Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rd3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.578 N/A THR 2.A N ASP 1.A OD1 no hydrogen 3.168 N/A GLN 4.A NE2 GLN 4.A O no hydrogen 3.188 N/A GLN 4.A NE2 ASP 8.A OD1 no hydrogen 2.903 N/A HIS 5.A N ASP 1.A O no hydrogen 2.890 N/A HIS 5.A NE2 ALA 31.A O no hydrogen 2.555 N/A LEU 6.A N THR 2.A O no hydrogen 2.882 N/A LEU 7.A N ARG 3.A O no hydrogen 3.025 N/A ASP 8.A N GLN 4.A O no hydrogen 2.834 N/A THR 9.A N HIS 5.A O no hydrogen 2.895 N/A THR 9.A OG1 HIS 5.A O no hydrogen 2.788 N/A GLY 10.A N LEU 6.A O no hydrogen 2.604 N/A TYR 11.A N LEU 7.A O no hydrogen 2.875 N/A TYR 11.A OH ARG 98.A O no hydrogen 2.883 N/A ARG 12.A N ASP 8.A O no hydrogen 3.028 N/A ILE 13.A N THR 9.A O no hydrogen 3.087 N/A MET 14.A N GLY 10.A O no hydrogen 2.816 N/A ALA 15.A N TYR 11.A O no hydrogen 2.706 N/A VAL 16.A N ILE 13.A O no hydrogen 2.986 N/A LYS 17.A N ILE 13.A O no hydrogen 2.886 N/A GLY 18.A N MET 14.A O no hydrogen 3.296 N/A PHE 19.A N GLU 107.A OE1 no hydrogen 3.096 N/A SER 20.A N GLU 107.A OE1 no hydrogen 3.391 N/A GLU 26.A N ASN 25.A OD1 no hydrogen 3.136 N/A ILE 27.A N GLY 23.A O no hydrogen 3.208 N/A LEU 28.A N LEU 24.A O no hydrogen 2.866 N/A GLN 29.A N ASN 25.A O no hydrogen 3.103 N/A SER 30.A N GLU 26.A O no hydrogen 3.045 N/A SER 30.A OG GLU 26.A O no hydrogen 3.281 N/A ALA 31.A N ILE 27.A O no hydrogen 2.779 N/A GLY 32.A N LEU 28.A O no hydrogen 2.831 N/A VAL 33.A N LEU 28.A O no hydrogen 3.231 N/A SER 37.A N PRO 34.A O no hydrogen 3.106 N/A PHE 38.A N PRO 34.A O no hydrogen 3.271 N/A PHE 38.A N LYS 35.A O no hydrogen 2.984 N/A TYR 39.A N LYS 35.A O no hydrogen 3.384 N/A TYR 41.A N PHE 38.A O no hydrogen 2.896 N/A PHE 42.A N PHE 38.A O no hydrogen 3.091 N/A LYS 43.A NZ GLN 47.A OE1 no hydrogen 3.074 N/A LYS 45.A NZ PHE 19.A O no hydrogen 2.716 N/A LYS 45.A NZ VAL 22.A O no hydrogen 2.749 N/A PHE 48.A N SER 44.A O no hydrogen 3.309 N/A GLY 49.A N LYS 45.A O no hydrogen 3.045 N/A GLN 50.A N GLU 46.A O no hydrogen 3.031 N/A GLN 50.A NE2 SER 114.A O no hydrogen 2.667 N/A GLN 50.A NE2 THR 118.A OG1 no hydrogen 2.913 N/A ALA 51.A N GLN 47.A O no hydrogen 2.985 N/A LEU 52.A N PHE 48.A O no hydrogen 3.050 N/A LEU 53.A N GLY 49.A O no hydrogen 3.060 N/A GLU 54.A N GLN 50.A O no hydrogen 2.812 N/A ASP 55.A N ALA 51.A O no hydrogen 2.840 N/A TYR 56.A N LEU 52.A O no hydrogen 2.858 N/A TYR 56.A OH ARG 98.A O no hydrogen 3.390 N/A PHE 57.A N LEU 53.A O no hydrogen 2.803 N/A ARG 58.A N GLU 54.A O no hydrogen 3.183 N/A VAL 59.A N ASP 55.A O no hydrogen 3.271 N/A TYR 60.A N TYR 56.A O no hydrogen 3.189 N/A TYR 60.A OH TYR 82.A OH no hydrogen 2.578 N/A LEU 61.A N PHE 57.A O no hydrogen 2.709 N/A ALA 62.A N ARG 58.A O no hydrogen 2.922 N/A ASP 63.A N VAL 59.A O no hydrogen 2.951 N/A MET 64.A N TYR 60.A O no hydrogen 3.246 N/A MET 64.A N LEU 61.A O no hydrogen 2.973 N/A ASP 65.A N LEU 61.A O no hydrogen 2.888 N/A GLN 66.A N ALA 