Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ubn_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N ASP 112.A OD1 no hydrogen 2.952 N/A GLY 4.A N GLY 1.A O no hydrogen 3.083 N/A ALA 5.A N ASP 112.A OD2 no hydrogen 3.030 N/A ILE 6.A N ASP 112.A OD2 no hydrogen 2.806 N/A ALA 7.A N ILE 10.A O no hydrogen 3.188 N/A GLY 8.A N ALA 5.A O no hydrogen 2.739 N/A PHE 9.A N GLY 4.A O no hydrogen 3.119 N/A ILE 10.A N ALA 5.A O no hydrogen 3.273 N/A TYR 22.A N THR 41.A OG1 no hydrogen 3.344 N/A TYR 22.A OH HIS 111.A ND1 no hydrogen 2.714 N/A TYR 24.A N ALA 35.A O no hydrogen 2.711 N/A TYR 24.A OH ASP 37.A OD1 no hydrogen 2.865 N/A ASN 28.A N GLY 31.A O no hydrogen 2.853 N/A ASN 28.A ND2 CYS 144.A O no hydrogen 3.095 N/A ASN 28.A ND2 ASN 146.A OD1 no hydrogen 2.889 N/A GLN 30.A N ASN 28.A OD1 no hydrogen 3.187 N/A GLY 31.A N ASN 28.A O no hydrogen 3.050 N/A GLY 33.A N HIS 26.A O no hydrogen 3.337 N/A ALA 35.A N TYR 24.A O no hydrogen 3.044 N/A ASP 37.A N TYR 22.A O no hydrogen 2.880 N/A LYS 39.A NZ ASN 43.A OD1 no hydrogen 3.223 N/A SER 40.A N ASP 37.A OD2 no hydrogen 3.145 N/A SER 40.A OG ASP 37.A O no hydrogen 3.329 N/A SER 40.A OG ASP 37.A OD2 no hydrogen 2.800 N/A THR 41.A N ASP 37.A O no hydrogen 3.070 N/A THR 41.A OG1 ASP 37.A O no hydrogen 2.897 N/A GLN 42.A N LEU 38.A O no hydrogen 2.885 N/A GLN 42.A NE2 ASP 46.A OD1 no hydrogen 3.267 N/A ASN 43.A N LYS 39.A O no hydrogen 3.099 N/A ALA 44.A N SER 40.A O no hydrogen 3.088 N/A ILE 45.A N THR 41.A O no hydrogen 3.079 N/A ASP 46.A N GLN 42.A O no hydrogen 2.950 N/A GLU 47.A N ASN 43.A O no hydrogen 3.009 N/A ILE 48.A N ALA 44.A O no hydrogen 2.983 N/A THR 49.A N ILE 45.A O no hydrogen 2.898 N/A THR 49.A OG1 ILE 45.A O no hydrogen 3.005 N/A THR 49.A OG1 ASP 46.A O no hydrogen 2.660 N/A ASN 50.A N ASP 46.A O no hydrogen 3.052 N/A LYS 51.A N GLU 47.A O no hydrogen 3.089 N/A LYS 51.A N ILE 48.A O no hydrogen 3.095 N/A LYS 51.A NZ GLU 103.A O no hydrogen 3.245 N/A LYS 51.A NZ GLU 103.A OE2 no hydrogen 3.000 N/A LYS 51.A NZ THR 107.A OG1 no hydrogen 2.691 N/A VAL 52.A N ILE 48.A O no hydrogen 2.918 N/A ASN 53.A N THR 49.A O no hydrogen 2.931 N/A SER 54.A N ASN 50.A O no hydrogen 3.189 N/A SER 54.A OG ASN 50.A O no hydrogen 2.820 N/A VAL 55.A N LYS 51.A O no hydrogen 3.342 N/A ILE 56.A N VAL 52.A O no hydrogen 3.193 N/A ILE 56.A N ASN 53.A O no hydrogen 3.230 N/A GLU 57.A N ASN 53.A O no hydrogen 2.634 N/A LYS 58.A N