Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1isc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N ASN 39.A OD1 no hydrogen 2.794 N/A TYR 9.A OH TRP 77.A O no hydrogen 2.709 N/A ALA 13.A N ALA 10.A O no hydrogen 3.002 N/A ALA 15.A N ASP 12.A O no hydrogen 3.322 N/A HIS 17.A N LEU 14.A O no hydrogen 2.889 N/A HIS 17.A ND1 HIS 176.A ND1 no hydrogen 2.940 N/A ILE 18.A N LEU 14.A O no hydrogen 3.133 N/A SER 19.A N ASP 165.A OD2 no hydrogen 3.097 N/A SER 19.A OG THR 22.A OG1 no hydrogen 3.233 N/A SER 19.A OG ASP 165.A OD1 no hydrogen 2.590 N/A SER 19.A OG ASP 165.A OD2 no hydrogen 3.343 N/A THR 22.A N SER 19.A OG no hydrogen 3.080 N/A THR 22.A OG1 SER 19.A OG no hydrogen 3.233 N/A THR 22.A OG1 ASP 165.A OD1 no hydrogen 3.359 N/A THR 22.A OG1 ASP 165.A OD2 no hydrogen 2.804 N/A ILE 23.A N SER 19.A O no hydrogen 3.160 N/A GLU 24.A N ALA 20.A O no hydrogen 2.952 N/A TYR 25.A N GLU 21.A O no hydrogen 3.098 N/A HIS 26.A N.A THR 22.A O no hydrogen 2.797 N/A HIS 26.A N.B THR 22.A O no hydrogen 2.799 N/A HIS 26.A NE2.A HIS 73.A NE2.B no hydrogen 3.051 N/A HIS 26.A NE2.B HIS 73.A NE2.B no hydrogen 3.064 N/A TYR 27.A N ILE 23.A O no hydrogen 2.806 N/A TYR 27.A OH PRO 5.A O no hydrogen 2.755 N/A GLY 28.A N ILE 23.A O no hydrogen 3.333 N/A LYS 29.A N TYR 25.A O no hydrogen 2.934 N/A HIS 30.A N TYR 25.A O no hydrogen 2.861 N/A HIS 31.A N HIS 26.A O.A no hydrogen 2.953 N/A HIS 31.A N HIS 26.A O.B no hydrogen 2.934 N/A HIS 31.A NE2 VAL 70.A O no hydrogen 3.154 N/A GLN 32.A N TYR 27.A O no hydrogen 3.385 N/A GLN 32.A NE2 GLN 32.A O no hydrogen 3.028 N/A THR 33.A N LYS 29.A O no hydrogen 2.986 N/A THR 33.A OG1 LYS 29.A O no hydrogen 2.818 N/A TYR 34.A N.A HIS 30.A O no hydrogen 3.192 N/A TYR 34.A N.B HIS 30.A O no hydrogen 3.188 N/A VAL 35.A N HIS 31.A O no hydrogen 3.326 N/A THR 36.A N GLN 32.A O no hydrogen 3.065 N/A THR 36.A OG1 GLN 32.A O no hydrogen 3.206 N/A ASN 37.A N THR 33.A O no hydrogen 2.901 N/A LEU 38.A N TYR 34.A O.A no hydrogen 2.922 N/A LEU 38.A N TYR 34.A O.B no hydrogen 2.935 N/A ASN 39.A N VAL 35.A O no hydrogen 2.941 N/A ASN 39.A ND2 PHE 2.A O no hydrogen 3.015 N/A ASN 40.A N THR 36.A O no hydrogen 3.014 N/A LEU 41.A N ASN 37.A O no hydrogen 2.997 N/A ILE 42.A N LEU 38.A O no hydrogen 3.113 N/A LYS 43.A N ASN 39.A O no hydrogen 3.276 N/A GLY 44.A N GLU 48.A OE1 no hydrogen 3.499 N/A THR 45.A N ILE 42.A O no hydrogen 3.003 N/A