Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3h85_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 ILE 84.A O no hydrogen 2.779 N/A ARG 4.A NE GLY 50.A O no hydrogen 3.068 N/A ARG 4.A NH1 PRO 85.A O no hydrogen 3.134 N/A ARG 4.A NH2 LEU 48.A O no hydrogen 2.649 N/A ARG 4.A NH2 GLY 50.A O no hydrogen 2.927 N/A TYR 10.A N SER 49.A OG no hydrogen 2.796 N/A TYR 10.A OH ASP 87.A OD1 no hydrogen 2.993 N/A TYR 10.A OH ASP 87.A OD2 no hydrogen 2.913 N/A GLU 14.A N TYR 47.A O no hydrogen 2.905 N/A LEU 15.A N ILE 237.A O no hydrogen 2.859 N/A PHE 16.A N LYS 45.A O no hydrogen 2.681 N/A LEU 17.A N TRP 239.A O no hydrogen 2.810 N/A ASP 18.A N VAL 43.A O no hydrogen 2.726 N/A VAL 19.A N ARG 241.A O no hydrogen 2.771 N/A LEU 20.A N ARG 41.A O no hydrogen 3.002 N/A GLU 21.A N ILE 243.A O no hydrogen 2.908 N/A SER 22.A N SER 39.A O no hydrogen 3.058 N/A VAL 23.A N ARG 245.A O no hydrogen 2.959 N/A ASN 24.A N HIS 37.A O no hydrogen 2.840 N/A ASN 24.A ND2 HIS 37.A O no hydrogen 3.550 N/A LEU 25.A N ILE 248.A O no hydrogen 2.662 N/A LEU 26.A N SER 35.A O no hydrogen 2.749 N/A MET 27.A N GLU 250.A O no hydrogen 2.944 N/A SER 28.A N GLN 32.A O no hydrogen 2.856 N/A SER 28.A OG GLN 30.A OE1 no hydrogen 2.924 N/A SER 28.A OG GLN 32.A O no hydrogen 3.545 N/A GLN 30.A N SER 28.A OG no hydrogen 3.260 N/A GLY 31.A N SER 28.A O no hydrogen 3.089 N/A GLN 32.A N SER 28.A OG no hydrogen 2.980 N/A LEU 34.A N LEU 26.A O no hydrogen 2.797 N/A SER 35.A N LEU 26.A O no hydrogen 3.105 N/A HIS 37.A N ASN 24.A O no hydrogen 3.031 N/A VAL 38.A N THR 97.A O no hydrogen 2.849 N/A SER 39.A N SER 22.A O no hydrogen 3.250 N/A GLY 40.A N TYR 95.A O no hydrogen 3.012 N/A ARG 41.A N LEU 20.A O no hydrogen 2.902 N/A ARG 41.A NH1 GLU 91.A OE2 no hydrogen 2.926 N/A VAL 42.A N MET 93.A O no hydrogen 2.898 N/A VAL 43.A N ASP 18.A O no hydrogen 2.796 N/A MET 44.A N PHE 90.A O no hydrogen 2.908 N/A LYS 45.A N PHE 16.A O no hydrogen 2.773 N/A LYS 45.A NZ ASP 18.A OD2 no hydrogen 3.308 N/A SER 46.A N GLY 88.A O no hydrogen 2.728 N/A TYR 47.A N GLU 14.A O no hydrogen 2.770 N/A SER 49.A N ASN 13.A OD1 no hydrogen 2.911 N/A SER 49.A OG ASN 13.A OD1 no hydrogen 2.511 N/A GLY 50.A N ILE 8.A O no hydrogen 2.734 N/A MET 51.A N GLU 226.A OE2 no hydrogen 2.610 N/A GLU 53.A N PHE 225.A O no hydrogen 2.787 N/A CYS 54.A N PHE 83.A O no hydrogen 2.543 N/A LYS 55.A N LYS 223.A O no hydrogen 2.860 N/A PHE 56.A N ILE 81.A O no hydrogen 3.217 N/A GLY 57.A N TYR 221.A O no hydrogen 2.906 N/A ASN 59.A N LYS 218.A O no hydrogen 3.088 N/A ASN 59.A ND2 GLY 216.A O no hydrogen 2.792 N/A ASP 60.A N MET 58.A O no hydrogen 2.803 N/A SER 63.A OG ASN 59.A O no hydrogen 3.504 N/A ILE 64.A N ASN 59.A O no hydrogen 2.806 N/A ASP 67.A N ARG 96.A O no hydrogen 2.905 N/A CYS 69.A SG ASP 68.A O no hydrogen 3.304 N/A THR 70.A N ARG 94.A O no hydrogen 2.958 N/A HIS 72.A N LEU 92.A O no hydrogen 2.862 N/A CYS 74.A N HIS 72.A O no hydrogen 2.342 N/A CYS 74.A SG ILE 84.A O no hydrogen 3.998 N/A VAL 75.A N HIS 72.A O no hydrogen 2.929 N/A ARG 76.A N SER 82.A O no hydrogen 2.736 N/A ARG 79.A NH1 ARG 79.A