Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1d3u_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 3.A O no hydrogen 3.481 N/A ALA 6.A N ASP 4.A OD2 no hydrogen 3.135 N/A ARG 8.A N ASP 4.A O no hydrogen 3.405 N/A ARG 8.A NH1 SER 3.A OG no hydrogen 3.384 N/A ASN 9.A N ALA 5.A O no hydrogen 3.087 N/A LEU 10.A N ALA 6.A O no hydrogen 2.816 N/A ALA 11.A N GLU 7.A O no hydrogen 2.944 N/A PHE 12.A N ARG 8.A O no hydrogen 3.006 N/A ALA 13.A N ASN 9.A O no hydrogen 2.965 N/A LEU 14.A N LEU 10.A O no hydrogen 2.772 N/A SER 15.A N ALA 11.A O no hydrogen 2.998 N/A SER 15.A OG ALA 11.A O no hydrogen 2.972 N/A GLU 16.A N PHE 12.A O no hydrogen 3.030 N/A LEU 17.A N ALA 13.A O no hydrogen 2.895 N/A ASP 18.A N LEU 14.A O no hydrogen 2.815 N/A ARG 19.A N SER 15.A O no hydrogen 2.867 N/A ARG 19.A NE GLU 16.A OE2 no hydrogen 2.951 N/A ARG 19.A NH1 ILE 79.A O no hydrogen 2.975 N/A ARG 19.A NH2 GLU 16.A OE1 no hydrogen 2.609 N/A ARG 19.A NH2 GLU 16.A OE2 no hydrogen 3.388 N/A ARG 19.A NH2 ILE 79.A O no hydrogen 2.839 N/A ILE 20.A N GLU 16.A O no hydrogen 3.019 N/A THR 21.A N LEU 17.A O no hydrogen 2.977 N/A THR 21.A OG1 LEU 17.A O no hydrogen 3.295 N/A THR 21.A OG1 ASP 18.A O no hydrogen 3.289 N/A ALA 22.A N ASP 18.A O no hydrogen 3.095 N/A GLN 23.A N ARG 19.A O no hydrogen 3.087 N/A LEU 24.A N ILE 20.A O no hydrogen 2.789 N/A LYS 25.A N ALA 22.A O no hydrogen 3.043 N/A LEU 26.A N THR 21.A O no hydrogen 3.002 N/A VAL 30.A N PRO 27.A O no hydrogen 2.965 N/A GLU 31.A N PRO 27.A O no hydrogen 3.189 N/A GLU 32.A N ARG 28.A O no hydrogen 2.844 N/A GLU 33.A N HIS 29.A O no hydrogen 3.124 N/A ALA 34.A N VAL 30.A O no hydrogen 2.837 N/A ALA 35.A N GLU 31.A O no hydrogen 2.970 N/A ARG 36.A N GLU 32.A O no hydrogen 2.950 N/A ARG 36.A NE GLU 33.A OE1 no hydrogen 3.361 N/A ARG 36.A NE GLU 33.A OE2 no hydrogen 3.209 N/A ARG 36.A NH2 GLU 33.A OE2 no hydrogen 2.560 N/A LEU 37.A N GLU 33.A O no hydrogen 2.969 N/A TYR 38.A N ALA 34.A O no hydrogen 2.962 N/A ARG 39.A N ALA 35.A O no hydrogen 2.976 N/A GLU 40.A N ARG 36.A O no hydrogen 3.110 N/A ALA 41.A N LEU 37.A O no hydrogen 2.860 N/A VAL 42.A N TYR 38.A O no hydrogen 2.979 N/A ARG 43.A N ARG 39.A O no hydrogen 2.984 N/A ARG 43.A NE GLU 40.A OE1 no hydrogen 2.667 N/A ARG 43.A NH2 GLU 40.A OE2 no hydrogen 3.207 N/A LYS 44.A N GLU 40.A O no hydrogen 3.032 N/A LYS 44.A NZ ASN 97.A O no hydrogen 3.309 N/A GLY 45.A N VAL 42.A O no