Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2iys_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASP 72.A OD1.A no hydrogen 3.400 N/A ALA 1.A N ASP 72.A OD1.B no hydrogen 2.905 N/A LYS 3.A N ASP 72.A O no hydrogen 3.317 N/A LYS 3.A N GLY 73.A O no hydrogen 2.830 N/A LYS 3.A NZ.B ASP 72.A O no hydrogen 2.621 N/A LYS 3.A NZ.C ALA 1.A O no hydrogen 3.128 N/A LYS 3.A NZ.C ASP 72.A O no hydrogen 2.698 N/A VAL 5.A N THR 95.A O no hydrogen 2.838 N/A LEU 6.A N LEU 75.A O no hydrogen 2.774 N/A VAL 7.A N VAL 97.A O no hydrogen 2.936 N/A SER 12.A N LEU 9.A O no hydrogen 2.980 N/A SER 12.A OG LEU 9.A O no hydrogen 2.677 N/A LYS 14.A NZ.A SER 76.A OG.A no hydrogen 3.079 N/A LYS 14.A NZ.A LEU 77.A O no hydrogen 3.276 N/A LYS 14.A NZ.B GLY 8.A O no hydrogen 3.273 N/A LYS 14.A NZ.B LEU 77.A O no hydrogen 2.856 N/A THR 16.A OG1.B GLY 13.A O no hydrogen 3.101 N/A ILE 17.A N GLY 13.A O no hydrogen 2.819 N/A GLY 18.A N LYS 14.A O no hydrogen 2.921 N/A ARG 19.A N SER 15.A O no hydrogen 3.078 N/A ARG 20.A N THR 16.A O no hydrogen 2.963 N/A LEU 21.A N ILE 17.A O no hydrogen 2.765 N/A ALA 22.A N GLY 18.A O no hydrogen 2.942 N/A LYS 23.A N ARG 19.A O no hydrogen 2.915 N/A ALA 24.A N ARG 20.A O no hydrogen 2.993 N/A LEU 25.A N LEU 21.A O no hydrogen 2.960 N/A GLY 26.A N LYS 23.A O no hydrogen 3.296 N/A VAL 27.A N ALA 22.A O no hydrogen 2.987 N/A LEU 30.A N VAL 74.A O no hydrogen 3.000 N/A THR 32.A N SER 76.A O no hydrogen 3.059 N/A ASP 33.A N ASP 31.A OD1.A no hydrogen 2.861 N/A VAL 34.A N ASP 31.A OD1.B no hydrogen 3.071 N/A ALA 35.A N ASP 31.A O no hydrogen 2.938 N/A ILE 36.A N THR 32.A O no hydrogen 2.973 N/A GLU 37.A N ASP 33.A O no hydrogen 3.293 N/A GLN 38.A N VAL 34.A O no hydrogen 2.913 N/A ARG 39.A N ALA 35.A O no hydrogen 2.944 N/A THR 40.A N ILE 36.A O no hydrogen 3.102 N/A THR 40.A OG1 ILE 36.A O no hydrogen 2.855 N/A THR 40.A OG1 ARG 42.A O no hydrogen 3.266 N/A GLY 41.A N GLU 37.A O no hydrogen 2.848 N/A ARG 42.A N THR 40.A OG1 no hydrogen 3.073 N/A ARG 42.A NH1 ASP 51.A OD2 no hydrogen 2.999 N/A ARG 42.A NH2 ASP 51.A OD2 no hydrogen 2.652 N/A ILE 44.A N GLU 37.A OE2 no hydrogen 2.969 N/A ASP 46.A N SER 43.A OG no hydrogen 3.089 N/A ILE 47.A N SER 43.A O no hydrogen 3.011 N/A PHE 48.A N ILE 44.A O no hydrogen 3.093 N/A ALA 49.A N ALA 45.A O no hydrogen 2.936 N/A THR 50.A N ASP 46.A O no hydrogen 3.085 N/A THR 50.A OG1 ASP 46.A O no hydrogen 2.792 N/A ASP 51.A N ILE 47.A O no hydrogen 2.870 N/A GLY 52.A N ILE 47.A O no hydrogen 3.263 N/A GLN 54.A NE2 GLU 53.A OE1 no hydrogen 2.623 N/A PHE 56.A N GLY 52.A O no hydrogen 3.064 N/A ARG 57.A N GLU 53.A O no hydrogen 2.856 N/A ARG 57.A NH1 GLU 60.A OE1 no hydrogen 2.916 N/A ARG 58.A N GLN 54.A O no hydrogen 2.956 N/A ARG 58.A NE GLU 55.A OE1 no hydrogen 3.506 N/A ARG 58.A NE