Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qio_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASN 30.A O no hydrogen 3.469 N/A LEU 4.A N ALA 31.A O no hydrogen 2.726 N/A GLN 5.A N GLU 2.A O no hydrogen 2.982 N/A LYS 7.A N LEU 4.A O no hydrogen 2.952 N/A THR 8.A N HIS 88.A ND1 no hydrogen 3.010 N/A PHE 9.A N LYS 34.A O no hydrogen 2.826 N/A VAL 10.A N GLY 89.A O no hydrogen 2.991 N/A VAL 11.A N ILE 36.A O no hydrogen 2.751 N/A MET 12.A N ALA 91.A O no hydrogen 2.876 N/A GLY 13.A N THR 38.A O no hydrogen 3.433 N/A ALA 15.A N SER 19.A OG no hydrogen 2.873 N/A ASN 16.A N SER 19.A OG no hydrogen 3.141 N/A ARG 18.A N ASN 16.A OD1 no hydrogen 2.935 N/A SER 19.A N ASN 16.A O no hydrogen 3.139 N/A SER 19.A OG ASN 16.A O no hydrogen 3.322 N/A TRP 22.A N SER 19.A O no hydrogen 2.972 N/A GLY 23.A N SER 19.A O no hydrogen 3.268 N/A ILE 24.A N ILE 20.A O no hydrogen 2.872 N/A ALA 25.A N ALA 21.A O no hydrogen 2.763 N/A ARG 26.A N TRP 22.A O no hydrogen 2.957 N/A SER 27.A N GLY 23.A O no hydrogen 3.106 N/A SER 27.A OG GLY 23.A O no hydrogen 3.386 N/A SER 27.A OG ASP 228.A OD1 no hydrogen 2.671 N/A LEU 28.A N ILE 24.A O no hydrogen 2.893 N/A HIS 29.A N ALA 25.A O no hydrogen 2.874 N/A HIS 29.A NE2 GLU 56.A O no hydrogen 2.767 N/A ASN 30.A N ARG 26.A O no hydrogen 2.911 N/A ALA 31.A N SER 27.A O no hydrogen 3.022 N/A ALA 31.A N LEU 28.A O no hydrogen 3.065 N/A GLY 32.A N HIS 29.A O no hydrogen 2.936 N/A ALA 33.A N LEU 28.A O no hydrogen 2.980 N/A LYS 34.A N LYS 7.A O no hydrogen 2.919 N/A ILE 36.A N PHE 9.A O no hydrogen 2.830 N/A PHE 37.A N LEU 61.A O no hydrogen 2.906 N/A THR 38.A N VAL 11.A O no hydrogen 3.124 N/A TYR 39.A N LEU 63.A O no hydrogen 2.917 N/A LEU 44.A N GLY 41.A O no hydrogen 2.995 N/A GLU 45.A N GLU 42.A O no hydrogen 3.139 N/A ARG 46.A NE GLU 50.A OE2 no hydrogen 3.067 N/A ARG 46.A NH2 GLU 50.A OE2 no hydrogen 3.567 N/A ASN 47.A ND2 ALA 15.A O no hydrogen 3.086 N/A VAL 48.A N LEU 44.A O no hydrogen 3.185 N/A ARG 49.A N GLU 45.A O no hydrogen 3.048 N/A ARG 49.A NH1 ASP 53.A OD1 no hydrogen 2.805 N/A ARG 49.A NH1 SER 60.A O no hydrogen 3.131 N/A ARG 49.A NH2 SER 60.A O no hydrogen 2.692 N/A GLU 50.A N ARG 46.A O no hydrogen 3.044 N/A LEU 51.A N ASN 47.A O no hydrogen 2.924 N/A ALA 52.A N VAL 48.A O no hydrogen 2.733 N/A ASP 53.A N ARG 49.A O no hydrogen 2.868 N/A THR 54.A N LEU 51.A O no hydrogen 2.968 N/A THR 54.A OG1 LEU 51.A O no hydrogen 2.582 N/A LEU 55.A N ALA 52.A O no hydrogen 3.158 N/A SER 60.A OG LEU 35.A O no hydrogen 3.319 N/A LEU 63.A N PHE 37.A O no hydrogen 2.795 N/A CYS 65.A N TYR 39.A O no hydrogen 2.593 N/A ASP 66.A N GLU 72.A OE1 no hydrogen 2.641 N/A THR 68.A N ASP 66.A OD1 no hydrogen 3.016 N/A ASN 69.A N ASP 66.A O no hydrogen 2.927 N/A GLU 72.A N ASN 69.A OD1 no hydrogen 3.106 N/A LEU 