A GLN 107.A NE2 SER 104.A O no hydrogen 3.253 N/A ASN 110.A N THR 160.A O no hydrogen 2.969 N/A LEU 112.A N LEU 158.A O no hydrogen 3.072 N/A VAL 113.A N TYR 102.A O no hydrogen 2.977 N/A CYS 114.A N VAL 156.A O no hydrogen 3.107 N/A SER 115.A N THR 100.A O no hydrogen 2.965 N/A VAL 116.A N THR 154.A O no hydrogen 2.923 N/A SER 117.A N LYS 98.A O no hydrogen 2.998 N/A PHE 119.A N PHE 152.A O no hydrogen 3.035 N/A TYR 120.A N VAL 95.A O no hydrogen 3.236 N/A GLU 125.A N GLU 173.A O no hydrogen 2.848 N/A ARG 127.A N GLN 171.A O no hydrogen 2.814 N/A ARG 127.A NH1 GLU 173.A OE2 no hydrogen 3.332 N/A ARG 127.A NH2 GLU 173.A OE2 no hydrogen 2.747 N/A TRP 128.A NE1 VAL 156.A O no hydrogen 3.029 N/A PHE 129.A N THR 169.A O no hydrogen 2.706 N/A ARG 130.A N GLN 133.A O no hydrogen 2.935 N/A ARG 130.A NE GLU 166.A OE2 no hydrogen 3.348 N/A ARG 130.A NH2 GLU 166.A OE2 no hydrogen 3.322 N/A ASN 131.A N VAL 167.A O no hydrogen 2.921 N/A GLN 133.A N ARG 130.A O no hydrogen 3.101 N/A GLN 133.A NE2 ARG 130.A O no hydrogen 3.479 N/A VAL 140.A N MET 157.A O no hydrogen 3.165 N/A THR 142.A N LEU 155.A O no hydrogen 3.002 N/A GLY 143.A N SER 141.A OG no hydrogen 2.941 N/A ILE 145.A N GLN 153.A O no hydrogen 2.994 N/A ASN 147.A N THR 151.A O no hydrogen 2.995 N/A ASN 147.A ND2 THR 151.A O no hydrogen 2.996 N/A PHE 152.A N PHE 119.A O no hydrogen 2.717 N/A GLN 153.A N ILE 145.A O no hydrogen 3.094 N/A GLN 153.A NE2 ASN 147.A OD1 no hydrogen 2.891 N/A THR 154.A N VAL 116.A O no hydrogen 2.810 N/A THR 154.A OG1 GLY 143.A O no hydrogen 2.789 N/A VAL 156.A N CYS 114.A O no hydrogen 3.029 N/A MET 157.A N VAL 140.A O no hydrogen 2.797 N/A LEU 158.A N LEU 112.A O no hydrogen 2.840 N/A THR 160.A N ASN 110.A O no hydrogen 2.986 N/A THR 160.A OG1 ASN 110.A O no hydrogen 3.032 N/A GLY 165.A N ALA 187.A OXT no hydrogen 2.874 N/A GLU 166.A N ARG 163.A O no hydrogen 2.881 N/A VAL 167.A N ASN 131.A OD1 no hydrogen 3.361 N/A TYR 168.A N TRP 185.A O no hydrogen 3.157 N/A TYR 168.A OH GLU 166.A OE1 no hydrogen 3.107 N/A THR 169.A N PHE 129.A O no hydrogen 2.862 N/A CYS 170.A N VAL 183.A O no hydrogen 2.889 N/A GLN 171.A N ARG 127.A O no hydrogen 2.668 N/A VAL 172.A N LEU 181.A O no hydrogen 2.749 N/A GLU 173.A N GLU 125.A O no hydrogen 2.663 N/A HIS 174.A ND1 SER 176.A OG no hydrogen 2.871 N/A HIS 174.A NE2 PRO 121.A O no hydrogen 2.928 N/A SER 176.A N HIS 174.A ND1 no hydrogen 3.147 N/A SER 176.A OG HIS 174.A ND1 no hydrogen 2.871 N/A VAL 177.A N HIS 174.A O no hydrogen 2.976 N/A LEU 181.A N VAL 172.A O no hydrogen 2.789 N/A VAL 183.A N CYS 170.A O no hydrogen 3.205 N/A TRP 185.A N TYR 168.A O no hydrogen 2.786 N/A ARG 186.A NE GLU 184.A OE1 no hydrogen 3.161 N/A ARG 186.A NH2 GLU 184.A OE1 no hydrogen 2.783 N/A ALA 187.A N GLU 166.A O no hydrogen 2.820 N/A