62.A O no hydrogen 2.987 N/A ARG 67.A N ASP 63.A O no hydrogen 3.267 N/A PHE 68.A N MET 64.A O no hydrogen 2.918 N/A SER 69.A N GLN 66.A O no hydrogen 3.110 N/A SER 69.A OG ASP 65.A O no hydrogen 2.696 N/A SER 69.A OG GLN 66.A O no hydrogen 3.137 N/A ALA 70.A N ARG 67.A O no hydrogen 3.169 N/A ASN 74.A N GLU 77.A OE1 no hydrogen 2.854 N/A ALA 75.A N ASP 140.A OD2 no hydrogen 3.228 N/A ARG 76.A NH2 GLU 187.A OE1 no hydrogen 2.868 N/A GLU 77.A N ASN 74.A OD1 no hydrogen 2.760 N/A ARG 78.A N ASN 74.A O no hydrogen 2.964 N/A ARG 78.A NE ALA 70.A O no hydrogen 3.100 N/A ARG 78.A NH1 GLN 136.A OE1 no hydrogen 2.342 N/A ARG 78.A NH2 ALA 70.A O no hydrogen 2.851 N/A LEU 79.A N ALA 75.A O no hydrogen 3.057 N/A MET 80.A N ARG 76.A O no hydrogen 2.884 N/A SER 81.A N GLU 77.A O no hydrogen 3.102 N/A SER 81.A OG ARG 78.A O no hydrogen 3.266 N/A TYR 82.A N LEU 79.A O no hydrogen 3.112 N/A TYR 82.A OH TYR 60.A OH no hydrogen 2.578 N/A TRP 83.A N LEU 79.A O no hydrogen 3.231 N/A GLN 84.A N MET 80.A O no hydrogen 3.003 N/A LYS 85.A N SER 81.A O no hydrogen 2.930 N/A TRP 86.A N TYR 82.A O no hydrogen 3.109 N/A TRP 86.A N TRP 83.A O no hydrogen 2.880 N/A TRP 86.A NE1 SER 163.A OG no hydrogen 2.821 N/A LEU 87.A N TRP 83.A O no hydrogen 3.009 N/A ASP 88.A N GLN 84.A O no hydrogen 2.865 N/A ASN 89.A N TRP 86.A O no hydrogen 3.427 N/A CYS 94.A N CYS 91.A O no hydrogen 3.008 N/A CYS 94.A SG CYS 91.A O no hydrogen 3.768 N/A GLN 97.A N ALA 15.A O no hydrogen 2.789 N/A LYS 103.A N CYS 99.A O no hydrogen 3.036 N/A LYS 103.A NZ VAL 16.A O no hydrogen 3.564 N/A LEU 104.A N LEU 100.A O no hydrogen 2.488 N/A SER 105.A N VAL 101.A O no hydrogen 2.740 N/A GLU 107.A N LEU 104.A O no hydrogen 2.940 N/A ASP 110.A N GLU 107.A O no hydrogen 3.261 N/A LEU 111.A N VAL 108.A O no hydrogen 3.087 N/A MET 115.A N SER 112.A OG no hydrogen 3.336 N/A ARG 116.A N SER 112.A O no hydrogen 3.043 N/A ILE 117.A N GLU 113.A O no hydrogen 2.742 N/A THR 118.A N SER 114.A O no hydrogen 3.183 N/A THR 118.A OG1 GLN 50.A OE1 no hydrogen 2.999 N/A THR 118.A OG1 SER 114.A O no hydrogen 2.917 N/A LEU 119.A N MET 115.A O no hydrogen 3.024 N/A ARG 120.A N ARG 116.A O no hydrogen 3.073 N/A ASP 121.A N ILE 117.A O no hydrogen 3.089 N/A GLY 122.A N THR 118.A O no hydrogen 2.941 N/A SER 123.A N LEU 119.A O no hydrogen 3.085 N/A SER 123.A OG TYR 156.A OH no hydrogen 3.402 N/A ASP 124.A N ARG 120.A O no hydrogen 2.707 N/A GLY 125.A N ASP 121.A O no hydrogen 2.863 N/A ILE 126.A N GLY 122.A O no hydrogen 3.355 N/A ILE 127.A N SER 123.A O no hydrogen 3.409 N/A GLU 128.A N ASP 124.A O no hydrogen 2.997 N/A ARG 129.A N GLY 125.A O no hydrogen 3.349 N/A ARG 129.A NE ASP 65.A OD1 no hydrogen 2.471 N/A ARG 129.A NH1 GLY 125.A O no hydrogen 3.117 N/A ARG 129.A NH2 ASP 65.A OD1 no hydrogen 3.063 N/A ARG 129.A NH2 ASP 65.A OD2 no hydrogen 3.258 N/A LEU 130.A N ILE 126.A O no hydrogen 3.024 N/A VAL 131.A N ILE 127.A O no hydrogen 2.911 N/A GLY 132.A