Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7khy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLY 30.A O no hydrogen 2.988 N/A GLN 2.A NE2 ASN 4.A OD1 no hydrogen 2.900 N/A ASN 4.A N THR 32.A O no hydrogen 2.779 N/A LYS 5.A NZ GLU 3.A OE1 no hydrogen 2.849 N/A TRP 7.A N ASN 4.A O no hydrogen 3.092 N/A TRP 7.A NE1 GLU 233.A OE2 no hydrogen 3.168 N/A ASN 8.A N LYS 5.A O no hydrogen 3.070 N/A ALA 9.A N SER 6.A O no hydrogen 3.362 N/A HIS 10.A N TRP 7.A O no hydrogen 2.995 N/A HIS 10.A NE2 GLN 232.A OE1 no hydrogen 2.260 N/A PHE 11.A N ASN 8.A O no hydrogen 2.947 N/A THR 12.A N ASN 8.A O no hydrogen 2.909 N/A THR 12.A OG1 ASN 8.A O no hydrogen 3.206 N/A THR 12.A OG1 ALA 9.A O no hydrogen 3.125 N/A GLU 13.A N ALA 9.A O no hydrogen 2.753 N/A HIS 14.A N PHE 11.A O no hydrogen 3.009 N/A HIS 14.A ND1 HIS 10.A O no hydrogen 2.457 N/A LYS 15.A N THR 12.A O no hydrogen 3.090 N/A SER 16.A N PHE 11.A O no hydrogen 2.858 N/A SER 16.A OG HIS 14.A O no hydrogen 3.078 N/A VAL 19.A N ASN 210.A O no hydrogen 2.749 N/A VAL 20.A N ASN 33.A OD1 no hydrogen 2.804 N/A VAL 21.A N ALA 208.A O no hydrogen 2.848 N/A LEU 22.A N PHE 31.A O no hydrogen 2.791 N/A TRP 23.A N PHE 206.A O no hydrogen 2.923 N/A TRP 23.A NE1 GLU 25.A OE1 no hydrogen 3.054 N/A ASN 24.A N GLN 29.A O no hydrogen 2.759 N/A GLU 25.A N VAL 204.A O no hydrogen 3.083 N/A ASN 26.A N ASN 203.A OD1 no hydrogen 3.040 N/A ASN 26.A ND2 ASP 202.A O no hydrogen 2.652 N/A LYS 27.A N ASN 24.A OD1 no hydrogen 3.181 N/A GLN 28.A NE2 GLU 25.A O no hydrogen 2.974 N/A GLN 29.A N ASN 24.A O no hydrogen 3.346 N/A PHE 31.A N LEU 22.A O no hydrogen 2.807 N/A THR 32.A N GLN 2.A O no hydrogen 3.047 N/A THR 32.A OG1 VAL 20.A O no hydrogen 2.854 N/A THR 32.A OG1 ASN 34.A O no hydrogen 3.493 N/A ASN 33.A ND2 ASN 8.A OD1 no hydrogen 2.958 N/A ASN 33.A ND2 GLY 18.A O no hydrogen 2.997 N/A ASN 34.A N THR 32.A OG1 no hydrogen 3.292 N/A LEU 35.A N GLU 3.A OE2 no hydrogen 2.714 N/A ARG 37.A N ASN 34.A OD1 no hydrogen 3.055 N/A ARG 37.A NE ASN 210.A OD1 no hydrogen 2.854 N/A ARG 37.A NH1 ASP 212.A OD1 no hydrogen 2.983 N/A ARG 37.A NH2 ASN 210.A OD1 no hydrogen 3.132 N/A ARG 37.A NH2 ASP 212.A OD1 no hydrogen 2.894 N/A ALA 38.A N ASN 34.A O no hydrogen 2.895 N/A ASN 39.A N LYS 36.A O no hydrogen 2.875 N/A ASN 39.A ND2 LEU 35.A O no hydrogen 3.033 N/A GLN 40.A N ARG 37.A O no hydrogen 3.048 N/A PHE 42.A N ILE 140.A O no hydrogen 2.988 N/A ALA 45.A N TRP 133.A O no hydrogen 3.143 N/A THR 47.A N PRO 44.A O no hydrogen 