Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bny_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 7.A OG GLU 248.A OE1 no hydrogen 2.710 N/A PHE 9.A N SER 7.A OG no hydrogen 2.905 N/A CYS 13.A SG HIS 14.A O no hydrogen 4.002 N/A HIS 14.A N CYS 53.A O no hydrogen 2.988 N/A HIS 14.A NE2 ALA 59.A O no hydrogen 2.950 N/A LEU 16.A N HIS 14.A ND1 no hydrogen 3.100 N/A VAL 17.A N HIS 14.A O no hydrogen 3.005 N/A GLU 19.A N GLU 19.A OE1 no hydrogen 2.377 N/A VAL 20.A N LEU 16.A O no hydrogen 3.005 N/A SER 21.A N VAL 17.A O no hydrogen 2.962 N/A LYS 22.A N GLU 18.A O no hydrogen 3.224 N/A GLU 23.A N GLU 19.A O no hydrogen 2.961 N/A VAL 24.A N VAL 20.A O no hydrogen 2.778 N/A ASP 25.A N SER 21.A O no hydrogen 2.785 N/A GLY 26.A N LYS 22.A O no hydrogen 3.028 N/A TYR 27.A N GLU 23.A O no hydrogen 3.396 N/A PHE 28.A N VAL 24.A O no hydrogen 3.268 N/A LEU 29.A N ASP 25.A O no hydrogen 2.860 N/A GLN 30.A N GLY 26.A O no hydrogen 2.935 N/A GLN 30.A N TYR 27.A O no hydrogen 3.255 N/A GLN 30.A NE2 HIS 31.A NE2 no hydrogen 3.078 N/A HIS 31.A N TYR 27.A O no hydrogen 2.992 N/A HIS 31.A ND1 TYR 114.A OH no hydrogen 2.488 N/A TRP 32.A N PHE 28.A O no hydrogen 2.709 N/A PHE 34.A N TRP 32.A O no hydrogen 3.005 N/A ARG 40.A NH1 PHE 34.A O no hydrogen 3.199 N/A LYS 41.A N GLU 37.A O no hydrogen 3.113 N/A LYS 42.A N LYS 38.A O no hydrogen 2.885 N/A PHE 43.A N ALA 39.A O no hydrogen 2.820 N/A VAL 44.A N ARG 40.A O no hydrogen 3.147 N/A ALA 45.A N LYS 41.A O no hydrogen 3.062 N/A ALA 46.A N LYS 42.A O no hydrogen 2.843 N/A GLY 47.A N PHE 43.A O no hydrogen 3.366 N/A GLY 47.A N VAL 44.A O no hydrogen 3.126 N/A ARG 50.A N GLY 47.A O no hydrogen 2.873 N/A ARG 50.A NH1 GLU 18.A OE1 no hydrogen 3.169 N/A ARG 50.A NH2 GLU 18.A OE2 no hydrogen 2.817 N/A VAL 51.A N GLY 47.A O no hydrogen 3.086 N/A THR 52.A N PHE 48.A O no hydrogen 2.965 N/A THR 52.A OG1 PHE 48.A O no hydrogen 2.872 N/A CYS 53.A N SER 49.A O no hydrogen 3.091 N/A CYS 53.A SG SER 49.A O no hydrogen 3.271 N/A LEU 54.A N ARG 50.A O no hydrogen 3.179 N/A LEU 54.A N VAL 51.A O no hydrogen 2.926 N/A TYR 55.A N VAL 51.A O no hydrogen 3.200 N/A TYR 55.A OH ASN 282.A OD1 no hydrogen 2.592 N/A PHE 56.A N THR 52.A O no hydrogen 3.011 N/A ALA 59.A N PHE 56.A O no hydrogen 3.108 N/A LEU 60.A N SER 179.A O no hydrogen 2.734 N/A ARG 63.A N LEU 60.A O no hydrogen 