Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qye_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N VAL 161.A O no hydrogen 3.365 N/A PHE 5.A N PHE 159.A O no hydrogen 2.772 N/A GLN 8.A N GLY 93.A O no hydrogen 3.195 N/A GLU 10.A N GLU 10.A OE2 no hydrogen 2.710 N/A VAL 11.A N GLN 8.A O no hydrogen 2.957 N/A ASN 12.A N GLN 8.A O no hydrogen 3.120 N/A ARG 13.A N ALA 9.A O no hydrogen 2.987 N/A ARG 13.A NH1 THR 108.A OG1 no hydrogen 3.378 N/A MET 14.A N GLU 10.A O no hydrogen 2.747 N/A MET 15.A N VAL 11.A O no hydrogen 2.758 N/A LYS 16.A N ASN 12.A O no hydrogen 3.216 N/A LEU 17.A N ARG 13.A O no hydrogen 3.009 N/A ILE 18.A N MET 14.A O no hydrogen 2.895 N/A ILE 19.A N MET 15.A O no hydrogen 2.856 N/A ASN 20.A N LYS 16.A O no hydrogen 2.931 N/A SER 21.A N LEU 17.A O no hydrogen 3.024 N/A SER 21.A N ILE 18.A O no hydrogen 3.120 N/A SER 21.A OG THR 117.A OG1 no hydrogen 2.939 N/A LEU 22.A N ILE 18.A O no hydrogen 3.214 N/A ASN 25.A N LEU 22.A O no hydrogen 2.783 N/A LYS 26.A NZ TYR 23.A O no hydrogen 2.775 N/A ILE 28.A N ASN 25.A O no hydrogen 2.778 N/A PHE 29.A N LYS 26.A O no hydrogen 3.072 N/A LEU 30.A N GLU 27.A O no hydrogen 3.289 N/A ARG 31.A NE GLU 32.A OE2 no hydrogen 3.053 N/A ARG 31.A NH2 GLU 32.A OE2 no hydrogen 2.825 N/A GLU 32.A N ILE 28.A O no hydrogen 3.260 N/A LEU 33.A N PHE 29.A O no hydrogen 3.034 N/A ILE 34.A N LEU 30.A O no hydrogen 2.961 N/A SER 35.A N ARG 31.A O no hydrogen 2.909 N/A ASN 36.A N GLU 32.A O no hydrogen 2.864 N/A ALA 37.A N LEU 33.A O no hydrogen 2.994 N/A SER 38.A N ILE 34.A O no hydrogen 2.846 N/A ASP 39.A N SER 35.A O no hydrogen 2.941 N/A ALA 40.A N ASN 36.A O no hydrogen 2.992 N/A LEU 41.A N ALA 37.A O no hydrogen 2.850 N/A ASP 42.A N SER 38.A O no hydrogen 2.902 N/A LYS 43.A N ASP 39.A O no hydrogen 2.993 N/A ILE 44.A N ALA 40.A O no hydrogen 3.209 N/A ARG 45.A N LEU 41.A O no hydrogen 3.022 N/A LEU 46.A N ASP 42.A O no hydrogen 2.896 N/A ILE 47.A N LYS 43.A O no hydrogen 2.910 N/A SER 48.A N ILE 44.A O no hydrogen 2.835 N/A SER 48.A OG ARG 45.A O no hydrogen 2.549 N/A LEU 49.A N LEU 46.A O no hydrogen 3.012 N/A THR 50.A N ILE 47.A O no hydrogen 2.975 N/A THR 50.A OG1 ILE 47.A O no hydrogen 2.879 N/A ASP 51.A N ILE 47.A O no hydrogen 2.776 N/A ASN 53.A N ASP 51.A OD1 no hydrogen 2.857 N/A ALA 54.A N ASP 51.A O no hydrogen 3.469 N/A ALA 56.A N ASN 53.A O no hydrogen 3.095 N/A ASN 58.A N LEU 55.A O no hydrogen 2.718 N/A ASN 58.A ND2 LEU 170.A O no hydrogen 3.039 N/A GLU 60.A N ASN 58.A OD1 no hydrogen 3.373 N/A THR 62.A N THR 79.A OG1 no hydrogen 2.878 N/A VAL 63.A N PRO 207.A O no hydrogen 