3.039 N/A THR 47.A OG1 PRO 44.A O no hydrogen 2.603 N/A PHE 48.A N ALA 45.A O no hydrogen 3.162 N/A ALA 49.A N SER 46.A O no hydrogen 3.047 N/A ILE 50.A N THR 47.A O no hydrogen 3.366 N/A ASN 52.A N PHE 48.A O no hydrogen 2.995 N/A ASN 52.A ND2 TYR 99.A O no hydrogen 3.123 N/A SER 53.A N ALA 49.A O no hydrogen 2.918 N/A SER 53.A OG ALA 49.A O no hydrogen 2.763 N/A LEU 54.A N ILE 50.A O no hydrogen 3.098 N/A ILE 55.A N PRO 51.A O no hydrogen 2.977 N/A ALA 56.A N ASN 52.A O no hydrogen 2.902 N/A LEU 57.A N SER 53.A O no hydrogen 2.906 N/A ASP 58.A N LEU 54.A O no hydrogen 2.932 N/A LEU 59.A N ILE 55.A O no hydrogen 2.931 N/A GLY 60.A N LEU 57.A O no hydrogen 3.189 N/A VAL 62.A N ALA 56.A O no hydrogen 3.184 N/A LYS 63.A N GLN 67.A OE1 no hydrogen 2.902 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.491 N/A HIS 66.A N ASP 64.A OD1 no hydrogen 2.792 N/A GLN 67.A N ASP 64.A O no hydrogen 3.416 N/A GLN 67.A N ASP 64.A OD1 no hydrogen 2.907 N/A PHE 69.A N HIS 85.A O no hydrogen 2.697 N/A LYS 70.A NZ ASP 84.A OD2 no hydrogen 2.856 N/A TRP 71.A N ASP 84.A OD1 no hydrogen 2.883 N/A TRP 71.A NE1 GLN 74.A O no hydrogen 2.693 N/A GLN 74.A N ASP 72.A OD1 no hydrogen 2.925 N/A ARG 76.A N ASN 82.A OD1 no hydrogen 2.638 N/A ARG 76.A NH1 ASP 72.A OD1 no hydrogen 3.052 N/A ARG 76.A NH1 ASP 72.A OD2 no hydrogen 3.293 N/A ARG 76.A NH2 ASP 72.A OD2 no hydrogen 2.896 N/A TRP 81.A N ILE 78.A O no hydrogen 3.049 N/A TRP 81.A NE1 TYR 93.A O no hydrogen 3.104 N/A ASN 82.A N ALA 79.A O no hydrogen 3.200 N/A ASN 82.A ND2 ARG 76.A O no hydrogen 2.795 N/A ARG 83.A N TRP 81.A O no hydrogen 2.883 N/A HIS 85.A N PHE 69.A O no hydrogen 3.249 N/A HIS 85.A ND1 THR 89.A OG1 no hydrogen 2.815 N/A HIS 85.A NE2 THR 80.A O no hydrogen 2.634 N/A ASN 86.A N THR 89.A OG1 no hydrogen 3.054 N/A THR 89.A N ASN 86.A OD1 no hydrogen 2.894 N/A THR 89.A OG1 HIS 85.A ND1 no hydrogen 2.815 N/A THR 89.A OG1 ASN 86.A O no hydrogen 3.390 N/A THR 89.A OG1 ASN 86.A OD1 no hydrogen 3.380 N/A ALA 90.A N ASN 86.A O no hydrogen 2.791 N/A MET 91.A N LEU 87.A O no hydrogen 3.223 N/A LYS 92.A N ILE 88.A O no hydrogen 2.996 N/A LYS 92.A NZ TYR 93.A OH no hydrogen 3.454 N/A TYR 93.A N THR 89.A O no hydrogen 2.913 N/A SER 94.A N MET 91.A O no hydrogen 3.404 N/A VAL 95.A N ALA 90.A O no hydrogen 3.034 N/A VAL 98.A N VAL 95.A O no hydrogen 3.172 N/A TYR 99.A N VAL 95.A O no hydrogen 3.489 N/A GLN 100.A N VAL 96.A O no hydrogen 2.855 N/A GLN 100.A NE2 ASP 130.A O no hydrogen 2.963 N/A GLU 101.A N