Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nju_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N GLU 2.A O no hydrogen 2.945 N/A GLN 6.A N GLU 2.A O no hydrogen 3.135 N/A ALA 7.A N GLN 3.A O no hydrogen 3.126 N/A VAL 11.A N VAL 79.A O no hydrogen 3.160 N/A TYR 12.A N GLY 157.A O no hydrogen 2.800 N/A VAL 13.A N GLY 77.A O no hydrogen 2.853 N/A GLY 14.A N VAL 155.A O no hydrogen 2.897 N/A GLY 15.A N CYS 75.A O no hydrogen 3.168 N/A LEU 17.A N LEU 73.A O no hydrogen 2.772 N/A ARG 19.A NH2 LEU 218.A O no hydrogen 3.385 N/A TYR 20.A N ASP 71.A O no hydrogen 2.818 N/A TYR 20.A OH SER 68.A OG no hydrogen 2.949 N/A GLN 22.A N ARG 19.A O no hydrogen 2.832 N/A GLN 22.A NE2 ASP 21.A O no hydrogen 3.496 N/A LEU 29.A N GLU 26.A O no hydrogen 2.951 N/A LEU 30.A N ALA 27.A O no hydrogen 3.122 N/A ARG 33.A NH1 VAL 69.A O no hydrogen 2.972 N/A ARG 33.A NH2 ARG 70.A O no hydrogen 2.567 N/A VAL 36.A N PRO 32.A O no hydrogen 2.957 N/A GLU 37.A N ARG 33.A O no hydrogen 2.968 N/A HIS 38.A N ASP 34.A O no hydrogen 3.235 N/A HIS 38.A ND1 GLN 134.A O no hydrogen 2.910 N/A TRP 39.A N VAL 35.A O no hydrogen 2.763 N/A LEU 40.A N VAL 36.A O no hydrogen 2.670 N/A HIS 41.A N GLU 37.A O no hydrogen 3.210 N/A ALA 42.A N HIS 38.A O no hydrogen 2.718 N/A GLN 43.A N TRP 39.A O no hydrogen 3.009 N/A LEU 50.A N GLY 61.A O no hydrogen 2.891 N/A ASN 51.A N VAL 141.A O no hydrogen 3.119 N/A ILE 52.A N ALA 58.A O no hydrogen 2.956 N/A ASN 53.A N LEU 143.A O no hydrogen 2.818 N/A ASN 53.A ND2 ASN 198.A OD1 no hydrogen 2.855 N/A HIS 54.A ND1 HIS 140.A NE2 no hydrogen 3.031 N/A HIS 54.A NE2 SER 123.A OG no hydrogen 2.816 N/A ASP 55.A N ILE 52.A O no hydrogen 2.916 N/A THR 57.A N ASP 55.A OD1 no hydrogen 2.544 N/A THR 57.A OG1 ASP 55.A OD1 no hydrogen 2.557 N/A ALA 58.A N ASP 55.A O no hydrogen 2.849 N/A VAL 60.A N LEU 50.A O no hydrogen 2.674 N/A GLY 61.A N LEU 50.A O no hydrogen 3.116 N/A HIS 62.A N CYS 78.A O no hydrogen 3.345 N/A VAL 63.A N LEU 48.A O no hydrogen 2.608 N/A ALA 64.A N LEU 76.A O no hydrogen 2.786 N/A ALA 65.A N LEU 76.A O no hydrogen 2.942 N/A GLN 67.A N PHE 74.A O no hydrogen 2.828 N/A SER 68.A OG TYR 20.A OH no hydrogen 2.949 N/A SER 68.A OG GLU 37.A OE2 no hydrogen 3.431 N/A VAL 69.A N GLY 72.A O no hydrogen 2.814 N/A LEU 73.A N ALA 18.A O no hydrogen 2.935 N/A PHE 74.A N GLN 67.A O no hydrogen 2.816 N/A CYS 75.A N GLY 15.A O no hydrogen 2.996 N/A LEU 76.A N ALA 65.A O no hydrogen 2.797 N/A GLY 77.A N VAL 13.A O no hydrogen 2.708 N/A CYS 78.A N HIS 62.A O no hydrogen 2.962 N/A CYS 78.A SG HIS 62.A O no hydrogen 4.025 N/A VAL 79.A N VAL 11.A O no hydrogen 2.759 N/A THR 80.A N VAL 60.A O no hydrogen 2.868 N/A SER 81.A N VAL 60.A O no hydrogen 2.975 N/A SER 81.A OG ASP 186.A OD1 no hydrogen 3.111 N/A SER 81.A OG ASP 186.A OD2 no hydrogen 2.352 N/A ARG 83.A N ASP 186.A OD1 no hydrogen 3.005 N/A ARG 83.A NH1 SER 190.A O no hydrogen 3.090 N/A PHE 84.A N SER 81.A OG no hydrogen 3.276 N/A LEU 85.A N SER 81.A O no hydrogen 2.947 N/A GLU 86.A N PRO 82.A O no hydrogen 2.690 N/A ILE 87.A