Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gj3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N CYS 76.A O no hydrogen 2.810 N/A HIS 4.A N TYR 27.A OH no hydrogen 2.999 N/A LYS 5.A NZ ASP 79.A OD1 no hydrogen 3.226 N/A TYR 7.A N HIS 4.A O no hydrogen 3.146 N/A LEU 8.A N LYS 5.A O no hydrogen 3.336 N/A LYS 9.A N CYS 26.A O no hydrogen 3.020 N/A LYS 9.A NZ ASP 28.A O no hydrogen 2.944 N/A LYS 10.A NZ ASP 13.A OD1 no hydrogen 3.246 N/A ILE 11.A N LEU 24.A O no hydrogen 2.757 N/A LEU 14.A N VAL 22.A O no hydrogen 2.793 N/A GLY 15.A N VAL 22.A O no hydrogen 3.270 N/A GLY 17.A N GLY 20.A O no hydrogen 2.874 N/A LYS 21.A N ALA 42.A O no hydrogen 3.193 N/A LYS 21.A NZ ASP 13.A OD1 no hydrogen 2.644 N/A LYS 21.A NZ SER 23.A OG no hydrogen 2.978 N/A VAL 22.A N GLY 15.A O no hydrogen 2.911 N/A SER 23.A N VAL 40.A O no hydrogen 3.004 N/A SER 23.A OG ASP 13.A OD1 no hydrogen 3.234 N/A LEU 24.A N ARG 12.A O no hydrogen 2.693 N/A TYR 25.A N VAL 38.A O no hydrogen 2.869 N/A CYS 26.A N LYS 9.A O no hydrogen 2.814 N/A CYS 26.A SG GLY 35.A O no hydrogen 3.867 N/A TYR 27.A N GLU 36.A O no hydrogen 3.016 N/A ASP 28.A N TYR 7.A O no hydrogen 2.904 N/A THR 30.A OG1 ASP 28.A OD1 no hydrogen 3.425 N/A THR 30.A OG1 ASP 32.A OD1 no hydrogen 2.664 N/A GLY 33.A N ASP 28.A OD1 no hydrogen 3.302 N/A GLY 33.A N ASP 28.A OD2 no hydrogen 2.824 N/A THR 34.A N ASP 32.A OD1 no hydrogen 3.185 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.736 N/A THR 34.A OG1 ASP 32.A OD2 no hydrogen 3.236 N/A GLY 35.A N ASP 28.A OD1 no hydrogen 3.185 N/A VAL 38.A N TYR 25.A O no hydrogen 2.768 N/A ALA 39.A N MET 89.A O no hydrogen 3.124 N/A VAL 40.A N SER 23.A O no hydrogen 2.927 N/A LYS 41.A N LEU 87.A O no hydrogen 2.795 N/A LYS 41.A NZ GLU 58.A OE1 no hydrogen 3.201 N/A LYS 41.A NZ GLU 58.A OE2 no hydrogen 2.766 N/A LYS 41.A NZ ASP 152.A OD2 no hydrogen 2.748 N/A ALA 42.A N LYS 21.A O no hydrogen 2.912 N/A LYS 44.A NZ ASP 46.A OD2 no hydrogen 2.968 N/A ALA 47.A N LYS 44.A O no hydrogen 3.248 N/A ARG 52.A N GLY 48.A O no hydrogen 3.249 N/A ARG 52.A NE ALA 47.A O no hydrogen 3.106 N/A ARG 52.A NH1 ALA 82.A O no hydrogen 2.731 N/A ARG 52.A NH2 ALA 45.A O no hydrogen 3.541 N/A ARG 52.A NH2 ALA 82.A O no hydrogen 3.064 N/A SER 53.A N PRO 49.A O no hydrogen 3.106 N/A TRP 55.A N HIS 51.A O no hydrogen 2.870 N/A TRP 55.A NE1 LEU 85.A O no hydrogen 2.764 N/A LYS 56.A N ARG 52.A O no hydrogen 3.283 N/A GLN 57.A N SER 53.A O no hydrogen 3.367 N/A GLU 58.A N GLY 54.A O no