Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gsi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N.A ASP 89.A O no hydrogen 3.113 N/A LEU 2.A N ASP 134.A OD2 no hydrogen 2.702 N/A ILE 3.A N VAL 91.A O no hydrogen 2.830 N/A ALA 4.A N TRP 135.A O no hydrogen 2.918 N/A ILE 5.A N LEU 93.A O no hydrogen 2.731 N/A GLU 6.A N VAL 137.A O no hydrogen 2.804 N/A ASP 9.A N GLN 172.A OE1 no hydrogen 3.208 N/A ALA 11.A N VAL 8.A O no hydrogen 3.280 N/A LYS 13.A NZ GLY 7.A O no hydrogen 3.232 N/A LYS 13.A NZ VAL 8.A O no hydrogen 2.948 N/A LEU 16.A N GLY 12.A O no hydrogen 3.033 N/A VAL 17.A N LYS 13.A O no hydrogen 2.914 N/A GLU 18.A N ARG 14.A O no hydrogen 3.173 N/A LYS 19.A N THR 15.A O no hydrogen 2.984 N/A LEU 20.A N LEU 16.A O no hydrogen 2.766 N/A SER 21.A N VAL 17.A O no hydrogen 2.900 N/A SER 21.A OG VAL 17.A O no hydrogen 2.656 N/A GLY 22.A N GLU 18.A O no hydrogen 3.051 N/A ALA 23.A N LYS 19.A O no hydrogen 2.975 N/A PHE 24.A N LEU 20.A O no hydrogen 3.005 N/A ARG 25.A N SER 21.A O no hydrogen 3.047 N/A ARG 25.A NH2 VAL 31.A O no hydrogen 3.290 N/A ALA 26.A N GLY 22.A O no hydrogen 2.906 N/A ALA 27.A N PHE 24.A O no hydrogen 2.971 N/A GLY 28.A N ARG 25.A O no hydrogen 3.070 N/A ARG 29.A N.A PHE 24.A O no hydrogen 3.085 N/A ARG 29.A N.B PHE 24.A O no hydrogen 3.093 N/A ARG 29.A NH1.B ALA 27.A O no hydrogen 2.929 N/A SER 30.A N ASP 89.A OD2 no hydrogen 2.960 N/A ALA 32.A N VAL 90.A O no hydrogen 3.014 N/A LEU 34.A N ILE 92.A O no hydrogen 3.071 N/A PHE 36.A N ASP 94.A O no hydrogen 2.953 N/A ARG 38.A N ASP 73.A OD2 no hydrogen 2.855 N/A ARG 38.A NE ASP 73.A OD1 no hydrogen 2.793 N/A ARG 38.A NH2 ASP 73.A O no hydrogen 2.899 N/A ARG 38.A NH2 ASP 73.A OD1 no hydrogen 3.212 N/A TYR 39.A N PRO 37.A O no hydrogen 2.902 N/A GLY 40.A N ASP 46.A OD1 no hydrogen 3.271 N/A GLY 40.A N ASP 46.A OD2 no hydrogen 2.735 N/A GLN 41.A N.A ARG 38.A O no hydrogen 2.994 N/A GLN 41.A N.B ARG 38.A O no hydrogen 2.983 N/A SER 42.A OG.A ASP 73.A OD1 no hydrogen 3.130 N/A SER 42.A OG.B ASP 73.A OD1 no hydrogen 2.845 N/A ALA 45.A N SER 42.A OG.A no hydrogen 3.095 N/A ALA 45.A N SER 42.A OG.B no hydrogen 3.250 N/A ASP 46.A N SER 42.A O.A no hydrogen 2.903 N/A ASP 46.A N SER 42.A O.B no hydrogen 3.297 N/A ILE 47.A N VAL 43.A O.A no hydrogen 2.814 N/A ILE 47.A N VAL 43.A O.B no hydrogen 2.859 N/A ALA 48.A N ALA 44.A O no hydrogen 3.010 N/A ALA 49.A N ALA 45.A O no hydrogen 3.003 N/A GLU 50.A N ASP 46.A O no hydrogen 2.906 N/A ALA 51.A N ILE 47.A O no hydrogen 2.843 N/A LEU 52.A N ALA 48.A O no hydrogen 3.056 N/A HIS 53.A N GLU 50.A O no hydrogen 2.971 N/A HIS 53.A ND1 ALA 49.A O no hydrogen 3.026 N/A HIS 53.A NE2 ALA 161.A O no hydrogen 3.269 N/A GLY 54.A N