Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3b2r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N GLU 5.A OE1 no hydrogen 2.621 N/A GLU 5.A N SER 2.A OG no hydrogen 3.257 N/A GLU 6.A N SER 2.A O no hydrogen 2.912 N/A THR 7.A N HIS 3.A O no hydrogen 2.985 N/A THR 7.A OG1 HIS 3.A O no hydrogen 2.958 N/A ARG 8.A N MET 4.A O no hydrogen 2.928 N/A ARG 8.A NH1 GLN 11.A OE1 no hydrogen 3.169 N/A GLU 9.A N GLU 5.A O no hydrogen 3.013 N/A LEU 10.A N GLU 6.A O no hydrogen 3.058 N/A GLN 11.A N THR 7.A O no hydrogen 2.934 N/A SER 12.A N ARG 8.A O no hydrogen 2.851 N/A SER 12.A OG ARG 8.A O no hydrogen 2.912 N/A LEU 13.A N GLU 9.A O no hydrogen 2.959 N/A ALA 14.A N LEU 10.A O no hydrogen 2.965 N/A ALA 15.A N GLN 11.A O no hydrogen 3.240 N/A ALA 16.A N SER 12.A O no hydrogen 3.112 N/A ALA 16.A N LEU 13.A O no hydrogen 3.109 N/A SER 20.A OG THR 23.A OG1 no hydrogen 2.923 N/A THR 23.A N SER 20.A OG no hydrogen 3.028 N/A THR 23.A OG1 SER 20.A OG no hydrogen 2.923 N/A LEU 24.A N SER 20.A O no hydrogen 2.931 N/A LYS 25.A N GLN 22.A O no hydrogen 3.197 N/A ASP 28.A N LYS 25.A O no hydrogen 3.150 N/A PHE 31.A N ASP 28.A O no hydrogen 3.171 N/A LEU 36.A N ASP 33.A O no hydrogen 3.028 N/A SER 37.A N GLU 40.A OE1 no hydrogen 2.763 N/A SER 37.A OG GLU 40.A OE1 no hydrogen 3.334 N/A GLU 40.A N SER 37.A OG no hydrogen 3.230 N/A THR 41.A N SER 37.A O no hydrogen 3.085 N/A THR 41.A OG1 ASP 38.A O no hydrogen 2.546 N/A ALA 42.A N ASP 38.A O no hydrogen 2.978 N/A LEU 43.A N LEU 39.A O no hydrogen 2.987 N/A CYS 44.A N GLU 40.A O no hydrogen 2.928 N/A CYS 44.A SG GLU 40.A O no hydrogen 3.313 N/A THR 45.A N THR 41.A O no hydrogen 2.902 N/A THR 45.A OG1 THR 41.A O no hydrogen 2.786 N/A ILE 46.A N ALA 42.A O no hydrogen 2.909 N/A ARG 47.A N LEU 43.A O no hydrogen 2.938 N/A ARG 47.A NE PRO 19.A O no hydrogen 2.865 N/A ARG 47.A NH1 ASP 51.A OD1 no hydrogen 2.818 N/A ARG 47.A NH2 VAL 18.A O no hydrogen 2.828 N/A ARG 47.A NH2 PRO 19.A O no hydrogen 3.371 N/A MET 48.A N CYS 44.A O no hydrogen 2.959 N/A PHE 49.A N THR 45.A O no hydrogen 3.102 N/A THR 50.A N ILE 46.A O no hydrogen 2.890 N/A THR 50.A OG1 ILE 46.A O no hydrogen 2.884 N/A ASP 51.A N ARG 47.A O no hydrogen 2.847 N/A LEU 52.A N MET 48.A O no hydrogen 3.183 N/A ASN 53.A N THR 50.A O no hydrogen 2.869 N/A LEU 54.A N PHE 49.A O no hydrogen 3.039 N/A ASN 57.A N ASN 53.A O no hydrogen 2.893 N/A ASN 