Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iva_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N VAL 76.A O no hydrogen 3.085 N/A GLU 5.A N TYR 28.A OH no hydrogen 2.933 N/A HIS 8.A N GLU 5.A O no hydrogen 3.041 N/A LEU 9.A N GLU 6.A O no hydrogen 3.147 N/A LYS 10.A N ARG 27.A O no hydrogen 2.835 N/A LYS 10.A NZ ARG 7.A O no hydrogen 2.788 N/A LEU 12.A N MET 25.A O no hydrogen 2.834 N/A GLN 13.A N MET 25.A O no hydrogen 3.092 N/A LEU 15.A N VAL 23.A O no hydrogen 2.949 N/A GLY 16.A N VAL 23.A O no hydrogen 3.159 N/A LYS 17.A NZ.B GLN 45.A OE1 no hydrogen 3.495 N/A GLY 18.A N GLY 21.A O no hydrogen 3.099 N/A GLY 21.A N GLY 18.A O no hydrogen 3.195 N/A SER 22.A N LYS 43.A O no hydrogen 2.948 N/A VAL 23.A N GLY 16.A O no hydrogen 2.759 N/A GLU 24.A N VAL 41.A O no hydrogen 2.799 N/A MET 25.A N GLN 13.A O no hydrogen 2.668 N/A CYS 26.A N VAL 39.A O no hydrogen 2.885 N/A ARG 27.A N LYS 10.A O no hydrogen 2.821 N/A ARG 27.A NH1 GLY 36.A O no hydrogen 2.868 N/A TYR 28.A N GLU 37.A O no hydrogen 2.754 N/A ASP 29.A N HIS 8.A O no hydrogen 2.940 N/A GLN 32.A N ASP 29.A O no hydrogen 2.871 N/A ASN 34.A N ASP 29.A OD2 no hydrogen 2.780 N/A THR 35.A N ASP 33.A OD1 no hydrogen 3.318 N/A THR 35.A OG1 ASP 33.A OD1 no hydrogen 2.630 N/A THR 35.A OG1 ASP 33.A OD2 no hydrogen 3.376 N/A GLY 36.A N ASP 29.A OD1 no hydrogen 3.031 N/A VAL 39.A N CYS 26.A O no hydrogen 2.735 N/A ALA 40.A N MET 89.A O no hydrogen 2.957 N/A VAL 41.A N GLU 24.A O no hydrogen 2.739 N/A LYS 42.A N LEU 87.A O no hydrogen 2.801 N/A LYS 42.A NZ GLU 58.A OE1 no hydrogen 3.554 N/A LYS 42.A NZ GLU 58.A OE2 no hydrogen 2.660 N/A LYS 42.A NZ ASP 154.A OD1 no hydrogen 2.784 N/A LYS 43.A N SER 22.A O no hydrogen 2.830 N/A LYS 43.A NZ GLU 24.A OE2 no hydrogen 2.544 N/A THR 48.A N HIS 46.A O no hydrogen 2.782 N/A HIS 51.A N THR 48.A OG1 no hydrogen 2.988 N/A LEU 52.A N THR 48.A O no hydrogen 2.815 N/A ARG 53.A N GLU 49.A O no hydrogen 2.997 N/A ASP 54.A N GLU 50.A O no hydrogen 2.970 N/A PHE 55.A N HIS 51.A O no hydrogen 2.882 N/A GLU 56.A N LEU 52.A O no hydrogen 2.886 N/A ARG 57.A N ARG 53.A O no hydrogen 3.061 N/A GLU 58.A N ASP 54.A O no hydrogen 2.892 N/A ILE 59.A N PHE 55.A O no hydrogen 2.885 N/A GLU 60.A N GLU 56.A O no hydrogen 3.003 N/A ILE 61.A N ARG 57.A O no hydrogen 2.842 N/A LEU 62.A N GLU 58.A O no hydrogen 2.919 N/A LYS 63.A N ILE 59.A O no hydrogen 2.902 N/A SER 64.A N GLU 60.A O no hydrogen 3.062 N/A SER 64.A OG ILE 61.A O no hydrogen 2.635 N/A SER 64.A OG TYR 132.A OH no hydrogen 2.689 N/A LEU 65.A N LEU 62.A O no hydrogen 3.048 N/A GLN 66.A N TYR 126.A OH no hydrogen 2.852 N/A ASN 69.A N