Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jd2_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N ASP 1.A OD2 no hydrogen 2.774 N/A SER 8.A N ARG 12.A O no hydrogen 2.707 N/A SER 8.A OG GLU 10.A OE2 no hydrogen 3.459 N/A GLU 10.A N SER 8.A OG no hydrogen 2.972 N/A GLY 11.A N SER 8.A O no hydrogen 2.938 N/A ARG 12.A N SER 8.A OG no hydrogen 3.396 N/A ARG 12.A NE GLU 17.A OE2 no hydrogen 3.113 N/A PHE 14.A N THR 6.A O no hydrogen 3.425 N/A GLU 17.A N LEU 13.A O no hydrogen 3.154 N/A TYR 18.A N PHE 14.A O no hydrogen 2.826 N/A SER 19.A N GLN 15.A O no hydrogen 2.888 N/A SER 19.A OG PHE 130.A O no hydrogen 3.386 N/A LEU 20.A N VAL 16.A O no hydrogen 2.828 N/A GLU 21.A N GLU 17.A O no hydrogen 3.218 N/A GLU 21.A N TYR 18.A O no hydrogen 2.861 N/A ALA 22.A N TYR 18.A O no hydrogen 3.322 N/A ILE 23.A N SER 19.A O no hydrogen 3.252 N/A ILE 23.A N LEU 20.A O no hydrogen 3.238 N/A LYS 24.A N LEU 20.A O no hydrogen 3.379 N/A LYS 24.A NZ GLU 21.A OE1 no hydrogen 2.947 N/A LEU 25.A N ALA 22.A O no hydrogen 3.310 N/A GLY 26.A N ILE 23.A O no hydrogen 2.668 N/A THR 28.A OG1 SER 166.A OG no hydrogen 3.011 N/A ALA 29.A N ILE 164.A O no hydrogen 2.802 N/A ILE 30.A N GLY 41.A O no hydrogen 2.858 N/A GLY 31.A N LYS 162.A O no hydrogen 3.073 N/A ILE 32.A N VAL 39.A O no hydrogen 3.098 N/A ALA 33.A N ASN 160.A O no hydrogen 3.022 N/A THR 34.A N GLY 37.A O no hydrogen 2.834 N/A THR 34.A OG1 GLY 37.A O no hydrogen 2.686 N/A GLU 36.A N THR 34.A OG1 no hydrogen 2.799 N/A VAL 39.A N ILE 32.A O no hydrogen 3.090 N/A LEU 40.A N SER 212.A O no hydrogen 2.634 N/A GLY 41.A N ILE 30.A O no hydrogen 2.786 N/A VAL 42.A N GLN 210.A O no hydrogen 2.797 N/A GLU 43.A N THR 28.A O no hydrogen 3.118 N/A LYS 44.A N ASN 208B.A O no hydrogen 2.847 N/A LYS 44.A NZ SER 53.A O no hydrogen 2.959 N/A ARG 45.A NE GLU 43.A OE1 no hydrogen 2.922 N/A ARG 45.A NH1 LEU 25.A O no hydrogen 2.803 N/A LEU 50.A N SER 48.A OG no hydrogen 3.133 N/A SER 55.A N GLU 52.A O no hydrogen 2.794 N/A SER 55.A OG GLU 52.A O no hydrogen 2.983 N/A ILE 56.A N SER 53.A O no hydrogen 3.026 N/A LYS 58.A NZ SER 27.A OG no hydrogen 2.902 N/A LYS 58.A NZ LYS 44.A O no hydrogen 2.933 N/A VAL 60.A N CYS 68.A O no hydrogen 2.826 N/A ILE 62.A N ILE 66.A O no hydrogen 2.597 N/A ASP 63.A N ILE 66.A O no hydrogen 2.723 N/A ARG 64.A NH1 GLN 217.A O no hydrogen 3.342 N/A HIS 65.A ND1 ASP 63.A OD1 no hydrogen 2.768 N/A HIS 65.A NE2 ILE 99.A O no hydrogen 2.785 N/A ILE 66.A N ASP 63.A O no hydrogen 2.786 N/A GLY 67.A N ALA 137.A O no hydrogen 3.195 N/A CYS 68.A N VAL 60.A O no hydrogen 2.726 N/A ALA 69.A N LEU 135.A O no hydrogen 2.751 N/A MET 70.A N LYS 58.A O no hydrogen 3.087 N/A SER 71.A N ALA 133.A O no hydrogen 3.034 N/A SER 71.A OG SER 27.A O no hydrogen 2.861 N/A LEU 73.A N GLY 131.A O no hydrogen 2.600 N/A ASP 76.A N LEU 73.A O no hydrogen 3.303 N/A ALA 77.A N THR 74.A O no hydrogen 2.966 N/A ARG 78.A N ALA 75.A O no hydrogen 2.959 N/A ARG 78.A NH2 GLU 57.A O no hydrogen 3.493 N/A ILE 81.A N ALA 77.A O no hydrogen 2.757 N/A GLU 82.A N ARG 78.A O no hydrogen 2.978 N/A HIS 83.A N SER 79.A O no hydrogen 