ALA 51.A O no hydrogen 3.099 N/A GLU 55.A N.A GLU 50.A O no hydrogen 2.994 N/A GLU 55.A N.B GLU 50.A O no hydrogen 2.998 N/A HIS 56.A NE2 GLU 50.A OE1 no hydrogen 2.739 N/A LEU 59.A N.A HIS 56.A O no hydrogen 3.106 N/A LEU 59.A N.B HIS 56.A O no hydrogen 3.100 N/A SER 61.A N ASP 58.A O no hydrogen 3.222 N/A SER 61.A OG ASP 58.A O no hydrogen 2.547 N/A SER 62.A N LEU 59.A O.A no hydrogen 3.104 N/A SER 62.A N LEU 59.A O.B no hydrogen 3.113 N/A ALA 65.A N SER 62.A OG no hydrogen 2.961 N/A MET 66.A N SER 62.A O no hydrogen 3.248 N/A ALA 67.A N VAL 63.A O no hydrogen 3.092 N/A THR 68.A N TYR 64.A O no hydrogen 2.855 N/A THR 68.A OG1 TYR 64.A O no hydrogen 2.742 N/A LEU 69.A N ALA 65.A O no hydrogen 3.026 N/A PHE 70.A N MET 66.A O no hydrogen 3.123 N/A ALA 71.A N ALA 67.A O no hydrogen 2.951 N/A LEU 72.A N THR 68.A O no hydrogen 2.785 N/A ASP 73.A N LEU 69.A O no hydrogen 2.999 N/A ARG 74.A N PHE 70.A O no hydrogen 3.199 N/A ARG 74.A NE GLU 124.A OE2 no hydrogen 2.686 N/A ARG 74.A NH2 GLU 124.A OE1 no hydrogen 2.746 N/A ARG 74.A NH2 GLU 124.A OE2 no hydrogen 3.287 N/A ALA 75.A N ALA 71.A O no hydrogen 2.823 N/A GLY 76.A N LEU 72.A O no hydrogen 3.160 N/A GLY 76.A N ASP 73.A O no hydrogen 3.132 N/A ALA 77.A N ARG 74.A O no hydrogen 2.799 N/A VAL 78.A N ALA 75.A O no hydrogen 3.450 N/A ILE 81.A N ALA 77.A O no hydrogen 2.893 N/A GLN 82.A N VAL 78.A O no hydrogen 3.017 N/A GLY 83.A N HIS 79.A O no hydrogen 2.879 N/A LEU 84.A N THR 80.A O no hydrogen 2.942 N/A CYS 85.A N ILE 81.A O no hydrogen 2.991 N/A CYS 85.A SG ILE 81.A O no hydrogen 3.395 N/A ARG 86.A N GLN 82.A O no hydrogen 3.307 N/A GLY 87.A N LEU 84.A O no hydrogen 3.182 N/A TYR 88.A N LEU 84.A O no hydrogen 2.873 N/A ASP 89.A N SER 30.A OG no hydrogen 2.812 N/A VAL 90.A N SER 30.A O no hydrogen 3.042 N/A VAL 91.A N MET 1.A O.A no hydrogen 2.880 N/A VAL 91.A N MET 1.A O.B no hydrogen 2.888 N/A ILE 92.A N ALA 32.A O no hydrogen 2.889 N/A LEU 93.A N ILE 3.A O no hydrogen 2.722 N/A ASP 94.A N LEU 34.A O no hydrogen 2.898 N/A ARG 95.A N ILE 5.A O no hydrogen 2.914 N/A ARG 95.A NH1 GLY 7.A O no hydrogen 3.228 N/A ARG 95.A NH1 TYR 103.A OH no hydrogen 3.088 N/A ARG 95.A NH2 GLY 7.A O no hydrogen 3.049 N/A ARG 95.A NH2 SER 99.A OG no hydrogen 2.831 N/A TYR 96.A N GLU 6.A OE1 no hydrogen 2.834 N/A TYR 96.A OH PRO 131.A O no hydrogen 2.671 N/A SER 99.A N TYR 96.A O no hydrogen 3.065 N/A SER 99.A OG GLU 6.A OE2 no hydrogen 2.524 N/A SER 99.A OG TYR 179.A OH no hydrogen 3.089 N/A ASN 100.A N VAL 97.A O no hydrogen 2.960 N/A ASN 100.A ND2 ALA 67.A O no hydrogen 2.845 N/A ASN 100.A ND2 GLU 124.A OE1 no hydrogen 2.828 N/A ALA 101.A N VAL 97.A O no hydrogen 3.406 N/A ALA 102.A N ALA 98.A O no hydrogen 