3.065 N/A ARG 63.A NH1 ASP 127.A OD2 no hydrogen 3.383 N/A ARG 63.A NH1 PHE 178.A O no hydrogen 2.945 N/A ARG 63.A NH2 ASP 127.A OD2 no hydrogen 2.867 N/A ILE 64.A N LEU 60.A O no hydrogen 3.059 N/A PHE 66.A N ARG 63.A O no hydrogen 3.017 N/A CYS 68.A N ILE 64.A O no hydrogen 3.034 N/A CYS 68.A SG SER 49.A O no hydrogen 3.732 N/A CYS 68.A SG ILE 64.A O no hydrogen 3.452 N/A ARG 69.A N HIS 65.A O no hydrogen 2.992 N/A ARG 69.A NH2 GLU 23.A OE2 no hydrogen 2.575 N/A LEU 70.A N PHE 66.A O no hydrogen 3.062 N/A LEU 71.A N ALA 67.A O no hydrogen 3.055 N/A THR 72.A N CYS 68.A O no hydrogen 3.000 N/A THR 72.A OG1 CYS 68.A O no hydrogen 2.564 N/A VAL 73.A N ARG 69.A O no hydrogen 3.089 N/A LEU 74.A N LEU 70.A O no hydrogen 3.017 N/A PHE 75.A N LEU 71.A O no hydrogen 2.734 N/A LEU 76.A N THR 72.A O no hydrogen 2.991 N/A ILE 77.A N VAL 73.A O no hydrogen 2.810 N/A ASP 78.A N LEU 74.A O no hydrogen 2.871 N/A ASP 79.A N PHE 75.A O no hydrogen 3.067 N/A LEU 80.A N LEU 76.A O no hydrogen 3.113 N/A LEU 81.A N ILE 77.A O no hydrogen 2.882 N/A GLU 82.A N ASP 79.A O no hydrogen 2.860 N/A TYR 83.A N LEU 80.A O no hydrogen 2.777 N/A MET 84.A N LEU 81.A O no hydrogen 3.057 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.603 N/A GLU 88.A N SER 85.A OG no hydrogen 3.199 N/A GLY 89.A N SER 85.A O no hydrogen 2.797 N/A SER 90.A N PHE 86.A O no hydrogen 2.845 N/A ALA 91.A N GLU 87.A O no hydrogen 3.104 N/A TYR 92.A N GLU 88.A O no hydrogen 2.793 N/A ASN 93.A N GLY 89.A O no hydrogen 3.120 N/A ASN 93.A ND2 GLN 145.A OE1 no hydrogen 3.412 N/A GLU 94.A N SER 90.A O no hydrogen 2.870 N/A LYS 95.A N ALA 91.A O no hydrogen 3.005 N/A LYS 95.A N TYR 92.A O no hydrogen 3.244 N/A LEU 96.A N ASN 93.A O no hydrogen 2.909 N/A SER 100.A N LEU 96.A O no hydrogen 2.882 N/A SER 100.A OG LEU 96.A O no hydrogen 2.791 N/A ARG 101.A N ILE 97.A O no hydrogen 2.983 N/A GLY 102.A N ILE 99.A O no hydrogen 3.129 N/A ASP 103.A N PRO 98.A O no hydrogen 3.016 N/A ASP 107.A N GLU 113.A OE1 no hydrogen 2.920 N/A ARG 108.A NH1 ASP 118.A OD2 no hydrogen 3.244 N/A ARG 108.A NH2 ASP 118.A OD1 no hydrogen 2.503 N/A ARG 108.A NH2 ASP 118.A OD2 no hydrogen 3.312 N/A SER 109.A N ASP 107.A OD2 no hydrogen 3.021 N/A SER 109.A OG ASP 107.A OD2 no hydrogen 2.275 N/A ILE 110.A N ASP 107.A O no hydrogen 2.617 N/A GLU 113.A N ILE 110.A O no hydrogen 2.897 N/A