73.A N ASN 69.A O no hydrogen 2.910 N/A THR 74.A N ASP 70.A O no hydrogen 2.903 N/A THR 74.A OG1 ASP 70.A O no hydrogen 3.085 N/A ALA 75.A N GLU 71.A O no hydrogen 2.876 N/A CYS 76.A N GLU 72.A O no hydrogen 2.720 N/A PHE 77.A N LEU 73.A O no hydrogen 3.208 N/A GLU 78.A N THR 74.A O no hydrogen 3.069 N/A THR 79.A N ALA 75.A O no hydrogen 2.924 N/A THR 79.A OG1 ALA 75.A O no hydrogen 3.132 N/A ILE 80.A N CYS 76.A O no hydrogen 2.976 N/A LYS 81.A N PHE 77.A O no hydrogen 2.981 N/A GLN 82.A N GLU 78.A O no hydrogen 2.996 N/A GLU 83.A N THR 79.A O no hydrogen 2.904 N/A VAL 84.A N ILE 80.A O no hydrogen 2.993 N/A THR 86.A N VAL 84.A O no hydrogen 2.776 N/A THR 86.A OG1 THR 137.A OG1 no hydrogen 2.851 N/A ILE 87.A N VAL 135.A O no hydrogen 3.156 N/A HIS 88.A N THR 8.A O no hydrogen 2.775 N/A HIS 88.A NE2 GLU 138.A OE2 no hydrogen 3.137 N/A VAL 90.A N ASN 141.A O no hydrogen 3.260 N/A ALA 91.A N VAL 10.A O no hydrogen 2.765 N/A HIS 92.A N LEU 143.A O no hydrogen 2.720 N/A HIS 92.A ND1 THR 144.A OG1 no hydrogen 2.879 N/A HIS 92.A NE2 SER 124.A OG no hydrogen 2.813 N/A CYS 93.A N MET 12.A O no hydrogen 2.926 N/A PHE 96.A N SER 121.A OG no hydrogen 2.951 N/A ARG 99.A NH2 LYS 199.A O no hydrogen 3.328 N/A ASP 101.A N ASN 98.A O no hydrogen 2.997 N/A LEU 102.A N ARG 99.A O no hydrogen 3.061 N/A ASP 108.A N GLU 105.A O no hydrogen 3.099 N/A THR 109.A N PHE 106.A O no hydrogen 2.982 N/A THR 109.A OG1 PHE 106.A O no hydrogen 2.706 N/A GLY 113.A N SER 110.A OG no hydrogen 2.991 N/A PHE 114.A N SER 110.A O no hydrogen 2.846 N/A LEU 115.A N ARG 111.A O no hydrogen 2.883 N/A LEU 116.A N ASP 112.A O no hydrogen 2.975 N/A ALA 117.A N GLY 113.A O no hydrogen 3.202 N/A GLN 118.A N PHE 114.A O no hydrogen 3.067 N/A GLN 118.A NE2 VAL 162.A O no hydrogen 3.556 N/A ASN 119.A N LEU 115.A O no hydrogen 2.730 N/A ILE 120.A N LEU 116.A O no hydrogen 2.968 N/A SER 121.A N ALA 117.A O no hydrogen 2.792 N/A SER 121.A OG PHE 96.A O no hydrogen 3.177 N/A SER 121.A OG ALA 117.A O no hydrogen 2.933 N/A ALA 122.A N GLN 118.A O no hydrogen 3.015 N/A PHE 123.A N GLN 118.A O no hydrogen 2.808 N/A SER 124.A N ASN 119.A O no hydrogen 3.088 N/A SER 124.A OG HIS 92.A NE2 no hydrogen 2.813 N/A SER 124.A OG ILE 120.A O no hydrogen 2.534 N/A LEU 125.A N ALA 122.A O no hydrogen 2.989 N/A ALA 127.A N PHE 123.A O no hydrogen 3.041 N/A VAL 128.A N SER 124.A O no hydrogen 3.030 N/A ALA 129.A N LEU 125.A O no hydrogen 2.829 N/A ARG 130.A N THR 126.A O no hydrogen 2.903 N/A GLU 131.A N ALA 127.A O no hydrogen 3.377 N/A ALA 132.A N VAL 128.A O no hydrogen 2.808 N/A LYS 133.A N ALA 129.A O no hydrogen 2.760 N/A LYS 134.A N GLU 131.A O no hydrogen 3.142 N/A LYS 134.A NZ GLU 131.A OE1 no hydrogen 2.746 N/A LYS 134.A NZ GLU 131.A OE2 no hydrogen 3.298 N/A VAL 135.A N ALA 132.A O