GLU 55.A OE2 no hydrogen 2.903 N/A ARG 58.A NH2 GLU 55.A OE2 no hydrogen 2.952 N/A ILE 59.A N GLU 55.A O no hydrogen 3.041 N/A GLU 60.A N PHE 56.A O no hydrogen 2.911 N/A GLU 61.A N ARG 57.A O no hydrogen 2.974 N/A ASP 62.A N ARG 58.A O no hydrogen 2.974 N/A VAL 63.A N ILE 59.A O no hydrogen 2.972 N/A VAL 64.A N GLU 60.A O no hydrogen 2.813 N/A ARG 65.A N GLU 61.A O no hydrogen 2.848 N/A ARG 65.A NE GLU 61.A OE2 no hydrogen 2.947 N/A ARG 65.A NH2 GLU 61.A OE2 no hydrogen 3.471 N/A ALA 66.A N ASP 62.A O no hydrogen 3.027 N/A ALA 67.A N VAL 63.A O no hydrogen 2.990 N/A LEU 68.A N VAL 64.A O no hydrogen 2.910 N/A ALA 69.A N ARG 65.A O no hydrogen 3.153 N/A ASP 70.A N ALA 66.A O no hydrogen 2.967 N/A ASP 70.A N ALA 67.A O no hydrogen 3.318 N/A HIS 71.A N ALA 67.A O no hydrogen 2.878 N/A HIS 71.A NE2 GLY 28.A O no hydrogen 3.154 N/A HIS 71.A NE2 VAL 74.A O no hydrogen 2.988 N/A VAL 74.A N GLY 28.A O no hydrogen 2.859 N/A LEU 75.A N ALA 4.A O no hydrogen 2.920 N/A SER 76.A N LEU 30.A O no hydrogen 2.842 N/A SER 76.A OG.A ASP 31.A OD2.B no hydrogen 3.468 N/A LEU 77.A N LEU 6.A O no hydrogen 3.077 N/A GLY 78.A N THR 32.A OG1 no hydrogen 2.967 N/A ALA 81.A N GLY 78.A O no hydrogen 3.173 N/A THR 83.A N GLY 80.A O no hydrogen 3.028 N/A THR 83.A OG1 GLY 80.A O no hydrogen 2.651 N/A SER 84.A N ALA 81.A O no hydrogen 3.081 N/A VAL 87.A N SER 84.A O no hydrogen 2.994 N/A ARG 88.A N SER 84.A O no hydrogen 3.185 N/A ARG 88.A NH1 VAL 82.A O no hydrogen 2.916 N/A ALA 89.A N PRO 85.A O no hydrogen 2.976 N/A ALA 90.A N GLY 86.A O no hydrogen 2.973 N/A LEU 91.A N VAL 87.A O no hydrogen 2.949 N/A ALA 92.A N ALA 89.A O no hydrogen 3.251 N/A HIS 94.A N LEU 91.A O no hydrogen 2.953 N/A VAL 96.A N THR 144.A OG1 no hydrogen 2.953 N/A VAL 97.A N VAL 5.A O no hydrogen 2.775 N/A TYR 98.A N MET 145.A O no hydrogen 2.923 N/A LEU 99.A N VAL 7.A O no hydrogen 2.970 N/A GLU 100.A N VAL 147.A O no hydrogen 2.787 N/A SER 102.A N ASN 150.A OD1 no hydrogen 2.908 N/A SER 102.A OG ASN 150.A OD1 no hydrogen 3.351 N/A GLU 105.A N SER 102.A OG no hydrogen 3.166 N/A GLY 106.A N SER 102.A O no hydrogen 3.012 N/A VAL 107.A N ALA 103.A O no hydrogen 2.996 N/A ARG 108.A N ALA 104.A O no hydrogen 3.096 N/A ARG 108.A NH1 GLU 105.A OE1 no hydrogen 3.175 N/A ARG 108.A NH2 GLU 105.A OE2 no hydrogen 2.703 N/A ARG 109.A N GLU 105.A O no hydrogen 2.960 N/A ARG 109.A NH1 GLY 11.A O no hydrogen 2.957 N/A ARG 109.A NH2 THR 149.A O no hydrogen 2.874 N/A THR 110.A N GLY 106.A O no hydrogen 3.113 N/A THR 110.A N VAL 107.A O no hydrogen 3.363 N/A THR 110.A OG1 GLY 106.A O no hydrogen 2.762 N/A THR 110.A OG1 VAL 107.A O no hydrogen 3.418 N/A GLY 111.A N ARG 108.A O no hydrogen 3.467 N/A LEU 119.A N ARG 116.A O no hydrogen 3.045 N/A ALA 120.A N PRO 117.A O no hydrogen 3.252 N/A GLY 121.A