hydrogen 3.048 N/A ILE 59.A N TRP 55.A O no hydrogen 3.296 N/A ASP 60.A N LYS 56.A O no hydrogen 3.118 N/A ILE 61.A N GLN 57.A O no hydrogen 3.053 N/A LEU 62.A N GLU 58.A O no hydrogen 3.134 N/A ARG 63.A N ILE 59.A O no hydrogen 3.014 N/A THR 64.A OG1 ASP 60.A O no hydrogen 2.944 N/A THR 64.A OG1 ILE 61.A O no hydrogen 2.990 N/A THR 64.A OG1 TYR 130.A OH no hydrogen 3.319 N/A LEU 65.A N LEU 62.A O no hydrogen 3.275 N/A TYR 66.A N TYR 124.A OH no hydrogen 2.939 N/A HIS 69.A N HIS 67.A ND1 no hydrogen 3.061 N/A HIS 69.A ND1 VAL 148.A O no hydrogen 2.875 N/A ILE 70.A N HIS 67.A O no hydrogen 3.393 N/A ILE 71.A N ILE 150.A O no hydrogen 2.918 N/A LYS 72.A N GLU 90.A OE2 no hydrogen 3.013 N/A LYS 74.A N VAL 88.A O no hydrogen 3.054 N/A GLY 75.A N VAL 88.A O no hydrogen 3.142 N/A CYS 76.A N THR 1.A O no hydrogen 3.180 N/A CYS 76.A SG TYR 73.A OH no hydrogen 3.118 N/A CYS 76.A SG GLY 75.A O no hydrogen 3.444 N/A CYS 76.A SG GLN 86.A O no hydrogen 3.942 N/A CYS 77.A N GLN 86.A O no hydrogen 3.037 N/A CYS 77.A SG PHE 3.A O no hydrogen 3.356 N/A CYS 77.A SG GLU 78.A O no hydrogen 3.966 N/A CYS 77.A SG GLN 86.A OE1 no hydrogen 3.783 N/A GLN 86.A N CYS 77.A O no hydrogen 3.285 N/A LEU 87.A N LYS 41.A O no hydrogen 2.805 N/A VAL 88.A N GLY 75.A O no hydrogen 3.027 N/A MET 89.A N ALA 39.A O no hydrogen 2.986 N/A GLU 90.A N LYS 72.A O no hydrogen 3.026 N/A LEU 94.A N LEU 142.A O no hydrogen 2.984 N/A SER 96.A OG ASP 99.A OD2 no hydrogen 2.757 N/A LEU 97.A N VAL 140.A O no hydrogen 2.998 N/A ASP 99.A N SER 96.A OG no hydrogen 3.307 N/A TYR 100.A N SER 96.A O no hydrogen 3.008 N/A LEU 101.A N LEU 97.A O no hydrogen 3.004 N/A ARG 103.A N TYR 100.A O no hydrogen 3.239 N/A ARG 103.A NH1 ASP 99.A O no hydrogen 2.903 N/A HIS 104.A N TYR 100.A O no hydrogen 3.034 N/A HIS 104.A ND1 TYR 100.A O no hydrogen 2.748 N/A GLN 110.A NE2 ASP 145.A O no hydrogen 2.783 N/A LEU 111.A N GLY 107.A O no hydrogen 3.133 N/A LEU 112.A N LEU 108.A O no hydrogen 3.012 N/A LEU 113.A N ALA 109.A O no hydrogen 3.042 N/A PHE 114.A N GLN 110.A O no hydrogen 3.106 N/A ALA 115.A N LEU 111.A O no hydrogen 3.210 N/A GLN 116.A N LEU 112.A O no hydrogen 3.146 N/A GLN 116.A NE2 GLU 120.A OE1 no hydrogen 3.084 N/A GLN 117.A N LEU 113.A O no hydrogen 2.968 N/A GLN 117.A NE2 ARG 146.A O no hydrogen 2.764 N/A ILE 118.A N PHE 114.A O no hydrogen 2.818 N/A CYS 119.A N ALA 115.A O no hydrogen 3.096 N/A CYS 119.A SG ALA 115.A O no hydrogen 3.301 N/A GLU 120.A N GLN 116.A O no hydrogen 2.963 N/A