Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nuu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 HIS 32.A O no hydrogen 3.245 N/A ARG 2.A NH1 TYR 37.A O no hydrogen 2.787 N/A ILE 3.A N MET 36.A O no hydrogen 2.859 N/A VAL 5.A N GLN 38.A O no hydrogen 2.855 N/A VAL 6.A N GLU 107.A O no hydrogen 3.032 N/A LEU 7.A N GLN 41.A O no hydrogen 2.894 N/A LEU 8.A N LYS 109.A O no hydrogen 2.857 N/A ALA 9.A N ILE 43.A O no hydrogen 2.768 N/A CYS 10.A SG GLU 82.A OE2 no hydrogen 3.518 N/A GLY 11.A N SER 45.A O no hydrogen 3.458 N/A THR 17.A N HIS 20.A ND1 no hydrogen 2.995 N/A ASN 18.A N LEU 196.A O no hydrogen 2.921 N/A ASN 18.A ND2 TYR 195.A O no hydrogen 3.244 N/A HIS 20.A N THR 17.A OG1 no hydrogen 3.164 N/A LEU 21.A N THR 17.A O no hydrogen 3.256 N/A ARG 22.A N ASN 18.A O no hydrogen 2.796 N/A ARG 22.A NE GLU 172.A OE1 no hydrogen 2.706 N/A ARG 22.A NE GLU 172.A OE2 no hydrogen 3.093 N/A ARG 22.A NH2 GLU 172.A OE2 no hydrogen 2.615 N/A MET 23.A N MET 19.A O no hydrogen 3.033 N/A PHE 24.A N LEU 21.A O no hydrogen 3.041 N/A GLU 25.A N LEU 21.A O no hydrogen 3.493 N/A VAL 26.A N ARG 22.A O no hydrogen 2.915 N/A ALA 27.A N MET 23.A O no hydrogen 3.067 N/A ARG 28.A N PHE 24.A O no hydrogen 2.900 N/A ARG 28.A NH2 GLU 25.A OE1 no hydrogen 3.418 N/A ASP 29.A N GLU 25.A O no hydrogen 3.086 N/A HIS 30.A N VAL 26.A O no hydrogen 2.976 N/A LEU 31.A N ALA 27.A O no hydrogen 2.974 N/A HIS 32.A N ARG 28.A O no hydrogen 2.916 N/A GLN 33.A N ASP 29.A O no hydrogen 2.780 N/A THR 34.A N HIS 30.A O no hydrogen 3.230 N/A THR 34.A N LEU 31.A O no hydrogen 3.146 N/A THR 34.A OG1 LEU 31.A O no hydrogen 2.636 N/A GLY 35.A N HIS 32.A O no hydrogen 2.915 N/A MET 36.A N THR 34.A OG1 no hydrogen 3.064 N/A GLN 38.A N ILE 3.A O no hydrogen 2.881 N/A VAL 39.A N HIS 32.A NE2 no hydrogen 2.896 N/A ILE 40.A N VAL 5.A O no hydrogen 2.906 N/A GLY 42.A N TRP 75.A O no hydrogen 2.861 N/A ILE 43.A N LEU 7.A O no hydrogen 2.733 N/A ILE 44.A N ARG 77.A O no hydrogen 2.933 N/A SER 45.A N ALA 9.A O no hydrogen 2.902 N/A SER 45.A OG GLU 82.A OE2 no hydrogen 2.614 N/A VAL 47.A N GLY 11.A O no hydrogen 2.828 N/A ASN 48.A ND2 GLU 82.A O no hydrogen 3.581 N/A ASN 48.A ND2 GLN 85.A O no hydrogen 2.532 N/A THR 50.A N ASN 48.A OD1 no hydrogen 3.035 N/A THR 50.A OG1 ASN 48.A OD1 no hydrogen 3.267 N/A TYR 51.A N ASN 48.A O no hydrogen 3.294 N/A LYS 54.A NZ ASP 55.A O no hydrogen 2.736 N/A SER 59.A N ASP 49.A OD1 no hydrogen 2.900 N/A SER 59.A N ASP 49.A OD2 no hydrogen 3.178 N/A SER 59.A OG ASP 49.A OD2 no hydrogen 3.189 N/A HIS 61.A ND1 TYR 204.A OH no hydrogen 2.723 N/A ARG 62.A N ALA 58.A O no hydrogen 3.064 N/A ARG 62.A NE ALA 57.A O no hydrogen 2.793 N/A ARG 62.A NH1 SER 12.A O no hydrogen 2.989 N/A ARG 62.A NH1 VAL 47.A O no hydrogen 3.009 N/A ARG 62.A NH2 VAL 47.A O no hydrogen 2.982 N/A ARG 62.A NH2 ASP 49.A OD1 no hydrogen 