2.856 N/A TYR 103.A N SER 99.A O no hydrogen 2.988 N/A TYR 103.A OH ASP 9.A OD2 no hydrogen 2.824 N/A SER 104.A N ASN 100.A O no hydrogen 3.021 N/A SER 104.A OG ASN 100.A O no hydrogen 2.686 N/A ALA 105.A N ALA 101.A O no hydrogen 3.025 N/A ALA 106.A N ALA 102.A O no hydrogen 2.993 N/A ARG 107.A N TYR 103.A O no hydrogen 2.919 N/A ARG 107.A NH1 ALA 60.A O no hydrogen 3.195 N/A ARG 107.A NH1 TYR 165.A OH no hydrogen 2.861 N/A ARG 107.A NH2 ALA 60.A O no hydrogen 2.834 N/A LEU 108.A N SER 104.A O no hydrogen 3.214 N/A HIS 109.A N ALA 106.A O no hydrogen 3.148 N/A GLU 110.A N ALA 105.A O no hydrogen 2.820 N/A ALA 112.A N GLU 181.A OE1 no hydrogen 3.011 N/A ALA 113.A N ASN 111.A OD1 no hydrogen 2.844 N/A GLY 114.A N ASN 111.A O no hydrogen 2.936 N/A ALA 116.A N GLU 110.A OE2 no hydrogen 2.868 N/A ALA 118.A N GLY 114.A O no hydrogen 3.346 N/A TRP 119.A N LYS 115.A O no hydrogen 2.894 N/A VAL 120.A N ALA 116.A O no hydrogen 2.960 N/A GLN 121.A N.A ALA 117.A O no hydrogen 3.116 N/A GLN 121.A N.B ALA 117.A O no hydrogen 3.106 N/A ARG 122.A N ALA 118.A O no hydrogen 3.025 N/A ILE 123.A N TRP 119.A O no hydrogen 2.859 N/A GLU 124.A N VAL 120.A O no hydrogen 2.888 N/A PHE 125.A N GLN 121.A O.A no hydrogen 3.202 N/A PHE 125.A N GLN 121.A O.B no hydrogen 3.314 N/A ALA 126.A N GLN 121.A O.A no hydrogen 3.414 N/A ALA 126.A N GLN 121.A O.B no hydrogen 3.445 N/A ARG 127.A N ARG 122.A O no hydrogen 2.994 N/A LEU 128.A N ILE 123.A O no hydrogen 2.826 N/A LEU 130.A N.A GLU 124.A O no hydrogen 3.091 N/A LEU 130.A N.B GLU 124.A O no hydrogen 3.088 N/A LYS 132.A NZ GLN 121.A OE1.A no hydrogen 3.289 N/A ASP 134.A N LEU 2.A O no hydrogen 2.812 N/A TRP 135.A N LEU 2.A O no hydrogen 3.258 N/A GLN 136.A N ARG 190.A O no hydrogen 2.999 N/A GLN 136.A NE2 TRP 187.A O no hydrogen 2.852 N/A VAL 137.A N ALA 4.A O no hydrogen 2.793 N/A LEU 138.A N LEU 192.A O.A no hydrogen 2.802 N/A LEU 138.A N LEU 192.A O.B no hydrogen 2.877 N/A LEU 139.A N GLU 6.A O no hydrogen 2.981 N/A ALA 140.A N VAL 194.A O no hydrogen 2.947 N/A LEU 145.A N SER 142.A OG no hydrogen 3.263 N/A ALA 146.A N SER 142.A O no hydrogen 3.056 N/A GLY 147.A N ALA 143.A O no hydrogen 3.030 N/A GLU 148.A N GLU 144.A O no hydrogen 3.093 N/A ARG 149.A N LEU 145.A O no hydrogen 3.094 N/A ARG 149.A NH1 GLY 10.A O no hydrogen 3.047 N/A SER 150.A N.A ALA 146.A O no hydrogen 3.066 N/A SER 150.A N.B ALA 146.A O no hydrogen 3.062 N/A SER 150.A OG.A ALA 146.A O no hydrogen 3.388 N/A SER 150.A OG.B ALA 146.A O no hydrogen 3.518 N/A SER 150.A OG.B GLY 147.A O no hydrogen 2.617 N/A ARG 151.A N GLY 147.A O no hydrogen 3.084 N/A GLY 152.A N GLU 148.A O no hydrogen 2.946 N/A ARG 153.A N.A ARG 149.A O no hydrogen 2.931 N/A