Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1p3u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N THR 3.A OG1 no hydrogen 3.228 N/A ARG 7.A N THR 3.A O no hydrogen 2.978 N/A ARG 7.A NE GLU 163.A OE1 no hydrogen 2.614 N/A ARG 7.A NH1 GLU 163.A OE1 no hydrogen 3.150 N/A ARG 7.A NH1 GLU 163.A OE2 no hydrogen 2.635 N/A LEU 8.A N PHE 4.A O no hydrogen 2.945 N/A LYS 9.A N ALA 5.A O no hydrogen 3.063 N/A ALA 10.A N LYS 6.A O no hydrogen 2.881 N/A ASP 11.A N ARG 7.A O no hydrogen 2.948 N/A THR 12.A N LYS 9.A O no hydrogen 3.075 N/A THR 12.A OG1 LEU 8.A O no hydrogen 2.779 N/A THR 13.A OG1 LYS 9.A O no hydrogen 2.754 N/A HIS 16.A N THR 12.A O no hydrogen 2.881 N/A HIS 16.A ND1 ASP 17.A OD1 no hydrogen 3.133 N/A ASP 17.A N THR 13.A O no hydrogen 2.907 N/A SER 18.A N ALA 14.A O no hydrogen 3.067 N/A SER 18.A OG VAL 15.A O no hydrogen 2.589 N/A VAL 19.A N VAL 15.A O no hydrogen 2.987 N/A ASP 20.A N HIS 16.A O no hydrogen 2.906 N/A ASN 21.A N ASP 17.A O no hydrogen 2.906 N/A LEU 22.A N SER 18.A O no hydrogen 2.952 N/A VAL 23.A N VAL 19.A O no hydrogen 2.783 N/A MET 24.A N ASP 20.A O no hydrogen 3.008 N/A SER 25.A N ASN 21.A O no hydrogen 2.850 N/A SER 25.A OG ASN 21.A O no hydrogen 2.793 N/A VAL 26.A N LEU 22.A O no hydrogen 3.223 N/A VAL 26.A N VAL 23.A O no hydrogen 3.316 N/A GLN 27.A N MET 24.A O no hydrogen 3.068 N/A VAL 30.A N GLN 27.A O no hydrogen 3.430 N/A ASN 34.A N SER 31.A OG no hydrogen 3.108 N/A ASN 34.A ND2 GLN 27.A O no hydrogen 2.810 N/A TYR 35.A N SER 31.A O no hydrogen 2.874 N/A TYR 35.A OH GLY 131.A O no hydrogen 2.633 N/A ILE 36.A N LYS 32.A O no hydrogen 2.902 N/A LYS 37.A N GLU 33.A O no hydrogen 3.122 N/A PHE 38.A N ASN 34.A O no hydrogen 2.924 N/A LEU 39.A N TYR 35.A O no hydrogen 2.844 N/A LYS 40.A N ILE 36.A O no hydrogen 2.955 N/A LEU 41.A N LYS 37.A O no hydrogen 3.076 N/A GLN 42.A N PHE 38.A O no hydrogen 2.946 N/A SER 43.A N LEU 39.A O no hydrogen 2.808 N/A SER 43.A OG TYR 86.A O no hydrogen 3.554 N/A VAL 44.A N LYS 40.A O no hydrogen 3.035 N/A PHE 45.A N LEU 41.A O no hydrogen 3.147 N/A HIS 46.A N GLN 42.A O no hydrogen 2.878 N/A HIS 46.A ND1 GLN 42.A O no hydrogen 3.025 N/A LYS 47.A N SER 43.A O no hydrogen 2.930 N/A ALA 48.A N VAL 44.A O no hydrogen 2.964 N/A VAL 49.A N HIS 46.A O no hydrogen 3.398 N/A ASP 50.A N LYS 47.A O no hydrogen 3.124 N/A HIS 51.A NE2 GLU 95.A O no hydrogen 2.706 N/A ILE 52.A N VAL 49.A O no hydrogen 2.939 N/A TYR 53.A N VAL 49.A O no hydrogen 3.138 N/A TYR 53.A OH GLU 108.A OE1 no hydrogen 2.807 N/A LYS 54.A N ASP 50.A O no hydrogen 3.249 N/A LYS 54.A NZ ASP 50.A OD1 no hydrogen 2.764 N/A ASP 55.A N ILE 52.A O no hydrogen 3.104 N/A LEU 58.A N ASP 55.A OD1 no hydrogen 2.898 N/A ASN 59.A N ASP 55.A O no hydrogen 2.906 N/A ASN 59.A ND2 TYR 53.A O no hydrogen 2.924 N/A ASN 59.A ND2 ASP 55.A O no hydrogen 2.799 N/A LYS 60.A N GLU 57.A