N GLU 128.A O no hydrogen 2.987 N/A CYS 133.A N ARG 129.A O no hydrogen 2.853 N/A CYS 133.A SG ALA 75.A O no hydrogen 3.633 N/A LEU 134.A N LEU 130.A O no hydrogen 2.901 N/A GLY 135.A N VAL 131.A O no hydrogen 2.886 N/A GLN 136.A N GLY 132.A O no hydrogen 2.938 N/A GLY 137.A N LEU 134.A O no hydrogen 3.086 N/A ARG 138.A N LEU 134.A O no hydrogen 3.307 N/A ARG 138.A NH1 CYS 146.A O no hydrogen 2.442 N/A ASP 140.A N GLN 136.A O no hydrogen 3.270 N/A SER 142.A N ASP 140.A OD1 no hydrogen 2.878 N/A SER 142.A OG ASP 140.A OD1 no hydrogen 2.400 N/A SER 142.A OG ASP 140.A OD2 no hydrogen 2.620 N/A LEU 143.A N GLY 137.A O no hydrogen 3.025 N/A HIS 150.A N ASP 147.A OD1 no hydrogen 3.309 N/A MET 151.A N ASP 147.A O no hydrogen 2.852 N/A ALA 152.A N ALA 148.A O no hydrogen 2.863 N/A SER 153.A N ARG 149.A O no hydrogen 3.141 N/A SER 153.A OG ARG 149.A O no hydrogen 3.341 N/A ALA 154.A N HIS 150.A O no hydrogen 2.869 N/A LEU 155.A N MET 151.A O no hydrogen 2.853 N/A TYR 156.A N ALA 152.A O no hydrogen 2.895 N/A TYR 156.A OH SER 123.A OG no hydrogen 3.402 N/A GLN 157.A N SER 153.A O no hydrogen 3.029 N/A LEU 158.A N ALA 154.A O no hydrogen 3.147 N/A TRP 159.A N LEU 155.A O no hydrogen 3.083 N/A TRP 159.A NE1 THR 182.A OG1 no hydrogen 2.844 N/A LEU 160.A N TYR 156.A O no hydrogen 2.876 N/A GLY 161.A N GLN 157.A O no hydrogen 2.866 N/A ALA 162.A N LEU 158.A O no hydrogen 3.023 N/A SER 163.A N TRP 159.A O no hydrogen 2.786 N/A SER 163.A OG TRP 159.A O no hydrogen 3.320 N/A LEU 164.A N LEU 160.A O no hydrogen 2.911 N/A LEU 165.A N GLY 161.A O no hydrogen 3.080 N/A SER 166.A N ALA 162.A O no hydrogen 2.736 N/A SER 166.A OG SER 171.A O no hydrogen 2.677 N/A LYS 167.A N SER 163.A O no hydrogen 3.027 N/A LYS 167.A NZ CYS 91.A O no hydrogen 2.731 N/A LYS 167.A NZ CYS 94.A O no hydrogen 3.171 N/A LYS 167.A NZ GLU 96.A O no hydrogen 3.058 N/A LEU 168.A N LEU 164.A O no hydrogen 3.286 N/A HIS 169.A N LEU 165.A O no hydrogen 3.171 N/A HIS 169.A ND1 LEU 165.A O no hydrogen 3.211 N/A ARG 170.A N LYS 167.A O no hydrogen 3.363 N/A SER 171.A N SER 166.A O no hydrogen 3.305 N/A GLY 173.A N SER 171.A OG no hydrogen 3.103 N/A LEU 175.A N PRO 172.A O no hydrogen 3.130 N/A GLU 176.A N PRO 172.A O no hydrogen 3.180 N/A THR 177.A N GLY 173.A O no hydrogen 3.045 N/A THR 177.A OG1 GLY 173.A O no hydrogen 3.514 N/A ALA 178.A N PRO 174.A O no hydrogen 3.091 N/A MET 179.A N LEU 175.A O no hydrogen 2.927 N/A GLN 180.A N GLU 176.A O no hydrogen 2.821 N/A THR 181.A N THR 177.A O no hydrogen 3.001 N/A THR 181.A OG1 THR 177.A O no hydrogen 2.563 N/A THR 182.A N ALA 178.A O no hydrogen 2.890 N/A THR 182.A OG1 ALA 178.A O no hydrogen 2.776 N/A ARG 183.A N MET 179.A O no hydrogen 2.961 N/A SER 184.A N GLN 180.A O no hydrogen 3.266 N/A SER 184.A OG GLN 180.A O no hydrogen 2.547 N/A SER 184.A OG THR 181.A O no hydrogen 3.410 N/A LEU 185.A N THR 181.A O no hydrogen 2.984 N/A LEU 186.A N THR 182.A O no hydrogen 3.102 N/A