3.169 N/A LYS 64.A N THR 77.A O no hydrogen 2.694 N/A ILE 65.A N TYR 209.A O no hydrogen 2.714 N/A LYS 66.A N HIS 75.A O no hydrogen 3.067 N/A CYS 67.A SG TYR 187.A O no hydrogen 3.910 N/A ASP 68.A N LEU 73.A O no hydrogen 2.850 N/A LYS 69.A NZ GLU 189.A OE2 no hydrogen 2.802 N/A LYS 71.A N ASP 68.A O no hydrogen 2.641 N/A LYS 71.A N ASP 68.A OD1 no hydrogen 2.967 N/A ASN 72.A N LYS 69.A O no hydrogen 3.055 N/A ASN 72.A ND2 LEU 180.A O no hydrogen 2.770 N/A LEU 73.A N ASP 68.A O no hydrogen 3.338 N/A LEU 74.A N LEU 178.A O no hydrogen 3.071 N/A HIS 75.A N LYS 66.A O no hydrogen 3.065 N/A HIS 75.A ND1 THR 177.A OG1 no hydrogen 2.820 N/A VAL 76.A N ILE 176.A O no hydrogen 2.818 N/A THR 77.A N LYS 64.A O no hydrogen 2.877 N/A THR 77.A OG1 THR 175.A OG1 no hydrogen 2.784 N/A ASP 78.A N THR 174.A O no hydrogen 2.754 N/A THR 79.A N THR 62.A O no hydrogen 3.086 N/A THR 79.A OG1 GLU 60.A O no hydrogen 2.651 N/A GLY 80.A N ASP 78.A OD1 no hydrogen 2.757 N/A VAL 81.A N ALA 40.A O no hydrogen 2.925 N/A MET 83.A N SER 142.A OG no hydrogen 2.785 N/A THR 84.A N GLU 87.A OE1 no hydrogen 3.117 N/A ARG 85.A N ASP 147.A OD2 no hydrogen 3.005 N/A ARG 85.A NH2 GLU 3.A OE1 no hydrogen 2.431 N/A GLU 87.A N THR 84.A OG1 no hydrogen 3.218 N/A LEU 88.A N THR 84.A O no hydrogen 3.005 N/A VAL 89.A N ARG 85.A O no hydrogen 3.143 N/A LYS 90.A N GLU 86.A O no hydrogen 2.830 N/A ASN 91.A N GLU 87.A O no hydrogen 2.716 N/A LEU 92.A N LEU 88.A O no hydrogen 3.288 N/A GLY 93.A N VAL 89.A O no hydrogen 3.049 N/A THR 94.A N LYS 90.A O no hydrogen 3.058 N/A THR 94.A OG1 LYS 90.A O no hydrogen 2.685 N/A ILE 95.A N GLN 8.A OE1 no hydrogen 3.070 N/A ALA 96.A N THR 94.A OG1 no hydrogen 3.122 N/A LYS 97.A NZ PHE 124.A O no hydrogen 3.460 N/A THR 100.A N LYS 97.A O no hydrogen 2.797 N/A THR 100.A OG1 LYS 97.A O no hydrogen 2.716 N/A PHE 103.A N GLY 99.A O no hydrogen 3.221 N/A LEU 104.A N THR 100.A O no hydrogen 3.072 N/A ASN 105.A N SER 101.A O no hydrogen 3.125 N/A LYS 106.A N GLU 102.A O no hydrogen 2.966 N/A LYS 106.A NZ GLU 102.A OE2 no hydrogen 2.744 N/A MET 107.A N PHE 103.A O no hydrogen 2.770 N/A THR 108.A N LEU 104.A O no hydrogen 3.292 N/A THR 108.A N ASN 105.A O no hydrogen 3.179 N/A THR 108.A OG1 LEU 104.A O no hydrogen 2.463 N/A GLU 109.A N ASN 105.A O no hydrogen 3.040 N/A ALA 110.A N LYS 106.A O no hydrogen 2.766 N/A GLN 111.A N MET 107.A O no hydrogen 3.230 N/A GLU 112.A N THR 108.A O no hydrogen 3.186 N/A GLU 112.A N GLU 109.A O no hydrogen 2.579 N/A ASP 113.A N GLU 109.A O no hydrogen 2.878 N/A GLN 115.A N ALA 110.A O no hydrogen 3.015 N/A SER 116.A OG GLU 119.A OE1 