GLY 121.A N GLN 117.A O no hydrogen 3.101 N/A MET 122.A N ILE 118.A O no hydrogen 2.913 N/A ALA 123.A N CYS 119.A O no hydrogen 2.951 N/A TYR 124.A N GLU 120.A O no hydrogen 3.430 N/A LEU 125.A N GLY 121.A O no hydrogen 3.110 N/A HIS 126.A N MET 122.A O no hydrogen 2.978 N/A HIS 126.A NE2 ASP 194.A OD2 no hydrogen 2.807 N/A ALA 127.A N ALA 123.A O no hydrogen 2.919 N/A GLN 128.A N TYR 124.A O no hydrogen 2.986 N/A HIS 129.A N HIS 126.A O no hydrogen 3.072 N/A TYR 130.A N LEU 125.A O no hydrogen 3.047 N/A TYR 130.A OH THR 64.A OG1 no hydrogen 3.319 N/A ILE 131.A N LYS 157.A O no hydrogen 2.817 N/A HIS 132.A N ASP 194.A OD2 no hydrogen 2.958 N/A ARG 133.A N ASP 194.A OD1 no hydrogen 3.119 N/A ASN 134.A N HIS 132.A ND1 no hydrogen 3.224 N/A ALA 137.A N GLU 204.A OE1 no hydrogen 3.075 N/A ASN 139.A N ALA 136.A O no hydrogen 2.972 N/A ASN 139.A ND2 ASN 134.A O no hydrogen 2.704 N/A VAL 140.A N ALA 137.A O no hydrogen 3.369 N/A LEU 141.A N LYS 149.A O no hydrogen 2.662 N/A LEU 142.A N GLY 95.A O no hydrogen 2.732 N/A ASP 143.A N LEU 147.A O no hydrogen 3.039 N/A ASN 144.A ND2 ASP 143.A OD1 no hydrogen 3.101 N/A ARG 146.A N ASN 144.A OD1 no hydrogen 3.052 N/A LEU 147.A N ASN 144.A O no hydrogen 3.005 N/A LYS 149.A N LEU 141.A O no hydrogen 2.727 N/A LYS 149.A NZ GLU 90.A OE1 no hydrogen 3.132 N/A LYS 149.A NZ GLU 90.A OE2 no hydrogen 2.936 N/A ILE 150.A N HIS 69.A O no hydrogen 2.938 N/A GLY 151.A N ASN 139.A O no hydrogen 2.730 N/A GLY 154.A N ASP 152.A OD2 no hydrogen 3.027 N/A ALA 156.A N PHE 153.A O no hydrogen 3.191 N/A LYS 157.A N ILE 131.A O no hydrogen 2.954 N/A LYS 157.A NZ GLN 57.A OE1 no hydrogen 2.882 N/A VAL 159.A N HIS 129.A O no hydrogen 2.973 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.883 N/A TYR 166.A N PHE 189.A O no hydrogen 2.999 N/A VAL 168.A N TYR 187.A O no hydrogen 2.755 N/A ARG 169.A NH2 TYR 166.A OH no hydrogen 2.996 N/A ASP 173.A N ASP 171.A OD1 no hydrogen 2.943 N/A SER 174.A OG ASP 171.A O no hydrogen 3.253 N/A VAL 176.A N SER 174.A O no hydrogen 2.732 N/A TRP 178.A N PRO 175.A O no hydrogen 2.939 N/A TRP 178.A NE1 GLU 204.A OE1 no hydrogen 2.835 N/A TYR 179.A N VAL 176.A O no hydrogen 3.104 N/A TYR 179.A OH ARG 133.A O no hydrogen 2.700 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 3.096 N/A CYS 183.A N ALA 180.A O no hydrogen 3.098 N/A CYS 183.A SG LYS 188.A O no hydrogen 3.449 N/A CYS 183.A SG SER 193.A OG no hydrogen 3.505 N/A LYS 185.A N PRO 181.A O no hydrogen 2.956 N/A LYS 185.A NZ GLU 