Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bre_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLY 26.A O no hydrogen 3.006 N/A VAL 2.A N GLY 26.A O no hydrogen 3.196 N/A MET 3.A N THR 48.A OG1 no hydrogen 2.855 N/A VAL 4.A N ASP 28.A O no hydrogen 2.822 N/A LEU 5.A N VAL 49.A O no hydrogen 3.154 N/A LEU 6.A N HIS 30.A O no hydrogen 3.011 N/A VAL 7.A N LEU 51.A O no hydrogen 2.835 N/A ASP 8.A N CYS 32.A O no hydrogen 3.214 N/A GLN 10.A N ASP 8.A OD1 no hydrogen 2.821 N/A GLY 14.A N GLN 10.A O no hydrogen 3.309 N/A GLU 15.A N MET 12.A O no hydrogen 2.776 N/A ALA 16.A N MET 12.A O no hydrogen 2.902 N/A VAL 17.A N ILE 13.A O no hydrogen 3.225 N/A ARG 18.A N GLY 14.A O no hydrogen 3.290 N/A ARG 19.A N GLU 15.A O no hydrogen 2.827 N/A ARG 19.A NE GLU 15.A OE1 no hydrogen 3.009 N/A SER 20.A OG ALA 16.A O no hydrogen 3.330 N/A SER 20.A OG VAL 17.A O no hydrogen 2.614 N/A LEU 21.A N VAL 17.A O no hydrogen 3.227 N/A ASP 28.A N VAL 2.A O no hydrogen 2.938 N/A CYS 32.A N LEU 6.A O no hydrogen 3.080 N/A CYS 32.A SG ASP 34.A O no hydrogen 3.301 N/A GLN 36.A N ASP 34.A OD1 no hydrogen 2.786 N/A GLN 37.A N ASP 34.A O no hydrogen 2.993 N/A ALA 38.A N PRO 35.A O no hydrogen 3.222 N/A VAL 41.A N GLN 37.A O no hydrogen 2.630 N/A ALA 42.A N ALA 38.A O no hydrogen 2.887 N/A ASN 43.A N VAL 39.A O no hydrogen 3.183 N/A ASN 43.A N ALA 40.A O no hydrogen 2.925 N/A GLN 44.A N VAL 41.A O no hydrogen 3.286 N/A ILE 45.A N VAL 41.A O no hydrogen 3.266 N/A THR 48.A N MET 3.A O no hydrogen 2.929 N/A THR 48.A OG1 MET 3.A O no hydrogen 3.512 N/A THR 48.A OG1 SER 120.A OG no hydrogen 2.969 N/A ILE 50.A N PRO 78.A O no hydrogen 3.087 N/A LEU 51.A N LEU 5.A O no hydrogen 2.912 N/A GLN 52.A N ILE 80.A O no hydrogen 2.803 N/A GLN 52.A NE2 ASP 53.A O no hydrogen 2.883 N/A ASP 53.A N VAL 7.A O no hydrogen 2.974 N/A LEU 54.A N LEU 82.A O no hydrogen 2.988 N/A GLY 61.A N LEU 54.A O no hydrogen 2.662 N/A THR 63.A N ASP 60.A O no hydrogen 3.143 N/A THR 63.A OG1 ASP 60.A O no hydrogen 3.457 N/A LEU 65.A N GLY 61.A O no hydrogen 3.039 N/A ALA 66.A N LEU 62.A O no hydrogen 3.229 N/A ALA 67.A N LEU 64.A O no hydrogen 2.965 N/A TYR 68.A N LEU 64.A O no hydrogen 2.900 N/A TYR 68.A OH GLN 52.A OE1 no hydrogen 2.595 N/A ARG 69.A N LEU 65.A O no hydrogen 3.180 N/A ARG 69.A NH1 ILE 77.A O no hydrogen 2.802 N/A ARG 69.A NH2 GLY 98.A O no hydrogen 3.193 N/A GLY 70.A N ALA 67.A O no hydrogen 2.814 N/A THR 74.A N ASN 71.A O no hydrogen 3.086 N/A THR 74.A OG1 TYR 68.A O no hydrogen 2.868 N/A ARG 75.A N ASN 71.A O no hydrogen 2.688 N/A ILE 77.A N THR 74.A O no hydrogen 3.025 N/A ILE 80.A