no hydrogen 3.133 N/A MET 136.A N ALA 132.A O no hydrogen 2.923 N/A THR 137.A OG1 THR 86.A OG1 no hydrogen 2.851 N/A GLY 139.A N MET 136.A O no hydrogen 2.930 N/A GLY 140.A N GLY 182.A O no hydrogen 3.032 N/A ASN 141.A N HIS 88.A O no hydrogen 3.263 N/A ILE 142.A N ARG 184.A O no hydrogen 2.811 N/A LEU 143.A N VAL 90.A O no hydrogen 2.807 N/A THR 144.A N ASN 186.A O no hydrogen 3.065 N/A THR 144.A OG1 HIS 92.A ND1 no hydrogen 2.879 N/A THR 144.A OG1 HIS 92.A O no hydrogen 3.441 N/A THR 146.A N ILE 188.A O no hydrogen 2.721 N/A THR 146.A OG1 GLU 168.A OE2 no hydrogen 2.669 N/A TYR 147.A N THR 146.A OG1 no hydrogen 2.715 N/A GLY 150.A N TYR 147.A O no hydrogen 2.764 N/A GLU 151.A N LEU 148.A O no hydrogen 2.758 N/A ARG 152.A N LEU 148.A O no hydrogen 2.984 N/A ARG 152.A NH2 HIS 253.A O no hydrogen 2.835 N/A TYR 157.A N VAL 154.A O no hydrogen 3.011 N/A ASN 158.A ND2 ASP 101.A O no hydrogen 3.256 N/A ASN 158.A ND2 LYS 103.A O no hydrogen 3.640 N/A ASN 158.A ND2 GLY 104.A O no hydrogen 3.164 N/A MET 160.A N TYR 157.A O no hydrogen 2.728 N/A GLY 161.A N TYR 157.A O no hydrogen 3.345 N/A VAL 162.A N ASN 158.A O no hydrogen 3.262 N/A ALA 163.A N VAL 159.A O no hydrogen 3.040 N/A LYS 164.A N MET 160.A O no hydrogen 2.768 N/A LYS 164.A NZ LEU 145.A O no hydrogen 2.812 N/A ALA 165.A N GLY 161.A O no hydrogen 2.977 N/A SER 166.A N VAL 162.A O no hydrogen 3.163 N/A SER 166.A OG GLN 118.A OE1 no hydrogen 2.909 N/A LEU 167.A N ALA 163.A O no hydrogen 2.866 N/A GLU 168.A N LYS 164.A O no hydrogen 2.678 N/A ALA 169.A N ALA 165.A O no hydrogen 2.872 N/A SER 170.A N SER 166.A O no hydrogen 2.912 N/A SER 170.A OG SER 166.A O no hydrogen 2.763 N/A VAL 171.A N LEU 167.A O no hydrogen 2.999 N/A LYS 172.A N GLU 168.A O no hydrogen 3.363 N/A TYR 173.A N ALA 169.A O no hydrogen 2.981 N/A LEU 174.A N SER 170.A O no hydrogen 2.714 N/A ALA 175.A N VAL 171.A O no hydrogen 2.861 N/A ASN 176.A N LYS 172.A O no hydrogen 3.002 N/A ASP 177.A N TYR 173.A O no hydrogen 2.983 N/A LEU 178.A N LEU 174.A O no hydrogen 2.821 N/A GLY 179.A N ALA 175.A O no hydrogen 3.106 N/A GLN 180.A NE2 ASP 177.A O no hydrogen 2.944 N/A HIS 181.A N LEU 178.A O no hydrogen 2.853 N/A GLY 182.A N GLY 179.A O no hydrogen 2.827 N/A ILE 183.A N LEU 178.A O no hydrogen 2.898 N/A ARG 184.A N GLY 140.A O no hydrogen 2.728 N/A ARG 184.A NH1 LEU 233.A O no hydrogen 2.980 N/A ARG 184.A NH1 VAL 241.A O no hydrogen 3.300 N/A ARG 184.A NH2 LEU 233.A O no hydrogen 2.863 N/A VAL 185.A N THR 242.A OG1 no hydrogen 3.028 N/A ASN 186.A N ILE 142.A O no hydrogen 2.895 N/A ASN 186.A ND2 ASN 141.A OD1 no hydrogen 2.958 N/A ASN 186.A ND2 VAL 241.A O no hydrogen 3.006 N/A ALA 187.A N GLU 244.A O no hydrogen 2.939 N/A ILE 188.A N THR 144.A O no hydrogen 2.915 N/A SER 189.A N ILE 246.A O no hydrogen 2.719 