Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ucn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N ASP 3.A OD1 no hydrogen 3.022 N/A SER 5.A OG ASP 3.A OD1 no hydrogen 2.978 N/A LEU 8.A N LEU 4.A O no hydrogen 2.946 N/A GLU 9.A N SER 5.A O no hydrogen 2.894 N/A ALA 10.A N PRO 6.A O no hydrogen 3.019 N/A ASN 11.A N LEU 7.A O no hydrogen 3.000 N/A ARG 12.A N LEU 8.A O no hydrogen 3.006 N/A LYS 13.A N GLU 9.A O no hydrogen 2.999 N/A TRP 14.A N ALA 10.A O no hydrogen 2.982 N/A ALA 15.A N ASN 11.A O no hydrogen 2.879 N/A ASP 16.A N ARG 12.A O no hydrogen 2.981 N/A GLU 17.A N LYS 13.A O no hydrogen 3.133 N/A CYS 18.A N TRP 14.A O no hydrogen 3.100 N/A CYS 18.A SG TRP 14.A O no hydrogen 3.567 N/A ALA 19.A N ALA 15.A O no hydrogen 3.142 N/A ALA 20.A N ASP 16.A O no hydrogen 2.750 N/A LYS 21.A N GLU 17.A O no hydrogen 3.119 N/A ASP 22.A N CYS 18.A O no hydrogen 2.970 N/A THR 24.A N ASP 22.A OD2 no hydrogen 3.066 N/A THR 24.A OG1 ASP 22.A OD2 no hydrogen 3.104 N/A TYR 25.A N ASP 22.A O no hydrogen 3.191 N/A LYS 28.A N THR 24.A O no hydrogen 3.134 N/A VAL 29.A N PHE 26.A O no hydrogen 3.026 N/A ALA 30.A N SER 27.A O no hydrogen 3.179 N/A TYR 37.A N GLU 59.A O no hydrogen 3.468 N/A LEU 38.A N HIS 92.A O no hydrogen 3.018 N/A TYR 39.A N PHE 61.A O no hydrogen 2.825 N/A ILE 40.A N LEU 94.A O no hydrogen 2.727 N/A GLY 41.A N GLN 63.A O no hydrogen 3.153 N/A CYS 42.A SG ASN 65.A O no hydrogen 3.718 N/A CYS 42.A SG HIS 98.A NE2 no hydrogen 3.746 N/A ALA 43.A N ASN 65.A O no hydrogen 2.853 N/A ARG 46.A N ASP 44.A OD1 no hydrogen 2.840 N/A ARG 46.A NE ASP 44.A OD1 no hydrogen 2.810 N/A ARG 46.A NH1 ASN 100.A OD1 no hydrogen 2.932 N/A ARG 46.A NH2 ASP 44.A OD2 no hydrogen 2.821 N/A ARG 46.A NH2 ASN 100.A O no hydrogen 3.064 N/A ARG 46.A NH2 ASN 100.A OD1 no hydrogen 3.097 N/A VAL 47.A N ASP 44.A O no hydrogen 3.172 N/A LEU 52.A N SER 48.A O no hydrogen 3.006 N/A PHE 53.A N PRO 49.A O no hydrogen 3.068 N/A ASN 54.A N GLN 51.A O no hydrogen 3.172 N/A MET 55.A N ALA 50.A O no hydrogen 2.777 N/A ALA 56.A N GLU 59.A OE1 no hydrogen 2.722 N/A PHE 61.A N TYR 37.A O no hydrogen 2.871 N/A GLN 63.A N TYR 39.A O no hydrogen 2.878 N/A GLN 63.A NE2 ASN 76.A OD1 no hydrogen 2.983 N/A ARG 64.A NE CYS 42.A O no hydrogen 2.995 N/A ASN 65.A N GLY 41.A O no hydrogen 3.148 N/A ASN 65.A ND2 GLN 63.A OE1 no hydrogen 2.870 N/A ASN 65.A ND2 LEU 69.A O no hydrogen 2.954 N/A ASN 68.A N ASN 65.A O no hydrogen 3.245 N/A ASN 68.A