2.807 N/A VAL 63.A N SER 59.A O no hydrogen 2.804 N/A ALA 64.A N HIS 60.A O no hydrogen 3.093 N/A MET 65.A N HIS 61.A O no hydrogen 2.770 N/A ALA 66.A N ARG 62.A O no hydrogen 3.069 N/A ARG 67.A N VAL 63.A O no hydrogen 2.930 N/A LEU 68.A N ALA 64.A O no hydrogen 2.966 N/A ALA 69.A N MET 65.A O no hydrogen 2.817 N/A LEU 70.A N ALA 66.A O no hydrogen 2.835 N/A LEU 70.A N ARG 67.A O no hydrogen 3.201 N/A GLN 71.A N LEU 68.A O no hydrogen 3.321 N/A SER 73.A N LEU 70.A O no hydrogen 2.933 N/A TRP 75.A N SER 73.A OG no hydrogen 3.259 N/A TRP 75.A NE1 GLU 25.A OE2 no hydrogen 2.917 N/A ILE 76.A N SER 73.A OG no hydrogen 2.994 N/A ARG 77.A N GLY 42.A O no hydrogen 3.009 N/A ARG 77.A NH1 ASP 79.A OD1 no hydrogen 3.042 N/A ARG 77.A NH2 ASP 79.A OD1 no hydrogen 3.437 N/A ASP 79.A N ILE 44.A O no hydrogen 2.801 N/A TRP 81.A N ASP 79.A OD2 no hydrogen 2.781 N/A SER 83.A OG PRO 80.A O no hydrogen 2.900 N/A GLU 84.A N PRO 80.A O no hydrogen 2.968 N/A GLU 84.A N TRP 81.A O no hydrogen 3.098 N/A GLN 85.A N GLU 82.A O no hydrogen 3.365 N/A TRP 88.A N THR 50.A OG1 no hydrogen 2.945 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 3.206 N/A LYS 93.A N GLU 90.A O no hydrogen 2.954 N/A LEU 95.A N THR 91.A O no hydrogen 3.055 N/A ARG 96.A N VAL 92.A O no hydrogen 2.994 N/A ARG 96.A NE GLU 133.A OE1 no hydrogen 2.967 N/A ARG 96.A NH2 GLU 133.A OE2 no hydrogen 2.811 N/A HIS 97.A N LYS 93.A O no hydrogen 3.017 N/A HIS 98.A N VAL 94.A O no hydrogen 3.050 N/A HIS 99.A N LEU 95.A O no hydrogen 2.791 N/A SER 100.A N ARG 96.A O no hydrogen 2.924 N/A SER 100.A OG ARG 96.A O no hydrogen 3.186 N/A LYS 101.A N HIS 97.A O no hydrogen 2.965 N/A LYS 101.A NZ ASP 79.A OD1 no hydrogen 2.708 N/A LEU 102.A N HIS 98.A O no hydrogen 3.177 N/A LEU 103.A N HIS 99.A O no hydrogen 3.116 N/A LEU 103.A N SER 100.A O no hydrogen 3.026 N/A GLU 107.A N PRO 4.A O no hydrogen 2.923 N/A LYS 109.A N VAL 6.A O no hydrogen 2.935 N/A LYS 109.A NZ GLU 107.A OE1 no hydrogen 2.677 N/A LYS 109.A NZ PHE 138.A O no hydrogen 3.127 N/A LEU 110.A N GLY 139.A O no hydrogen 2.891 N/A LEU 111.A N LEU 8.A O no hydrogen 2.701 N/A CYS 112.A N VAL 141.A O no hydrogen 2.929 N/A CYS 112.A SG GLY 113.A O no hydrogen 3.536 N/A ALA 114.A N VAL 143.A O no hydrogen 2.829 N/A VAL 116.A N GLY 113.A O no hydrogen 3.003 N/A LYS 118.A N ALA 114.A O no hydrogen 3.269 N/A THR 119.A N ASP 115.A O no hydrogen 3.165 N/A THR 119.A OG1 VAL 116.A O no hydrogen 2.806 N/A PHE 120.A N LEU 117.A O no hydrogen 3.286 N/A GLN 121.A N LYS 118.A O no hydrogen 3.112 N/A THR 122.A N THR 119.A O no hydrogen 2.985 N/A THR 122.A OG1 THR 119.A O no hydrogen 3.273 N/A LEU 125.A N THR 122.A O no hydrogen 2.968 N/A TRP 126.A NE1 THR 119.A OG1 no hydrogen 2.934 N/A HIS 130.A N LYS 127.A O no hydrogen 2.671 N/A ILE 131.A N LYS 127.A O no hydrogen 2.929 N/A GLN 132.A N ASP 128.A O no hydrogen 2.978 