Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wkn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 LEU 230.A OXT no hydrogen 3.142 N/A ILE 4.A N GLU 44.A O no hydrogen 2.906 N/A GLY 5.A N LYS 72.A O no hydrogen 2.915 N/A ILE 6.A N ILE 46.A O no hydrogen 2.767 N/A LEU 7.A N LEU 74.A O no hydrogen 3.014 N/A GLY 8.A N ALA 48.A O no hydrogen 3.042 N/A ALA 9.A N GLU 13.A OE1 no hydrogen 2.821 N/A MET 10.A N GLU 13.A OE1 no hydrogen 2.882 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.773 N/A GLU 13.A N MET 10.A O no hydrogen 2.833 N/A ILE 14.A N ARG 11.A O no hydrogen 3.038 N/A THR 15.A N ARG 11.A O no hydrogen 2.918 N/A THR 15.A OG1 ARG 11.A O no hydrogen 3.016 N/A LEU 18.A N ILE 14.A O no hydrogen 2.947 N/A GLU 19.A N THR 15.A O no hydrogen 3.059 N/A LEU 20.A N PRO 16.A O no hydrogen 2.780 N/A PHE 21.A N ILE 17.A O no hydrogen 3.028 N/A GLY 22.A N LEU 18.A O no hydrogen 3.239 N/A GLU 26.A N LYS 37.A O no hydrogen 2.839 N/A ILE 28.A N PHE 35.A O no hydrogen 2.803 N/A LEU 30.A N ASN 33.A O no hydrogen 2.890 N/A ASN 33.A N LEU 30.A O no hydrogen 2.947 N/A ASN 33.A ND2 TYR 49.A O no hydrogen 3.290 N/A ASN 33.A ND2 SER 50.A O no hydrogen 3.093 N/A PHE 35.A N ILE 28.A O no hydrogen 2.814 N/A HIS 36.A N VAL 47.A O no hydrogen 2.744 N/A LYS 37.A N GLU 26.A O no hydrogen 2.803 N/A GLY 38.A N ILE 45.A O no hydrogen 2.892 N/A TYR 40.A N LYS 43.A O no hydrogen 2.861 N/A TYR 40.A OH ASP 228.A OD1 no hydrogen 2.472 N/A LYS 43.A N TYR 40.A O no hydrogen 2.991 N/A LYS 43.A NZ HIS 41.A O no hydrogen 2.975 N/A GLU 44.A N GLN 2.A O no hydrogen 2.859 N/A ILE 45.A N GLY 38.A O no hydrogen 2.793 N/A ILE 46.A N ILE 4.A O no hydrogen 2.880 N/A VAL 47.A N HIS 36.A O no hydrogen 2.801 N/A ALA 48.A N ILE 6.A O no hydrogen 2.981 N/A SER 50.A N GLY 8.A O no hydrogen 2.878 N/A SER 50.A OG GLY 8.A O no hydrogen 3.530 N/A SER 50.A OG LYS 51.A O no hydrogen 2.643 N/A LYS 51.A N ALA 9.A O no hydrogen 2.778 N/A LYS 51.A NZ GLY 32.A O no hydrogen 3.092 N/A GLY 53.A N GLU 175.A OE2 no hydrogen 2.909 N/A LYS 54.A N ASP 151.A OD1 no hydrogen 2.758 N/A LYS 54.A NZ GLN 99.A OE1 no hydrogen 2.871 N/A LYS 54.A NZ ASP 101.A OD1 no hydrogen 2.773 N/A HIS 56.A ND1 ILE 52.A O no hydrogen 2.759 N/A SER 57.A N GLY 53.A O no hydrogen 3.078 N/A SER 57.A OG GLY 53.A O no hydrogen 2.767 N/A SER 57.A OG LYS 54.A O no hydrogen 3.321 N/A SER 57.A OG SER 178.A OG no hydrogen 2.636 N/A THR 58.A N LYS 54.A O no hydrogen 2.941 N/A THR 58.A OG1 LYS 54.A O no hydrogen 2.710 N/A LEU 59.A N VAL 55.A O no hydrogen 2.961 N/A THR 60.A N HIS 56.A O no hydrogen 2.978 N/A THR 60.A OG1 ASN 33.A OD1 no hydrogen 