no hydrogen 3.060 N/A SER 116.A OG GLU 119.A OE2 no hydrogen 2.665 N/A THR 117.A OG1 SER 21.A OG no hydrogen 2.939 N/A ILE 121.A N THR 117.A O no hydrogen 3.214 N/A GLY 122.A N SER 118.A O no hydrogen 3.522 N/A GLN 123.A N GLU 119.A O no hydrogen 2.705 N/A PHE 124.A N LEU 120.A O no hydrogen 2.849 N/A GLY 125.A N GLY 122.A O no hydrogen 3.240 N/A VAL 126.A N ILE 121.A O no hydrogen 3.334 N/A TYR 129.A OH LEU 92.A O no hydrogen 2.594 N/A SER 130.A N GLY 127.A O no hydrogen 2.963 N/A SER 130.A OG GLY 127.A O no hydrogen 2.767 N/A ALA 131.A N PHE 128.A O no hydrogen 3.120 N/A PHE 132.A N TYR 129.A O no hydrogen 3.065 N/A LEU 133.A N SER 130.A O no hydrogen 2.983 N/A VAL 134.A N ALA 131.A O no hydrogen 3.103 N/A ASP 136.A N VAL 179.A O no hydrogen 2.966 N/A VAL 138.A N SER 154.A O no hydrogen 3.007 N/A ILE 139.A N THR 177.A O no hydrogen 2.729 N/A VAL 140.A N TRP 152.A O no hydrogen 2.791 N/A THR 141.A N THR 175.A O no hydrogen 2.907 N/A SER 142.A N HIS 150.A O no hydrogen 2.947 N/A SER 142.A OG MET 83.A O no hydrogen 3.480 N/A SER 142.A OG GLY 173.A O no hydrogen 3.377 N/A SER 142.A OG THR 174.A OG1 no hydrogen 2.944 N/A LYS 143.A N GLY 173.A O no hydrogen 2.920 N/A LYS 143.A NZ HIS 144.A O no hydrogen 3.104 N/A LYS 143.A NZ ASP 147.A O no hydrogen 2.530 N/A ASN 145.A ND2 ALA 54.A O no hydrogen 2.942 N/A ASN 146.A N HIS 144.A ND1 no hydrogen 2.858 N/A ASP 147.A N HIS 144.A O no hydrogen 2.801 N/A THR 148.A N ASP 147.A OD1 no hydrogen 2.509 N/A THR 148.A OG1 ASP 147.A OD1 no hydrogen 3.371 N/A GLN 149.A NE2 ASP 164.A OD2 no hydrogen 2.875 N/A GLN 149.A NE2 THR 169.A OG1 no hydrogen 3.094 N/A HIS 150.A N SER 142.A O no hydrogen 3.010 N/A HIS 150.A ND1 THR 148.A O no hydrogen 2.765 N/A ILE 151.A N ILE 162.A O no hydrogen 2.885 N/A TRP 152.A N VAL 140.A O no hydrogen 2.798 N/A GLU 153.A N SER 160.A O no hydrogen 2.927 N/A SER 154.A N VAL 138.A O no hydrogen 3.027 N/A SER 154.A OG GLU 158.A O no hydrogen 2.629 N/A SER 156.A N SER 154.A OG no hydrogen 2.821 N/A SER 156.A OG ASP 155.A O no hydrogen 2.472 N/A ASN 157.A N ASP 155.A OD1 no hydrogen 2.916 N/A ASN 157.A ND2 ASP 155.A OD2 no hydrogen 2.970 N/A PHE 159.A N PHE 5.A O no hydrogen 2.947 N/A SER 160.A N GLU 153.A O no hydrogen 2.953 N/A SER 160.A OG GLU 153.A OE1 no hydrogen 2.878 N/A VAL 161.A N GLU 3.A O no hydrogen 3.286 N/A ILE 162.A N ILE 151.A O no hydrogen 3.030 N/A ASP 164.A N GLN 149.A O no hydrogen 2.680 N/A ARG 166.A N ASP 164.A OD1 no hydrogen 2.823 N/A ARG 166.A NE ASP 164.A OD1 no hydrogen 2.892 N/A ARG 166.A NE ASP 164.A OD2 no hydrogen 3.252 N/A ARG 166.A NH2 ASP 164.A OD2 no