N ILE 50.A O no hydrogen 2.755 N/A VAL 81.A N ASP 101.A O no hydrogen 2.943 N/A LEU 82.A N GLN 52.A O no hydrogen 2.685 N/A SER 83.A N LEU 103.A O no hydrogen 2.917 N/A SER 83.A OG TYR 102.A OH no hydrogen 2.730 N/A LYS 85.A NZ THR 84.A OG1 no hydrogen 3.416 N/A VAL 90.A N GLU 87.A O no hydrogen 2.867 N/A LYS 91.A N GLU 87.A O no hydrogen 3.007 N/A ALA 93.A N THR 89.A O no hydrogen 3.256 N/A ALA 94.A N VAL 90.A O no hydrogen 2.689 N/A ALA 94.A N LYS 91.A O no hydrogen 2.954 N/A PHE 95.A N LYS 91.A O no hydrogen 3.209 N/A ALA 96.A N SER 92.A O no hydrogen 3.205 N/A ALA 97.A N ALA 93.A O no hydrogen 2.923 N/A GLY 98.A N PHE 95.A O no hydrogen 2.879 N/A ALA 99.A N ALA 94.A O no hydrogen 3.020 N/A ASN 100.A N ILE 79.A O no hydrogen 2.834 N/A ASP 101.A N ILE 79.A O no hydrogen 3.230 N/A TYR 102.A N ASP 101.A OD2 no hydrogen 3.052 N/A LEU 103.A N VAL 81.A O no hydrogen 2.948 N/A LYS 105.A N SER 83.A O no hydrogen 2.630 N/A LYS 105.A NZ ASP 8.A OD1 no hydrogen 3.546 N/A LYS 105.A NZ ASP 8.A OD2 no hydrogen 2.924 N/A LYS 105.A NZ ASP 53.A OD1 no hydrogen 2.858 N/A LEU 112.A N ASP 108.A O no hydrogen 2.862 N/A VAL 113.A N ALA 109.A O no hydrogen 3.074 N/A ALA 114.A N ILE 110.A O no hydrogen 3.259 N/A ARG 115.A N GLU 111.A O no hydrogen 2.955 N/A ARG 115.A NE GLU 111.A OE2 no hydrogen 2.591 N/A ARG 115.A NH1 ASP 101.A OD1 no hydrogen 2.868 N/A ARG 115.A NH2 GLU 111.A OE2 no hydrogen 3.110 N/A ILE 116.A N LEU 112.A O no hydrogen 3.202 N/A ARG 117.A N VAL 113.A O no hydrogen 3.053 N/A TYR 118.A N ALA 114.A O no hydrogen 3.100 N/A HIS 119.A N ARG 115.A O no hydrogen 3.129 N/A HIS 119.A ND1 ARG 115.A O no hydrogen 2.808 N/A SER 120.A N ILE 116.A O no hydrogen 3.197 N/A SER 120.A OG THR 48.A OG1 no hydrogen 2.969 N/A SER 120.A OG ILE 116.A O no hydrogen 2.778 N/A ARG 121.A N ARG 117.A O no hydrogen 2.954 N/A SER 122.A N TYR 118.A O no hydrogen 3.061 N/A TYR 123.A N HIS 119.A O no hydrogen 2.801 N/A ILE 124.A N SER 120.A O no hydrogen 2.847 N/A ALA 125.A N ARG 121.A O no hydrogen 2.784 N/A LEU 126.A N SER 122.A O no hydrogen 3.052 N/A GLN 127.A N TYR 123.A O no hydrogen 3.152 N/A GLN 128.A N ILE 124.A O no hydrogen 2.771 N/A ARG 129.A N ALA 125.A O no hydrogen 2.793 N/A ARG 129.A NE ASP 130.A OD1 no hydrogen 2.848 N/A ASP 130.A N LEU 126.A O no hydrogen 3.169 N/A GLU 131.A N GLN 127.A O no hydrogen 3.064 N/A ALA 132.A N GLN 128.A O no hydrogen 2.971 N/A TYR 133.A N ARG 129.A O no hydrogen 2.890 N/A ARG 134.A N ASP 130.A O no hydrogen 2.888 N/A ALA 135.A N GLU 131.A O no hydrogen 2.984 N/A LEU 136.A N ALA 132.A O no hydrogen 2.754 N/A ARG 137.A N TYR 133.A