hydrogen 2.892 N/A LEU 46.A N ALA 41.A O no hydrogen 2.715 N/A ARG 48.A NH1 GLY 45.A O no hydrogen 3.292 N/A ARG 50.A N ILE 47.A O no hydrogen 2.890 N/A ARG 50.A NE LEU 46.A O no hydrogen 3.290 N/A GLU 53.A N GLU 53.A OE1 no hydrogen 2.698 N/A SER 54.A N SER 51.A OG no hydrogen 3.171 N/A SER 54.A OG GLU 86.A OE2 no hydrogen 2.846 N/A SER 54.A OG SER 90.A OG no hydrogen 2.874 N/A VAL 55.A N SER 51.A O no hydrogen 2.928 N/A MET 56.A N ILE 52.A O no hydrogen 2.883 N/A ALA 57.A N GLU 53.A O no hydrogen 3.053 N/A ALA 58.A N SER 54.A O no hydrogen 3.115 N/A CYS 59.A N VAL 55.A O no hydrogen 2.832 N/A CYS 59.A SG VAL 55.A O no hydrogen 3.270 N/A VAL 60.A N MET 56.A O no hydrogen 3.022 N/A TYR 61.A N ALA 57.A O no hydrogen 3.160 N/A ALA 62.A N ALA 58.A O no hydrogen 2.749 N/A ALA 63.A N CYS 59.A O no hydrogen 2.835 N/A CYS 64.A N VAL 60.A O no hydrogen 2.990 N/A CYS 64.A SG VAL 60.A O no hydrogen 3.281 N/A ARG 65.A N TYR 61.A O no hydrogen 2.963 N/A ARG 65.A NE LEU 105.A O no hydrogen 2.812 N/A ARG 65.A NH1 TYR 61.A OH no hydrogen 2.927 N/A ARG 65.A NH2 LEU 105.A O no hydrogen 3.386 N/A LEU 66.A N ALA 62.A O no hydrogen 2.897 N/A LEU 67.A N ALA 63.A O no hydrogen 2.942 N/A LYS 68.A NZ ARG 65.A O no hydrogen 3.092 N/A LYS 68.A NZ LYS 104.A O no hydrogen 2.768 N/A LYS 68.A NZ PHE 106.A O no hydrogen 2.804 N/A VAL 69.A N CYS 64.A O no hydrogen 2.827 N/A ARG 71.A N VAL 69.A O no hydrogen 2.763 N/A ARG 71.A NH2 LEU 24.A O no hydrogen 2.898 N/A ARG 71.A NH2 LYS 25.A O no hydrogen 3.315 N/A THR 72.A N GLU 75.A OE1 no hydrogen 3.018 N/A GLU 75.A N THR 72.A O no hydrogen 3.166 N/A GLU 75.A N THR 72.A OG1 no hydrogen 3.339 N/A ALA 77.A N LEU 73.A O no hydrogen 2.885 N/A ASP 78.A N ASP 74.A O no hydrogen 2.751 N/A ILE 79.A N ILE 76.A O no hydrogen 3.090 N/A ALA 80.A N ILE 76.A O no hydrogen 2.823 N/A LYS 84.A NZ ASP 74.A OD1 no hydrogen 3.246 N/A GLU 86.A N ASP 83.A OD2 no hydrogen 3.145 N/A ILE 87.A N ASP 83.A O no hydrogen 2.891 N/A GLY 88.A N LYS 84.A O no hydrogen 2.760 N/A ARG 89.A N LYS 85.A O no hydrogen 3.005 N/A SER 90.A N GLU 86.A O no hydrogen 3.073 N/A SER 90.A OG SER 54.A OG no hydrogen 2.874 N/A SER 90.A OG GLU 86.A OE2 no hydrogen 3.178 N/A TYR 91.A N ILE 87.A O no hydrogen 2.765 N/A ARG 92.A N GLY 88.A O no hydrogen 2.970 N/A PHE 93.A N ARG 89.A O no hydrogen 2.886 N/A ILE 94.A N SER 90.A O no hydrogen 2.855 N/A ALA 95.A N TYR 91.A O no hydrogen 2.922 N/A ARG 