N ARG 83.A O no hydrogen 3.025 N/A VAL 88.A N PHE 84.A O no hydrogen 2.886 N/A ARG 89.A N LEU 85.A O no hydrogen 2.605 N/A ARG 89.A NE GLU 86.A OE2 no hydrogen 2.645 N/A ARG 89.A NH2 GLU 86.A OE1 no hydrogen 2.612 N/A ARG 90.A N GLU 86.A O no hydrogen 3.041 N/A ALA 91.A N ILE 87.A O no hydrogen 2.924 N/A SER 92.A N VAL 88.A O no hydrogen 2.845 N/A SER 92.A OG VAL 88.A O no hydrogen 2.942 N/A SER 92.A OG ARG 89.A O no hydrogen 2.325 N/A GLU 93.A N ARG 90.A O no hydrogen 3.170 N/A LYS 94.A N ALA 91.A O no hydrogen 2.865 N/A SER 95.A N SER 92.A O no hydrogen 3.165 N/A VAL 98.A N SER 95.A OG no hydrogen 3.069 N/A SER 99.A N SER 95.A O no hydrogen 2.944 N/A ARG 100.A N GLU 96.A O no hydrogen 3.172 N/A GLY 101.A N VAL 98.A O no hydrogen 2.797 N/A LEU 106.A N VAL 103.A O no hydrogen 3.054 N/A ASP 109.A N GLU 113.A OE2 no hydrogen 3.121 N/A VAL 112.A N ASP 109.A OD2 no hydrogen 3.116 N/A GLU 113.A N ASP 109.A O no hydrogen 2.679 N/A PHE 114.A N LYS 110.A O no hydrogen 2.767 N/A LEU 115.A N VAL 111.A O no hydrogen 3.044 N/A SER 116.A N VAL 112.A O no hydrogen 2.826 N/A SER 116.A OG VAL 112.A O no hydrogen 3.049 N/A GLY 117.A N GLU 113.A O no hydrogen 3.092 N/A GLY 117.A N PHE 114.A O no hydrogen 3.072 N/A SER 118.A N PHE 114.A O no hydrogen 2.979 N/A SER 118.A OG PHE 114.A O no hydrogen 3.489 N/A TYR 119.A N LEU 115.A O no hydrogen 2.930 N/A GLY 121.A N CYS 144.A O no hydrogen 2.868 N/A LEU 122.A N THR 152.A O no hydrogen 2.631 N/A SER 123.A N ALA 142.A O no hydrogen 2.957 N/A SER 123.A OG HIS 54.A NE2 no hydrogen 2.816 N/A SER 125.A N HIS 140.A O no hydrogen 2.925 N/A ARG 127.A N PRO 137.A O no hydrogen 2.918 N/A ARG 128.A NH1 GLU 28.A OE1 no hydrogen 3.343 N/A GLN 134.A NE2 VAL 132.A O no hydrogen 2.824 N/A PHE 138.A N GLN 43.A OE1 no hydrogen 2.499 N/A LYS 139.A N SER 125.A O no hydrogen 2.705 N/A LYS 139.A NZ HIS 140.A ND1 no hydrogen 3.060 N/A HIS 140.A N SER 125.A O no hydrogen 3.433 N/A HIS 140.A NE2 HIS 54.A ND1 no hydrogen 3.031 N/A VAL 141.A N PRO 49.A O no hydrogen 3.226 N/A ALA 142.A N SER 123.A O no hydrogen 2.897 N/A LEU 143.A N ASN 51.A O no hydrogen 2.802 N/A CYS 144.A N GLY 121.A O no hydrogen 2.954 N/A CYS 144.A SG ALA 142.A O no hydrogen 3.816 N/A SER 145.A OG SER 118.A O no hydrogen 3.105 N/A ARG 148.A NH2 GLU 28.A OE2 no hydrogen 2.690 N/A ARG 149.A NE LEU 29.A O no hydrogen 2.856 N/A ARG 149.A NH2 LEU 29.A O no hydrogen 3.472 N/A ARG 150.A NE ASP 215.A OD1 no hydrogen 2.720 N/A ARG 150.A NH1 GLY 147.A O no hydrogen 3.177 N/A ARG 150.A NH2 GLY 147.A O no hydrogen 2.753 N/A ARG 150.A NH2 ASP 215.A OD1 no hydrogen 3.493 N/A ARG 150.A NH2 ASP 215.A OD2 no hydrogen 2.983 N/A THR 152.A OG1 ARG 149.A O no hydrogen 2.538 N/A ALA 154.A N ALA 120.A O no hydrogen 2.545 N/A VAL 155.A N GLY 14.A O no hydrogen 2.813 N/A TYR 156.A OH TYR 119.A O no hydrogen 2.747 N/A GLY 157.A N TYR 12.A O no hydrogen 3.039 N/A ARG 158.A NE ASP 109.A OD1 no hydrogen 2.864 N/A ARG 158.A NH1 ALA 7.A O no hydrogen 3.444 N/A ARG 158.A NH1 PRO 10.A O no hydrogen 3.553 N/A ARG 158.A NH2 ALA 