N/A GLU 133.A N ALA 129.A O no hydrogen 3.029 N/A ILE 134.A N HIS 130.A O no hydrogen 2.813 N/A VAL 135.A N ILE 131.A O no hydrogen 3.085 N/A GLU 136.A N GLN 132.A O no hydrogen 2.859 N/A LYS 137.A N GLU 133.A O no hydrogen 2.896 N/A GLY 139.A N ILE 134.A O no hydrogen 2.783 N/A LEU 140.A N ASN 166.A O no hydrogen 2.971 N/A VAL 141.A N LEU 110.A O no hydrogen 2.882 N/A CYS 142.A N HIS 168.A O no hydrogen 2.816 N/A VAL 143.A N CYS 112.A O no hydrogen 2.875 N/A GLY 144.A N ALA 170.A O no hydrogen 2.851 N/A ARG 145.A NE GLU 177.A OE1 no hydrogen 3.404 N/A ARG 145.A NH1 ASP 115.A OD1 no hydrogen 2.941 N/A ARG 145.A NH2 GLU 177.A OE1 no hydrogen 3.206 N/A VAL 146.A N GLU 177.A OE2 no hydrogen 2.983 N/A HIS 148.A N ARG 145.A O no hydrogen 3.053 N/A GLY 152.A N ASP 149.A OD2 no hydrogen 3.096 N/A TYR 153.A N ASP 149.A O no hydrogen 3.057 N/A ILE 154.A N PRO 150.A O no hydrogen 2.910 N/A ALA 155.A N LYS 151.A O no hydrogen 2.991 N/A GLU 156.A N GLY 152.A O no hydrogen 2.916 N/A SER 157.A N ILE 154.A O no hydrogen 3.329 N/A LEU 160.A N SER 157.A OG no hydrogen 3.344 N/A ARG 161.A N SER 157.A O no hydrogen 2.854 N/A MET 162.A N PRO 158.A O no hydrogen 3.056 N/A HIS 163.A N ILE 159.A O no hydrogen 3.287 N/A HIS 163.A N LEU 160.A O no hydrogen 3.081 N/A GLN 164.A N ARG 161.A O no hydrogen 3.367 N/A ASN 166.A N HIS 163.A O no hydrogen 2.822 N/A ILE 167.A N GLN 164.A O no hydrogen 3.049 N/A HIS 168.A N LEU 140.A O no hydrogen 2.769 N/A ALA 170.A N CYS 142.A O no hydrogen 2.786 N/A VAL 174.A N GLU 172.A O no hydrogen 2.585 N/A TYR 182.A N SER 179.A OG no hydrogen 3.054 N/A ILE 183.A N SER 179.A O no hydrogen 3.085 N/A ARG 184.A N ALA 180.A O no hydrogen 2.882 N/A ARG 184.A NH1 ASN 14.A O no hydrogen 2.767 N/A ARG 185.A N THR 181.A O no hydrogen 3.070 N/A ALA 186.A N TYR 182.A O no hydrogen 2.819 N/A LEU 187.A N ILE 183.A O no hydrogen 2.927 N/A GLY 188.A N ARG 184.A O no hydrogen 2.904 N/A GLN 189.A N ARG 185.A O no hydrogen 3.026 N/A GLN 189.A N ALA 186.A O no hydrogen 2.954 N/A GLY 190.A N LEU 187.A O no hydrogen 3.080 N/A GLN 191.A N ALA 186.A O no hydrogen 2.981 N/A LYS 194.A N SER 192.A OG no hydrogen 2.995 N/A LYS 194.A NZ ASP 199.A OD1 no hydrogen 2.712 N/A LEU 196.A N VAL 193.A O no hydrogen 3.010 N/A ILE 197.A N VAL 193.A O no hydrogen 3.397 N/A VAL 201.A N PRO 198.A O no hydrogen 2.968 N/A ILE 202.A N PRO 198.A O no hydrogen 3.131 N/A THR 203.A N ASP 199.A O no hydrogen 3.111 N/A THR 203.A OG1 ASP 199.A O no hydrogen 3.183 N/A TYR 204.A N ALA 200.A O no hydrogen 3.193 N/A TYR 204.A OH HIS 61.A ND1 no hydrogen 2.723 N/A ILE 205.A N VAL 201.A O no hydrogen 2.922 N/A LYS 206.A N ILE 202.A O no hydrogen 2.896 N/A ASP 207.A N THR 203.A O no hydrogen 2.824 N/A HIS 208.A N TYR 204.A O no hydrogen 2.871 N/A GLY 209.A N LYS 206.A O no hydrogen 3.279 N/A LEU 210.A N ILE 205.A O no hydrogen 3.005 N/A