2.780 N/A THR 60.A OG1 HIS 56.A O no hydrogen 2.992 N/A THR 61.A N SER 57.A O no hydrogen 3.038 N/A THR 61.A OG1 SER 57.A O no hydrogen 2.668 N/A THR 62.A N THR 58.A O no hydrogen 3.019 N/A THR 62.A OG1 THR 58.A O no hydrogen 2.759 N/A SER 63.A N LEU 59.A O no hydrogen 2.921 N/A SER 63.A OG LEU 59.A O no hydrogen 3.315 N/A MET 64.A N THR 60.A O no hydrogen 2.938 N/A ILE 65.A N THR 61.A O no hydrogen 3.076 N/A LEU 66.A N THR 62.A O no hydrogen 2.836 N/A ALA 67.A N SER 63.A O no hydrogen 2.787 N/A PHE 68.A N SER 63.A O no hydrogen 3.399 N/A PHE 68.A N MET 64.A O no hydrogen 3.196 N/A GLY 69.A N ILE 65.A O no hydrogen 3.046 N/A VAL 70.A N MET 64.A O no hydrogen 3.430 N/A GLN 71.A N LYS 3.A O no hydrogen 2.842 N/A GLN 71.A NE2 VAL 1.A O no hydrogen 3.591 N/A VAL 73.A N PRO 189.A O no hydrogen 2.887 N/A LEU 74.A N GLY 5.A O no hydrogen 2.911 N/A PHE 75.A N CYS 191.A O no hydrogen 2.794 N/A SER 76.A N LEU 7.A O no hydrogen 2.794 N/A SER 76.A OG SER 219.A OG no hydrogen 2.812 N/A GLY 77.A N LEU 193.A O no hydrogen 3.304 N/A VAL 78.A N GLU 13.A OE2 no hydrogen 2.910 N/A ALA 79.A N SER 195.A O no hydrogen 3.056 N/A GLY 80.A N VAL 172.A O no hydrogen 2.828 N/A SER 81.A N ASP 198.A O no hydrogen 2.846 N/A SER 81.A OG LEU 86.A O no hydrogen 2.628 N/A LEU 82.A N SER 170.A O no hydrogen 2.852 N/A VAL 83.A N SER 81.A OG no hydrogen 3.294 N/A LEU 86.A N VAL 83.A O no hydrogen 3.193 N/A LYS 87.A N ASP 90.A OD2 no hydrogen 2.880 N/A LYS 87.A NZ LYS 84.A O no hydrogen 2.831 N/A ASN 89.A N ILE 196.A O no hydrogen 2.821 N/A ASP 90.A N LYS 87.A O no hydrogen 2.920 N/A LEU 92.A N ARG 194.A O no hydrogen 2.984 N/A VAL 93.A N LYS 143.A O no hydrogen 2.917 N/A ALA 94.A N VAL 192.A O no hydrogen 3.013 N/A THR 95.A N GLY 145.A O no hydrogen 2.890 N/A LEU 97.A N ILE 121.A O no hydrogen 2.828 N/A VAL 98.A N ILE 147.A O no hydrogen 3.129 N/A HIS 100.A N SER 149.A O no hydrogen 2.883 N/A VAL 102.A N GLN 99.A O no hydrogen 3.305 N/A SER 105.A N ASP 103.A OD1 no hydrogen 2.933 N/A SER 105.A OG ASP 103.A OD1 no hydrogen 2.622 N/A PHE 107.A N LEU 104.A O no hydrogen 3.066 N/A ASP 108.A N SER 105.A O no hydrogen 2.840 N/A GLY 112.A N VAL 102.A O no hydrogen 2.948 N/A PHE 113.A N PRO 110.A O no hydrogen 3.092 N/A SER 117.A N ILE 114.A O no hydrogen 2.901 N/A ILE 121.A N LEU 97.A O no hydrogen 2.805 N/A THR 123.A N THR 95.A O no hydrogen 3.477 N/A THR 123.A OG1 ALA 94.A O no hydrogen 2.615 N/A THR 123.A OG1 THR 95.A O no hydrogen 3.312 N/A SER 124.A N CYS 190.A O no hydrogen 2.890 N/A LEU 127.A N SER 124.A OG no hydrogen 2.924 N/A ASN 128.A N SER 124.A O no hydrogen 2.947 N/A ASN 128.A ND2 