7.A O no hydrogen 2.832 N/A ARG 158.A NH2 ASP 109.A OD2 no hydrogen 3.188 N/A GLU 161.A N ASP 159.A OD2 no hydrogen 2.829 N/A VAL 163.A N ASP 159.A O no hydrogen 2.944 N/A THR 164.A N PRO 160.A O no hydrogen 2.975 N/A THR 164.A OG1 PRO 160.A O no hydrogen 3.402 N/A THR 164.A OG1 GLU 161.A O no hydrogen 2.641 N/A THR 164.A OG1 GLU 161.A OE2 no hydrogen 3.203 N/A GLN 165.A N GLU 161.A O no hydrogen 2.787 N/A ARG 166.A N VAL 163.A O no hydrogen 2.842 N/A ARG 166.A NE TRP 162.A O no hydrogen 2.495 N/A ARG 166.A NH1 GLU 225.A O no hydrogen 2.824 N/A PHE 167.A N THR 164.A O no hydrogen 3.197 N/A LEU 170.A N PHE 167.A O no hydrogen 3.179 N/A THR 171.A N ASP 174.A OD2 no hydrogen 2.765 N/A ASP 174.A N THR 171.A OG1 no hydrogen 3.019 N/A ARG 175.A N THR 171.A O no hydrogen 2.943 N/A ARG 175.A NE GLN 165.A OE1 no hydrogen 2.944 N/A ARG 175.A NH1 LEU 170.A O no hydrogen 2.506 N/A ARG 175.A NH2 LEU 170.A O no hydrogen 3.091 N/A ASP 176.A N ALA 172.A O no hydrogen 2.688 N/A GLY 177.A N ALA 173.A O no hydrogen 3.017 N/A LEU 178.A N ASP 174.A O no hydrogen 3.027 N/A ARG 179.A N ARG 175.A O no hydrogen 3.070 N/A ARG 179.A NE GLU 161.A OE1 no hydrogen 2.677 N/A ALA 180.A N ASP 176.A O no hydrogen 3.108 N/A GLN 181.A N LEU 178.A O no hydrogen 2.805 N/A GLN 181.A NE2 MET 66.A O no hydrogen 3.195 N/A TRP 182.A N LEU 178.A O no hydrogen 3.185 N/A GLN 183.A N GLN 181.A O no hydrogen 2.646 N/A PHE 188.A N ASP 186.A OD2 no hydrogen 3.086 N/A ARG 189.A N THR 57.A O no hydrogen 2.815 N/A ARG 189.A NH1 PRO 187.A O no hydrogen 3.168 N/A ASP 191.A N SER 190.A OG no hydrogen 2.698 N/A GLY 194.A N ASP 191.A OD1 no hydrogen 2.956 N/A LEU 195.A N ASP 191.A O no hydrogen 3.126 N/A LEU 196.A N SER 192.A O no hydrogen 2.772 N/A GLY 197.A N TYR 193.A O no hydrogen 2.726 N/A ASN 198.A N GLY 194.A O no hydrogen 2.805 N/A SER 199.A N LEU 196.A O no hydrogen 2.887 N/A SER 199.A OG LEU 196.A O no hydrogen 2.440 N/A VAL 200.A N GLY 197.A O no hydrogen 3.280 N/A ALA 202.A N ASN 198.A O no hydrogen 3.325 N/A LEU 203.A N SER 199.A O no hydrogen 3.195 N/A TYR 204.A N ASP 201.A O no hydrogen 3.005 N/A ILE 205.A N ALA 202.A O no hydrogen 3.002 N/A LYS 211.A N GLU 207.A O no hydrogen 2.954 N/A LYS 211.A NZ ARG 206.A O no hydrogen 3.485 N/A LEU 212.A N ARG 208.A O no hydrogen 3.077 N/A ARG 213.A N LEU 209.A O no hydrogen 2.929 N/A TYR 214.A N PRO 210.A O no hydrogen 2.983 N/A TYR 214.A OH GLN 22.A OE1 no hydrogen 2.749 N/A ASP 215.A N LYS 211.A O no hydrogen 2.682 N/A LYS 216.A N LEU 212.A O no hydrogen 2.652 N/A LYS 216.A NZ ALA 230.A OXT no hydrogen 3.058 N/A GLN 217.A N ARG 213.A O no hydrogen 2.769 N/A LEU 218.A N TYR 214.A O no hydrogen 2.721 N/A VAL 219.A N ASP 215.A O no hydrogen 3.064 N/A GLY 220.A N GLN 217.A O no hydrogen 3.174 N/A VAL 221.A N LYS 216.A O no hydrogen 3.181 N/A TYR 227.A OH GLN 107.A O no hydrogen 2.641 N/A VAL 228.A N SER 226.A OG no hydrogen 3.403 N/A LYS 229.A NZ GLU 113.A O no hydrogen 3.521 N/A LYS 229.A NZ GLU 113.A OE1 no hydrogen 2.972 N/A LYS 229.A NZ TYR 227.A O no hydrogen 3.496 N/A