Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1e12_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N GLU 2.A O no hydrogen 2.979 N/A SER 7.A N ASN 3.A O no hydrogen 2.829 N/A SER 7.A OG ASN 3.A O no hydrogen 3.112 N/A SER 7.A OG ALA 4.A O no hydrogen 3.317 N/A SER 8.A N ALA 4.A O no hydrogen 2.971 N/A SER 8.A OG ALA 4.A O no hydrogen 2.915 N/A SER 8.A OG LEU 5.A O no hydrogen 3.012 N/A SER 9.A N LEU 5.A O no hydrogen 3.446 N/A SER 9.A OG LEU 6.A O no hydrogen 2.659 N/A SER 9.A OG SER 208.A OG no hydrogen 2.788 N/A LEU 10.A N SER 7.A O no hydrogen 3.153 N/A TRP 11.A N SER 7.A O no hydrogen 3.054 N/A VAL 12.A N SER 8.A O no hydrogen 2.928 N/A ASN 13.A N LEU 10.A O no hydrogen 3.104 N/A ASN 13.A ND2 TYR 54.A OH no hydrogen 3.039 N/A ASN 13.A ND2 SER 212.A O no hydrogen 3.037 N/A VAL 14.A N LEU 10.A O no hydrogen 3.164 N/A ALA 15.A N TRP 11.A O no hydrogen 3.030 N/A LEU 16.A N VAL 12.A O no hydrogen 2.965 N/A ALA 17.A N ASN 13.A O no hydrogen 2.830 N/A GLY 18.A N VAL 14.A O no hydrogen 3.003 N/A ILE 19.A N ALA 15.A O no hydrogen 2.947 N/A ALA 20.A N LEU 16.A O no hydrogen 2.866 N/A ILE 21.A N ALA 17.A O no hydrogen 2.979 N/A LEU 22.A N GLY 18.A O no hydrogen 3.260 N/A VAL 23.A N ILE 19.A O no hydrogen 2.940 N/A PHE 24.A N ALA 20.A O no hydrogen 2.806 N/A VAL 25.A N ILE 21.A O no hydrogen 2.960 N/A TYR 26.A N LEU 22.A O no hydrogen 3.004 N/A MET 27.A N VAL 23.A O no hydrogen 2.826 N/A GLY 28.A N PHE 24.A O no hydrogen 2.938 N/A ARG 29.A N VAL 25.A O no hydrogen 3.101 N/A ILE 31.A N GLY 28.A O no hydrogen 3.056 N/A ARG 32.A N GLU 234.A OE1 no hydrogen 2.928 N/A ARG 35.A NH2 PRO 33.A O no hydrogen 3.267 N/A LEU 38.A N GLY 34.A O no hydrogen 2.944 N/A ILE 39.A N ARG 35.A O no hydrogen 3.059 N/A TRP 40.A N PRO 36.A O no hydrogen 3.064 N/A TRP 40.A NE1 PHE 24.A O no hydrogen 2.891 N/A GLY 41.A N ARG 37.A O no hydrogen 2.981 N/A ALA 42.A N LEU 38.A O no hydrogen 3.036 N/A THR 43.A N ILE 39.A O no hydrogen 2.908 N/A THR 43.A OG1 ALA 223.A O no hydrogen 3.527 N/A LEU 44.A N TRP 40.A O no hydrogen 2.997 N/A LEU 44.A N GLY 41.A O no hydrogen 3.035 N/A MET 45.A N GLY 41.A O no hydrogen 2.997 N/A ILE 46.A N ALA 42.A O no hydrogen 3.003 N/A LEU 48.A N LEU 44.A O no hydrogen 3.345 N/A VAL 49.A N MET 45.A O no hydrogen 2.902 N/A SER 50.A N ILE 46.A O no hydrogen 3.052 N/A SER 50.A OG TYR 220.A OH no hydrogen 2.577 N/A ILE 51.A N PRO 47.A O no hydrogen 2.861 N/A SER 52.A N LEU 48.A O no hydrogen 3.148 N/A SER 53.A N VAL 49.A O no hydrogen 3.016 N/A TYR 54.A N SER 50.A O no hydrogen 3.062 N/A TYR 54.A OH ASP 215.A OD2 no hydrogen 2.384 N/A LEU 55.A N ILE 51.A O no hydrogen 2.928 N/A GLY 56.A N SER 52.A O no hydrogen 2.928 N/A LEU 57.A N SER 53.A O no hydrogen 3.127 N/A LEU 58.A N TYR 54.A O no hydrogen 2.844 N/A SER 59.A N LEU 55.A O no hydrogen 2.947 N/A SER 59.A OG LEU 55.A O no hydrogen 