TYR 114.A N ILE 110.A O no hydrogen 3.236 N/A TYR 114.A OH HIS 31.A ND1 no hydrogen 2.488 N/A ILE 115.A N PRO 111.A O no hydrogen 2.728 N/A ILE 116.A N VAL 112.A O no hydrogen 3.217 N/A TYR 117.A N GLU 113.A O no hydrogen 3.101 N/A ASP 118.A N TYR 114.A O no hydrogen 2.887 N/A LEU 119.A N ILE 115.A O no hydrogen 2.960 N/A TRP 120.A N ILE 116.A O no hydrogen 3.146 N/A GLU 121.A N TYR 117.A O no hydrogen 3.012 N/A SER 122.A N ASP 118.A O no hydrogen 2.904 N/A SER 122.A OG ASP 118.A O no hydrogen 3.330 N/A SER 122.A OG LEU 119.A O no hydrogen 2.464 N/A MET 123.A N LEU 119.A O no hydrogen 2.932 N/A ARG 124.A N TRP 120.A O no hydrogen 2.921 N/A ARG 124.A NH1 SER 100.A O no hydrogen 3.006 N/A ARG 124.A NH2 SER 100.A O no hydrogen 3.361 N/A ARG 124.A NH2 GLU 121.A OE2 no hydrogen 2.977 N/A ALA 125.A N GLU 121.A O no hydrogen 2.984 N/A HIS 126.A N SER 122.A O no hydrogen 3.106 N/A HIS 126.A N MET 123.A O no hydrogen 2.899 N/A ASP 127.A N MET 123.A O no hydrogen 2.911 N/A ARG 128.A NE ASP 132.A OD2 no hydrogen 2.696 N/A MET 130.A N ASP 127.A OD1 no hydrogen 2.944 N/A ALA 131.A N ASP 127.A O no hydrogen 2.771 N/A ASP 132.A N ARG 128.A O no hydrogen 2.935 N/A GLU 133.A N GLU 129.A O no hydrogen 3.176 N/A ILE 134.A N ALA 131.A O no hydrogen 3.199 N/A LEU 135.A N ASP 132.A O no hydrogen 3.281 N/A VAL 138.A N ILE 134.A O no hydrogen 3.231 N/A PHE 139.A N LEU 135.A O no hydrogen 3.012 N/A LEU 140.A N GLU 136.A O no hydrogen 2.765 N/A PHE 141.A N PRO 137.A O no hydrogen 3.257 N/A MET 142.A N VAL 138.A O no hydrogen 2.831 N/A ARG 143.A N PHE 139.A O no hydrogen 2.891 N/A ARG 143.A NE GLU 94.A OE1 no hydrogen 3.208 N/A ARG 143.A NE GLU 94.A OE2 no hydrogen 3.342 N/A ARG 143.A NH2 GLU 94.A OE2 no hydrogen 2.790 N/A ALA 144.A N LEU 140.A O no hydrogen 3.120 N/A ALA 144.A N PHE 141.A O no hydrogen 2.983 N/A GLN 145.A N PHE 141.A O no hydrogen 3.025 N/A GLN 145.A N MET 142.A O no hydrogen 3.311 N/A GLN 145.A NE2 LEU 74.A O no hydrogen 3.595 N/A THR 146.A OG1 ARG 143.A O no hydrogen 3.483 N/A ASP 147.A N ALA 144.A O no hydrogen 3.321 N/A LEU 156.A N GLU 228.A OE2 no hydrogen 2.939 N/A TYR 159.A N GLY 155.A O no hydrogen 2.954 N/A TYR 159.A OH ASP 208.A OD1 no hydrogen 3.207 N/A TYR 159.A OH ASP 208.A OD2 no hydrogen 2.698 N/A LEU 160.A N LEU 156.A O no hydrogen 2.862 N/A GLU 161.A N GLY 157.A O no hydrogen 2.953 N/A