THR 45.A OG1 ILE 42.A O no hydrogen 2.676 N/A PHE 47.A N THR 45.A OG1 no hydrogen 3.299 N/A GLU 48.A N THR 45.A O no hydrogen 3.276 N/A LYS 50.A N PHE 47.A O no hydrogen 3.128 N/A SER 51.A N GLU 54.A OE1 no hydrogen 3.004 N/A SER 51.A OG GLU 54.A OE1 no hydrogen 3.129 N/A GLU 53.A N GLU 53.A OE1 no hydrogen 2.873 N/A GLU 54.A N SER 51.A OG no hydrogen 3.290 N/A ILE 55.A N SER 51.A O no hydrogen 2.948 N/A ILE 56.A N LEU 52.A O no hydrogen 3.002 N/A ARG 57.A N GLU 53.A O no hydrogen 2.950 N/A ARG 57.A NE LEU 145.A O no hydrogen 3.006 N/A SER 58.A N ILE 55.A O no hydrogen 3.099 N/A SER 58.A OG GLU 54.A O no hydrogen 2.788 N/A SER 58.A OG ILE 55.A O no hydrogen 3.557 N/A SER 59.A OG ILE 55.A O no hydrogen 2.800 N/A PHE 64.A N GLU 60.A O no hydrogen 3.489 N/A ASN 65.A N GLY 61.A O no hydrogen 2.895 N/A ASN 66.A N GLY 62.A O no hydrogen 3.046 N/A ASN 66.A ND2 ASN 37.A OD1 no hydrogen 3.681 N/A ALA 67.A N VAL 63.A O no hydrogen 2.928 N/A ALA 68.A N PHE 64.A O no hydrogen 2.830 N/A GLN 69.A N ASN 65.A O no hydrogen 3.159 N/A GLN 69.A NE2 TYR 34.A OH.A no hydrogen 2.997 N/A GLN 69.A NE2 TYR 34.A OH.B no hydrogen 3.055 N/A VAL 70.A N ASN 66.A O no hydrogen 2.985 N/A TRP 71.A N ALA 67.A O no hydrogen 3.175 N/A TRP 71.A NE1 GLU 53.A OE2 no hydrogen 2.925 N/A ASN 72.A N ALA 68.A O no hydrogen 2.826 N/A ASN 72.A ND2 GLN 69.A OE1 no hydrogen 3.355 N/A ASN 72.A ND2 ALA 141.A O no hydrogen 3.207 N/A HIS 73.A N.A GLN 69.A O no hydrogen 3.130 N/A HIS 73.A N.B GLN 69.A O no hydrogen 3.121 N/A HIS 73.A ND1.A GLN 69.A O no hydrogen 2.762 N/A HIS 73.A ND1.B GLN 69.A O no hydrogen 2.868 N/A HIS 73.A NE2.A ASP 156.A OD2.A no hydrogen 3.123 N/A HIS 73.A NE2.A ASP 156.A OD2.B no hydrogen 2.954 N/A HIS 73.A NE2.B HIS 26.A NE2.B no hydrogen 3.064 N/A THR 74.A N VAL 70.A O no hydrogen 3.222 N/A THR 74.A OG1 VAL 70.A O no hydrogen 3.314 N/A PHE 75.A N TRP 71.A O no hydrogen 3.031 N/A TYR 76.A N ASN 72.A O no hydrogen 2.956 N/A TYR 76.A OH TYR 173.A OH no hydrogen 2.674 N/A TRP 77.A N HIS 73.A O.A no hydrogen 2.905 N/A TRP 77.A N HIS 73.A O.B no hydrogen 2.923 N/A TRP 77.A NE1 HIS 31.A ND1 no hydrogen 3.059 N/A ASN 78.A N THR 74.A O no hydrogen 3.195 N/A CYS 79.A N PHE 75.A O no hydrogen 3.035 N/A CYS 79.A N TYR 76.A O no hydrogen 3.042 N/A CYS 79.A SG PHE 75.A O no hydrogen 3.326 N/A LEU 80.A N TRP 77.A O no hydrogen 3.322 N/A ALA 81.A N LEU 180.A O no hydrogen 