HIS 67.A ND1 no hydrogen 2.970 N/A ILE 70.A N.A HIS 67.A O no hydrogen 3.106 N/A ILE 70.A N.B HIS 67.A O no hydrogen 3.101 N/A VAL 71.A N ILE 152.A O no hydrogen 2.917 N/A LYS 72.A N GLU 90.A OE1 no hydrogen 2.864 N/A LYS 74.A N ILE 88.A O no hydrogen 2.845 N/A LYS 74.A NZ GLU 37.A OE1 no hydrogen 2.765 N/A GLY 75.A N ILE 88.A O no hydrogen 3.119 N/A VAL 76.A N THR 2.A O no hydrogen 2.954 N/A CYS 77.A N LYS 86.A O no hydrogen 2.909 N/A CYS 77.A SG PHE 4.A O no hydrogen 3.385 N/A ALA 80.A N GLU 6.A OE2 no hydrogen 2.905 N/A GLY 81.A N GLU 6.A OE1 no hydrogen 2.871 N/A ARG 82.A N TYR 78.A O no hydrogen 3.120 N/A ARG 82.A NH1.B ARG 82.A O no hydrogen 3.198 N/A ARG 83.A N SER 79.A O no hydrogen 3.080 N/A ARG 83.A N ALA 80.A O no hydrogen 3.293 N/A ARG 83.A NE ALA 80.A O no hydrogen 3.013 N/A ARG 83.A NH2 ALA 80.A O no hydrogen 3.109 N/A LYS 86.A N CYS 77.A O no hydrogen 2.933 N/A LEU 87.A N LYS 42.A O no hydrogen 2.887 N/A ILE 88.A N GLY 75.A O no hydrogen 2.834 N/A MET 89.A N ALA 40.A O no hydrogen 2.820 N/A GLU 90.A N LYS 72.A O no hydrogen 2.903 N/A GLY 95.A N LEU 92.A O no hydrogen 3.052 N/A LEU 97.A N ILE 142.A O no hydrogen 2.755 N/A ASP 99.A N SER 96.A OG no hydrogen 3.231 N/A TYR 100.A N SER 96.A O no hydrogen 2.962 N/A LEU 101.A N LEU 97.A O no hydrogen 2.922 N/A GLN 102.A N ARG 98.A O no hydrogen 3.283 N/A LYS 103.A N ASP 99.A O no hydrogen 3.013 N/A HIS 104.A N TYR 100.A O no hydrogen 2.941 N/A LYS 105.A NZ TYR 208.A O no hydrogen 3.101 N/A ARG 107.A NH1 TYR 100.A OH no hydrogen 3.129 N/A ILE 108.A N HIS 104.A O no hydrogen 3.156 N/A LYS 112.A N ASP 109.A OD2 no hydrogen 3.323 N/A LYS 112.A NZ ASN 148.A OD1 no hydrogen 2.603 N/A LEU 113.A N ASP 109.A O no hydrogen 3.095 N/A LEU 114.A N HIS 110.A O no hydrogen 2.938 N/A GLN 115.A N ILE 111.A O no hydrogen 2.997 N/A TYR 116.A N LYS 112.A O no hydrogen 2.974 N/A TYR 116.A OH GLU 147.A O no hydrogen 2.735 N/A THR 117.A N LEU 113.A O no hydrogen 2.913 N/A THR 117.A OG1 LEU 113.A O no hydrogen 2.794 N/A SER 118.A N LEU 114.A O no hydrogen 2.914 N/A SER 118.A OG ASP 282.A OD1 no hydrogen 2.592 N/A SER 118.A OG ASP 282.A OD2 no hydrogen 3.356 N/A GLN 119.A N GLN 115.A O no hydrogen 3.113 N/A GLN 119.A NE2 ASN 148.A O no hydrogen 2.869 N/A ILE 120.A N TYR 116.A O no hydrogen 2.985 N/A CYS 121.A N THR 117.A O no hydrogen 3.033 N/A CYS 121.A SG THR 117.A O no hydrogen 3.457 N/A LYS 122.A N SER 118.A O no hydrogen 2.970 N/A LYS 122.A NZ SER 118.A OG no hydrogen 3.180 N/A LYS 122.A NZ ASP 282.A OD2 no hydrogen 2.670 N/A GLY 123.A N GLN 119.A O no hydrogen 2.997 N/A MET 124.A N ILE 120.A O no hydrogen 2.972 N/A GLU 125.A N