O no hydrogen 3.086 N/A GLU 138.A N ARG 134.A O no hydrogen 3.107 N/A SER 139.A N ALA 135.A O no hydrogen 2.903 N/A GLN 140.A N LEU 136.A O no hydrogen 3.027 N/A GLN 141.A N ARG 137.A O no hydrogen 3.166 N/A GLN 142.A N GLU 138.A O no hydrogen 2.871 N/A LEU 143.A N SER 139.A O no hydrogen 2.803 N/A LEU 144.A N GLN 140.A O no hydrogen 2.921 N/A GLU 145.A N GLN 141.A O no hydrogen 3.209 N/A THR 146.A N GLN 142.A O no hydrogen 2.838 N/A THR 146.A OG1 GLN 142.A O no hydrogen 3.025 N/A ASN 147.A N LEU 143.A O no hydrogen 2.966 N/A LEU 148.A N LEU 144.A O no hydrogen 3.021 N/A VAL 149.A N GLU 145.A O no hydrogen 2.911 N/A LEU 150.A N THR 146.A O no hydrogen 2.913 N/A GLN 151.A N ASN 147.A O no hydrogen 2.828 N/A ARG 152.A N LEU 148.A O no hydrogen 2.943 N/A LEU 153.A N VAL 149.A O no hydrogen 2.947 N/A MET 154.A N LEU 150.A O no hydrogen 2.752 N/A ASN 155.A N GLN 151.A O no hydrogen 2.871 N/A SER 156.A N ARG 152.A O no hydrogen 2.852 N/A SER 156.A OG ARG 152.A O no hydrogen 3.150 N/A ASP 157.A N LEU 162.A O no hydrogen 2.580 N/A THR 160.A N ASP 157.A OD2 no hydrogen 2.939 N/A GLY 161.A N ASP 157.A O no hydrogen 2.886 N/A SER 163.A N ALA 230.A O no hydrogen 3.387 N/A SER 163.A OG ASN 164.A O no hydrogen 3.063 N/A ASN 164.A N ASN 155.A O no hydrogen 2.700 N/A ASN 164.A ND2 MET 154.A O no hydrogen 2.913 N/A ARG 166.A NE GLU 170.A OE1 no hydrogen 3.405 N/A ARG 166.A NH1 ASN 155.A OD1 no hydrogen 3.041 N/A ARG 166.A NH2 ASN 155.A OD1 no hydrogen 3.538 N/A ARG 166.A NH2 GLU 170.A OE2 no hydrogen 3.222 N/A HIS 167.A N ASN 164.A OD1 no hydrogen 2.803 N/A PHE 168.A N ASN 164.A O no hydrogen 3.220 N/A ASP 169.A N ARG 165.A O no hydrogen 2.928 N/A GLU 170.A N ARG 166.A O no hydrogen 3.043 N/A TYR 171.A N HIS 167.A O no hydrogen 3.086 N/A TYR 171.A OH SER 227.A O no hydrogen 2.664 N/A LEU 172.A N PHE 168.A O no hydrogen 2.772 N/A GLU 173.A N ASP 169.A O no hydrogen 2.853 N/A MET 174.A N GLU 170.A O no hydrogen 3.051 N/A GLU 175.A N TYR 171.A O no hydrogen 2.788 N/A TRP 176.A N LEU 172.A O no hydrogen 2.881 N/A ARG 177.A N GLU 173.A O no hydrogen 3.158 N/A ARG 178.A N MET 174.A O no hydrogen 3.118 N/A ARG 178.A NH1 GLU 175.A OE1 no hydrogen 3.304 N/A SER 179.A N GLU 175.A O no hydrogen 3.066 N/A SER 179.A OG GLU 175.A O no hydrogen 3.169 N/A SER 179.A OG SER 184.A OG no hydrogen 3.380 N/A LEU 180.A N TRP 176.A O no hydrogen 3.027 N/A ARG 181.A N ARG 177.A O no hydrogen 3.436 N/A GLU 182.A N ARG 178.A O no hydrogen 2.911 N/A GLN 183.A NE2 LEU 180.A O no hydrogen 3.011 N/A GLN 183.A NE2 PRO 288.A O no hydrogen 2.877 N/A SER 184.A N SER 179.A O no hydrogen 