57.A ND2 ASN 53.A O no hydrogen 3.154 N/A PHE 58.A N LEU 54.A O no hydrogen 3.047 N/A GLN 59.A N GLN 56.A O no hydrogen 3.151 N/A GLN 59.A NE2 GLN 56.A O no hydrogen 3.235 N/A MET 60.A N VAL 55.A O no hydrogen 2.980 N/A HIS 62.A NE2 ALA 14.A O no hydrogen 3.070 N/A GLU 63.A N GLU 63.A OE1 no hydrogen 2.726 N/A LEU 65.A N LYS 61.A O no hydrogen 3.052 N/A CYS 66.A N HIS 62.A O no hydrogen 2.943 N/A CYS 66.A SG HIS 62.A NE2 no hydrogen 3.645 N/A CYS 66.A SG HIS 62.A O no hydrogen 3.380 N/A ARG 67.A N GLU 63.A O no hydrogen 2.949 N/A ARG 67.A NH1 GLY 151.A O no hydrogen 2.769 N/A TRP 68.A N VAL 64.A O no hydrogen 2.887 N/A ILE 69.A N LEU 65.A O no hydrogen 2.991 N/A LEU 70.A N CYS 66.A O no hydrogen 3.018 N/A SER 71.A N ARG 67.A O no hydrogen 2.781 N/A SER 71.A OG ARG 67.A O no hydrogen 2.699 N/A SER 71.A OG ASN 152.A OD1 no hydrogen 3.039 N/A VAL 72.A N TRP 68.A O no hydrogen 2.888 N/A LYS 73.A N ILE 69.A O no hydrogen 3.008 N/A LYS 73.A NZ GLU 9.A OE2 no hydrogen 2.709 N/A LYS 73.A NZ ASP 38.A OD2 no hydrogen 3.197 N/A LYS 74.A N LEU 70.A O no hydrogen 2.930 N/A ASN 75.A N SER 71.A O no hydrogen 3.218 N/A ASN 75.A N VAL 72.A O no hydrogen 3.166 N/A ASN 75.A ND2 SER 71.A O no hydrogen 2.547 N/A TYR 76.A N LYS 73.A O no hydrogen 3.212 N/A TYR 76.A OH LEU 121.A O no hydrogen 2.540 N/A ARG 77.A NH1 HIS 127.A O no hydrogen 2.688 N/A TYR 82.A N GLU 239.A OE1 no hydrogen 2.801 N/A HIS 83.A N GLU 239.A OE1 no hydrogen 2.743 N/A HIS 83.A ND1 GLU 239.A OE2 no hydrogen 2.639 N/A ASN 84.A N TYR 82.A O no hydrogen 2.856 N/A ASN 84.A ND2 VAL 80.A O no hydrogen 2.801 N/A ASN 84.A ND2 ALA 81.A O no hydrogen 3.234 N/A TRP 85.A NE1 THR 41.A OG1 no hydrogen 2.934 N/A ARG 86.A NH1 ASP 33.A OD2 no hydrogen 2.974 N/A ARG 86.A NH1 LEU 36.A O no hydrogen 3.009 N/A ARG 86.A NH2 LEU 36.A O no hydrogen 3.020 N/A ARG 86.A NH2 ASP 38.A OD1 no hydrogen 2.752 N/A HIS 87.A N ASN 84.A OD1 no hydrogen 3.348 N/A HIS 87.A NE2 ASP 218.A OD1 no hydrogen 2.781 N/A ALA 88.A N ASN 84.A O no hydrogen 3.080 N/A PHE 89.A N TRP 85.A O no hydrogen 2.674 N/A ASN 90.A N ARG 86.A O no hydrogen 2.811 N/A ASN 90.A ND2 ASP 33.A OD1 no hydrogen 3.015 N/A ASN 90.A ND2 ARG 86.A O no hydrogen 2.976 N/A THR 91.A N HIS 87.A O no hydrogen 2.819 N/A THR 91.A OG1 HIS 87.A O no hydrogen 2.830 N/A ALA 92.A N ALA 88.A O no hydrogen 3.028 N/A GLN 93.A N PHE 89.A O no hydrogen 2.890 N/A GLN 93.A