TYR 162.A N GLY 158.A O no hydrogen 3.106 N/A ARG 163.A N TYR 159.A O no hydrogen 2.908 N/A ARG 163.A NE TYR 159.A OH no hydrogen 2.794 N/A GLU 164.A N LEU 160.A O no hydrogen 2.914 N/A GLU 164.A N GLU 161.A O no hydrogen 3.280 N/A ARG 165.A N TYR 162.A O no hydrogen 3.002 N/A ARG 165.A NH1 GLU 161.A OE2 no hydrogen 3.085 N/A ASP 166.A N ARG 163.A O no hydrogen 3.071 N/A LYS 169.A N ASP 166.A OD2 no hydrogen 2.807 N/A GLU 170.A N ASP 166.A O no hydrogen 3.044 N/A LEU 171.A N VAL 167.A O no hydrogen 2.884 N/A LEU 172.A N GLY 168.A O no hydrogen 3.075 N/A ALA 173.A N LYS 169.A O no hydrogen 3.065 N/A ALA 174.A N GLU 170.A O no hydrogen 2.975 N/A LEU 175.A N LEU 171.A O no hydrogen 2.821 N/A MET 176.A N LEU 172.A O no hydrogen 2.958 N/A ARG 177.A N ALA 173.A O no hydrogen 3.055 N/A PHE 178.A N ALA 174.A O no hydrogen 3.048 N/A SER 179.A N LEU 175.A O no hydrogen 2.786 N/A SER 179.A OG LEU 175.A O no hydrogen 2.782 N/A MET 180.A N MET 176.A O no hydrogen 2.844 N/A MET 180.A N ARG 177.A O no hydrogen 3.144 N/A GLY 181.A N PHE 178.A O no hydrogen 3.086 N/A LEU 182.A N ARG 177.A O no hydrogen 2.957 N/A SER 185.A N GLU 188.A OE2 no hydrogen 2.827 N/A SER 185.A OG GLU 188.A OE2 no hydrogen 3.237 N/A GLU 188.A N SER 185.A OG no hydrogen 3.165 N/A LEU 189.A N SER 185.A O no hydrogen 3.085 N/A GLN 190.A N PRO 186.A O no hydrogen 2.889 N/A ARG 191.A N SER 187.A O no hydrogen 3.039 N/A ARG 191.A NE SER 187.A O no hydrogen 3.472 N/A ARG 191.A NH1 LEU 263.A O no hydrogen 2.886 N/A ARG 191.A NH2 SER 187.A OG no hydrogen 2.710 N/A VAL 192.A N LEU 189.A O no hydrogen 3.166 N/A ARG 193.A N GLN 190.A O no hydrogen 3.298 N/A ASP 196.A N VAL 192.A O no hydrogen 2.778 N/A ALA 197.A N ARG 193.A O no hydrogen 3.010 N/A ASN 198.A N GLU 194.A O no hydrogen 3.048 N/A CYS 199.A N ILE 195.A O no hydrogen 3.056 N/A SER 200.A N ASP 196.A O no hydrogen 2.903 N/A SER 200.A OG ARG 163.A O no hydrogen 2.922 N/A LYS 201.A N ALA 197.A O no hydrogen 3.188 N/A LYS 201.A NZ GLU 164.A OE1 no hydrogen 2.537 N/A HIS 202.A N ASN 198.A O no hydrogen 3.114 N/A HIS 202.A NE2 GLU 248.A OE2 no hydrogen 2.866 N/A LEU 203.A N CYS 199.A O no hydrogen 2.897 N/A SER 204.A N SER 200.A O no hydrogen 3.062 N/A SER 204.A OG SER 200.A O no hydrogen 2.918 N/A VAL 205.A N LYS 201.A O no hydrogen 2.853 N/A VAL 206.A N HIS 202.A O no hydrogen 3.026 N/A ASN 