hydrogen 2.652 N/A GLY 167.A N ASP 164.A O no hydrogen 2.972 N/A THR 169.A N GLN 149.A OE1 no hydrogen 3.287 N/A LEU 170.A N GLN 149.A OE1 no hydrogen 3.112 N/A GLY 171.A N ASN 168.A OD1 no hydrogen 2.862 N/A ARG 172.A NE THR 79.A O no hydrogen 3.072 N/A ARG 172.A NE GLY 80.A O no hydrogen 2.897 N/A ARG 172.A NH1 ASN 58.A O no hydrogen 3.011 N/A ARG 172.A NH2 ASN 58.A O no hydrogen 3.016 N/A ARG 172.A NH2 GLU 60.A O no hydrogen 3.198 N/A ARG 172.A NH2 THR 79.A O no hydrogen 2.474 N/A GLY 173.A N LYS 143.A O no hydrogen 2.879 N/A THR 174.A N ASP 78.A O no hydrogen 2.872 N/A THR 174.A OG1 SER 142.A OG no hydrogen 2.944 N/A THR 175.A N THR 141.A O no hydrogen 2.751 N/A THR 175.A OG1 THR 77.A OG1 no hydrogen 2.784 N/A ILE 176.A N VAL 76.A O no hydrogen 2.764 N/A THR 177.A N ILE 139.A O no hydrogen 2.645 N/A THR 177.A OG1 HIS 75.A ND1 no hydrogen 2.820 N/A LEU 178.A N LEU 74.A O no hydrogen 2.781 N/A VAL 179.A N LYS 137.A O no hydrogen 2.853 N/A LEU 180.A N ASN 72.A O no hydrogen 3.389 N/A LYS 181.A N VAL 134.A O no hydrogen 2.994 N/A LYS 181.A NZ ASP 136.A OD2 no hydrogen 2.904 N/A ALA 184.A N LYS 181.A O no hydrogen 3.019 N/A SER 185.A N GLU 182.A O no hydrogen 2.936 N/A SER 185.A OG GLU 182.A O no hydrogen 3.403 N/A TYR 187.A N ALA 184.A O no hydrogen 2.888 N/A LEU 188.A N SER 185.A O no hydrogen 2.753 N/A GLU 189.A N ASP 186.A O no hydrogen 2.967 N/A THR 192.A OG1 ASP 186.A OD1 no hydrogen 3.026 N/A ILE 193.A N GLU 189.A O no hydrogen 3.152 N/A LYS 194.A N LEU 190.A O no hydrogen 2.765 N/A LYS 194.A NZ LEU 190.A O no hydrogen 2.695 N/A ASN 195.A N ASP 191.A O no hydrogen 3.085 N/A ASN 195.A ND2 ASP 191.A O no hydrogen 2.923 N/A LEU 196.A N THR 192.A O no hydrogen 3.062 N/A VAL 197.A N ILE 193.A O no hydrogen 2.698 N/A LYS 198.A N LYS 194.A O no hydrogen 3.190 N/A LYS 199.A N ASN 195.A O no hydrogen 3.090 N/A SER 201.A N LYS 198.A O no hydrogen 3.487 N/A SER 201.A OG VAL 197.A O no hydrogen 2.670 N/A SER 201.A OG ASN 225.A OXT no hydrogen 3.102 N/A ILE 204.A N SER 201.A O no hydrogen 2.900 N/A TYR 209.A N VAL 63.A O no hydrogen 2.789 N/A VAL 210.A N GLU 222.A O no hydrogen 3.063 N/A TRP 211.A N ILE 65.A O no hydrogen 2.899 N/A SER 212.A N ASP 220.A O no hydrogen 3.305 N/A SER 212.A OG GLU 222.A OE1 no hydrogen 2.808 N/A LYS 214.A N VAL 218.A O no hydrogen 3.189 N/A THR 215.A OG1 THR 217.A OG1 no hydrogen 2.851 N/A THR 217.A OG1 THR 215.A OG1 no hydrogen 2.851 N/A ASP 220.A N SER 212.A O no hydrogen 3.162 N/A TRP 221.A N ASP 220.A OD2 no hydrogen 2.684 N/A GLU 222.A N VAL 210.A O no hydrogen 2.985 N/A MET 224.A N ILE 208.A O no hydrogen 2.906 N/A