SER 54.A O no hydrogen 3.295 N/A LYS 68.A NZ GLY 67.A O no hydrogen 2.921 N/A ASN 71.A N GLU 74.A OE1 no hydrogen 2.934 N/A LEU 73.A N ASN 71.A OD1 no hydrogen 3.068 N/A GLU 74.A N ASN 71.A O no hydrogen 3.054 N/A GLU 78.A N GLU 74.A O no hydrogen 3.193 N/A ASN 79.A N LYS 75.A O no hydrogen 3.003 N/A LEU 80.A N ARG 76.A O no hydrogen 2.824 N/A ASN 81.A N ILE 77.A O no hydrogen 2.861 N/A LYS 82.A N GLU 78.A O no hydrogen 2.973 N/A LYS 83.A N ASN 79.A O no hydrogen 2.872 N/A VAL 84.A N LEU 80.A O no hydrogen 3.037 N/A ASP 85.A N ASN 81.A O no hydrogen 3.101 N/A ASP 86.A N LYS 82.A O no hydrogen 2.838 N/A GLY 87.A N LYS 83.A O no hydrogen 2.817 N/A PHE 88.A N VAL 84.A O no hydrogen 3.139 N/A LEU 89.A N ASP 85.A O no hydrogen 3.022 N/A ASP 90.A N ASP 86.A O no hydrogen 2.980 N/A ILE 91.A N GLY 87.A O no hydrogen 2.996 N/A TRP 92.A N PHE 88.A O no hydrogen 2.822 N/A THR 93.A N LEU 89.A O no hydrogen 2.827 N/A THR 93.A OG1 LEU 89.A O no hydrogen 2.793 N/A TYR 94.A N ASP 90.A O no hydrogen 3.223 N/A ASN 95.A N ILE 91.A O no hydrogen 3.154 N/A ALA 96.A N TRP 92.A O no hydrogen 2.825 N/A GLU 97.A N THR 93.A O no hydrogen 3.107 N/A LEU 98.A N TYR 94.A O no hydrogen 3.214 N/A LEU 99.A N ASN 95.A O no hydrogen 2.913 N/A VAL 100.A N ALA 96.A O no hydrogen 3.025 N/A LEU 101.A N GLU 97.A O no hydrogen 2.915 N/A LEU 102.A N LEU 98.A O no hydrogen 2.820 N/A GLU 103.A N LEU 99.A O no hydrogen 3.168 N/A ASN 104.A N VAL 100.A O no hydrogen 2.926 N/A GLU 105.A N LEU 101.A O no hydrogen 3.119 N/A ARG 106.A N LEU 102.A O no hydrogen 3.151 N/A THR 107.A N GLU 103.A O no hydrogen 2.841 N/A THR 107.A OG1 GLU 103.A O no hydrogen 3.072 N/A LEU 108.A N ASN 104.A O no hydrogen 3.156 N/A ASP 109.A N GLU 105.A O no hydrogen 3.040 N/A TYR 110.A N ARG 106.A O no hydrogen 2.728 N/A TYR 110.A OH GLU 47.A OE1 no hydrogen 2.556 N/A HIS 111.A N THR 107.A O no hydrogen 3.064 N/A HIS 111.A ND1 TYR 22.A OH no hydrogen 2.714 N/A ASP 112.A N LEU 108.A O no hydrogen 3.106 N/A SER 113.A N ASP 109.A O no hydrogen 2.807 N/A ASN 114.A N TYR 110.A O no hydrogen 2.951 N/A ASN 114.A ND2 TYR 22.A OH no hydrogen 2.766 N/A VAL 115.A N HIS 111.A O no hydrogen 2.977 N/A LYS 116.A N ASP 112.A O no hydrogen 3.039 N/A ASN 117.A N SER 113.A O no hydrogen 2.877 N/A LEU 118.A N ASN 114.A O no hydrogen 3.027 N/A TYR 119.A N VAL 115.A O no hydrogen 3.020 N/A TYR 119.A OH GLU 132.A OE1 no hydrogen 2.750 N/A GLU 120.A N LYS 