207.A N LEU 203.A O no hydrogen 3.063 N/A ASP 208.A N SER 204.A O no hydrogen 2.885 N/A ILE 209.A N VAL 205.A O no hydrogen 2.816 N/A TYR 210.A N VAL 206.A O no hydrogen 3.314 N/A SER 211.A N ASN 207.A O no hydrogen 2.810 N/A SER 211.A N ASP 208.A O no hydrogen 3.216 N/A SER 211.A OG ASN 207.A O no hydrogen 3.092 N/A SER 211.A OG ASP 208.A O no hydrogen 3.529 N/A SER 211.A OG GLU 215.A OE2 no hydrogen 2.620 N/A LYS 214.A NZ ARG 291.A O no hydrogen 3.137 N/A GLU 215.A N SER 211.A O no hydrogen 2.888 N/A LEU 216.A N TYR 212.A O no hydrogen 2.690 N/A SER 221.A N ASP 208.A OD2 no hydrogen 2.977 N/A SER 221.A OG ASP 208.A OD2 no hydrogen 2.662 N/A VAL 222.A N THR 220.A OG1 no hydrogen 3.098 N/A ILE 224.A N THR 220.A O no hydrogen 3.115 N/A LEU 225.A N SER 221.A O no hydrogen 2.922 N/A ALA 226.A N VAL 222.A O no hydrogen 3.092 N/A GLN 227.A N GLN 223.A O no hydrogen 2.934 N/A GLU 228.A N ILE 224.A O no hydrogen 2.908 N/A ALA 229.A N LEU 225.A O no hydrogen 2.863 N/A VAL 231.A N ALA 226.A O no hydrogen 2.973 N/A ALA 235.A N THR 232.A OG1 no hydrogen 3.145 N/A ALA 236.A N THR 232.A O no hydrogen 2.908 N/A LYS 237.A N ALA 233.A O no hydrogen 2.832 N/A LYS 237.A NZ GLU 213.A OE2 no hydrogen 2.743 N/A LYS 237.A NZ GLU 234.A OE2 no hydrogen 2.609 N/A ARG 238.A N GLU 234.A O no hydrogen 3.163 N/A VAL 239.A N ALA 235.A O no hydrogen 3.019 N/A LEU 240.A N ALA 236.A O no hydrogen 2.863 N/A PHE 241.A N LYS 237.A O no hydrogen 2.943 N/A VAL 242.A N ARG 238.A O no hydrogen 3.350 N/A MET 243.A N VAL 239.A O no hydrogen 3.000 N/A CYS 244.A N LEU 240.A O no hydrogen 2.872 N/A CYS 244.A SG LEU 240.A O no hydrogen 3.293 N/A ARG 245.A N PHE 241.A O no hydrogen 3.151 N/A ARG 245.A NE PRO 5.A O no hydrogen 3.112 N/A ARG 245.A NE PRO 6.A O no hydrogen 3.053 N/A ARG 245.A NH1 GLU 248.A OE2 no hydrogen 2.820 N/A ARG 245.A NH1 GLU 283.A OE1 no hydrogen 2.876 N/A ARG 245.A NH2 PRO 5.A O no hydrogen 2.930 N/A ARG 245.A NH2 GLU 283.A OE2 no hydrogen 2.937 N/A GLU 246.A N VAL 242.A O no hydrogen 3.039 N/A TRP 247.A N MET 243.A O no hydrogen 2.960 N/A GLU 248.A N CYS 244.A O no hydrogen 3.099 N/A LEU 249.A N ARG 245.A O no hydrogen 3.006 N/A ARG 250.A N GLU 246.A O no hydrogen 2.828 N/A ARG 250.A NH2 GLU 194.A OE1 no hydrogen 2.876 N/A HIS 251.A N TRP 247.A O no hydrogen 2.850 N/A GLN 252.A N GLU 248.A O no hydrogen 3.151 N/A