96.A N ARG 92.A O no hydrogen 2.959 N/A ASN 97.A N PHE 93.A O no hydrogen 3.210 N/A ASN 97.A ND2 PHE 93.A O no hydrogen 2.814 N/A LEU 98.A N ILE 94.A O no hydrogen 2.853 N/A LEU 98.A N ALA 95.A O no hydrogen 3.261 N/A ASN 99.A N ARG 96.A O no hydrogen 3.349 N/A LEU 100.A N ALA 95.A O no hydrogen 2.887 N/A LYS 104.A N THR 101.A OG1 no hydrogen 3.269 N/A LYS 104.A NZ ASN 99.A O no hydrogen 3.251 N/A LEU 105.A N THR 101.A O no hydrogen 3.043 N/A PHE 106.A N LYS 103.A O no hydrogen 3.454 N/A ASP 111.A N LYS 108.A O no hydrogen 3.168 N/A VAL 113.A N PRO 109.A O no hydrogen 2.846 N/A ASN 114.A N THR 110.A O no hydrogen 3.024 N/A LYS 115.A N ASP 111.A O no hydrogen 3.083 N/A LYS 115.A NZ PRO 70.A O no hydrogen 2.976 N/A LYS 115.A NZ GLU 75.A OE1 no hydrogen 3.042 N/A PHE 116.A N TYR 112.A O no hydrogen 2.769 N/A ALA 117.A N VAL 113.A O no hydrogen 2.837 N/A ASP 118.A N ASN 114.A O no hydrogen 2.924 N/A ASP 118.A N LYS 115.A O no hydrogen 3.105 N/A GLU 119.A N LYS 115.A O no hydrogen 3.263 N/A LEU 120.A N PHE 116.A O no hydrogen 2.938 N/A LEU 120.A N ALA 117.A O no hydrogen 3.211 N/A GLY 121.A N ASP 118.A O no hydrogen 3.032 N/A LEU 122.A N ALA 117.A O no hydrogen 2.963 N/A SER 123.A N GLU 165.A OE1 no hydrogen 3.295 N/A SER 123.A OG GLU 165.A OE2 no hydrogen 2.496 N/A LYS 125.A N SER 123.A OG no hydrogen 3.012 N/A ARG 127.A N SER 123.A O no hydrogen 3.187 N/A ARG 127.A NE LEU 122.A O no hydrogen 3.361 N/A ARG 127.A NH1 ASP 118.A OD1 no hydrogen 3.117 N/A ARG 127.A NH2 ASP 118.A OD1 no hydrogen 2.567 N/A ARG 127.A NH2 LEU 122.A O no hydrogen 3.445 N/A ARG 128.A N GLU 124.A O no hydrogen 3.212 N/A ARG 129.A N LYS 125.A O no hydrogen 3.127 N/A ALA 130.A N VAL 126.A O no hydrogen 2.873 N/A ILE 131.A N ARG 127.A O no hydrogen 2.814 N/A GLU 132.A N ARG 128.A O no hydrogen 2.964 N/A ILE 133.A N ARG 129.A O no hydrogen 2.922 N/A LEU 134.A N ALA 130.A O no hydrogen 2.871 N/A ASP 135.A N ILE 131.A O no hydrogen 2.939 N/A GLU 136.A N GLU 132.A O no hydrogen 3.104 N/A ALA 137.A N ILE 133.A O no hydrogen 2.852 N/A TYR 138.A N LEU 134.A O no hydrogen 3.070 N/A LYS 139.A N ASP 135.A O no hydrogen 3.133 N/A ARG 140.A N GLU 136.A O no hydrogen 3.037 N/A ARG 140.A NE GLU 136.A OE2 no hydrogen 2.693 N/A ARG 140.A NH2 GLU 136.A OE2 no hydrogen 3.157 N/A GLY 141.A N TYR 138.A O no hydrogen 3.241 N/A LEU 142.A N ALA 137.A O no hydrogen 2.962 N/A LYS 146.A N THR 143.A O no hydrogen 