CYS 121.A O no hydrogen 2.773 N/A TYR 126.A N LYS 122.A O no hydrogen 3.050 N/A LEU 127.A N GLY 123.A O no hydrogen 2.975 N/A GLY 128.A N MET 124.A O no hydrogen 3.024 N/A THR 129.A N GLU 125.A O no hydrogen 3.215 N/A THR 129.A N TYR 126.A O no hydrogen 3.036 N/A THR 129.A OG1 TYR 126.A O no hydrogen 2.690 N/A LYS 130.A N LEU 127.A O no hydrogen 2.989 N/A LYS 130.A NZ SER 64.A O no hydrogen 3.392 N/A ARG 131.A N GLY 128.A O no hydrogen 2.996 N/A ARG 131.A NH2 PRO 162.A O no hydrogen 3.240 N/A TYR 132.A N LEU 127.A O no hydrogen 3.098 N/A TYR 132.A OH SER 64.A OG no hydrogen 2.689 N/A ILE 133.A N.A LYS 159.A O no hydrogen 2.828 N/A ILE 133.A N.B LYS 159.A O no hydrogen 2.840 N/A HIS 134.A N ASP 194.A OD2 no hydrogen 2.803 N/A ARG 135.A N ASP 194.A OD1 no hydrogen 2.924 N/A ARG 135.A NE LEU 157.A O no hydrogen 2.777 N/A ARG 135.A NH2 LEU 157.A O no hydrogen 3.501 N/A ARG 135.A NH2 GLU 170.A OE2 no hydrogen 3.152 N/A THR 139.A N GLU 204.A OE2 no hydrogen 2.964 N/A THR 139.A OG1 GLU 204.A OE1 no hydrogen 2.685 N/A ARG 140.A NH1 ASP 136.A OD2 no hydrogen 3.080 N/A ARG 140.A NH2 ASP 136.A OD1 no hydrogen 2.506 N/A ASN 141.A N ALA 138.A O no hydrogen 2.929 N/A ASN 141.A ND2 ASP 136.A O no hydrogen 2.790 N/A ASN 141.A ND2 ASP 136.A OD2 no hydrogen 2.963 N/A ILE 142.A N THR 139.A O no hydrogen 3.154 N/A LEU 143.A N LYS 151.A O no hydrogen 2.741 N/A VAL 144.A N GLY 95.A O no hydrogen 2.855 N/A GLU 145.A N ARG 149.A O no hydrogen 2.787 N/A ASN 146.A N ARG 149.A O no hydrogen 3.200 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.941 N/A ASN 148.A N ASN 146.A OD1 no hydrogen 2.730 N/A ARG 149.A N ASN 146.A O no hydrogen 3.083 N/A VAL 150.A N GLN 119.A OE1 no hydrogen 2.882 N/A LYS 151.A N LEU 143.A O no hydrogen 2.814 N/A LYS 151.A NZ GLU 90.A OE1 no hydrogen 2.741 N/A LYS 151.A NZ GLU 90.A OE2 no hydrogen 3.555 N/A ILE 152.A N ASN 69.A O no hydrogen 2.812 N/A GLY 153.A N ASN 141.A O no hydrogen 2.779 N/A GLY 156.A N ASP 154.A OD2 no hydrogen 3.007 N/A THR 158.A N PHE 155.A O no hydrogen 3.110 N/A THR 158.A OG1 HIS 134.A O no hydrogen 3.488 N/A THR 158.A OG1 PHE 155.A O no hydrogen 3.450 N/A LYS 159.A N ILE 133.A O.A no hydrogen 2.919 N/A LYS 159.A N ILE 133.A O.B no hydrogen 2.900 N/A LEU 161.A N ARG 131.A O no hydrogen 2.878 N/A GLN 163.A NE2 ASP 164.A OD2 no hydrogen 3.342 N/A LYS 165.A N PRO 162.A O no hydrogen 2.996 N/A VAL 168.A N SER 187.A O no hydrogen 2.998 N/A SER 174.A OG TYR 179.A OH no hydrogen 2.926 N/A ILE 176.A N SER 174.A O no hydrogen 2.861 N/A TRP 178.A N PRO 175.A O no hydrogen 2.958 N/A TRP 178.A NE1 GLU 204.A OE2 no hydrogen 2.927 N/A TYR 179.A N ILE 