GLN 252.A NE2 THR 8.A OG1 no hydrogen 3.151 N/A LEU 253.A N LEU 249.A O no hydrogen 2.884 N/A LEU 254.A N ARG 250.A O no hydrogen 2.770 N/A VAL 255.A N HIS 251.A O no hydrogen 2.944 N/A ALA 256.A N GLN 252.A O no hydrogen 2.931 N/A ARG 257.A N LEU 253.A O no hydrogen 2.929 N/A LEU 258.A N LEU 254.A O no hydrogen 2.881 N/A SER 259.A N VAL 255.A O no hydrogen 2.971 N/A ALA 260.A N ALA 256.A O no hydrogen 2.625 N/A GLU 261.A N ARG 257.A O no hydrogen 2.934 N/A GLY 262.A N SER 259.A O no hydrogen 3.174 N/A LEU 263.A N LEU 258.A O no hydrogen 3.192 N/A THR 265.A OG1 GLU 188.A OE1 no hydrogen 2.551 N/A LEU 268.A N THR 265.A OG1 no hydrogen 3.147 N/A ALA 269.A N THR 265.A O no hydrogen 2.857 N/A ALA 270.A N PRO 266.A O no hydrogen 3.182 N/A TYR 271.A N GLY 267.A O no hydrogen 2.958 N/A TYR 271.A OH ASP 196.A OD1 no hydrogen 2.562 N/A VAL 272.A N LEU 268.A O no hydrogen 2.806 N/A GLU 273.A N ALA 269.A O no hydrogen 3.440 N/A GLY 274.A N ALA 270.A O no hydrogen 2.942 N/A LEU 275.A N TYR 271.A O no hydrogen 3.080 N/A GLU 276.A N VAL 272.A O no hydrogen 3.150 N/A TYR 277.A N GLU 273.A O no hydrogen 3.140 N/A GLN 278.A N GLY 274.A O no hydrogen 3.041 N/A MET 279.A N LEU 275.A O no hydrogen 2.934 N/A SER 280.A N GLU 276.A O no hydrogen 3.009 N/A SER 280.A OG GLN 10.A O no hydrogen 2.839 N/A SER 280.A OG GLU 276.A O no hydrogen 3.495 N/A SER 280.A OG TYR 277.A O no hydrogen 3.288 N/A GLY 281.A N TYR 277.A O no hydrogen 2.776 N/A ASN 282.A N GLN 278.A O no hydrogen 2.834 N/A ASN 282.A ND2 LEU 203.A O no hydrogen 3.070 N/A ASN 282.A ND2 ASN 207.A OD1 no hydrogen 3.403 N/A GLU 283.A N MET 279.A O no hydrogen 3.200 N/A LEU 284.A N SER 280.A O no hydrogen 3.264 N/A TRP 285.A N GLY 281.A O no hydrogen 2.905 N/A SER 286.A N ASN 282.A O no hydrogen 2.803 N/A SER 286.A OG ASN 207.A OD1 no hydrogen 3.119 N/A SER 286.A OG ASN 282.A O no hydrogen 2.736 N/A GLN 287.A N GLU 283.A O no hydrogen 3.110 N/A GLN 287.A NE2 TYR 210.A OH no hydrogen 2.990 N/A THR 288.A N TRP 285.A O no hydrogen 3.013 N/A THR 288.A OG1 LEU 284.A O no hydrogen 2.964 N/A THR 288.A OG1 TRP 285.A O no hydrogen 3.480 N/A THR 289.A N TRP 285.A O no hydrogen 2.855 N/A ARG 291.A N THR 289.A OG1 no hydrogen 2.922 N/A ARG 291.A NH2 ASP 78.A OD2 no hydrogen 2.752 N/A TYR 292.A N THR 289.A O no hydrogen 3.476 N/A SER 293.A N LEU 290.A O no hydrogen 3.068 N/A