2.930 N/A SER 59.A OG GLY 56.A O no hydrogen 3.185 N/A GLY 60.A N GLY 56.A O no hydrogen 3.251 N/A GLY 60.A N LEU 57.A O no hydrogen 3.297 N/A LEU 61.A N SER 59.A OG no hydrogen 3.204 N/A THR 62.A N GLY 56.A O no hydrogen 3.160 N/A GLY 64.A N SER 81.A O no hydrogen 3.270 N/A ILE 66.A N VAL 79.A O no hydrogen 2.724 N/A MET 68.A N GLU 77.A O no hydrogen 3.084 N/A HIS 72.A N PRO 69.A O no hydrogen 3.008 N/A HIS 72.A NE2 VAL 195.A O no hydrogen 2.974 N/A LEU 74.A N HIS 72.A ND1 no hydrogen 2.736 N/A ALA 75.A N HIS 72.A O no hydrogen 2.989 N/A GLY 76.A N MET 68.A O no hydrogen 2.904 N/A GLU 77.A N LEU 74.A O no hydrogen 2.969 N/A VAL 79.A N ILE 66.A O no hydrogen 2.695 N/A SER 81.A N GLY 64.A O no hydrogen 2.732 N/A SER 81.A OG GLU 196.A OE2 no hydrogen 3.082 N/A GLN 82.A NE2 SER 208.A OG no hydrogen 2.931 N/A GLY 84.A N THR 62.A O no hydrogen 2.923 N/A ARG 85.A N GLN 82.A O no hydrogen 3.087 N/A ARG 85.A NE GLN 82.A OE1 no hydrogen 2.897 N/A ARG 85.A NH1 TYR 54.A OH no hydrogen 2.979 N/A ARG 85.A NH2 SER 208.A OG no hydrogen 3.018 N/A ARG 85.A NH2 SER 212.A OG no hydrogen 3.218 N/A TYR 86.A OH GLU 196.A OE2 no hydrogen 2.780 N/A LEU 87.A N TRP 83.A O no hydrogen 2.948 N/A THR 88.A N GLY 84.A O no hydrogen 2.932 N/A THR 88.A OG1 GLY 84.A O no hydrogen 2.907 N/A TRP 89.A N ARG 85.A O no hydrogen 3.149 N/A ALA 90.A N LEU 87.A O no hydrogen 3.064 N/A LEU 91.A N THR 88.A O no hydrogen 2.835 N/A SER 92.A N THR 88.A O no hydrogen 3.102 N/A SER 92.A OG THR 88.A O no hydrogen 3.535 N/A THR 93.A N TRP 89.A O no hydrogen 2.989 N/A THR 93.A OG1 TRP 89.A O no hydrogen 2.744 N/A THR 93.A OG1 ASP 118.A OD1 no hydrogen 3.227 N/A THR 93.A OG1 ASP 118.A OD2 no hydrogen 2.553 N/A ILE 96.A N SER 92.A O no hydrogen 3.076 N/A LEU 97.A N THR 93.A O no hydrogen 2.989 N/A LEU 98.A N PRO 94.A O no hydrogen 2.650 N/A ALA 99.A N MET 95.A O no hydrogen 2.919 N/A LEU 100.A N ILE 96.A O no hydrogen 2.994 N/A GLY 101.A N LEU 97.A O no hydrogen 2.802 N/A LEU 102.A N LEU 98.A O no hydrogen 2.848 N/A LEU 103.A N ALA 99.A O no hydrogen 2.984 N/A ALA 104.A N LEU 100.A O no hydrogen 2.886 N/A ASP 105.A N LEU 102.A O no hydrogen 3.168 N/A VAL 106.A N GLY 101.A O no hydrogen 2.936 N/A SER 110.A N ASP 107.A OD2 no hydrogen 3.103 N/A SER 110.A OG ASP 159.A OD2 no hydrogen 2.967 N/A LEU 111.A N ASP 107.A O no hydrogen 3.035 N/A PHE 112.A N LEU 108.A O no hydrogen 2.785 N/A THR 113.A N GLY 109.A O no hydrogen 3.081 N/A THR 113.A OG1 GLY 109.A O no hydrogen 2.656 N/A VAL 114.A N SER 110.A O no hydrogen 2.936 N/A ILE 115.A N LEU 111.A O no hydrogen 2.954 N/A ALA 116.A N PHE 112.A O no hydrogen 2.891 N/A ALA 117.A N THR 113.A O no hydrogen 3.044 N/A ASP 118.A N VAL 114.A O no hydrogen 2.860 N/A ILE 119.A N ILE 115.A O no hydrogen 2.807 N/A GLY 120.A N ALA 116.A O no hydrogen 3.039 N/A MET 121.A N ALA 117.A O no hydrogen 2.915 N/A