176.A O no hydrogen 3.160 N/A TYR 179.A OH SER 174.A OG no hydrogen 2.926 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.831 N/A SER 183.A N ALA 180.A O no hydrogen 2.945 N/A SER 183.A OG LYS 188.A O no hydrogen 2.742 N/A LEU 184.A N ALA 180.A O no hydrogen 3.129 N/A THR 185.A N PRO 181.A O no hydrogen 2.884 N/A THR 185.A OG1 PRO 181.A O no hydrogen 3.150 N/A GLU 186.A N GLU 182.A O no hydrogen 2.985 N/A SER 187.A N SER 183.A O no hydrogen 3.037 N/A LYS 188.A N GLU 182.A O no hydrogen 3.291 N/A SER 190.A N SER 193.A OG no hydrogen 2.807 N/A SER 193.A N SER 190.A OG no hydrogen 2.967 N/A SER 193.A OG SER 190.A O no hydrogen 3.022 N/A ASP 194.A N SER 190.A O no hydrogen 3.058 N/A VAL 195.A N VAL 191.A O no hydrogen 2.922 N/A TRP 196.A N ALA 192.A O no hydrogen 3.056 N/A SER 197.A N SER 193.A O no hydrogen 2.992 N/A SER 197.A OG TRP 178.A O no hydrogen 2.697 N/A SER 197.A OG SER 193.A O no hydrogen 3.306 N/A PHE 198.A N ASP 194.A O no hydrogen 2.771 N/A GLY 199.A N VAL 195.A O no hydrogen 3.006 N/A VAL 200.A N TRP 196.A O no hydrogen 3.304 N/A VAL 201.A N SER 197.A O no hydrogen 2.915 N/A LEU 202.A N PHE 198.A O no hydrogen 2.900 N/A TYR 203.A N GLY 199.A O no hydrogen 2.985 N/A TYR 203.A OH LYS 213.A O no hydrogen 2.645 N/A GLU 204.A N VAL 200.A O no hydrogen 2.840 N/A LEU 205.A N VAL 201.A O no hydrogen 2.937 N/A PHE 206.A N LEU 202.A O no hydrogen 3.148 N/A THR 207.A N TYR 203.A O no hydrogen 3.048 N/A THR 207.A N GLU 204.A O no hydrogen 3.201 N/A THR 207.A OG1 GLU 204.A O no hydrogen 2.737 N/A TYR 208.A N LEU 205.A O no hydrogen 2.969 N/A TYR 208.A OH ILE 108.A O no hydrogen 2.704 N/A ILE 209.A N THR 207.A OG1 no hydrogen 3.202 N/A GLU 210.A N THR 207.A O no hydrogen 3.113 N/A LYS 213.A N GLU 210.A O no hydrogen 2.895 N/A SER 214.A N LYS 211.A O no hydrogen 3.236 N/A SER 214.A OG LYS 211.A O no hydrogen 3.370 N/A ALA 217.A N SER 214.A OG no hydrogen 3.086 N/A GLU 218.A N SER 214.A O no hydrogen 2.911 N/A PHE 219.A N PRO 215.A O no hydrogen 2.927 N/A MET 220.A N PRO 216.A O no hydrogen 2.930 N/A ARG 221.A N ALA 217.A O no hydrogen 3.017 N/A ARG 221.A NH1 SER 212.A O no hydrogen 3.280 N/A ARG 221.A NH2 SER 212.A O no hydrogen 3.135 N/A MET 222.A N GLU 218.A O no hydrogen 3.127 N/A ILE 223.A N PHE 219.A O no hydrogen 2.825 N/A GLY 224.A N MET 220.A O no hydrogen 2.765 N/A LYS 227.A N GLY 224.A O no hydrogen 3.105 N/A LYS 227.A NZ ILE 223.A O no hydrogen 2.909 N/A ILE 232.A N GLY 229.A O no hydrogen 3.075 N/A PHE 234.A N GLN 230.A O no hydrogen 2.860 N/A HIS 235.A N MET 231.A O no hydrogen 3.063 N/A LEU 236.A N ILE 232.A O no hydrogen 2.891 N/A ILE 237.A N VAL 