Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2b2u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ARG 72.A O no hydrogen 2.886 N/A GLU 5.A N LYS 49.A O no hydrogen 2.958 N/A ARG 6.A N LYS 49.A O no hydrogen 3.008 N/A MET 8.A N LEU 47.A O no hydrogen 2.875 N/A ARG 11.A N GLN 45.A O no hydrogen 2.859 N/A ARG 11.A NE GLN 45.A OE1 no hydrogen 2.645 N/A ARG 11.A NH2 ALA 17.A O no hydrogen 3.350 N/A ARG 11.A NH2 GLN 45.A OE1 no hydrogen 3.105 N/A GLY 13.A N GLU 43.A O no hydrogen 3.236 N/A ARG 14.A N ASN 34.A OD1 no hydrogen 2.710 N/A ARG 14.A NE PRO 33.A O no hydrogen 3.359 N/A ALA 17.A N ARG 14.A O no hydrogen 3.157 N/A THR 18.A N GLY 16.A O no hydrogen 2.836 N/A GLY 19.A N TRP 60.A O no hydrogen 2.930 N/A THR 21.A OG1 THR 18.A O no hydrogen 3.461 N/A THR 22.A N GLY 19.A O no hydrogen 2.803 N/A THR 22.A OG1 GLY 19.A O no hydrogen 2.557 N/A THR 23.A N ALA 20.A O no hydrogen 2.951 N/A THR 23.A OG1 ALA 20.A O no hydrogen 3.048 N/A TYR 25.A OH HIS 57.A ND1 no hydrogen 2.574 N/A ALA 26.A N THR 23.A OG1 no hydrogen 3.419 N/A VAL 27.A N THR 23.A O no hydrogen 2.737 N/A GLU 28.A N ILE 24.A O no hydrogen 2.761 N/A ALA 29.A N TYR 25.A O no hydrogen 3.147 N/A ASP 30.A N ALA 26.A O no hydrogen 2.774 N/A GLY 31.A N VAL 27.A O no hydrogen 2.543 N/A ASN 34.A N ASP 32.A OD1 no hydrogen 2.612 N/A GLU 40.A N GLU 40.A OE2 no hydrogen 2.421 N/A GLU 43.A N GLY 13.A O no hydrogen 3.195 N/A GLN 45.A N ARG 11.A O no hydrogen 3.055 N/A GLN 45.A NE2 ARG 14.A O no hydrogen 2.879 N/A TYR 46.A N GLU 61.A O no hydrogen 2.697 N/A LEU 47.A N ASP 9.A O no hydrogen 2.751 N/A ILE 48.A N THR 59.A O no hydrogen 2.807 N/A LYS 49.A N ARG 6.A O no hydrogen 2.768 N/A LYS 49.A NZ TRP 50.A O no hydrogen 3.385 N/A LYS 49.A NZ TRP 53.A O no hydrogen 2.241 N/A TRP 50.A NE1 THR 59.A OG1 no hydrogen 3.116 N/A LYS 51.A N THR 3.A O no hydrogen 2.902 N/A TRP 53.A N TRP 50.A O no hydrogen 3.253 N/A TRP 53.A NE1 GLU 2.A OE1 no hydrogen 2.566 N/A SER 54.A OG SER 150.A OG no hydrogen 3.131 N/A SER 54.A OG GLU 152.A OE1 no hydrogen 2.617 N/A HIS 57.A N SER 54.A O no hydrogen 2.759 N/A HIS 57.A ND1 TYR 25.A OH no hydrogen 2.574 N/A HIS 57.A NE2 GLU 152.A OE2 no hydrogen 3.050 N/A ASN 58.A N HIS 55.A O no hydrogen 2.954 N/A THR 59.A N ILE 48.A O no hydrogen 3.322 N/A THR 59.A OG1 GLU 61.A OE2 no hydrogen 3.035 N/A TRP 60.A N THR 22.A OG1 no hydrogen 2.982 N/A GLU 61.A N TYR 46.A O no hydrogen 2.605 N/A THR 62.A N THR 65.A OG1 no hydrogen 2.853 N/A THR 65.A N THR 62.A OG1 no hydrogen 3.209 