PRO 97.A O no hydrogen 3.099 N/A PHE 102.A N VAL 98.A O no hydrogen 2.944 N/A ALA 103.A N TYR 99.A O no hydrogen 2.912 N/A ARG 104.A N GLN 100.A O no hydrogen 2.944 N/A ARG 104.A NH1 ASP 130.A OD2 no hydrogen 3.045 N/A ARG 104.A NH2 GLU 101.A OE1 no hydrogen 3.018 N/A GLN 105.A N GLU 101.A O no hydrogen 3.073 N/A GLN 105.A NE2 GLU 101.A OE2 no hydrogen 3.068 N/A ILE 106.A N PHE 102.A O no hydrogen 2.832 N/A GLY 107.A N ALA 103.A O no hydrogen 2.788 N/A ARG 110.A NE ILE 106.A O no hydrogen 3.008 N/A ARG 110.A NH2 GLN 105.A O no hydrogen 3.017 N/A ARG 110.A NH2 ILE 106.A O no hydrogen 3.565 N/A MET 111.A N GLY 107.A O no hydrogen 2.959 N/A SER 112.A N GLU 108.A O no hydrogen 2.898 N/A LYS 113.A N ALA 109.A O no hydrogen 3.170 N/A MET 114.A N ARG 110.A O no hydrogen 2.922 N/A LEU 115.A N MET 111.A O no hydrogen 3.001 N/A HIS 116.A N SER 112.A O no hydrogen 3.129 N/A HIS 116.A ND1 GLU 123.A OE1 no hydrogen 2.801 N/A ALA 117.A N LYS 113.A O no hydrogen 2.931 N/A PHE 118.A N MET 114.A O no hydrogen 2.794 N/A ASP 119.A N HIS 116.A O no hydrogen 2.924 N/A TYR 120.A N LEU 115.A O no hydrogen 2.970 N/A ASN 122.A N ARG 139.A O no hydrogen 2.970 N/A ASN 122.A ND2 GLY 137.A O no hydrogen 2.791 N/A GLU 123.A N TYR 120.A O no hydrogen 2.977 N/A ASP 124.A N ASN 122.A OD1 no hydrogen 3.193 N/A SER 126.A N ASP 124.A OD1 no hydrogen 2.930 N/A ASN 128.A ND2 SER 131.A OG no hydrogen 3.011 N/A SER 131.A N ASN 128.A O no hydrogen 3.155 N/A SER 131.A OG ASP 135.A OD1 no hydrogen 2.664 N/A SER 131.A OG ASP 135.A OD2 no hydrogen 3.349 N/A LEU 134.A N SER 131.A O no hydrogen 2.847 N/A ASP 135.A N SER 131.A O no hydrogen 2.895 N/A GLY 136.A N PHE 132.A O no hydrogen 2.845 N/A GLY 137.A N SER 126.A O no hydrogen 3.090 N/A ARG 139.A N ASN 122.A OD1 no hydrogen 2.993 N/A ARG 139.A NH1 GLY 136.A O no hydrogen 2.715 N/A ARG 139.A NH1 ILE 138.A O no hydrogen 2.967 N/A ILE 140.A N PHE 42.A O no hydrogen 2.840 N/A SER 141.A N GLU 144.A OE1 no hydrogen 3.006 N/A SER 141.A OG THR 143.A OG1 no hydrogen 3.150 N/A THR 143.A N ALA 38.A O no hydrogen 3.101 N/A THR 143.A OG1 ASN 39.A OD1 no hydrogen 2.760 N/A THR 143.A OG1 SER 141.A OG no hydrogen 3.150 N/A GLU 144.A N SER 141.A OG no hydrogen 3.144 N/A GLN 145.A N SER 141.A O no hydrogen 2.792 N/A GLN 145.A NE2 THR 47.A OG1 no hydrogen 3.085 N/A ILE 146.A N ALA 142.A O no hydrogen 3.083 N/A SER 147.A N THR 143.A O no hydrogen 2.988 N/A PHE 148.A N GLU 144.A O no hydrogen 3.056 N/A LEU 149.A N GLN 145.A O no hydrogen 2.841 N/A ARG 