3.062 N/A SER 184.A OG SER 179.A OG no hydrogen 3.380 N/A LEU 186.A N LEU 286.A O no hydrogen 2.765 N/A SER 187.A N LEU 242.A O no hydrogen 3.272 N/A SER 187.A OG THR 245.A O no hydrogen 2.883 N/A LEU 188.A N SER 284.A O no hydrogen 2.860 N/A LEU 189.A N MET 240.A O no hydrogen 2.685 N/A MET 190.A N GLY 282.A O no hydrogen 2.821 N/A ILE 191.A N PHE 238.A O no hydrogen 2.772 N/A ASP 192.A N SER 280.A O no hydrogen 3.101 N/A VAL 193.A N GLU 236.A O no hydrogen 3.061 N/A ASP 194.A N THR 278.A O no hydrogen 2.943 N/A TYR 199.A N TYR 195.A O no hydrogen 3.219 N/A ASN 200.A N PHE 196.A O no hydrogen 2.681 N/A ASN 200.A ND2 HIS 205.A ND1 no hydrogen 3.614 N/A ASP 201.A N LYS 197.A O no hydrogen 3.271 N/A ASP 209.A N HIS 205.A O no hydrogen 2.595 N/A GLU 210.A N VAL 206.A O no hydrogen 3.148 N/A ALA 211.A N ALA 207.A O no hydrogen 3.035 N/A LEU 212.A N GLY 208.A O no hydrogen 2.910 N/A ARG 213.A N ASP 209.A O no hydrogen 2.840 N/A GLN 214.A N GLU 210.A O no hydrogen 3.228 N/A VAL 215.A N ALA 211.A O no hydrogen 2.858 N/A ALA 216.A N LEU 212.A O no hydrogen 3.039 N/A GLY 217.A N ARG 213.A O no hydrogen 3.095 N/A ALA 218.A N GLN 214.A O no hydrogen 3.172 N/A ALA 218.A N VAL 215.A O no hydrogen 3.035 N/A ILE 219.A N ALA 216.A O no hydrogen 3.182 N/A ARG 220.A N ALA 216.A O no hydrogen 3.234 N/A ARG 220.A NH2 THR 160.A O no hydrogen 3.542 N/A GLY 222.A N ILE 219.A O no hydrogen 3.198 N/A CYS 223.A N ARG 220.A O no hydrogen 3.443 N/A ARG 225.A N ASP 228.A OD2 no hydrogen 2.966 N/A ASP 228.A N ARG 225.A O no hydrogen 2.689 N/A LEU 229.A N VAL 241.A O no hydrogen 3.230 N/A ALA 231.A N ALA 239.A O no hydrogen 2.622 N/A ARG 232.A N SER 163.A O no hydrogen 3.192 N/A ARG 232.A NE GLY 235.A O no hydrogen 2.914 N/A ARG 232.A NH1 ASP 157.A OD2 no hydrogen 3.495 N/A ARG 232.A NH2 GLY 235.A O no hydrogen 3.068 N/A TYR 233.A OH ASP 169.A OD1 no hydrogen 2.337 N/A GLY 234.A N GLU 237.A O no hydrogen 3.380 N/A GLU 236.A N GLU 236.A OE1 no hydrogen 2.607 N/A GLU 237.A N GLY 234.A O no hydrogen 3.163 N/A PHE 238.A N ILE 191.A O no hydrogen 2.634 N/A ALA 239.A N ALA 231.A O no hydrogen 2.897 N/A MET 240.A N LEU 189.A O no hydrogen 2.886 N/A VAL 241.A N LEU 229.A O no hydrogen 2.858 N/A LEU 242.A N SER 187.A O no hydrogen 2.794 N/A THR 245.A OG1 LEU 242.A O no hydrogen 3.469 N/A THR 245.A OG1 PRO 243.A O no hydrogen 3.036 N/A GLY 249.A N SER 246.A OG no hydrogen 3.338 N/A ALA 250.A N SER 246.A O no hydrogen 2.757 N/A ARG 251.A N PRO 247.A O no hydrogen 2.764 N/A LEU 252.A N GLY 248.A O no hydrogen 2.912 N/A LEU 253.A N GLY 249.A O no hydrogen 3.034 N/A ALA 254.A N ALA 250.A