ALA 94.A O no hydrogen 3.498 N/A ASN 128.A ND2 THR 123.A OG1 no hydrogen 2.931 N/A ALA 129.A N GLY 125.A O no hydrogen 2.876 N/A LEU 130.A N SER 126.A O no hydrogen 3.002 N/A ALA 131.A N LEU 127.A O no hydrogen 2.966 N/A LYS 132.A N ASN 128.A O no hydrogen 2.978 N/A LYS 132.A NZ LEU 142.A O no hydrogen 2.926 N/A LYS 133.A N ALA 129.A O no hydrogen 2.963 N/A ILE 134.A N LEU 130.A O no hydrogen 2.964 N/A ALA 135.A N ALA 131.A O no hydrogen 2.827 N/A ASN 136.A N LYS 132.A O no hydrogen 3.003 N/A GLU 137.A N LYS 133.A O no hydrogen 3.027 N/A GLN 138.A N ILE 134.A O no hydrogen 2.847 N/A HIS 139.A N ASN 136.A O no hydrogen 3.126 N/A ILE 140.A N.A ALA 135.A O no hydrogen 2.871 N/A ILE 140.A N.B ALA 135.A O no hydrogen 2.930 N/A LYS 143.A N LEU 91.A O no hydrogen 3.138 N/A LYS 143.A NZ ASP 85.A O no hydrogen 3.241 N/A LYS 143.A NZ ASP 85.A OD2 no hydrogen 2.599 N/A GLY 145.A N VAL 93.A O no hydrogen 3.172 N/A ILE 147.A N GLN 96.A O no hydrogen 2.954 N/A ALA 148.A N ALA 171.A O no hydrogen 2.899 N/A SER 149.A N VAL 98.A O no hydrogen 2.818 N/A SER 149.A OG GLU 173.A OE1 no hydrogen 2.662 N/A GLY 150.A N GLU 173.A O no hydrogen 3.210 N/A ASP 151.A N ASP 101.A OD2 no hydrogen 2.890 N/A GLN 152.A NE2 ASP 101.A OD2 no hydrogen 2.922 N/A SER 156.A N ALA 200.A O no hydrogen 3.163 N/A ARG 159.A N SER 156.A OG no hydrogen 3.315 N/A ARG 159.A NH2 HIS 100.A ND1 no hydrogen 3.123 N/A LYS 160.A N SER 156.A O no hydrogen 3.081 N/A LYS 160.A NZ ASN 199.A O no hydrogen 2.717 N/A GLU 161.A N LYS 157.A O no hydrogen 2.943 N/A PHE 162.A N GLU 158.A O no hydrogen 3.211 N/A LEU 163.A N ARG 159.A O no hydrogen 3.023 N/A VAL 164.A N LYS 160.A O no hydrogen 3.014 N/A SER 165.A N GLU 161.A O no hydrogen 2.907 N/A SER 165.A OG GLU 161.A O no hydrogen 3.382 N/A SER 165.A OG PHE 162.A O no hydrogen 3.521 N/A GLU 166.A N PHE 162.A O no hydrogen 2.823 N/A PHE 167.A N LEU 163.A O no hydrogen 3.137 N/A LYS 168.A N VAL 164.A O no hydrogen 2.930 N/A ALA 169.A N LEU 163.A O no hydrogen 3.434 N/A SER 170.A N VAL 146.A O no hydrogen 2.772 N/A VAL 172.A N GLY 80.A O no hydrogen 2.768 N/A GLU 173.A N ALA 148.A O no hydrogen 2.952 N/A MET 174.A N GLU 175.A OE1 no hydrogen 3.271 N/A GLU 175.A N GLU 173.A OE1 no hydrogen 3.128 N/A GLY 176.A N GLU 173.A OE1 no hydrogen 2.865 N/A ALA 177.A N SER 149.A OG no hydrogen 2.966 N/A SER 178.A OG SER 57.A OG no hydrogen 2.636 N/A SER 178.A OG GLU 175.A O no hydrogen 2.843 N/A VAL 179.A N GLU 175.A O no hydrogen 3.012 N/A ALA 180.A N GLY 176.A O no hydrogen 2.903 N/A PHE 181.A N ALA 177.A O no hydrogen 2.825 N/A VAL 182.A N SER 178.A O no hydrogen 3.116 N/A CYS 