2.794 N/A GLY 85.A N VAL 181.A O no hydrogen 2.852 N/A ALA 93.A N THR 89.A O no hydrogen 3.429 N/A GLU 94.A N GLY 90.A O no hydrogen 3.115 N/A ALA 95.A N LYS 91.A O no hydrogen 2.874 N/A ILE 96.A N VAL 92.A O no hydrogen 2.943 N/A ALA 97.A N ALA 93.A O no hydrogen 2.916 N/A ALA 98.A N GLU 94.A O no hydrogen 3.005 N/A SER 99.A N ALA 95.A O no hydrogen 3.111 N/A SER 99.A N ILE 96.A O no hydrogen 3.272 N/A SER 99.A OG ALA 95.A O no hydrogen 3.391 N/A PHE 100.A N ILE 96.A O no hydrogen 2.908 N/A GLY 101.A N ALA 97.A O no hydrogen 2.810 N/A ASP 105.A N SER 102.A OG no hydrogen 3.177 N/A PHE 106.A N SER 102.A O no hydrogen 3.122 N/A LYS 107.A N PHE 103.A O no hydrogen 2.918 N/A ALA 108.A N ALA 104.A O no hydrogen 3.136 N/A GLN 109.A N ASP 105.A O no hydrogen 3.014 N/A PHE 110.A N PHE 106.A O no hydrogen 2.812 N/A THR 111.A N LYS 107.A O no hydrogen 2.951 N/A THR 111.A OG1 LYS 107.A O no hydrogen 2.828 N/A ASP 112.A N ALA 108.A O no hydrogen 3.006 N/A ALA 113.A N GLN 109.A O no hydrogen 3.100 N/A ALA 114.A N PHE 110.A O no hydrogen 3.061 N/A ILE 115.A N THR 111.A O no hydrogen 2.976 N/A LYS 116.A N ASP 112.A O no hydrogen 2.993 N/A LYS 116.A NZ ASP 112.A OD2 no hydrogen 2.921 N/A ASN 117.A ND2 THR 138.A O no hydrogen 3.225 N/A TRP 122.A N THR 138.A O no hydrogen 3.076 N/A TRP 122.A NE1 GLN 69.A OE1 no hydrogen 3.079 N/A THR 123.A N VAL 155.A O no hydrogen 3.269 N/A THR 123.A OG1 SER 137.A OG no hydrogen 3.092 N/A TRP 124.A N VAL 136.A O no hydrogen 2.805 N/A TRP 124.A NE1 THR 138.A OG1 no hydrogen 3.026 N/A LEU 125.A N LEU 153.A O no hydrogen 2.940 N/A VAL 126.A N ALA 134.A O no hydrogen 2.846 N/A LYS 127.A N THR 150.A O no hydrogen 2.816 N/A LYS 127.A NZ LEU 190.A O no hydrogen 3.366 N/A LYS 127.A NZ ALA 192.A O no hydrogen 3.183 N/A ASN 128.A N LYS 132.A O no hydrogen 2.868 N/A SER 129.A OG ASP 148.A OD2 no hydrogen 3.071 N/A GLY 131.A N ASN 128.A O no hydrogen 2.990 N/A LYS 132.A N ASP 130.A OD1 no hydrogen 3.457 N/A LEU 133.A N SER 99.A OG no hydrogen 2.974 N/A ALA 134.A N VAL 126.A O no hydrogen 2.901 N/A VAL 136.A N TRP 124.A O no hydrogen 3.003 N/A SER 137.A OG THR 123.A OG1 no hydrogen 3.092 N/A THR 138.A N TRP 122.A O no hydrogen 2.834 N/A THR 138.A OG1 GLY 142.A O no hydrogen 2.700 N/A ASN 140.A N SER 120.A O no hydrogen 2.836 N/A ASN 140.A ND2 SER 120.A O no hydrogen 3.515 N/A GLY 142.A N SER 139.A O no hydrogen 2.940 N/A THR 143.A OG1 