233.A O no hydrogen 2.978 N/A GLU 238.A N PHE 234.A O no hydrogen 3.112 N/A LEU 239.A N HIS 235.A O no hydrogen 2.853 N/A LEU 240.A N LEU 236.A O no hydrogen 2.905 N/A LYS 241.A N ILE 237.A O no hydrogen 2.916 N/A ASN 242.A N LEU 239.A O no hydrogen 3.320 N/A ASN 242.A ND2 GLU 238.A O no hydrogen 3.042 N/A ASN 243.A N LEU 240.A O no hydrogen 3.214 N/A GLY 244.A N LEU 239.A O no hydrogen 2.845 N/A ARG 245.A NE TRP 264.A O no hydrogen 3.045 N/A ARG 245.A NH1 LEU 240.A O no hydrogen 2.967 N/A ARG 245.A NH1 GLY 244.A O no hydrogen 2.859 N/A ARG 245.A NH2 TRP 264.A O no hydrogen 2.848 N/A ARG 245.A NH2 ASN 266.A OD1 no hydrogen 2.854 N/A ARG 248.A NH1 CYS 252.A O no hydrogen 3.055 N/A CYS 252.A N PRO 249.A O no hydrogen 2.982 N/A CYS 252.A SG PRO 253.A O no hydrogen 3.470 N/A ILE 256.A N PRO 253.A O no hydrogen 3.019 N/A TYR 257.A N PRO 253.A O no hydrogen 3.117 N/A TYR 257.A OH LEU 246.A O no hydrogen 2.562 N/A MET 258.A N ASP 254.A O no hydrogen 2.923 N/A MET 260.A N ILE 256.A O no hydrogen 3.264 N/A THR 261.A N TYR 257.A O no hydrogen 2.888 N/A THR 261.A OG1 TYR 257.A O no hydrogen 3.433 N/A THR 261.A OG1 MET 258.A O no hydrogen 2.910 N/A GLU 262.A N MET 258.A O no hydrogen 2.992 N/A CYS 263.A N ILE 259.A O no hydrogen 3.082 N/A CYS 263.A SG ILE 259.A O no hydrogen 3.408 N/A TRP 264.A N MET 260.A O no hydrogen 3.013 N/A ASN 265.A ND2 GLN 270.A OE1 no hydrogen 3.099 N/A ASN 266.A ND2 LEU 240.A O no hydrogen 3.193 N/A ASN 267.A N ASN 265.A OD1 no hydrogen 2.887 N/A ASN 269.A N ASN 267.A OD1 no hydrogen 3.142 N/A GLN 270.A N ASN 267.A O no hydrogen 2.992 N/A ARG 271.A N VAL 268.A O no hydrogen 3.368 N/A ARG 271.A NE ASN 265.A O no hydrogen 2.749 N/A ARG 271.A NH1 GLU 182.A OE2 no hydrogen 2.865 N/A ARG 271.A NH1 ALA 192.A O no hydrogen 2.967 N/A ARG 271.A NH2 GLU 182.A OE1 no hydrogen 2.819 N/A ARG 271.A NH2 GLU 182.A OE2 no hydrogen 3.541 N/A ARG 271.A NH2 ASN 265.A O no hydrogen 2.933 N/A SER 273.A N ASP 276.A OD2 no hydrogen 3.067 N/A ASP 276.A N SER 273.A OG no hydrogen 2.937 N/A LEU 277.A N SER 273.A O no hydrogen 2.993 N/A ALA 278.A N PHE 274.A O no hydrogen 2.904 N/A LEU 279.A N ARG 275.A O no hydrogen 3.111 N/A ARG 280.A N ASP 276.A O no hydrogen 2.954 N/A VAL 281.A N LEU 277.A O no hydrogen 2.885 N/A ASP 282.A N ALA 278.A O no hydrogen 2.938 N/A GLN 283.A N LEU 279.A O no hydrogen 2.858 N/A ILE 284.A N ARG 280.A O no hydrogen 2.924 N/A ARG 285.A N VAL 281.A O no hydrogen 3.007 N/A ARG 285.A NH1 ASP 282.A OD1 no hydrogen 2.952 N/A ASP 286.A N ASP 282.A O no hydrogen 2.934 N/A ASN 287.A N GLN 283.A O no hydrogen 2.900 N/A MET 288.A N ARG 285.A O no hydrogen 3.316 N/A