O no hydrogen 3.350 N/A ILE 81.A N SER 80.A OG no hydrogen 2.550 N/A PHE 83.A N CYS 54.A O no hydrogen 3.135 N/A GLY 88.A N SER 46.A O no hydrogen 2.745 N/A PHE 90.A N MET 44.A O no hydrogen 2.875 N/A LEU 92.A N VAL 42.A O no hydrogen 2.756 N/A ARG 94.A N THR 70.A O no hydrogen 2.994 N/A TYR 95.A N GLY 40.A O no hydrogen 2.918 N/A TYR 95.A OH GLU 21.A OE2 no hydrogen 2.285 N/A ARG 96.A N ASP 68.A O no hydrogen 3.355 N/A THR 97.A N VAL 38.A O no hydrogen 2.834 N/A THR 97.A OG1 ALA 65.A O no hydrogen 3.451 N/A THR 98.A OG1 ASP 67.A OD1 no hydrogen 3.484 N/A THR 98.A OG1 ASP 67.A OD2 no hydrogen 2.387 N/A ILE 102.A N PRO 214.A O no hydrogen 2.683 N/A PHE 105.A N TYR 249.A OH no hydrogen 2.940 N/A ARG 106.A N LYS 126.A O no hydrogen 3.179 N/A ILE 108.A N VAL 124.A O no hydrogen 2.665 N/A LEU 110.A N LYS 122.A O no hydrogen 2.736 N/A ARG 112.A N GLU 120.A O no hydrogen 2.942 N/A VAL 114.A N LYS 118.A O no hydrogen 2.841 N/A LYS 118.A N VAL 114.A O no hydrogen 3.249 N/A LEU 119.A N ILE 188.A O no hydrogen 2.748 N/A GLU 120.A N ARG 112.A O no hydrogen 2.798 N/A VAL 121.A N ALA 186.A O no hydrogen 2.826 N/A LYS 122.A N LEU 110.A O no hydrogen 2.869 N/A LYS 122.A NZ SER 185.A OG no hydrogen 2.982 N/A VAL 123.A N ILE 184.A O no hydrogen 2.923 N/A VAL 124.A N ILE 108.A O no hydrogen 3.026 N/A ILE 125.A N SER 182.A O no hydrogen 2.934 N/A LYS 126.A N ARG 106.A O no hydrogen 2.927 N/A SER 127.A N LYS 180.A O no hydrogen 2.789 N/A SER 127.A OG ALA 177.A O no hydrogen 2.726 N/A SER 127.A OG LYS 180.A O no hydrogen 3.192 N/A ASN 128.A N PRO 104.A O no hydrogen 2.747 N/A ASN 128.A ND2 LEU 103.A O no hydrogen 3.037 N/A LEU 133.A N LYS 130.A O no hydrogen 3.078 N/A ALA 135.A N MET 176.A O no hydrogen 2.828 N/A GLN 136.A N GLU 209.A O no hydrogen 3.008 N/A LYS 137.A N LYS 174.A O no hydrogen 3.245 N/A LYS 137.A NZ GLU 209.A OE1 no hydrogen 2.963 N/A LYS 137.A NZ GLU 209.A OE2 no hydrogen 3.370 N/A ILE 138.A N ILE 173.A O no hydrogen 3.000 N/A GLU 139.A N ASN 207.A O no hydrogen 2.752 N/A VAL 140.A N TRP 171.A O no hydrogen 2.882 N/A ARG 141.A N SER 205.A O no hydrogen 2.777 N/A ILE 142.A N ILE 169.A O no hydrogen 2.936 N/A THR 144.A N ASN 167.A O no hydrogen 2.769 N/A THR 148.A OG1 PRO 145.A O no hydrogen 2.520 N/A SER 149.A N GLU 189.A O no hydrogen 2.697 N/A SER 149.A OG GLU 189.A O no hydrogen 3.008 N/A GLN 152.A N GLU 187.A O no hydrogen 2.858 N/A GLN 152.A NE2 GLU 189.A OE2 no hydrogen 3.539 N/A ILE 154.A N SER 185.A O no hydrogen 2.822 N/A CYS 155.A SG LYS 157.A O no hydrogen 3.434 N/A LYS 157.A NZ GLU 181.A O no hydrogen 3.448 N/A LYS 157.A NZ SER 182.A OG no hydrogen 2.996 N/A LYS 159.A N LYS 172.A O no hydrogen 2.852 N/A LYS 161.A N VAL 170.A O no hydrogen 3.001 N/A LYS 163.A N ALA 168.A O no hydrogen 3.040 N/A GLU 166.A N LYS 163.A O no hydrogen 2.923 N/A ASN 167.A N LYS 163.A O no hydrogen 2.862 N/A ASN 167.A N ALA 164.A O no hydrogen 2.977 N/A ILE 169.A N ILE 142.A O no hydrogen 2.851 N/A VAL 170.A N LYS 161.A O no hydrogen 2.944 N/A TRP 171.A N VAL 140.A O no hydrogen 2.899 N/A TRP 171.A NE1 LYS 157.A O no hydrogen 2.835 N/A