240.A OE2 no hydrogen 3.334 N/A LYS 188.A N GLU 182.A O no hydrogen 3.068 N/A LYS 188.A NZ GLU 186.A OE2 no hydrogen 3.529 N/A PHE 189.A N TYR 166.A O no hydrogen 2.810 N/A TYR 190.A N SER 193.A OG no hydrogen 2.966 N/A SER 193.A N TYR 190.A O no hydrogen 3.280 N/A SER 193.A OG GLU 182.A OE2 no hydrogen 2.609 N/A ASP 194.A N TYR 191.A O no hydrogen 3.248 N/A TRP 196.A N ALA 192.A O no hydrogen 3.329 N/A SER 197.A N SER 193.A O no hydrogen 3.332 N/A SER 197.A OG TRP 178.A O no hydrogen 2.636 N/A SER 197.A OG SER 193.A O no hydrogen 3.449 N/A PHE 198.A N ASP 194.A O no hydrogen 3.010 N/A GLY 199.A N VAL 195.A O no hydrogen 3.142 N/A VAL 200.A N TRP 196.A O no hydrogen 3.217 N/A THR 201.A N SER 197.A O no hydrogen 2.920 N/A THR 201.A OG1 SER 197.A O no hydrogen 2.707 N/A LEU 202.A N PHE 198.A O no hydrogen 2.677 N/A TYR 203.A N GLY 199.A O no hydrogen 2.925 N/A TYR 203.A OH GLN 213.A O no hydrogen 2.668 N/A GLU 204.A N VAL 200.A O no hydrogen 3.081 N/A LEU 205.A N THR 201.A O no hydrogen 3.091 N/A LEU 206.A N LEU 202.A O no hydrogen 3.152 N/A THR 207.A N TYR 203.A O no hydrogen 3.220 N/A THR 207.A OG1 TYR 203.A O no hydrogen 3.164 N/A THR 207.A OG1 GLU 204.A O no hydrogen 2.867 N/A HIS 208.A N LEU 205.A O no hydrogen 3.039 N/A HIS 208.A NE2 ILE 106.A O no hydrogen 2.779 N/A CYS 209.A N GLU 204.A O no hydrogen 2.765 N/A CYS 209.A SG LEU 97.A O no hydrogen 3.562 N/A CYS 209.A SG GLU 204.A O no hydrogen 3.595 N/A ASP 210.A N THR 207.A O no hydrogen 3.376 N/A SER 212.A OG ASP 210.A OD1 no hydrogen 3.235 N/A SER 212.A OG ASP 210.A OD2 no hydrogen 2.866 N/A GLN 213.A N ASP 210.A O no hydrogen 2.906 N/A GLN 213.A NE2 ASP 210.A OD2 no hydrogen 3.007 N/A SER 214.A N SER 211.A O no hydrogen 3.458 N/A SER 214.A OG SER 211.A O no hydrogen 2.761 N/A SER 214.A OG THR 217.A OG1 no hydrogen 3.177 N/A THR 217.A OG1 SER 211.A O no hydrogen 3.049 N/A THR 217.A OG1 SER 214.A OG no hydrogen 3.177 N/A LYS 218.A N SER 214.A O no hydrogen 3.084 N/A PHE 219.A N PRO 215.A O no hydrogen 2.969 N/A LEU 220.A N PRO 216.A O no hydrogen 3.152 N/A GLU 221.A N THR 217.A O no hydrogen 3.262 N/A LEU 222.A N PHE 219.A O no hydrogen 3.105 N/A ILE 223.A N PHE 219.A O no hydrogen 2.856 N/A GLY 224.A N LEU 220.A O no hydrogen 2.824 N/A MET 230.A N GLN 227.A O no hydrogen 2.999 N/A ARG 234.A N MET 230.A O no hydrogen 2.871 N/A LEU 235.A N THR 231.A O no hydrogen 2.920 N/A THR 236.A N VAL 232.A O no hydrogen 2.861 N/A THR 236.A OG1 VAL 232.A O no hydrogen 2.698 N/A GLU 237.A