150.A N ILE 146.A O no hydrogen 2.858 N/A ARG 150.A NE GLU 25.A OE1 no hydrogen 2.748 N/A ARG 150.A NH2 GLU 25.A OE1 no hydrogen 3.445 N/A ARG 150.A NH2 GLU 25.A OE2 no hydrogen 2.952 N/A LYS 151.A N SER 147.A O no hydrogen 3.415 N/A LYS 151.A NZ SER 147.A O no hydrogen 3.200 N/A LYS 151.A NZ SER 147.A OG no hydrogen 3.091 N/A LEU 152.A N PHE 148.A O no hydrogen 3.101 N/A TYR 153.A N LEU 149.A O no hydrogen 2.808 N/A HIS 154.A N ARG 150.A O no hydrogen 3.151 N/A HIS 154.A NE2 GLU 25.A OE2 no hydrogen 2.810 N/A ASN 155.A N LEU 152.A O no hydrogen 3.107 N/A LYS 156.A N LYS 151.A O no hydrogen 2.814 N/A LEU 157.A N GLN 164.A OE1 no hydrogen 3.038 N/A VAL 159.A N LEU 157.A O no hydrogen 2.766 N/A SER 160.A N ASP 58.A OD1 no hydrogen 2.679 N/A SER 160.A OG ASP 58.A OD1 no hydrogen 2.901 N/A SER 160.A OG SER 163.A OG no hydrogen 2.848 N/A ARG 162.A NH1 LYS 63.A O no hydrogen 3.390 N/A ARG 162.A NH2 LYS 63.A O no hydrogen 2.685 N/A SER 163.A N SER 160.A OG no hydrogen 2.926 N/A SER 163.A OG ASP 58.A OD1 no hydrogen 3.063 N/A SER 163.A OG SER 160.A OG no hydrogen 2.848 N/A GLN 164.A N SER 160.A O no hydrogen 3.283 N/A GLN 164.A NE2 ASN 155.A O no hydrogen 3.313 N/A GLN 164.A NE2 VAL 159.A O no hydrogen 3.140 N/A GLN 164.A NE2 SER 160.A O no hydrogen 3.340 N/A ARG 165.A N GLU 161.A O no hydrogen 2.942 N/A ARG 165.A NE GLU 161.A OE2 no hydrogen 2.816 N/A ARG 165.A NH2 GLU 161.A OE2 no hydrogen 3.237 N/A ILE 166.A N ARG 162.A O no hydrogen 2.978 N/A VAL 167.A N SER 163.A O no hydrogen 3.088 N/A LYS 168.A N GLN 164.A O no hydrogen 2.976 N/A LYS 168.A NZ LEU 152.A O no hydrogen 3.053 N/A LYS 168.A NZ TYR 153.A O no hydrogen 2.998 N/A LYS 168.A NZ ASN 155.A OD1 no hydrogen 2.758 N/A GLN 169.A N ARG 165.A O no hydrogen 2.966 N/A ALA 170.A N ILE 166.A O no hydrogen 2.964 N/A MET 171.A N VAL 167.A O no hydrogen 2.871 N/A MET 171.A N LYS 168.A O no hydrogen 3.261 N/A LEU 172.A N GLN 169.A O no hydrogen 3.016 N/A THR 173.A N ILE 181.A O no hydrogen 2.881 N/A THR 173.A OG1 MET 171.A O no hydrogen 2.973 N/A GLU 174.A N ILE 181.A O no hydrogen 3.223 N/A ASN 176.A N TYR 179.A O no hydrogen 3.032 N/A ASP 178.A N ASN 176.A OD1 no hydrogen 2.829 N/A TYR 179.A N ASN 176.A OD1 no hydrogen 3.006 N/A TYR 179.A OH GLU 174.A OE2 no hydrogen 3.067 N/A ILE 180.A N GLU 199.A O no hydrogen 3.037 N/A ILE 181.A N GLU 174.A O no hydrogen 2.765 N/A ARG 182.A N TRP 197.A O no hydrogen 3.206 N/A ARG 182.A NE GLU 199.A OE2 no hydrogen 2.921 N/A ARG 182.A NH1 LYS 168.A O no