NE2 ILE 26.A O no hydrogen 2.872 N/A GLN 93.A NE2 ASP 28.A O no hydrogen 2.870 N/A CYS 94.A N ASN 90.A O no hydrogen 2.901 N/A MET 95.A N THR 91.A O no hydrogen 3.065 N/A PHE 96.A N ALA 92.A O no hydrogen 2.923 N/A ALA 97.A N GLN 93.A O no hydrogen 2.896 N/A ALA 98.A N CYS 94.A O no hydrogen 2.853 N/A LEU 99.A N MET 95.A O no hydrogen 2.970 N/A LYS 100.A N PHE 96.A O no hydrogen 2.916 N/A LYS 100.A NZ ASP 51.A O no hydrogen 3.049 N/A LYS 100.A NZ GLN 105.A OE1 no hydrogen 2.633 N/A GLY 102.A N ALA 97.A O no hydrogen 2.810 N/A LYS 103.A N LYS 100.A O no hydrogen 2.832 N/A ILE 104.A N ALA 98.A O no hydrogen 3.134 N/A GLN 105.A N LEU 99.A O no hydrogen 2.965 N/A LYS 107.A N ILE 104.A O no hydrogen 3.017 N/A LEU 108.A N GLN 105.A O no hydrogen 3.052 N/A THR 109.A N GLU 112.A OE1 no hydrogen 3.034 N/A GLU 112.A N THR 109.A OG1 no hydrogen 3.246 N/A ILE 113.A N THR 109.A O no hydrogen 3.051 N/A LEU 114.A N ASP 110.A O no hydrogen 2.942 N/A ALA 115.A N LEU 111.A O no hydrogen 2.902 N/A LEU 116.A N GLU 112.A O no hydrogen 2.796 N/A LEU 117.A N ILE 113.A O no hydrogen 2.997 N/A ILE 118.A N LEU 114.A O no hydrogen 3.167 N/A ALA 119.A N ALA 115.A O no hydrogen 2.887 N/A ALA 120.A N LEU 116.A O no hydrogen 2.949 N/A LEU 121.A N LEU 117.A O no hydrogen 3.109 N/A SER 122.A N ILE 118.A O no hydrogen 2.947 N/A SER 122.A OG ILE 118.A O no hydrogen 2.839 N/A HIS 123.A N ALA 119.A O no hydrogen 2.653 N/A HIS 123.A ND1 ALA 120.A O no hydrogen 2.636 N/A HIS 123.A NE2 ASP 218.A OD1 no hydrogen 2.687 N/A ASP 124.A N TYR 76.A OH no hydrogen 3.340 N/A LEU 125.A N SER 122.A O no hydrogen 3.152 N/A ARG 128.A NH2 ASP 126.A OD2 no hydrogen 2.670 N/A ILE 134.A N CYS 131.A O no hydrogen 2.563 N/A MET 135.A N HIS 132.A O no hydrogen 3.358 N/A HIS 137.A ND1 ASP 178.A OD2 no hydrogen 2.806 N/A HIS 138.A N ASP 178.A OD1 no hydrogen 2.680 N/A HIS 138.A ND1 ASP 178.A OD1 no hydrogen 2.649 N/A LEU 144.A N PHE 140.A O no hydrogen 3.183 N/A MET 145.A N ASP 141.A O no hydrogen 2.984 N/A ILE 146.A N GLN 142.A O no hydrogen 3.005 N/A LEU 147.A N CYS 143.A O no hydrogen 3.009 N/A ASN 148.A N LEU 144.A O no hydrogen 2.867 N/A ASN 148.A N MET 145.A O no hydrogen 3.097 N/A ASN 148.A ND2 TYR 163.A OH no hydrogen 3.412 N/A SER 149.A N ILE 146.A O no hydrogen 3.201 N/A SER 149.A OG ILE 146.A O no hydrogen 2.654 N/A ASN 152.A N SER 149.A O no hydrogen 2.998 N/A ASN 152.A ND2 SER 