183.A N VAL 179.A O no hydrogen 3.076 N/A CYS 183.A SG VAL 179.A O no hydrogen 3.441 N/A GLN 184.A N ALA 180.A O no hydrogen 2.948 N/A LYS 185.A N PHE 181.A O no hydrogen 3.054 N/A PHE 186.A N VAL 182.A O no hydrogen 3.168 N/A PHE 186.A N CYS 183.A O no hydrogen 3.130 N/A GLY 187.A N GLN 184.A O no hydrogen 3.167 N/A VAL 188.A N CYS 183.A O no hydrogen 2.893 N/A CYS 190.A SG VAL 73.A O no hydrogen 3.993 N/A CYS 191.A N VAL 73.A O no hydrogen 2.967 N/A CYS 191.A SG ASN 128.A OD1 no hydrogen 3.624 N/A LEU 193.A N PHE 75.A O no hydrogen 2.935 N/A ARG 194.A N LEU 92.A O no hydrogen 3.022 N/A ARG 194.A NE GLU 173.A OE2 no hydrogen 3.011 N/A ARG 194.A NH1 GLU 175.A OE1 no hydrogen 2.980 N/A SER 195.A N GLY 77.A O no hydrogen 2.877 N/A SER 195.A OG ASN 89.A O no hydrogen 2.929 N/A ILE 196.A N ASP 90.A O no hydrogen 2.942 N/A SER 197.A N ALA 79.A O no hydrogen 2.855 N/A SER 197.A OG ALA 79.A O no hydrogen 3.369 N/A SER 197.A OG ASP 198.A OD1 no hydrogen 2.705 N/A ALA 200.A N ASP 198.A OD2 no hydrogen 2.933 N/A LYS 203.A N ASP 201.A OD1 no hydrogen 3.020 N/A ALA 204.A N ASP 201.A O no hydrogen 2.930 N/A SER 207.A N LYS 203.A O no hydrogen 3.037 N/A SER 207.A OG SER 197.A O no hydrogen 2.699 N/A PHE 208.A N ALA 204.A O no hydrogen 2.786 N/A ASP 209.A N GLY 205.A O no hydrogen 3.042 N/A GLU 210.A N MET 206.A O no hydrogen 3.119 N/A PHE 211.A N SER 207.A O no hydrogen 2.859 N/A LEU 212.A N PHE 208.A O no hydrogen 2.834 N/A SER 215.A N PHE 211.A O no hydrogen 2.811 N/A SER 215.A OG ILE 196.A O no hydrogen 2.779 N/A SER 215.A OG PHE 211.A O no hydrogen 3.249 N/A ALA 216.A N LEU 212.A O no hydrogen 2.848 N/A HIS 217.A N GLU 213.A O.A no hydrogen 3.073 N/A HIS 217.A N GLU 213.A O.B no hydrogen 3.003 N/A THR 218.A N LYS 214.A O no hydrogen 2.920 N/A THR 218.A OG1 ASN 89.A OD1 no hydrogen 2.580 N/A THR 218.A OG1 LYS 214.A O no hydrogen 3.079 N/A SER 219.A N SER 215.A O no hydrogen 3.024 N/A SER 219.A OG SER 76.A OG no hydrogen 2.812 N/A SER 219.A OG GLY 77.A O no hydrogen 3.483 N/A ALA 220.A N ALA 216.A O no hydrogen 2.862 N/A LYS 221.A N HIS 217.A O no hydrogen 2.835 N/A PHE 222.A N THR 218.A O no hydrogen 3.252 N/A LEU 223.A N SER 219.A O no hydrogen 2.909 N/A LYS 224.A N ALA 220.A O no hydrogen 2.975 N/A LYS 224.A NZ ASP 228.A OD2 no hydrogen 3.446 N/A SER 225.A N LYS 221.A O no hydrogen 3.085 N/A SER 225.A OG PHE 222.A O no hydrogen 2.597 N/A MET 226.A N PHE 222.A O no hydrogen 3.025 N/A VAL 227.A N LEU 223.A O no hydrogen 2.942 N/A ASP 228.A N LYS 224.A O no hydrogen 2.829 N/A GLU 229.A N MET 226.A O no hydrogen 2.877 N/A LEU 230.A N VAL 227.A O no hydrogen 3.149 N/A