N/A ALA 190.A N THR 146.A O no hydrogen 3.263 N/A GLY 191.A N VAL 248.A O no hydrogen 3.137 N/A ARG 194.A NH1 ASN 205.A OD1 no hydrogen 2.864 N/A ALA 198.A N THR 195.A O no hydrogen 3.070 N/A ALA 198.A N THR 195.A OG1 no hydrogen 3.344 N/A GLY 200.A N SER 197.A O no hydrogen 2.899 N/A VAL 201.A N ALA 198.A O no hydrogen 3.102 N/A SER 206.A N ASP 203.A O no hydrogen 3.039 N/A SER 206.A OG ASP 203.A O no hydrogen 2.841 N/A ILE 207.A N ASP 203.A O no hydrogen 3.161 N/A LEU 208.A N PHE 204.A O no hydrogen 2.976 N/A ARG 209.A N ASN 205.A O no hydrogen 3.226 N/A GLU 210.A N SER 206.A O no hydrogen 3.120 N/A ILE 211.A N ILE 207.A O no hydrogen 3.056 N/A GLU 212.A N LEU 208.A O no hydrogen 2.932 N/A GLU 213.A N ARG 209.A O no hydrogen 2.934 N/A ARG 214.A N GLU 210.A O no hydrogen 2.857 N/A ARG 214.A NH1 GLY 256.A OXT no hydrogen 3.132 N/A ALA 215.A N ILE 211.A O no hydrogen 2.779 N/A LEU 217.A N SER 250.A O no hydrogen 3.163 N/A ARG 218.A N ALA 215.A O no hydrogen 2.732 N/A ARG 218.A NH1 ALA 215.A O no hydrogen 2.894 N/A THR 221.A OG1 VAL 248.A O no hydrogen 3.379 N/A THR 222.A OG1 GLU 224.A OE1 no hydrogen 3.261 N/A GLN 223.A N GLN 223.A OE1 no hydrogen 2.657 N/A GLN 223.A NE2 ARG 18.A O no hydrogen 2.725 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.631 N/A GLU 225.A N THR 222.A OG1 no hydrogen 3.075 N/A VAL 226.A N THR 222.A O no hydrogen 3.300 N/A GLY 227.A N GLN 223.A O no hydrogen 2.912 N/A ASP 228.A N GLU 224.A O no hydrogen 2.807 N/A THR 229.A N GLU 225.A O no hydrogen 3.205 N/A THR 229.A OG1 GLU 225.A O no hydrogen 3.196 N/A ALA 230.A N VAL 226.A O no hydrogen 2.829 N/A VAL 231.A N GLY 227.A O no hydrogen 2.913 N/A PHE 232.A N ASP 228.A O no hydrogen 3.360 N/A LEU 233.A N THR 229.A O no hydrogen 3.187 N/A PHE 234.A N ALA 230.A O no hydrogen 2.909 N/A SER 235.A N VAL 231.A O no hydrogen 2.916 N/A SER 235.A N PHE 232.A O no hydrogen 3.095 N/A SER 235.A OG PHE 232.A O no hydrogen 2.792 N/A LEU 237.A N SER 235.A OG no hydrogen 3.103 N/A ALA 238.A N SER 235.A O no hydrogen 3.278 N/A ARG 239.A N ASP 236.A O no hydrogen 2.904 N/A ARG 239.A NE ASP 236.A O no hydrogen 3.447 N/A VAL 241.A N ALA 238.A O no hydrogen 2.755 N/A GLY 243.A N VAL 185.A O no hydrogen 2.617 N/A GLU 244.A N ASN 186.A OD1 no hydrogen 2.970 N/A ASN 245.A N GLU 244.A OE1 no hydrogen 2.794 N/A ILE 246.A N ALA 187.A O no hydrogen 3.095 N/A HIS 247.A NE2 GLU 151.A OE2 no hydrogen 2.719 N/A VAL 248.A N SER 189.A O no hydrogen 2.881 N/A SER 250.A OG ARG 219.A O no hydrogen 2.722 N/A GLY 251.A N ASP 249.A OD1 no hydrogen 3.112 N/A TYR 252.A N ASP 249.A O no hydrogen 3.217 N/A TYR 252.A OH GLU 210.A OE2 no hydrogen 3.207 N/A HIS 253.A N ASP 249.A OD2 no hydrogen 2.843 N/A ILE 254.A N GLY 251.A O no hydrogen 3.164 N/A LEU 255.A N TYR 252.A O no hydrogen 3.001 N/A