N/A THR 65.A OG1 GLU 61.A OE1 no hydrogen 2.661 N/A THR 65.A OG1 THR 62.A O no hydrogen 2.893 N/A LEU 66.A N THR 62.A O no hydrogen 2.977 N/A LYS 67.A N GLU 63.A O no hydrogen 3.334 N/A GLN 68.A N GLU 64.A O no hydrogen 2.713 N/A GLN 69.A N THR 65.A O no hydrogen 2.856 N/A GLN 69.A N LEU 66.A O no hydrogen 2.981 N/A ASN 70.A N LYS 67.A O no hydrogen 3.088 N/A ARG 72.A N GLU 2.A O no hydrogen 2.598 N/A LYS 76.A N GLY 73.A O no hydrogen 2.672 N/A LYS 76.A NZ ILE 4.A O no hydrogen 2.711 N/A LEU 77.A N MET 74.A O no hydrogen 2.639 N/A ASP 78.A N LYS 75.A O no hydrogen 2.891 N/A ASN 79.A N LYS 75.A O no hydrogen 3.389 N/A TYR 80.A N LYS 76.A O no hydrogen 2.996 N/A LYS 81.A N LEU 77.A O no hydrogen 3.213 N/A LYS 81.A NZ GLU 63.A OE1 no hydrogen 2.783 N/A LYS 82.A N ASP 78.A O no hydrogen 2.690 N/A LYS 83.A N ASN 79.A O no hydrogen 2.510 N/A ASP 84.A N TYR 80.A O no hydrogen 2.686 N/A GLN 85.A N LYS 81.A O no hydrogen 2.979 N/A GLU 86.A N LYS 82.A O no hydrogen 3.026 N/A THR 87.A N LYS 83.A O no hydrogen 2.925 N/A THR 87.A OG1 LYS 83.A O no hydrogen 3.519 N/A LYS 88.A N ASP 84.A O no hydrogen 3.350 N/A LYS 88.A NZ ASP 84.A O no hydrogen 3.424 N/A LYS 88.A NZ ASP 84.A OD1 no hydrogen 2.623 N/A LYS 88.A NZ ASP 84.A OD2 no hydrogen 3.323 N/A ARG 89.A N GLN 85.A O no hydrogen 3.092 N/A TRP 90.A N GLU 86.A O no hydrogen 3.143 N/A TRP 90.A NE1 GLU 86.A OE2 no hydrogen 2.838 N/A LEU 91.A N LYS 88.A O no hydrogen 2.519 N/A SER 95.A N ASP 98.A OD2 no hydrogen 2.947 N/A SER 95.A OG ASP 98.A OD2 no hydrogen 3.093 N/A VAL 99.A N SER 95.A O no hydrogen 3.124 N/A GLU 100.A N PRO 96.A O no hydrogen 2.697 N/A TYR 101.A N GLU 97.A O no hydrogen 3.032 N/A TYR 102.A N ASP 98.A O no hydrogen 3.108 N/A ASN 103.A N VAL 99.A O no hydrogen 3.022 N/A ASN 103.A ND2 VAL 99.A O no hydrogen 3.387 N/A CYS 104.A N GLU 100.A O no hydrogen 2.827 N/A CYS 104.A SG GLU 100.A O no hydrogen 2.910 N/A CYS 104.A SG GLU 100.A OE2 no hydrogen 3.316 N/A GLN 105.A N TYR 101.A O no hydrogen 2.617 N/A GLU 107.A N ASN 103.A O no hydrogen 3.161 N/A GLU 107.A N CYS 104.A O no hydrogen 2.714 N/A LEU 108.A N CYS 104.A O no hydrogen 3.021 N/A THR 109.A OG1 GLN 106.A O no hydrogen 2.924 N/A ASP 110.A N GLN 106.A O no hydrogen 3.051 N/A ASP 111.A N GLU 107.A O no hydrogen 2.948 N/A LEU 112.A N LEU 108.A O no hydrogen 2.857 N/A HIS 113.A N THR 109.A O no hydrogen 2.870 N/A LYS 114.A NZ ASP 111.A OD1 no hydrogen 2.779 N/A GLN 115.A N LEU 112.A O no hydrogen 2.897 N/A GLN 117.A N LYS 114.A O no hydrogen 