CYS 122.A N ASP 118.A O no hydrogen 3.041 N/A CYS 122.A SG THR 93.A OG1 no hydrogen 3.388 N/A CYS 122.A SG ASP 118.A O no hydrogen 3.488 N/A VAL 123.A N ILE 119.A O no hydrogen 2.863 N/A THR 124.A N GLY 120.A O no hydrogen 3.045 N/A THR 124.A OG1 GLY 120.A O no hydrogen 2.700 N/A THR 124.A OG1 MET 121.A O no hydrogen 3.319 N/A GLY 125.A N MET 121.A O no hydrogen 3.007 N/A LEU 126.A N CYS 122.A O no hydrogen 2.988 N/A ALA 127.A N VAL 123.A O no hydrogen 3.051 N/A ALA 128.A N THR 124.A O no hydrogen 2.981 N/A ALA 129.A N GLY 125.A O no hydrogen 3.146 N/A MET 130.A N LEU 126.A O no hydrogen 2.908 N/A THR 131.A N ALA 127.A O no hydrogen 2.911 N/A THR 131.A OG1 ALA 127.A O no hydrogen 2.758 N/A ARG 138.A NH1 ALA 129.A O no hydrogen 2.995 N/A ARG 138.A NH1 THR 131.A O no hydrogen 2.711 N/A ARG 138.A NH2 GLU 196.A O no hydrogen 2.826 N/A ARG 138.A NH2 GLU 196.A OE1 no hydrogen 2.753 N/A TRP 139.A N LEU 135.A O no hydrogen 3.282 N/A ALA 140.A N LEU 136.A O no hydrogen 2.951 N/A PHE 141.A N PHE 137.A O no hydrogen 2.992 N/A TYR 142.A N ARG 138.A O no hydrogen 3.065 N/A TYR 142.A OH PRO 188.A O no hydrogen 2.880 N/A ALA 143.A N TRP 139.A O no hydrogen 2.854 N/A ILE 144.A N ALA 140.A O no hydrogen 3.054 N/A SER 145.A N PHE 141.A O no hydrogen 2.891 N/A SER 145.A OG MET 121.A O no hydrogen 2.720 N/A CYS 146.A N TYR 142.A O no hydrogen 2.995 N/A CYS 146.A SG TYR 142.A O no hydrogen 3.428 N/A ALA 147.A N ALA 143.A O no hydrogen 3.027 N/A PHE 148.A N ILE 144.A O no hydrogen 3.047 N/A PHE 149.A N SER 145.A O no hydrogen 2.913 N/A VAL 150.A N CYS 146.A O no hydrogen 2.891 N/A VAL 151.A N ALA 147.A O no hydrogen 3.357 N/A VAL 152.A N PHE 148.A O no hydrogen 3.194 N/A LEU 153.A N PHE 149.A O no hydrogen 2.787 N/A SER 154.A N VAL 150.A O no hydrogen 2.835 N/A ALA 155.A N VAL 151.A O no hydrogen 3.238 N/A LEU 156.A N VAL 152.A O no hydrogen 3.022 N/A VAL 157.A N LEU 153.A O no hydrogen 2.836 N/A THR 158.A OG1 SER 154.A O no hydrogen 2.653 N/A ASP 159.A N THR 158.A OG1 no hydrogen 2.509 N/A TRP 160.A N ALA 155.A O no hydrogen 2.951 N/A TRP 160.A NE1 SER 110.A OG no hydrogen 2.696 N/A ALA 162.A N THR 158.A O no hydrogen 3.381 N/A ALA 162.A N ASP 159.A O no hydrogen 3.116 N/A SER 163.A N ASP 159.A O no hydrogen 3.406 N/A SER 163.A OG ALA 104.A O no hydrogen 3.133 N/A SER 163.A OG ASP 105.A O no hydrogen 3.013 N/A ALA 164.A N TRP 160.A O no hydrogen 3.017 N/A SER 165.A N ALA 161.A O no hydrogen 3.121 N/A SER 166.A N SER 163.A O no hydrogen 3.232 N/A ALA 167.A N ALA 164.A O no hydrogen 2.865 N/A THR 169.A N ALA 164.A O no hydrogen 3.103 N/A THR 169.A OG1 LEU 103.A O no hydrogen 2.816 N/A THR 169.A OG1 ALA 164.A O no hydrogen 3.543 N/A PHE 173.A N THR 169.A O no hydrogen 2.957 N/A ASP 174.A N ALA 170.A O no hydrogen 2.649 N/A THR 175.A N GLU 171.A O no hydrogen 3.241 N/A THR 175.A OG1 GLU 171.A O no hydrogen 