149.A OG no hydrogen 2.725 N/A SER 156.A N GLN 153.A O no hydrogen 3.296 N/A SER 156.A OG GLN 153.A O no hydrogen 3.275 N/A LEU 158.A N LEU 155.A O no hydrogen 3.037 N/A SER 159.A N GLU 162.A OE2 no hydrogen 3.187 N/A GLU 162.A N SER 159.A OG no hydrogen 3.243 N/A TYR 163.A N SER 159.A O no hydrogen 2.968 N/A LYS 164.A N ILE 160.A O no hydrogen 3.113 N/A THR 165.A N GLU 161.A O no hydrogen 2.868 N/A THR 165.A OG1 GLU 161.A O no hydrogen 3.095 N/A THR 166.A N GLU 162.A O no hydrogen 2.854 N/A THR 166.A OG1 GLU 162.A O no hydrogen 2.709 N/A LEU 167.A N TYR 163.A O no hydrogen 2.980 N/A LYS 168.A N LYS 164.A O no hydrogen 3.250 N/A ILE 169.A N THR 165.A O no hydrogen 3.042 N/A ILE 170.A N THR 166.A O no hydrogen 2.809 N/A LYS 171.A N LEU 167.A O no hydrogen 3.013 N/A GLN 172.A N LYS 168.A O no hydrogen 3.131 N/A ALA 173.A N ILE 169.A O no hydrogen 2.749 N/A ILE 174.A N ILE 170.A O no hydrogen 2.956 N/A LEU 175.A N LYS 171.A O no hydrogen 3.043 N/A ALA 176.A N GLN 172.A O no hydrogen 2.952 N/A ALA 176.A N ALA 173.A O no hydrogen 3.199 N/A THR 177.A N ILE 174.A O no hydrogen 3.024 N/A THR 177.A OG1 ILE 174.A O no hydrogen 2.552 N/A ASP 178.A N LEU 175.A O no hydrogen 3.028 N/A LEU 181.A N ASP 178.A O no hydrogen 3.016 N/A TYR 182.A N ASP 178.A O no hydrogen 3.244 N/A TYR 182.A OH ILE 261.A O no hydrogen 2.952 N/A ILE 183.A N LEU 179.A O no hydrogen 2.863 N/A LYS 184.A N ALA 180.A O no hydrogen 2.982 N/A ARG 185.A N LEU 181.A O no hydrogen 3.155 N/A ARG 186.A N TYR 182.A O no hydrogen 2.927 N/A ARG 186.A NH1 TYR 182.A OH no hydrogen 3.353 N/A ARG 186.A NH1 ALA 260.A O no hydrogen 2.895 N/A ARG 186.A NH2 ALA 260.A O no hydrogen 3.057 N/A PHE 190.A N ARG 186.A O no hydrogen 2.880 N/A GLU 191.A N GLY 187.A O no hydrogen 3.023 N/A LEU 192.A N GLU 188.A O no hydrogen 3.010 N/A ILE 193.A N PHE 189.A O no hydrogen 3.145 N/A ARG 194.A N PHE 190.A O no hydrogen 2.856 N/A ARG 194.A NE GLU 191.A OE1 no hydrogen 3.057 N/A ARG 194.A NE GLU 191.A OE2 no hydrogen 3.352 N/A ARG 194.A NH2 GLU 191.A OE1 no hydrogen 2.876 N/A LYS 195.A N GLU 191.A O no hydrogen 2.858 N/A ASN 196.A N ILE 193.A O no hydrogen 3.025 N/A ASN 196.A ND2 ILE 193.A O no hydrogen 3.352 N/A GLN 197.A N LEU 192.A O no hydrogen 2.809 N/A ASN 199.A N GLN 205.A OE1 no hydrogen 2.523 N/A ASP 202.A N ASN 199.A O no hydrogen 3.123 N/A HIS 204.A NE2 GLU 188.A OE1 no hydrogen 3.272 N/A HIS 