O no hydrogen 3.119 N/A ALA 61.A N LEU 58.A O no hydrogen 3.219 N/A ILE 62.A N LEU 58.A O no hydrogen 2.768 N/A LEU 65.A N ILE 62.A O no hydrogen 3.207 N/A GLU 66.A N ASN 59.A OD1 no hydrogen 2.867 N/A TYR 67.A N GLU 64.A O no hydrogen 3.091 N/A MET 68.A N LEU 65.A O no hydrogen 3.033 N/A ARG 70.A NE HIS 134.A O no hydrogen 3.095 N/A ARG 70.A NH1 SER 110.A OG no hydrogen 3.026 N/A ARG 70.A NH2 HIS 134.A O no hydrogen 2.766 N/A VAL 74.A N ARG 70.A O no hydrogen 3.020 N/A THR 75.A N TYR 71.A O no hydrogen 3.034 N/A THR 75.A OG1 TYR 71.A O no hydrogen 3.077 N/A GLN 76.A N ASP 72.A O no hydrogen 2.955 N/A ASP 77.A N ALA 73.A O no hydrogen 2.931 N/A LEU 78.A N VAL 74.A O no hydrogen 2.971 N/A LYS 79.A N THR 75.A O no hydrogen 3.027 N/A ASP 80.A N GLN 76.A O no hydrogen 2.803 N/A LEU 81.A N ASP 77.A O no hydrogen 3.152 N/A GLY 82.A N LYS 79.A O no hydrogen 2.871 N/A GLU 83.A N LEU 78.A O no hydrogen 2.802 N/A ALA 96.A N GLU 95.A OE2 no hydrogen 3.003 N/A ASN 98.A ND2 GLU 165.A OE1 no hydrogen 2.893 N/A LYS 99.A NZ GLU 172.A OE1 no hydrogen 2.760 N/A LYS 99.A NZ GLU 172.A OE2 no hydrogen 3.135 N/A ALA 100.A N ALA 96.A O no hydrogen 3.174 N/A ILE 101.A N ASN 98.A O no hydrogen 2.954 N/A GLY 102.A N LYS 99.A O no hydrogen 2.927 N/A TRP 103.A N LYS 99.A O no hydrogen 3.264 N/A LEU 104.A N ALA 100.A O no hydrogen 3.009 N/A TYR 105.A N ILE 101.A O no hydrogen 3.017 N/A CYS 106.A N GLY 102.A O no hydrogen 3.045 N/A ALA 107.A N TRP 103.A O no hydrogen 2.951 N/A GLU 108.A N LEU 104.A O no hydrogen 2.927 N/A GLY 109.A N TYR 105.A O no hydrogen 2.860 N/A SER 110.A N CYS 106.A O no hydrogen 3.127 N/A SER 110.A OG ALA 107.A O no hydrogen 2.513 N/A ASN 111.A N GLU 108.A O no hydrogen 2.976 N/A ASN 111.A ND2 GLU 108.A OE2 no hydrogen 3.164 N/A LEU 112.A N GLU 108.A O no hydrogen 3.322 N/A GLY 113.A N GLY 109.A O no hydrogen 3.013 N/A ALA 114.A N ASN 111.A O no hydrogen 3.490 N/A PHE 118.A N ALA 114.A O no hydrogen 2.921 N/A LYS 119.A N ALA 115.A O no hydrogen 2.995 N/A HIS 120.A N PHE 116.A O no hydrogen 3.210 N/A HIS 120.A ND1 PHE 116.A O no hydrogen 3.254 N/A ALA 121.A N LEU 117.A O no hydrogen 2.878 N/A GLN 122.A N PHE 118.A O no hydrogen 2.997 N/A LYS 123.A N HIS 120.A O no hydrogen 3.182 N/A LYS 123.A NZ HIS 120.A NE2 no hydrogen 3.506 N/A LEU 124.A N ALA 121.A O no hydrogen 2.830 N/A ASP 125.A N GLN 122.A O no hydrogen 2.841 N/A TYR 126.A N ALA 121.A O no hydrogen 3.260 N/A ASN 127.A N HIS 130.A O no hydrogen 2.773 N/A GLU 129.A N ASN 127.A OD1 no hydrogen 2.747 N/A HIS 130.A N ASN 127.A O no hydrogen 3.104 N/A GLY 131.A N ASP 80.A OD2 no hydrogen 2.969 N/A ALA 132.A N ASN 127.A O no hydrogen 2.967 N/A ARG 133.A N ASP 77.A OD1 no hydrogen 2.718 N/A ARG 133.A NE ASP 80.A OD2 no hydrogen 2.677 N/A ARG 133.A NH2 ASP 80.A OD1 no hydrogen 3.180 N/A ARG 133.A NH2 ASP 80.A OD2 no hydrogen 3.470 N/A HIS 134.A