2.864 N/A HIS 83.A NE2 SER 107.A OG no hydrogen 2.825 N/A ALA 84.A N MET 80.A O no hydrogen 2.815 N/A ARG 85.A N ILE 81.A O no hydrogen 2.773 N/A ARG 85.A NE GLU 61.A O no hydrogen 2.958 N/A ARG 85.A NH2 GLU 61.A O no hydrogen 2.936 N/A THR 86.A N GLU 82.A O no hydrogen 2.847 N/A THR 86.A OG1 GLU 82.A O no hydrogen 3.217 N/A THR 86.A OG1 GLU 82.A OE2 no hydrogen 3.349 N/A ALA 87.A N HIS 83.A O no hydrogen 3.209 N/A ALA 88.A N ALA 84.A O no hydrogen 3.369 N/A ALA 88.A N ARG 85.A O no hydrogen 2.804 N/A VAL 89.A N ARG 85.A O no hydrogen 3.017 N/A THR 90.A N THR 86.A O no hydrogen 2.902 N/A THR 90.A OG1 THR 86.A O no hydrogen 2.854 N/A HIS 91.A N ALA 87.A O no hydrogen 2.983 N/A HIS 91.A NE2 GLU 97.A OE1 no hydrogen 3.165 N/A ASN 92.A N ALA 88.A O no hydrogen 2.824 N/A ASN 92.A ND2 GLU 97.A O no hydrogen 2.734 N/A LEU 93.A N VAL 89.A O no hydrogen 2.846 N/A TYR 94.A N THR 90.A O no hydrogen 2.950 N/A TYR 95.A N HIS 91.A O no hydrogen 3.155 N/A ASP 96.A N ASN 92.A O no hydrogen 2.732 N/A VAL 101.A N ASP 140.A OD1 no hydrogen 2.984 N/A LEU 104.A N ASN 100.A O no hydrogen 2.985 N/A THR 105.A N VAL 101.A O no hydrogen 2.910 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.744 N/A GLN 106.A N GLU 102.A O no hydrogen 2.661 N/A SER 107.A N SER 103.A O no hydrogen 2.952 N/A SER 107.A OG HIS 83.A NE2 no hydrogen 2.825 N/A VAL 108.A N LEU 104.A O no hydrogen 3.239 N/A CYS 109.A N THR 105.A O no hydrogen 3.117 N/A ASP 110.A N GLN 106.A O no hydrogen 2.973 N/A LEU 111.A N VAL 108.A O no hydrogen 2.828 N/A ALA 112.A N VAL 108.A O no hydrogen 3.317 N/A ARG 114.A N LEU 111.A O no hydrogen 3.176 N/A PHE 115.A N LEU 113.A O no hydrogen 2.753 N/A ARG 128.A NH1 ASP 76.A OD1 no hydrogen 2.713 N/A ARG 128.A NH1 PRO 129.A O no hydrogen 2.939 N/A ARG 128.A NH2 ASP 76.A OD1 no hydrogen 3.153 N/A ARG 128.A NH2 ASP 76.A OD2 no hydrogen 2.973 N/A GLY 131.A N ASP 76.A OD1 no hydrogen 2.779 N/A ALA 133.A N SER 71.A O no hydrogen 3.185 N/A LEU 134.A N ALA 150.A O no hydrogen 3.025 N/A LEU 135.A N ALA 69.A O no hydrogen 2.692 N/A ILE 136.A N PHE 148.A O no hydrogen 2.798 N/A ALA 137.A N GLY 67.A O no hydrogen 3.204 N/A GLY 138.A N GLN 146.A O no hydrogen 3.007 N/A HIS 139.A N HIS 65.A O no hydrogen 3.375 N/A GLN 146.A N GLY 138.A O no hydrogen 2.919 N/A PHE 148.A N ILE 136.A O no hydrogen 2.732 N/A HIS 149.A N TYR 157.A O no hydrogen 2.868 N/A ALA 150.A N LEU 134.A O no hydrogen 2.698 N/A GLU 151.A N THR 155.A O no hydrogen 3.491 N/A SER 153.A OG GLU 151.A OE2 no hydrogen 3.174 N/A SER 153.A OG THR 155.A OG1 no hydrogen 2.713 N/A GLY 154.A N GLU 151.A O no hydrogen 2.815 N/A THR 155.A OG1 SER 153.A OG no hydrogen 2.713 N/A TYR 157.A N HIS 149.A O no hydrogen 3.241 N/A ARG 158.A NH2 TYR 145.A O no hydrogen 3.359 N/A TYR 159.A N LEU 147.A O no hydrogen 3.162 N/A LYS 162.A N GLY 31.A O no hydrogen 2.797 N/A LYS 162.A NZ TYR 159.A OH no hydrogen 2.826 N/A ILE 164.A N ALA 29.A O no hydrogen 3.065 N/A SER 166.A N GLY 26.A O no hydrogen 2.674 N/A SER 166.A OG GLY 26.A O no hydrogen 3.558 N/A SER 166.A OG THR 28.A OG1 no hydrogen 3.011 N/A GLY 167.A N THR 28.A OG1 no