ND2 ASN 68.A O no hydrogen 2.876 N/A LEU 69.A N ASN 65.A OD1 no hydrogen 2.957 N/A VAL 70.A N GLN 156.A OE1 no hydrogen 2.925 N/A LYS 73.A N SER 71.A OG no hydrogen 3.123 N/A ASP 74.A N SER 71.A O no hydrogen 3.196 N/A ASN 76.A N ASP 74.A OD2 no hydrogen 3.107 N/A CYS 77.A N ASP 74.A OD1 no hydrogen 3.140 N/A CYS 77.A SG LEU 69.A O no hydrogen 4.011 N/A MET 78.A N ASP 74.A O no hydrogen 2.955 N/A SER 79.A N LEU 75.A O no hydrogen 3.007 N/A SER 79.A OG LEU 75.A O no hydrogen 2.904 N/A SER 79.A OG ASN 76.A O no hydrogen 3.260 N/A CYS 80.A N ASN 76.A O no hydrogen 3.513 N/A CYS 80.A SG ASN 76.A O no hydrogen 3.867 N/A LEU 81.A N CYS 77.A O no hydrogen 3.104 N/A GLU 82.A N MET 78.A O no hydrogen 2.837 N/A TYR 83.A N SER 79.A O no hydrogen 2.833 N/A THR 84.A N CYS 80.A O no hydrogen 3.366 N/A THR 84.A OG1 CYS 80.A O no hydrogen 3.045 N/A THR 84.A OG1 LEU 81.A O no hydrogen 3.220 N/A VAL 85.A N LEU 81.A O no hydrogen 3.081 N/A ASP 86.A N GLU 82.A O no hydrogen 2.862 N/A HIS 87.A N TYR 83.A O no hydrogen 3.124 N/A LEU 88.A N TYR 83.A O no hydrogen 3.056 N/A LYS 89.A NZ ASP 86.A O no hydrogen 3.255 N/A ILE 90.A N THR 84.A O no hydrogen 2.940 N/A LYS 91.A N GLU 36.A O no hydrogen 2.966 N/A HIS 92.A N GLU 36.A O no hydrogen 3.178 N/A HIS 92.A ND1 SER 177.A OG no hydrogen 2.896 N/A ILE 93.A N SER 177.A O no hydrogen 2.750 N/A LEU 94.A N LEU 38.A O no hydrogen 2.819 N/A VAL 95.A N HIS 179.A O no hydrogen 2.963 N/A CYS 96.A N ILE 40.A O no hydrogen 2.876 N/A CYS 96.A SG TYR 39.A OH no hydrogen 3.542 N/A CYS 96.A SG GLY 97.A O no hydrogen 3.465 N/A GLY 97.A N ILE 181.A O no hydrogen 3.015 N/A HIS 98.A ND1 TYR 99.A O no hydrogen 2.829 N/A TYR 99.A N TYR 183.A O no hydrogen 3.037 N/A TYR 99.A OH GLU 150.A OE1 no hydrogen 2.605 N/A CYS 101.A SG HIS 98.A NE2 no hydrogen 3.506 N/A LYS 105.A N CYS 101.A O no hydrogen 3.120 N/A ALA 106.A N GLY 102.A O no hydrogen 2.954 N/A GLY 107.A N ALA 103.A O no hydrogen 2.952 N/A LEU 108.A N CYS 104.A O no hydrogen 3.311 N/A VAL 109.A N LYS 105.A O no hydrogen 3.030 N/A VAL 109.A N ALA 106.A O no hydrogen 3.227 N/A TRP 110.A N ALA 106.A O no hydrogen 2.815 N/A LYS 113.A N HIS 111.A ND1 no hydrogen 3.055 N/A THR 114.A N HIS 111.A O no hydrogen 3.013 N/A THR 114.A OG1 HIS 111.A O no hydrogen 2.667 N/A ASN 119.A ND2 PRO 112.A O no hydrogen 2.951 N/A TRP 121.A N VAL 117.A O no hydrogen 2.937 N/A TRP 121.A NE1 VAL 66.A O no hydrogen 2.835 N/A ILE 122.A N THR 118.A O no hydrogen 