O no hydrogen 2.835 N/A GLU 255.A N ARG 251.A O no hydrogen 2.925 N/A LYS 256.A N LEU 252.A O no hydrogen 2.824 N/A LYS 256.A NZ GLU 221.A O no hydrogen 2.722 N/A VAL 257.A N LEU 253.A O no hydrogen 2.794 N/A ARG 258.A N ALA 254.A O no hydrogen 2.801 N/A ARG 258.A NE ASN 315.A O no hydrogen 2.964 N/A ARG 259.A N GLU 255.A O no hydrogen 2.906 N/A THR 260.A N LYS 256.A O no hydrogen 3.115 N/A THR 260.A OG1 LYS 256.A O no hydrogen 3.038 N/A THR 260.A OG1 VAL 257.A O no hydrogen 3.083 N/A VAL 261.A N VAL 257.A O no hydrogen 3.017 N/A GLU 262.A N ARG 258.A O no hydrogen 3.095 N/A SER 263.A N ARG 259.A O no hydrogen 3.034 N/A SER 263.A OG THR 260.A O no hydrogen 3.026 N/A LEU 264.A N VAL 261.A O no hydrogen 3.220 N/A GLN 265.A N GLU 262.A O no hydrogen 2.932 N/A GLN 265.A NE2 GLU 262.A O no hydrogen 3.185 N/A HIS 268.A N SER 275.A O no hydrogen 3.134 N/A SER 275.A N ARG 272.A O no hydrogen 3.160 N/A SER 275.A OG HIS 268.A O no hydrogen 3.509 N/A SER 275.A OG ARG 272.A O no hydrogen 2.764 N/A LEU 277.A N ILE 266.A O no hydrogen 2.773 N/A THR 278.A OG1 ASP 194.A OD2 no hydrogen 2.827 N/A SER 280.A N ASP 192.A O no hydrogen 2.960 N/A SER 280.A OG ASP 194.A OD1 no hydrogen 2.587 N/A SER 280.A OG ASP 194.A OD2 no hydrogen 3.328 N/A ILE 281.A N GLN 316.A O no hydrogen 3.121 N/A GLY 282.A N MET 190.A O no hydrogen 2.990 N/A VAL 283.A N GLY 318.A O no hydrogen 2.777 N/A SER 284.A N LEU 188.A O no hydrogen 2.901 N/A SER 284.A OG LEU 298.A O no hydrogen 2.877 N/A LEU 286.A N LEU 186.A O no hydrogen 3.053 N/A GLY 289.A N GLN 293.A OE1 no hydrogen 3.466 N/A ARG 296.A N THR 294.A OG1 no hydrogen 3.063 N/A VAL 297.A N THR 294.A O no hydrogen 3.061 N/A LEU 298.A N PHE 295.A O no hydrogen 2.885 N/A ILE 299.A N PHE 295.A O no hydrogen 3.280 N/A GLU 300.A N ARG 296.A O no hydrogen 3.031 N/A MET 301.A N VAL 297.A O no hydrogen 3.278 N/A ALA 302.A N LEU 298.A O no hydrogen 3.172 N/A ASP 303.A N ILE 299.A O no hydrogen 3.037 N/A GLN 304.A N GLU 300.A O no hydrogen 3.037 N/A ALA 305.A N MET 301.A O no hydrogen 2.958 N/A LEU 306.A N ALA 302.A O no hydrogen 2.821 N/A TYR 307.A N ASP 303.A O no hydrogen 2.789 N/A GLN 308.A N GLN 304.A O no hydrogen 2.850 N/A ALA 309.A N ALA 305.A O no hydrogen 2.892 N/A LYS 310.A N LEU 306.A O no hydrogen 2.989 N/A LYS 310.A NZ ASP 192.A OD2 no hydrogen 2.916 N/A ASN 311.A N TYR 307.A O no hydrogen 2.965 N/A ASN 312.A N ALA 309.A O no hydrogen 3.365 N/A GLY 313.A N LYS 310.A O no hydrogen 3.403 N/A ARG 314.A N ALA 309.A O no hydrogen 3.133 N/A ASN 315.A N ASP 194.A OD2 no hydrogen 3.100 N/A GLY 318.A N ILE 281.A O no hydrogen 2.787 N/A