ARG 153.A N.B ARG 149.A O no hydrogen 2.914 N/A ALA 154.A N SER 150.A O.A no hydrogen 3.271 N/A ALA 154.A N SER 150.A O.B no hydrogen 3.289 N/A GLN 155.A N ARG 151.A O no hydrogen 3.117 N/A ARG 156.A N.A GLY 152.A O no hydrogen 3.200 N/A ARG 156.A N.B GLY 152.A O no hydrogen 3.169 N/A ASP 157.A N ARG 153.A O.A no hydrogen 2.971 N/A GLY 159.A N ASP 157.A OD1 no hydrogen 2.797 N/A ARG 160.A N ASP 157.A O no hydrogen 2.917 N/A ASP 163.A N GLU 166.A OE2 no hydrogen 3.009 N/A ASN 164.A N.A LEU 52.A O no hydrogen 2.857 N/A ASN 164.A N.B LEU 52.A O no hydrogen 2.857 N/A GLU 166.A N ASP 163.A OD1 no hydrogen 3.012 N/A ARG 167.A N ASP 163.A O no hydrogen 3.004 N/A ASP 168.A N TYR 165.A O no hydrogen 3.132 N/A LEU 171.A N ASP 168.A OD1 no hydrogen 3.000 N/A GLN 172.A N ASP 168.A O no hydrogen 3.052 N/A GLN 172.A NE2 ASP 9.A OD2 no hydrogen 2.968 N/A GLN 172.A NE2 TYR 165.A O no hydrogen 2.969 N/A GLN 173.A N.A ALA 169.A O no hydrogen 3.019 N/A GLN 173.A N.B ALA 169.A O no hydrogen 3.003 N/A ARG 174.A N GLU 170.A O.A no hydrogen 2.936 N/A ARG 174.A N GLU 170.A O.B no hydrogen 2.871 N/A ARG 174.A NE ALA 106.A O no hydrogen 2.814 N/A ARG 174.A NH2 ALA 106.A O no hydrogen 2.947 N/A THR 175.A N LEU 171.A O no hydrogen 2.829 N/A THR 175.A OG1 LEU 171.A O no hydrogen 2.730 N/A GLY 176.A N GLN 172.A O no hydrogen 3.087 N/A ALA 177.A N GLN 173.A O.A no hydrogen 3.152 N/A ALA 177.A N GLN 173.A O.B no hydrogen 3.220 N/A VAL 178.A N ARG 174.A O no hydrogen 2.942 N/A TYR 179.A N THR 175.A O no hydrogen 2.909 N/A TYR 179.A OH GLU 6.A OE2 no hydrogen 2.665 N/A ALA 180.A N GLY 176.A O no hydrogen 3.121 N/A GLU 181.A N ALA 177.A O no hydrogen 3.188 N/A LEU 182.A N VAL 178.A O no hydrogen 2.847 N/A ALA 183.A N TYR 179.A O no hydrogen 2.971 N/A ALA 184.A N ALA 180.A O no hydrogen 3.100 N/A GLN 185.A N.A GLU 181.A O no hydrogen 2.968 N/A GLN 185.A N.B GLU 181.A O no hydrogen 3.009 N/A GLN 185.A NE2.B ALA 112.A O no hydrogen 3.457 N/A GLY 186.A N ALA 183.A O no hydrogen 3.065 N/A TRP 187.A N LEU 182.A O no hydrogen 2.999 N/A GLY 189.A N GLY 186.A O no hydrogen 3.119 N/A TRP 191.A NE1 TRP 187.A O no hydrogen 2.835 N/A LEU 192.A N.A GLN 136.A O no hydrogen 2.998 N/A LEU 192.A N.B GLN 136.A O no hydrogen 3.011 N/A VAL 194.A N LEU 138.A O no hydrogen 2.900 N/A VAL 198.A N GLY 195.A O no hydrogen 3.201 N/A ARG 202.A N ASP 199.A OD2 no hydrogen 2.916 N/A LEU 203.A N ASP 199.A O no hydrogen 2.931 N/A ALA 204.A N PRO 200.A O no hydrogen 2.987 N/A ALA 205.A N GLY 201.A O no hydrogen 3.213 N/A THR 206.A N ARG 202.A O no hydrogen 2.874 N/A THR 206.A OG1 ARG 202.A O no hydrogen 2.989 N/A LEU 207.A N LEU 203.A O no hydrogen 3.004 N/A ALA 208.A N ALA 204.A O no hydrogen 2.648 N/A