116.A O no hydrogen 2.968 N/A LYS 121.A N ASN 117.A O no hydrogen 3.034 N/A LYS 121.A N LEU 118.A O no hydrogen 3.255 N/A VAL 122.A N LEU 118.A O no hydrogen 3.237 N/A ARG 123.A N TYR 119.A O no hydrogen 3.038 N/A SER 124.A N GLU 120.A O no hydrogen 2.962 N/A GLN 125.A N VAL 122.A O no hydrogen 3.030 N/A GLN 125.A NE2 VAL 152.A O no hydrogen 3.107 N/A LEU 126.A N VAL 122.A O no hydrogen 3.013 N/A LYS 127.A N ARG 123.A O no hydrogen 2.981 N/A ASN 129.A N LEU 126.A O no hydrogen 2.841 N/A ASN 129.A ND2 TYR 157.A OH no hydrogen 2.875 N/A ASN 129.A ND2 TYR 159.A O no hydrogen 2.795 N/A LYS 131.A N GLU 139.A O no hydrogen 2.659 N/A ILE 133.A N CYS 137.A O no hydrogen 3.380 N/A CYS 137.A N GLY 134.A O no hydrogen 2.988 N/A CYS 137.A SG ASN 135.A O no hydrogen 3.822 N/A GLU 139.A N LYS 131.A O no hydrogen 2.676 N/A TYR 141.A N ASN 129.A O no hydrogen 2.843 N/A HIS 142.A NE2 TYR 157.A OH no hydrogen 2.846 N/A ASN 146.A N GLN 30.A OE1 no hydrogen 3.499 N/A CYS 148.A N ASP 145.A OD1 no hydrogen 2.706 N/A MET 149.A N ASP 145.A O no hydrogen 2.805 N/A GLU 150.A N ASN 146.A O no hydrogen 3.010 N/A SER 151.A N THR 147.A O no hydrogen 3.173 N/A SER 151.A N CYS 148.A O no hydrogen 3.166 N/A SER 151.A OG CYS 148.A O no hydrogen 2.572 N/A VAL 152.A N CYS 148.A O no hydrogen 3.365 N/A VAL 152.A N MET 149.A O no hydrogen 3.186 N/A LYS 153.A N MET 149.A O no hydrogen 3.378 N/A ASN 154.A N GLU 150.A O no hydrogen 3.249 N/A GLY 155.A N VAL 152.A O no hydrogen 3.103 N/A THR 156.A N SER 151.A O no hydrogen 2.657 N/A THR 156.A OG1 SER 151.A O no hydrogen 3.361 N/A THR 156.A OG1 ASN 154.A OD1 no hydrogen 2.738 N/A TYR 157.A N GLN 125.A OE1 no hydrogen 3.251 N/A TYR 157.A OH HIS 142.A NE2 no hydrogen 2.846 N/A LYS 161.A N ASP 158.A O no hydrogen 3.178 N/A LYS 161.A N ASP 158.A OD2 no hydrogen 2.855 N/A TYR 162.A N TYR 159.A O no hydrogen 3.013 N/A SER 163.A N PRO 160.A O no hydrogen 3.431 N/A SER 163.A OG PRO 160.A O no hydrogen 2.819 N/A ALA 166.A N TYR 162.A O no hydrogen 2.919 N/A LYS 167.A N SER 163.A O no hydrogen 2.932 N/A ASN 169.A N GLU 165.A O no hydrogen 3.483 N/A ASN 169.A ND2 TYR 141.A O no hydrogen 2.688 N/A ARG 170.A N ALA 166.A O no hydrogen 2.740 N/A ARG 170.A NE ASN 128.A O no hydrogen 3.380 N/A GLU 171.A N LYS 167.A O no hydrogen 2.910 N/A GLU 172.A N LEU 168.A O no hydrogen 3.366 N/A ILE 173.A N ASN 169.A O no hydrogen 3.489 N/A ASP 174.A N ARG 170.A O no hydrogen 2.835 N/A