204.A NE2 GLU 188.A OE2 no hydrogen 2.577 N/A GLN 205.A N ASP 202.A OD1 no hydrogen 2.766 N/A LYS 206.A N ASP 202.A O no hydrogen 2.856 N/A LYS 206.A NZ LYS 107.A O no hydrogen 3.562 N/A LYS 206.A NZ GLU 112.A OE1 no hydrogen 2.948 N/A LYS 206.A NZ GLU 112.A OE2 no hydrogen 3.327 N/A GLU 207.A N PRO 203.A O no hydrogen 3.024 N/A LEU 208.A N HIS 204.A O no hydrogen 3.033 N/A PHE 209.A N GLN 205.A O no hydrogen 2.944 N/A LEU 210.A N LYS 206.A O no hydrogen 3.014 N/A ALA 211.A N GLU 207.A O no hydrogen 3.201 N/A MET 212.A N LEU 208.A O no hydrogen 3.041 N/A LEU 213.A N PHE 209.A O no hydrogen 2.742 N/A MET 214.A N LEU 210.A O no hydrogen 3.106 N/A THR 215.A N ALA 211.A O no hydrogen 3.181 N/A THR 215.A OG1 ALA 176.A O no hydrogen 3.522 N/A THR 215.A OG1 ALA 211.A O no hydrogen 3.351 N/A ALA 216.A N MET 212.A O no hydrogen 2.984 N/A CYS 217.A N LEU 213.A O no hydrogen 3.004 N/A CYS 217.A SG LEU 213.A O no hydrogen 3.359 N/A ASP 218.A N MET 214.A O no hydrogen 2.839 N/A LEU 219.A N THR 215.A O no hydrogen 2.955 N/A SER 220.A N CYS 217.A O no hydrogen 3.312 N/A SER 220.A OG CYS 217.A O no hydrogen 2.599 N/A ILE 222.A N LEU 219.A O no hydrogen 2.904 N/A THR 223.A N SER 220.A O no hydrogen 2.813 N/A THR 223.A OG1 SER 220.A O no hydrogen 2.665 N/A LYS 224.A N ALA 221.A O no hydrogen 3.367 N/A LYS 224.A NZ PHE 29.A O no hydrogen 2.958 N/A LYS 224.A NZ PHE 31.A O no hydrogen 2.722 N/A GLN 229.A N PRO 225.A O no hydrogen 2.945 N/A GLN 229.A NE2 ALA 221.A O no hydrogen 3.021 N/A GLN 230.A N TRP 226.A O no hydrogen 2.771 N/A ARG 231.A N PRO 227.A O no hydrogen 3.283 N/A ARG 231.A NH1 GLU 234.A OE2 no hydrogen 3.171 N/A ILE 232.A N ILE 228.A O no hydrogen 3.065 N/A ALA 233.A N GLN 229.A O no hydrogen 2.907 N/A GLU 234.A N GLN 230.A O no hydrogen 3.210 N/A LEU 235.A N ARG 231.A O no hydrogen 3.170 N/A VAL 236.A N ILE 232.A O no hydrogen 3.015 N/A ALA 237.A N ALA 233.A O no hydrogen 2.939 N/A THR 238.A N GLU 234.A O no hydrogen 2.807 N/A THR 238.A OG1 GLU 234.A O no hydrogen 2.867 N/A GLU 239.A N LEU 235.A O no hydrogen 2.987 N/A PHE 240.A N VAL 236.A O no hydrogen 3.206 N/A PHE 241.A N ALA 237.A O no hydrogen 2.841 N/A ASP 242.A N THR 238.A O no hydrogen 2.817 N/A GLN 243.A N GLU 239.A O no hydrogen 3.139 N/A GLY 244.A N PHE 240.A O no hydrogen 2.897 N/A ASP 245.A N PHE 241.A O no hydrogen 3.066 N/A LYS 249.A N LYS 246.A O no hydrogen 2.919 N/A