3.200 N/A GLY 150.A N SER 147.A OG no hydrogen 3.099 N/A LEU 151.A N SER 147.A O no hydrogen 3.141 N/A VAL 152.A N PRO 148.A O no hydrogen 3.007 N/A ALA 153.A N ALA 149.A O no hydrogen 2.906 N/A ALA 154.A N GLY 150.A O no hydrogen 3.128 N/A ALA 155.A N LEU 151.A O no hydrogen 2.881 N/A LEU 156.A N VAL 152.A O no hydrogen 2.867 N/A TYR 157.A N ALA 153.A O no hydrogen 2.886 N/A ILE 158.A N ALA 154.A O no hydrogen 2.958 N/A ALA 159.A N ALA 155.A O no hydrogen 2.943 N/A SER 160.A N LEU 156.A O no hydrogen 2.752 N/A SER 160.A OG TYR 157.A O no hydrogen 2.903 N/A LEU 161.A N TYR 157.A O no hydrogen 3.232 N/A LEU 162.A N ILE 158.A O no hydrogen 3.067 N/A GLU 163.A N ALA 159.A O no hydrogen 2.997 N/A GLY 164.A N LEU 161.A O no hydrogen 2.981 N/A LYS 166.A NZ ARG 167.A O no hydrogen 3.361 N/A LYS 166.A NZ ALA 201.A OXT no hydrogen 2.911 N/A ARG 167.A N SER 160.A OG no hydrogen 3.030 N/A ARG 167.A NE LEU 120.A O no hydrogen 2.859 N/A ARG 167.A NH1 LYS 166.A O no hydrogen 2.790 N/A ARG 167.A NH2 LEU 120.A O no hydrogen 3.022 N/A THR 168.A N GLU 171.A OE1 no hydrogen 2.677 N/A GLU 171.A N THR 168.A OG1 no hydrogen 2.905 N/A VAL 172.A N THR 168.A O no hydrogen 3.010 N/A ALA 173.A N GLN 169.A O no hydrogen 3.047 N/A GLU 174.A N ARG 170.A O no hydrogen 2.931 N/A VAL 175.A N GLU 171.A O no hydrogen 3.188 N/A ALA 176.A N VAL 172.A O no hydrogen 2.915 N/A ARG 177.A NH1 ASP 78.A OD1 no hydrogen 2.764 N/A ARG 177.A NH2 ASP 78.A OD1 no hydrogen 2.852 N/A ARG 177.A NH2 ASP 78.A OD2 no hydrogen 2.883 N/A VAL 178.A N ALA 173.A O no hydrogen 3.356 N/A THR 179.A OG1 THR 182.A OG1 no hydrogen 3.305 N/A THR 182.A N THR 179.A OG1 no hydrogen 3.330 N/A THR 182.A OG1 THR 179.A OG1 no hydrogen 3.305 N/A VAL 183.A N THR 179.A O no hydrogen 3.146 N/A ARG 184.A N GLU 180.A O no hydrogen 2.735 N/A ARG 184.A NH1 GLN 169.A OE1 no hydrogen 3.175 N/A ASN 185.A N VAL 181.A O no hydrogen 2.688 N/A ARG 186.A N THR 182.A O no hydrogen 2.938 N/A ARG 186.A NH1 GLU 189.A OE1 no hydrogen 2.680 N/A TYR 187.A N VAL 183.A O no hydrogen 2.735 N/A LYS 188.A N ARG 184.A O no hydrogen 3.048 N/A GLU 189.A N ASN 185.A O no hydrogen 3.265 N/A LEU 190.A N ARG 186.A O no hydrogen 2.811 N/A VAL 191.A N TYR 187.A O no hydrogen 2.860 N/A GLU 192.A N LYS 188.A O no hydrogen 3.039 N/A LYS 193.A N GLU 189.A O no hydrogen 3.053 N/A LEU 194.A N LEU 190.A O no hydrogen 3.074 N/A ILE 196.A N VAL 191.A O no hydrogen 2.928 N/A