hydrogen 3.296 N/A SER 168.A N GLY 165.A O no hydrogen 2.843 N/A SER 168.A OG GLY 165.A O no hydrogen 2.642 N/A GLY 170.A N GLU 169.A OE1 no hydrogen 3.109 N/A ALA 171.A N GLY 167.A O no hydrogen 3.021 N/A GLN 172.A N SER 168.A O no hydrogen 2.667 N/A ALA 173.A N GLU 169.A O no hydrogen 3.449 N/A GLU 174.A N GLY 170.A O no hydrogen 3.347 N/A LEU 175.A N ALA 171.A O no hydrogen 3.021 N/A LEU 176.A N GLN 172.A O no hydrogen 2.967 N/A ASN 177.A N ALA 173.A O no hydrogen 3.344 N/A GLU 178.A N GLU 174.A O no hydrogen 3.020 N/A TRP 179.A N LEU 175.A O no hydrogen 3.058 N/A LEU 183.A N HIS 180C.A O no hydrogen 3.282 N/A GLU 187.A N THR 184.A OG1 no hydrogen 3.307 N/A ALA 188.A N THR 184.A O no hydrogen 2.961 N/A GLU 189.A N LEU 185.A O no hydrogen 2.966 N/A LEU 190.A N LYS 186.A O no hydrogen 3.023 N/A LEU 191.A N GLU 187.A O no hydrogen 2.957 N/A VAL 192.A N ALA 188.A O no hydrogen 2.831 N/A LEU 193.A N GLU 189.A O no hydrogen 3.004 N/A LYS 194.A N LEU 190.A O no hydrogen 2.759 N/A LYS 194.A NZ GLU 178.A OE1 no hydrogen 3.435 N/A ILE 195.A N LEU 191.A O no hydrogen 2.863 N/A LEU 196.A N VAL 192.A O no hydrogen 3.184 N/A LYS 197.A N LEU 193.A O no hydrogen 3.145 N/A GLN 198.A N LYS 194.A O no hydrogen 3.130 N/A GLN 198.A NE2 GLU 174.A OE2 no hydrogen 3.422 N/A VAL 199.A N ILE 195.A O no hydrogen 3.082 N/A VAL 199.A N LEU 196.A O no hydrogen 3.121 N/A MET 200.A N LEU 196.A O no hydrogen 2.887 N/A ASP 205.A N ASN 208B.A OD1 no hydrogen 2.734 N/A GLU 206.A N GLU 206.A OE2 no hydrogen 2.967 N/A GLN 210.A N VAL 42.A O no hydrogen 3.064 N/A SER 212.A OG LEU 40.A O no hydrogen 2.848 N/A CYS 213.A N LYS 221.A O no hydrogen 3.241 N/A CYS 213.A SG TYR 223.A OH no hydrogen 2.944 N/A ILE 214.A N VAL 38.A O no hydrogen 3.090 N/A THR 215.A N GLY 219.A O no hydrogen 3.099 N/A LYS 216.A N TYR 145.A OH no hydrogen 2.977 N/A ASP 218.A N THR 215.A OG1 no hydrogen 3.178 N/A GLY 219.A N THR 215.A O no hydrogen 2.616 N/A PHE 220.A N ARG 64.A O no hydrogen 2.796 N/A LYS 221.A N CYS 213.A O no hydrogen 2.997 N/A TYR 223.A N LEU 211.A O no hydrogen 3.297 N/A TYR 223.A OH GLU 189.A OE1 no hydrogen 2.695 N/A LYS 227.A N ASP 224.A OD2 no hydrogen 3.389 N/A THR 228.A N ASP 224.A O no hydrogen 3.336 N/A ALA 229.A N ASN 225.A O no hydrogen 2.893 N/A GLU 230.A N GLU 226.A O no hydrogen 3.338 N/A LEU 231.A N THR 228.A O no hydrogen 2.576 N/A ILE 232.A N THR 228.A O no hydrogen 3.004 N/A LYS 233.A N ALA 229.A O no hydrogen 3.115 N/A GLU 234.A N GLU 230.A O no hydrogen 3.421 N/A LEU 235.A N LEU 231.A O no hydrogen 3.088 N/A LEU 235.A N ILE 232.A O no hydrogen 2.819 N/A LYS 236.A N ILE 232.A O no hydrogen 3.385 N/A LYS 238.A N GLU 234.A O no hydrogen 3.250 N/A GLU 239.A N LEU 235.A O no hydrogen 2.828 N/A ALA 240.A N LYS 236.A O no hydrogen 3.076 N/A ALA 241.A N GLU 239.A O no hydrogen 2.699 N/A GLY 116A.A N MET 126.A O no hydrogen 2.876 N/A ASP 143A.A N ASP 140.A OD2 no hydrogen 3.113 N/A ASN 207A.A N ASP 205.A OD1 no hydrogen 2.838 N/A ASN 208B.A ND2 LYS 203.A O no hydrogen 3.059 N/A SER 182E.A N HIS 180C.A O no hydrogen 2.608 N/A SER 182E.A OG SER 181D.A O no hydrogen 2.395 N/A