N LEU 233.A O no hydrogen 3.050 N/A LEU 238.A N ARG 234.A O no hydrogen 3.149 N/A LEU 239.A N LEU 235.A O no hydrogen 3.300 N/A GLU 240.A N THR 236.A O no hydrogen 3.041 N/A ARG 241.A N GLU 237.A O no hydrogen 3.062 N/A ARG 241.A NE GLU 243.A OE2 no hydrogen 3.329 N/A ARG 241.A NH2 GLU 243.A OE2 no hydrogen 3.145 N/A GLY 242.A N LEU 239.A O no hydrogen 3.260 N/A GLU 243.A N LEU 238.A O no hydrogen 2.946 N/A ARG 244.A NE TRP 263.A O no hydrogen 2.785 N/A ARG 244.A NH1 LEU 239.A O no hydrogen 2.865 N/A ARG 244.A NH1 GLU 243.A O no hydrogen 2.976 N/A ARG 244.A NH2 TRP 263.A O no hydrogen 2.811 N/A ARG 244.A NH2 THR 265.A OG1 no hydrogen 2.823 N/A ARG 247.A NH2 CYS 251.A O no hydrogen 2.776 N/A CYS 251.A N PRO 248.A O no hydrogen 3.401 N/A CYS 251.A SG PRO 252.A O no hydrogen 3.591 N/A TYR 256.A N PRO 252.A O no hydrogen 3.091 N/A TYR 256.A OH LEU 245.A O no hydrogen 2.965 N/A HIS 257.A N ALA 253.A O no hydrogen 2.959 N/A LEU 258.A N GLU 254.A O no hydrogen 3.017 N/A MET 259.A N VAL 255.A O no hydrogen 3.056 N/A LYS 260.A N TYR 256.A O no hydrogen 2.912 N/A ASN 261.A N HIS 257.A O no hydrogen 2.992 N/A ASN 261.A ND2 PHE 269.A O no hydrogen 3.607 N/A CYS 262.A N LEU 258.A O no hydrogen 3.059 N/A CYS 262.A SG LEU 258.A O no hydrogen 3.372 N/A TRP 263.A N MET 259.A O no hydrogen 3.085 N/A TRP 263.A N LYS 260.A O no hydrogen 3.177 N/A THR 265.A OG1 LEU 239.A O no hydrogen 3.559 N/A PHE 269.A N GLU 266.A O no hydrogen 3.153 N/A ARG 270.A N ALA 267.A O no hydrogen 3.296 N/A ARG 270.A NE ALA 192.A O no hydrogen 2.975 N/A ARG 270.A NH1 GLU 264.A O no hydrogen 2.720 N/A ARG 270.A NH2 GLU 182.A OE1 no hydrogen 3.304 N/A ARG 270.A NH2 GLU 182.A OE2 no hydrogen 2.602 N/A ARG 270.A NH2 ALA 192.A O no hydrogen 3.072 N/A THR 272.A N ASN 275.A OD1 no hydrogen 2.947 N/A ASN 275.A N THR 272.A O no hydrogen 3.112 N/A ASN 275.A N THR 272.A OG1 no hydrogen 3.295 N/A LEU 276.A N THR 272.A O no hydrogen 3.233 N/A ILE 277.A N PHE 273.A O no hydrogen 3.351 N/A LEU 280.A N LEU 276.A O no hydrogen 2.804 N/A LYS 281.A N ILE 277.A O no hydrogen 3.142 N/A THR 282.A N PRO 278.A O no hydrogen 3.294 N/A THR 282.A OG1 PRO 278.A O no hydrogen 2.836 N/A VAL 283.A N ILE 279.A O no hydrogen 2.947 N/A HIS 284.A N LEU 280.A O no hydrogen 2.977 N/A HIS 284.A ND1 ALA 109.A O no hydrogen 2.701 N/A GLU 285.A N LYS 281.A O no hydrogen 3.048 N/A LYS 286.A N THR 282.A O no hydrogen 3.094 N/A LYS 286.A NZ TYR 287.A OH no hydrogen 3.062 N/A TYR 287.A N VAL 283.A O no hydrogen 3.315 N/A