2.810 N/A ILE 118.A N GLN 115.A O no hydrogen 2.620 N/A GLY 120.A N LYS 140.A O no hydrogen 2.795 N/A ARG 121.A N LYS 140.A O no hydrogen 3.171 N/A ILE 123.A N TYR 138.A O no hydrogen 2.767 N/A HIS 125.A ND1 TYR 168.A OH no hydrogen 2.512 N/A SER 126.A N ASP 136.A O no hydrogen 3.171 N/A SER 126.A OG GLN 128.A O no hydrogen 2.482 N/A SER 130.A N TYR 134.A O no hydrogen 2.652 N/A SER 130.A OG TYR 134.A O no hydrogen 3.500 N/A GLY 133.A N SER 130.A O no hydrogen 3.030 N/A TYR 134.A N SER 130.A OG no hydrogen 2.899 N/A ASP 136.A N SER 126.A OG no hydrogen 2.947 N/A TYR 137.A N GLU 152.A O no hydrogen 2.960 N/A TYR 138.A N ALA 124.A O no hydrogen 2.802 N/A CYS 139.A N SER 150.A O no hydrogen 2.670 N/A CYS 139.A SG TYR 137.A O no hydrogen 3.020 N/A CYS 139.A SG SER 150.A O no hydrogen 3.936 N/A LYS 140.A N ARG 121.A O no hydrogen 2.595 N/A LYS 140.A NZ TRP 141.A O no hydrogen 3.266 N/A LYS 140.A NZ LEU 144.A O no hydrogen 2.773 N/A TRP 141.A NE1 SER 150.A OG no hydrogen 3.206 N/A GLN 142.A N ILE 118.A O no hydrogen 2.951 N/A LEU 144.A N TRP 141.A O no hydrogen 3.122 N/A SER 147.A OG GLU 148.A OE1 no hydrogen 3.474 N/A GLU 148.A N PRO 145.A O no hydrogen 2.615 N/A CYS 149.A N TYR 146.A O no hydrogen 3.150 N/A CYS 149.A SG TYR 146.A O no hydrogen 3.357 N/A SER 150.A N CYS 139.A O no hydrogen 3.062 N/A SER 150.A OG SER 54.A OG no hydrogen 3.131 N/A SER 150.A OG GLU 152.A OE1 no hydrogen 3.542 N/A GLU 152.A N TYR 137.A O no hydrogen 2.921 N/A GLY 154.A N ASP 136.A OD1 no hydrogen 3.323 N/A ALA 155.A N ASP 153.A OD2 no hydrogen 2.869 N/A ILE 157.A N ASP 153.A O no hydrogen 3.168 N/A SER 158.A N GLY 154.A O no hydrogen 3.031 N/A SER 158.A OG TYR 134.A OH no hydrogen 3.397 N/A SER 158.A OG ALA 155.A O no hydrogen 2.758 N/A LYS 159.A N ALA 155.A O no hydrogen 3.298 N/A LYS 159.A N LEU 156.A O no hydrogen 3.328 N/A LYS 160.A N ILE 157.A O no hydrogen 2.810 N/A LYS 160.A NZ GLU 28.A OE1 no hydrogen 2.741 N/A PHE 161.A N ILE 157.A O no hydrogen 2.751 N/A GLN 162.A NE2 ASP 166.A OD1 no hydrogen 3.207 N/A CYS 164.A SG VAL 119.A O no hydrogen 3.342 N/A ILE 165.A N PHE 161.A O no hydrogen 3.070 N/A ASP 166.A N GLN 162.A O no hydrogen 2.644 N/A GLU 167.A N ALA 163.A O no hydrogen 2.520 N/A TYR 168.A N ILE 165.A O no hydrogen 2.641 N/A TYR 168.A OH HIS 125.A ND1 no hydrogen 2.512 N/A PHE 169.A N ILE 165.A O no hydrogen 3.210 N/A SER 170.A N ASP 166.A O no hydrogen 2.953 N/A SER 170.A OG ASP 166.A O no hydrogen 2.603 N/A LYS 172.A N PHE 169.A O no hydrogen 3.204 N/A