LYS 172.A N LYS 159.A O no hydrogen 2.771 N/A ILE 173.A N ILE 138.A O no hydrogen 2.840 N/A MET 176.A N ALA 135.A O no hydrogen 2.899 N/A GLY 178.A N LEU 133.A O no hydrogen 3.152 N/A MET 179.A N SER 127.A O no hydrogen 2.799 N/A LYS 180.A N SER 127.A OG no hydrogen 3.182 N/A SER 182.A N ILE 125.A O no hydrogen 2.942 N/A ILE 184.A N VAL 123.A O no hydrogen 2.779 N/A SER 185.A N ILE 154.A O no hydrogen 2.969 N/A SER 185.A OG GLN 183.A OE1 no hydrogen 3.083 N/A ALA 186.A N VAL 121.A O no hydrogen 2.720 N/A GLU 187.A N GLN 152.A O no hydrogen 2.742 N/A ILE 188.A N LEU 119.A O no hydrogen 2.703 N/A GLU 189.A N GLY 150.A O no hydrogen 2.929 N/A LEU 190.A N THR 117.A O no hydrogen 2.851 N/A LEU 191.A N ASN 147.A O no hydrogen 2.808 N/A LYS 196.A N ASN 194.A OD1 no hydrogen 3.276 N/A LYS 197.A NZ ASN 194.A O no hydrogen 3.265 N/A LYS 198.A NZ LYS 196.A O no hydrogen 3.316 N/A ILE 204.A N THR 251.A O no hydrogen 2.909 N/A SER 205.A N ARG 141.A O no hydrogen 2.905 N/A MET 206.A N TYR 249.A O no hydrogen 3.136 N/A ASN 207.A N GLU 139.A O no hydrogen 2.654 N/A PHE 208.A N SER 246.A OG no hydrogen 3.233 N/A VAL 210.A N GLY 244.A O no hydrogen 2.736 N/A SER 215.A N GLU 21.A OE1 no hydrogen 2.958 N/A SER 215.A OG GLU 21.A OE1 no hydrogen 3.421 N/A SER 215.A OG GLU 21.A OE2 no hydrogen 2.533 N/A GLY 216.A N ALA 213.A O no hydrogen 2.943 N/A LEU 217.A N SER 215.A OG no hydrogen 3.227 N/A LYS 218.A N ASN 59.A OD1 no hydrogen 2.969 N/A VAL 219.A N TYR 242.A OH no hydrogen 2.907 N/A ARG 220.A N GLY 57.A O no hydrogen 2.592 N/A TYR 221.A N GLY 57.A O no hydrogen 3.060 N/A LYS 223.A N LYS 55.A O no hydrogen 2.948 N/A VAL 224.A N ASP 233.A OD1 no hydrogen 2.908 N/A PHE 225.A N GLU 53.A O no hydrogen 3.187 N/A LYS 228.A N GLU 226.A OE1 no hydrogen 2.921 N/A LEU 229.A N GLU 226.A OE1 no hydrogen 3.420 N/A TYR 231.A OH SER 49.A O no hydrogen 2.344 N/A SER 232.A N ASP 235.A OD2 no hydrogen 2.722 N/A SER 232.A OG HIS 234.A ND1 no hydrogen 2.547 N/A HIS 234.A ND1 SER 232.A OG no hydrogen 2.547 N/A ASP 235.A N SER 232.A O no hydrogen 2.862 N/A VAL 236.A N ASP 233.A O no hydrogen 3.264 N/A ILE 237.A N ASN 13.A O no hydrogen 2.896 N/A LYS 238.A NZ LEU 222.A O no hydrogen 2.661 N/A LYS 238.A NZ ASP 233.A OD1 no hydrogen 2.767 N/A LYS 238.A NZ ASP 233.A OD2 no hydrogen 3.487 N/A TRP 239.A N LEU 15.A O no hydrogen 2.950 N/A TRP 239.A NE1 GLU 14.A OE2 no hydrogen 2.685 N/A ARG 241.A N LEU 17.A O no hydrogen 2.782 N/A ARG 241.A NE ASP 18.A OD1 no hydrogen 2.702 N/A ARG 241.A NE ASP 18.A OD2 no hydrogen 3.213 N/A ARG 241.A NH2 ASP 18.A OD2 no hydrogen 2.967 N/A ILE 243.A N VAL 19.A O no hydrogen 2.900 N/A GLY 244.A N VAL 210.A O no hydrogen 2.711 N/A ARG 245.A N GLU 21.A O no hydrogen 2.607 N/A SER 246.A N PHE 208.A O no hydrogen 3.311 N/A SER 246.A OG ASN 207.A OD1 no hydrogen 2.671 N/A GLY 247.A N VAL 23.A O no hydrogen 3.146 N/A ILE 248.A N ASN 24.A OD1 no hydrogen 2.984 N/A TYR 249.A OH PHE 105.A O no hydrogen 2.459 N/A GLU 250.A N LEU 25.A O no hydrogen 2.775 N/A THR 251.A N ILE 204.A O no hydrogen 2.930 N/A ARG 252.A N MET 27.A O no hydrogen 2.827 N/A