N ASP 77.A OD2 no hydrogen 2.928 N/A HIS 134.A ND1 ASP 77.A OD2 no hydrogen 2.781 N/A HIS 134.A NE2 GLN 42.A OE1 no hydrogen 3.026 N/A LEU 135.A N ALA 132.A O no hydrogen 3.172 N/A ALA 136.A N ARG 133.A O no hydrogen 3.441 N/A ASP 140.A N HIS 138.A ND1 no hydrogen 3.047 N/A GLY 141.A N HIS 138.A O no hydrogen 2.611 N/A ARG 142.A NH1 ASN 111.A O no hydrogen 2.952 N/A ARG 142.A NH1 LEU 135.A O no hydrogen 3.385 N/A ARG 142.A NH2 LEU 135.A O no hydrogen 2.677 N/A HIS 145.A N GLY 141.A O no hydrogen 2.994 N/A HIS 145.A NE2 GLU 108.A OE2 no hydrogen 2.909 N/A TRP 146.A N ARG 142.A O no hydrogen 2.984 N/A ARG 147.A N GLY 143.A O no hydrogen 2.865 N/A ALA 148.A N LYS 144.A O no hydrogen 3.314 N/A PHE 149.A N HIS 145.A O no hydrogen 3.187 N/A VAL 150.A N TRP 146.A O no hydrogen 2.766 N/A GLU 151.A N ARG 147.A O no hydrogen 3.136 N/A HIS 152.A N ALA 148.A O no hydrogen 3.418 N/A LEU 153.A N PHE 149.A O no hydrogen 3.000 N/A ASN 154.A N VAL 150.A O no hydrogen 2.958 N/A ALA 155.A N GLU 151.A O no hydrogen 2.834 N/A LEU 156.A N LEU 153.A O no hydrogen 3.236 N/A ASN 157.A N ASN 154.A O no hydrogen 3.178 N/A THR 159.A OG1 GLU 161.A OE1 no hydrogen 3.051 N/A ALA 162.A N THR 159.A OG1 no hydrogen 3.174 N/A GLU 163.A N THR 159.A O no hydrogen 2.854 N/A ALA 164.A N PRO 160.A O no hydrogen 3.144 N/A ALA 166.A N ALA 162.A O no hydrogen 2.981 N/A ILE 167.A N GLU 163.A O no hydrogen 2.733 N/A GLN 168.A N ALA 164.A O no hydrogen 2.981 N/A GLN 168.A NE2 GLU 172.A OE2 no hydrogen 2.860 N/A GLY 169.A N GLU 165.A O no hydrogen 2.824 N/A ALA 170.A N ALA 166.A O no hydrogen 2.820 N/A ARG 171.A N ILE 167.A O no hydrogen 2.926 N/A ARG 171.A NE ASP 11.A O no hydrogen 3.324 N/A ARG 171.A NH2 ASP 11.A O no hydrogen 3.068 N/A GLU 172.A N GLN 168.A O no hydrogen 2.952 N/A ALA 173.A N GLY 169.A O no hydrogen 2.873 N/A PHE 174.A N ALA 170.A O no hydrogen 3.115 N/A ALA 175.A N ARG 171.A O no hydrogen 3.029 N/A PHE 176.A N GLU 172.A O no hydrogen 2.854 N/A TYR 177.A N ALA 173.A O no hydrogen 2.985 N/A LYS 178.A N PHE 174.A O no hydrogen 3.158 N/A LYS 178.A NZ SER 18.A OG no hydrogen 2.956 N/A LYS 178.A NZ GLU 192.A OE1 no hydrogen 2.947 N/A LYS 178.A NZ GLU 192.A OE2 no hydrogen 3.374 N/A VAL 179.A N ALA 175.A O no hydrogen 3.061 N/A VAL 180.A N PHE 176.A O no hydrogen 2.956 N/A LEU 181.A N TYR 177.A O no hydrogen 2.885 N/A ARG 182.A N LYS 178.A O no hydrogen 2.960 N/A ARG 182.A NE ALA 191.A O no hydrogen 2.759 N/A ARG 182.A NH2 ALA 191.A O no hydrogen 3.055 N/A GLU 183.A N VAL 179.A O no hydrogen 3.172 N/A THR 184.A N VAL 180.A O no hydrogen 2.871 N/A THR 184.A OG1 VAL 180.A O no hydrogen 2.779 N/A PHE 185.A N LEU 181.A O no hydrogen 2.857 N/A GLY 186.A N GLU 183.A O no hydrogen 3.364 N/A LEU 187.A N ARG 182.A O no hydrogen 2.702 N/A ALA 191.A N ALA 188.A O no hydrogen 3.159 N/A MET 197.A N PRO 194.A O no hydrogen 3.194 N/A