ILE 250.A N LYS 247.A O no hydrogen 3.038 N/A MET 253.A N LYS 249.A O no hydrogen 3.104 N/A GLN 254.A N ILE 250.A O no hydrogen 2.830 N/A GLN 254.A NE2 GLN 229.A OE1 no hydrogen 3.129 N/A VAL 255.A N PRO 251.A O no hydrogen 3.206 N/A GLY 256.A N SER 252.A O no hydrogen 3.003 N/A PHE 257.A N MET 253.A O no hydrogen 2.766 N/A ILE 258.A N GLN 254.A O no hydrogen 2.830 N/A ASP 259.A N VAL 255.A O no hydrogen 2.846 N/A ALA 260.A N GLY 256.A O no hydrogen 2.884 N/A ILE 261.A N PHE 257.A O no hydrogen 2.940 N/A CYS 262.A N PHE 257.A O no hydrogen 3.414 N/A CYS 262.A SG PHE 257.A O no hydrogen 3.936 N/A LEU 263.A N ILE 258.A O no hydrogen 2.951 N/A LEU 265.A N CYS 262.A O no hydrogen 2.899 N/A TYR 266.A N CYS 262.A O no hydrogen 3.166 N/A TYR 266.A OH ALA 216.A O no hydrogen 2.731 N/A GLU 267.A N LEU 263.A O no hydrogen 2.851 N/A ALA 268.A N GLN 264.A O no hydrogen 3.030 N/A LEU 269.A N LEU 265.A O no hydrogen 2.872 N/A THR 270.A N TYR 266.A O no hydrogen 3.118 N/A THR 270.A OG1 TYR 266.A O no hydrogen 2.869 N/A HIS 271.A N ALA 268.A O no hydrogen 2.859 N/A VAL 272.A N ALA 268.A O no hydrogen 3.318 N/A SER 273.A N LEU 269.A O no hydrogen 3.020 N/A SER 273.A OG GLY 102.A O no hydrogen 2.608 N/A CYS 276.A N SER 273.A O no hydrogen 2.968 N/A CYS 276.A SG GLY 102.A O no hydrogen 3.914 N/A PHE 277.A N GLU 274.A O no hydrogen 2.923 N/A LEU 279.A N CYS 276.A O no hydrogen 3.064 N/A ASP 281.A N PHE 277.A O no hydrogen 2.870 N/A GLY 282.A N PRO 278.A O no hydrogen 2.772 N/A CYS 283.A N LEU 279.A O no hydrogen 3.060 N/A ARG 284.A N LEU 280.A O no hydrogen 2.926 N/A LYS 285.A N ASP 281.A O no hydrogen 3.002 N/A LYS 285.A NZ ASP 281.A OD1 no hydrogen 3.514 N/A ASN 286.A N GLY 282.A O no hydrogen 3.016 N/A ASN 286.A ND2 ILE 222.A O no hydrogen 2.773 N/A ASN 286.A ND2 LYS 224.A O no hydrogen 2.854 N/A ARG 287.A N CYS 283.A O no hydrogen 2.932 N/A ARG 287.A NH1 ASP 259.A OD1 no hydrogen 2.905 N/A GLN 288.A N ARG 284.A O no hydrogen 3.101 N/A LYS 289.A N LYS 285.A O no hydrogen 3.088 N/A TRP 290.A N ASN 286.A O no hydrogen 2.992 N/A TRP 290.A NE1 GLN 229.A OE1 no hydrogen 2.821 N/A GLN 291.A N ARG 287.A O no hydrogen 2.818 N/A ALA 292.A N GLN 288.A O no hydrogen 2.963 N/A LEU 293.A N LYS 289.A O no hydrogen 3.170 N/A ALA 294.A N TRP 290.A O no hydrogen 2.756 N/A GLU 295.A N GLN 291.A O no hydrogen 2.920 N/A GLN 296.A N LEU 293.A O no hydrogen 2.733 N/A