N LEU 118.A O no hydrogen 3.058 N/A ARG 124.A NH1 THR 110.A OG1 no hydrogen 2.886 N/A ARG 124.A NH2 VAL 107.A O no hydrogen 3.282 N/A ARG 124.A NH2 THR 110.A OG1 no hydrogen 3.259 N/A GLU 126.A N PRO 122.A O no hydrogen 2.965 N/A LYS 127.A N ASP 123.A O no hydrogen 2.921 N/A TYR 128.A N ARG 124.A O no hydrogen 2.967 N/A TYR 128.A OH PRO 10.A O no hydrogen 2.630 N/A ARG 129.A N ALA 125.A O no hydrogen 2.936 N/A ALA 130.A N GLU 126.A O no hydrogen 2.994 N/A LEU 131.A N LYS 127.A O no hydrogen 3.012 N/A MET 132.A N TYR 128.A O no hydrogen 2.897 N/A ALA 133.A N ARG 129.A O no hydrogen 3.070 N/A LYS 134.A N ALA 130.A O no hydrogen 3.206 N/A LYS 134.A N LEU 131.A O no hydrogen 3.120 N/A ARG 135.A N LEU 131.A O no hydrogen 2.874 N/A ARG 135.A NE.A GLY 79.A O.A no hydrogen 2.978 N/A ALA 136.A N MET 132.A O no hydrogen 2.874 N/A TYR 139.A N ARG 135.A O no hydrogen 3.021 N/A TYR 139.A OH.B GLY 79.A O.A no hydrogen 2.990 N/A TYR 139.A OH.B GLY 79.A O.B no hydrogen 2.684 N/A ARG 140.A N ALA 136.A O no hydrogen 2.967 N/A ARG 141.A N PRO 137.A O no hydrogen 3.067 N/A VAL 142.A N LEU 138.A O no hydrogen 3.104 N/A ALA 143.A N TYR 139.A O no hydrogen 3.081 N/A THR 144.A N VAL 96.A O no hydrogen 2.823 N/A THR 144.A OG1 VAL 96.A O no hydrogen 3.357 N/A MET 145.A N VAL 96.A O no hydrogen 3.026 N/A ARG 146.A NE GLU 100.A OE1 no hydrogen 3.051 N/A ARG 146.A NH2 GLU 100.A OE1 no hydrogen 3.348 N/A ARG 146.A NH2 GLU 100.A OE2 no hydrogen 3.142 N/A VAL 147.A N TYR 98.A O no hydrogen 2.847 N/A THR 149.A N GLU 100.A O no hydrogen 2.973 N/A THR 149.A OG1 SER 12.A O no hydrogen 3.544 N/A THR 149.A OG1 GLU 100.A O no hydrogen 3.553 N/A ASN 150.A N ASP 148.A OD1 no hydrogen 3.078 N/A ASN 150.A ND2 ASP 148.A OD1 no hydrogen 2.867 N/A ARG 152.A N THR 149.A O no hydrogen 3.246 N/A ARG 152.A NH1 ASP 148.A O no hydrogen 3.140 N/A ARG 152.A NH2 HIS 160.A ND1 no hydrogen 3.421 N/A GLY 155.A N ASN 153.A OD1 no hydrogen 3.045 N/A VAL 157.A N ASN 153.A O no hydrogen 3.196 N/A VAL 158.A N PRO 154.A O no hydrogen 3.028 N/A ARG 159.A N GLY 155.A O no hydrogen 3.012 N/A HIS 160.A N ALA 156.A O no hydrogen 3.008 N/A ILE 161.A N VAL 157.A O no hydrogen 3.055 N/A LEU 162.A N VAL 158.A O no hydrogen 2.879 N/A SER 163.A N ARG 159.A O no hydrogen 2.948 N/A SER 163.A OG.A ARG 159.A O no hydrogen 3.454 N/A SER 163.A OG.A HIS 160.A O no hydrogen 2.876 N/A SER 163.A OG.B ARG 159.A O no hydrogen 2.861 N/A ARG 164.A N ILE 161.A O no hydrogen 2.913 N/A ARG 164.A NH1 HIS 160.A O no hydrogen 3.084 N/A LEU 165.A N LEU 162.A O no hydrogen 3.170 N/A GLN 166.A NE2 SER 163.A O no hydrogen 3.063 N/A GLU 172.A N GLU 172.A OE2.B no hydrogen 2.584 N/A ALA 174.A N SER 171.A OG no hydrogen 3.084 N/A THR 175.A N SER 171.A O no hydrogen 3.260 N/A THR 175.A OG1 SER 171.A O no hydrogen 3.247 N/A