ASN 72.A OD1 no hydrogen 3.215 N/A THR 146.A N THR 143.A O no hydrogen 3.240 N/A THR 146.A OG1 THR 143.A O no hydrogen 2.925 N/A THR 147.A N PRO 144.A O no hydrogen 2.814 N/A THR 147.A OG1 PRO 144.A O no hydrogen 2.787 N/A ALA 149.A N THR 147.A OG1 no hydrogen 3.233 N/A THR 150.A N LYS 127.A O no hydrogen 2.868 N/A LEU 152.A N LEU 125.A O no hydrogen 2.857 N/A LEU 153.A N LEU 125.A O no hydrogen 3.389 N/A THR 154.A OG1 THR 123.A O no hydrogen 3.157 N/A VAL 155.A N THR 123.A O no hydrogen 3.040 N/A VAL 157.A N GLY 121.A O no hydrogen 2.904 N/A TRP 158.A N ASP 156.A OD1.A no hydrogen 3.251 N/A TRP 158.A N ASP 156.A OD1.B no hydrogen 3.046 N/A TRP 158.A NE1 ASN 140.A O no hydrogen 3.036 N/A ALA 161.A N TRP 158.A O no hydrogen 3.023 N/A TYR 162.A N GLU 159.A O no hydrogen 3.100 N/A TYR 163.A N GLU 159.A O no hydrogen 2.863 N/A TYR 166.A N TYR 162.A O no hydrogen 2.878 N/A TYR 166.A OH HIS 17.A O no hydrogen 2.731 N/A ARG 167.A N TYR 163.A O no hydrogen 2.932 N/A ARG 167.A NH1 TYR 163.A O no hydrogen 2.975 N/A ALA 169.A N TYR 166.A O no hydrogen 2.968 N/A ARG 170.A N ASN 168.A O no hydrogen 2.935 N/A ARG 170.A NE TYR 162.A OH no hydrogen 2.991 N/A ARG 170.A NH1 ALA 114.A O no hydrogen 2.959 N/A ARG 170.A NH1 ASN 117.A O no hydrogen 2.725 N/A ARG 170.A NH2 GLY 119.A O no hydrogen 3.033 N/A GLY 172.A N ALA 169.A O no hydrogen 2.994 N/A TYR 173.A N ALA 169.A O no hydrogen 3.335 N/A TYR 173.A OH TYR 76.A OH no hydrogen 2.674 N/A TYR 173.A OH ASP 156.A O.A no hydrogen 2.797 N/A TYR 173.A OH ASP 156.A O.B no hydrogen 2.793 N/A LEU 174.A N ARG 170.A O no hydrogen 3.014 N/A GLU 175.A N PRO 171.A O no hydrogen 2.978 N/A HIS 176.A N GLY 172.A O no hydrogen 3.094 N/A HIS 176.A ND1 HIS 17.A ND1 no hydrogen 2.940 N/A PHE 177.A N TYR 173.A O no hydrogen 2.929 N/A TRP 178.A NE1 THR 111.A OG1 no hydrogen 3.050 N/A ALA 179.A N HIS 176.A O no hydrogen 3.232 N/A LEU 180.A N PHE 177.A O no hydrogen 2.861 N/A ASN 182.A N CYS 79.A O no hydrogen 2.898 N/A TRP 183.A NE1 GLY 86.A O no hydrogen 2.978 N/A PHE 185.A N ASN 182.A O no hydrogen 3.095 N/A VAL 186.A N ASN 182.A O no hydrogen 3.421 N/A ALA 187.A N TRP 183.A O no hydrogen 3.016 N/A LYS 188.A N GLU 184.A O no hydrogen 3.105 N/A ASN 189.A N PHE 185.A O no hydrogen 2.964 N/A LEU 190.A N VAL 186.A O no hydrogen 2.803 N/A ALA 191.A N ALA 187.A O no hydrogen 3.355 N/A ALA 192.A N ASN 189.A O no hydrogen 3.213 N/A