3.225 N/A LEU 176.A N ILE 172.A O no hydrogen 3.028 N/A ARG 177.A N PHE 173.A O no hydrogen 2.824 N/A ARG 177.A NH1 ASP 174.A OD1 no hydrogen 2.995 N/A VAL 178.A N ASP 174.A O no hydrogen 3.044 N/A LEU 179.A N THR 175.A O no hydrogen 3.068 N/A THR 180.A N LEU 176.A O no hydrogen 2.940 N/A THR 180.A OG1 LEU 176.A O no hydrogen 2.745 N/A VAL 181.A N ARG 177.A O no hydrogen 2.865 N/A VAL 182.A N VAL 178.A O no hydrogen 2.942 N/A LEU 183.A N LEU 179.A O no hydrogen 2.965 N/A TRP 184.A N THR 180.A O no hydrogen 2.756 N/A LEU 185.A N VAL 181.A O no hydrogen 3.194 N/A GLY 186.A N LEU 183.A O no hydrogen 2.953 N/A TYR 187.A N TRP 184.A O no hydrogen 3.098 N/A TYR 187.A OH ASP 215.A OD1 no hydrogen 2.754 N/A VAL 190.A N GLY 186.A O no hydrogen 2.916 N/A TRP 191.A N TYR 187.A O no hydrogen 2.975 N/A ALA 192.A N PRO 188.A O no hydrogen 3.002 N/A VAL 193.A N ILE 189.A O no hydrogen 2.921 N/A GLY 194.A N VAL 190.A O no hydrogen 2.849 N/A GLY 197.A N GLY 194.A O no hydrogen 3.020 N/A LEU 198.A N ALA 192.A O no hydrogen 2.656 N/A ALA 199.A N GLY 194.A O no hydrogen 2.970 N/A VAL 201.A N VAL 193.A O no hydrogen 3.119 N/A GLN 202.A NE2 ALA 199.A O no hydrogen 3.275 N/A ALA 206.A N SER 203.A OG no hydrogen 3.078 N/A THR 207.A N SER 203.A O no hydrogen 3.239 N/A SER 208.A N VAL 204.A O no hydrogen 2.914 N/A SER 208.A OG SER 9.A OG no hydrogen 2.788 N/A TRP 209.A N GLY 205.A O no hydrogen 3.009 N/A ALA 210.A N ALA 206.A O no hydrogen 2.962 N/A TYR 211.A N THR 207.A O no hydrogen 2.988 N/A SER 212.A N SER 208.A O no hydrogen 2.892 N/A SER 212.A OG SER 9.A O no hydrogen 2.881 N/A SER 212.A OG SER 208.A O no hydrogen 2.953 N/A VAL 213.A N TRP 209.A O no hydrogen 2.863 N/A LEU 214.A N ALA 210.A O no hydrogen 3.048 N/A ASP 215.A N TYR 211.A O no hydrogen 2.834 N/A VAL 216.A N SER 212.A O no hydrogen 3.112 N/A PHE 217.A N VAL 213.A O no hydrogen 3.501 N/A ALA 218.A N LEU 214.A O no hydrogen 2.744 N/A LYS 219.A N ASP 215.A O no hydrogen 2.917 N/A LYS 219.A NZ ASP 215.A OD1 no hydrogen 3.471 N/A TYR 220.A OH SER 50.A OG no hydrogen 2.577 N/A VAL 221.A N VAL 216.A O no hydrogen 2.881 N/A PHE 222.A N PHE 217.A O no hydrogen 3.046 N/A ALA 223.A N LYS 219.A O no hydrogen 2.894 N/A PHE 224.A N TYR 220.A O no hydrogen 2.918 N/A ILE 225.A N VAL 221.A O no hydrogen 2.985 N/A LEU 226.A N PHE 222.A O no hydrogen 3.059 N/A LEU 227.A N ALA 223.A O no hydrogen 2.800 N/A ARG 228.A N PHE 224.A O no hydrogen 2.796 N/A TRP 229.A N ILE 225.A O no hydrogen 3.075 N/A VAL 230.A N LEU 226.A O no hydrogen 2.984 N/A ALA 231.A N LEU 227.A O no hydrogen 2.935 N/A ASN 232.A N ARG 228.A O no hydrogen 3.000 N/A ASN 233.A N VAL 230.A O no hydrogen 3.290 N/A ASN 233.A ND2 TRP 229.A O no hydrogen 2.841 N/A VAL 237.A N ASN 233.A O no hydrogen 3.354 N/A ALA 238.A N GLU 234.A O no hydrogen 2.903 N/A VAL 239.A N ARG 235.A O no hydrogen 3.066 N/A