hydrogen 2.965 N/A ALA 183.A N MET 171.A O no hydrogen 2.925 N/A LYS 184.A N VAL 195.A O no hydrogen 2.843 N/A LYS 184.A NZ SER 94.A OG no hydrogen 2.798 N/A LYS 184.A NZ THR 185.A O no hydrogen 2.883 N/A GLY 186.A N TRP 193.A O no hydrogen 3.072 N/A ASP 188.A N ILE 191.A O no hydrogen 3.239 N/A THR 189.A OG1 ASP 188.A O no hydrogen 2.390 N/A LYS 190.A N ASP 188.A OD1 no hydrogen 2.912 N/A ILE 191.A N ASP 188.A OD1 no hydrogen 2.697 N/A GLY 192.A N MET 211.A O no hydrogen 2.923 N/A TRP 193.A N GLY 186.A O no hydrogen 2.687 N/A TRP 193.A NE1 LEU 43.A O no hydrogen 2.812 N/A TRP 194.A N MET 209.A O no hydrogen 2.974 N/A VAL 195.A N LYS 184.A O no hydrogen 3.139 N/A GLY 196.A N PHE 207.A O no hydrogen 2.902 N/A TRP 197.A N ARG 182.A O no hydrogen 2.898 N/A TRP 197.A NE1 GLU 199.A OE2 no hydrogen 2.863 N/A VAL 198.A N TRP 205.A O no hydrogen 2.725 N/A GLU 199.A N ILE 180.A O no hydrogen 2.726 N/A LEU 200.A N ASN 203.A O no hydrogen 2.825 N/A ASN 203.A ND2 ASN 24.A OD1 no hydrogen 2.788 N/A VAL 204.A N ASN 203.A OD1 no hydrogen 2.803 N/A TRP 205.A N VAL 198.A O no hydrogen 2.923 N/A PHE 206.A N TRP 23.A O no hydrogen 2.964 N/A PHE 207.A N GLY 196.A O no hydrogen 2.850 N/A ALA 208.A N VAL 21.A O no hydrogen 2.991 N/A MET 209.A N TRP 194.A O no hydrogen 2.829 N/A ASN 210.A N VAL 19.A O no hydrogen 3.035 N/A MET 211.A N GLY 192.A O no hydrogen 3.062 N/A ASP 212.A N GLN 17.A O no hydrogen 2.875 N/A MET 213.A N LYS 190.A O no hydrogen 2.781 N/A LEU 219.A N SER 216.A O no hydrogen 3.105 N/A LEU 221.A N GLY 218.A O no hydrogen 2.774 N/A ARG 222.A N LEU 219.A O no hydrogen 3.228 N/A ARG 222.A NE LEU 219.A O no hydrogen 2.847 N/A ARG 222.A NH1 GLY 186.A O no hydrogen 2.901 N/A GLN 223.A N GLN 223.A OE1 no hydrogen 2.778 N/A ALA 224.A N GLY 220.A O no hydrogen 3.060 N/A ILE 225.A N LEU 221.A O no hydrogen 2.807 N/A THR 226.A N ARG 222.A O no hydrogen 3.385 N/A THR 226.A OG1 ARG 222.A O no hydrogen 2.667 N/A LYS 227.A N GLN 223.A O no hydrogen 2.840 N/A LYS 227.A NZ GLU 174.A OE1 no hydrogen 2.658 N/A LYS 227.A NZ GLU 174.A OE2 no hydrogen 3.110 N/A GLU 228.A N ALA 224.A O no hydrogen 2.854 N/A VAL 229.A N ILE 225.A O no hydrogen 2.963 N/A LEU 230.A N THR 226.A O no hydrogen 2.861 N/A LYS 231.A N LYS 227.A O no hydrogen 2.902 N/A LYS 231.A NZ PRO 237.A O no hydrogen 2.473 N/A GLN 232.A N GLU 228.A O no hydrogen 3.087 N/A GLU 233.A N VAL 229.A O no hydrogen 3.014 N/A LYS 234.A N LYS 231.A O no hydrogen 3.001 N/A ILE 235.A N LEU 230.A O no hydrogen 2.867 N/A