2.941 N/A SER 123.A N LEU 120.A O no hydrogen 3.018 N/A SER 123.A OG LEU 120.A O no hydrogen 2.744 N/A VAL 125.A N ILE 122.A O no hydrogen 2.839 N/A ARG 126.A N ILE 122.A O no hydrogen 3.454 N/A ARG 126.A NH1 ASN 119.A OD1 no hydrogen 2.928 N/A ARG 126.A NH2 ASN 119.A O no hydrogen 3.054 N/A ARG 126.A NH2 ASN 119.A OD1 no hydrogen 3.494 N/A GLU 127.A N SER 123.A O no hydrogen 3.254 N/A VAL 128.A N ASP 124.A O no hydrogen 3.233 N/A ARG 129.A N VAL 125.A O no hydrogen 2.945 N/A ARG 129.A NE ASP 130.A OD2 no hydrogen 2.925 N/A ARG 129.A NH1 GLY 107.A O no hydrogen 3.036 N/A ARG 129.A NH2 ASP 130.A OD2 no hydrogen 2.628 N/A ASP 130.A N ARG 126.A O no hydrogen 2.857 N/A LYS 131.A N GLU 127.A O no hydrogen 3.172 N/A ASN 132.A N ARG 129.A O no hydrogen 2.868 N/A ASN 132.A ND2 VAL 128.A O no hydrogen 2.732 N/A LYS 135.A N ASN 132.A O no hydrogen 2.856 N/A LYS 135.A NZ ASN 132.A OD1 no hydrogen 3.181 N/A LEU 136.A N ALA 133.A O no hydrogen 2.903 N/A HIS 137.A N ALA 133.A O no hydrogen 2.885 N/A LEU 139.A N LEU 136.A O no hydrogen 3.215 N/A SER 140.A OG ASP 143.A OD2 no hydrogen 2.995 N/A ASP 143.A N SER 140.A O no hydrogen 2.881 N/A ASP 143.A N SER 140.A OG no hydrogen 3.306 N/A ALA 144.A N SER 140.A O no hydrogen 3.003 N/A TRP 145.A N ALA 141.A O no hydrogen 2.988 N/A TRP 145.A NE1 CYS 101.A O no hydrogen 2.846 N/A ASP 146.A N ASP 142.A O no hydrogen 3.165 N/A LYS 147.A N ASP 143.A O no hydrogen 3.013 N/A MET 148.A N ALA 144.A O no hydrogen 2.772 N/A VAL 149.A N TRP 145.A O no hydrogen 3.126 N/A GLU 150.A N ASP 146.A O no hydrogen 3.310 N/A LEU 151.A N LYS 147.A O no hydrogen 2.885 N/A ASN 152.A N MET 148.A O no hydrogen 2.854 N/A ASN 152.A ND2 GLY 67.A O no hydrogen 3.071 N/A VAL 153.A N VAL 149.A O no hydrogen 3.055 N/A GLU 154.A N GLU 150.A O no hydrogen 3.107 N/A ALA 155.A N LEU 151.A O no hydrogen 2.831 N/A GLN 156.A N ASN 152.A O no hydrogen 2.871 N/A GLN 156.A NE2 ASN 152.A OD1 no hydrogen 2.709 N/A VAL 157.A N VAL 153.A O no hydrogen 2.812 N/A PHE 158.A N GLU 154.A O no hydrogen 3.004 N/A ASN 159.A N ALA 155.A O no hydrogen 2.868 N/A ASN 159.A ND2 GLN 156.A OE1 no hydrogen 2.885 N/A VAL 160.A N GLN 156.A O no hydrogen 2.876 N/A CYS 161.A N VAL 157.A O no hydrogen 2.948 N/A CYS 161.A SG VAL 157.A O no hydrogen 3.351 N/A ALA 162.A N PHE 158.A O no hydrogen 2.746 N/A SER 163.A N VAL 160.A O no hydrogen 3.102 N/A SER 163.A OG VAL 160.A O no hydrogen 2.771 N/A VAL 166.A N SER 163.A OG no hydrogen 3.356 N/A GLN 167.A N SER 163.A O no hydrogen 3.043 N/A GLN 167.A NE2 CYS 161.A O no hydrogen 2.823 N/A ALA 168.A N PRO 164.A O no hydrogen 2.890 N/A ALA 169.A N ILE 165.A O no hydrogen 3.067 N/A TRP 170.A N VAL 166.A O no hydrogen 2.971 N/A TRP 170.A NE1 LEU 176.A O no hydrogen 3.005 N/A ALA 171.A N GLN 167.A O no hydrogen 3.107 N/A ARG 172.A N ALA 168.A O no hydrogen 3.246 N/A ARG 172.A N ALA 169.A O no hydrogen 3.232 N/A ARG 172.A NE GLN 174.A OE1 no hydrogen 3.388 N/A ARG 172.A NH2 ASP 86.A OD1 no hydrogen 2.975 N/A ARG 172.A NH2 GLN 174.A OE1 no hydrogen 2.795 N/A GLY 173.A N TRP 170.A O no hydrogen 3.042 N/A GLN 174.A N ALA 169.A O no hydrogen 3.080 N/A GLN 174.A NE2 VAL 85.A O no hydrogen 3.148 N/A SER 177.A N LYS 91.A O no hydrogen 2.855 N/A SER 177.A OG LYS 91.A O no hydrogen 3.479 N/A SER 177.A OG HIS 92.A ND1 no hydrogen 2.896 N/A SER 177.A OG HIS 179.A NE2 no hydrogen 2.585 N/A VAL 178.A N ILE 197.A O no hydrogen 2.814 N/A HIS 179.A N ILE 93.A O no hydrogen 2.998 N/A HIS 179.A NE2 SER 177.A OG no hydrogen 2.585 N/A ILE 181.A N VAL 95.A O no hydrogen 3.012 N/A VAL 182.A N LYS 191.A O no hydrogen 2.984 N/A TYR 183.A N GLY 97.A O no hydrogen 2.905 N/A THR 184.A N LEU 189.A O no hydrogen 2.838 N/A THR 187.A N THR 184.A O no hydrogen 3.238 N/A GLY 188.A N THR 184.A O no hydrogen 3.005 N/A LYS 191.A N VAL 182.A O no hydrogen 2.904 N/A LYS 191.A NZ TYR 99.A OH no hydrogen 3.468 N/A LEU 193.A N GLY 180.A O no hydrogen 2.788 N/A ILE 194.A N GLY 180.A O no hydrogen 2.924 N/A LYS 195.A NZ GLU 192.A OE1 no hydrogen 3.118 N/A ILE 197.A N VAL 178.A O no hydrogen 3.003 N/A THR 198.A N ASP 202.A OD1 no hydrogen 2.959 N/A THR 198.A OG1 ASP 202.A OD1 no hydrogen 2.915 N/A ALA 203.A N GLY 199.A O no hydrogen 3.238 N/A GLY 204.A N MET 200.A O no hydrogen 2.975 N/A ALA 205.A N GLU 201.A O no hydrogen 3.447 N/A LEU 206.A N ASP 202.A O no hydrogen 2.862 N/A LEU 206.A N ALA 203.A O no hydrogen 3.259 N/A LEU 207.A N ALA 203.A O no hydrogen 3.089 N/A ARG 208.A N GLU 154.A OE2 no hydrogen 2.980 N/A GLN 213.A N ASP 210.A OD2 no hydrogen 3.080 N/A HIS 214.A N ASP 210.A O no hydrogen 3.104 N/A CYS 215.A N LEU 211.A O no hydrogen 2.980 N/A CYS 215.A SG LEU 211.A O no hydrogen 3.537 N/A PHE 216.A N LYS 212.A O no hydrogen 2.790 N/A GLU 219.A N PHE 216.A O no hydrogen 3.170 N/A SER 220.A N PHE 217.A O no hydrogen 2.968 N/A SER 220.A OG PHE 217.A O no hydrogen 3.046 N/A LEU 221.A N SER 218.A O no hydrogen 3.331 N/A