Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1knu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 8.A N GLU 4.A O no hydrogen 3.232 N/A ARG 9.A N SER 5.A O no hydrogen 2.914 N/A ARG 9.A NH1 GLN 209.A OE1 no hydrogen 2.939 N/A ARG 9.A NH2 GLN 209.A OE1 no hydrogen 2.752 N/A ALA 10.A N ALA 6.A O no hydrogen 3.016 N/A LEU 11.A N ASP 7.A O no hydrogen 3.092 N/A ALA 12.A N LEU 8.A O no hydrogen 3.002 N/A LYS 13.A N ARG 9.A O no hydrogen 2.879 N/A HIS 14.A N ALA 10.A O no hydrogen 3.110 N/A LEU 15.A N LEU 11.A O no hydrogen 3.000 N/A TYR 16.A N ALA 12.A O no hydrogen 2.932 N/A ASP 17.A N LYS 13.A O no hydrogen 2.848 N/A SER 18.A N HIS 14.A O no hydrogen 3.080 N/A SER 18.A OG HIS 14.A O no hydrogen 2.774 N/A SER 18.A OG SER 91.A OG no hydrogen 3.049 N/A TYR 19.A N LEU 15.A O no hydrogen 2.870 N/A TYR 19.A OH ASP 170.A OD1 no hydrogen 2.610 N/A ILE 20.A N TYR 16.A O no hydrogen 3.055 N/A LYS 21.A N ASP 17.A O no hydrogen 3.127 N/A LYS 21.A NZ ASP 17.A OD2 no hydrogen 2.756 N/A SER 22.A N TYR 19.A O no hydrogen 3.115 N/A SER 22.A OG SER 18.A O no hydrogen 2.852 N/A PHE 23.A N TYR 19.A O no hydrogen 2.953 N/A LYS 27.A N ASP 170.A OD1 no hydrogen 2.817 N/A LYS 27.A NZ LEU 168.A O no hydrogen 2.301 N/A ALA 28.A N ASP 170.A OD2 no hydrogen 3.029 N/A LYS 29.A N THR 26.A OG1 no hydrogen 3.261 N/A ALA 30.A N THR 26.A O no hydrogen 3.033 N/A ARG 31.A N LYS 27.A O no hydrogen 2.821 N/A ARG 31.A NE SER 121.A O no hydrogen 3.383 N/A ARG 31.A NH2 SER 121.A O no hydrogen 2.738 N/A ARG 31.A NH2 MET 123.A O no hydrogen 2.728 N/A ALA 32.A N ALA 28.A O no hydrogen 3.147 N/A ILE 33.A N LYS 29.A O no hydrogen 2.980 N/A LEU 34.A N ALA 30.A O no hydrogen 2.982 N/A THR 35.A N ARG 31.A O no hydrogen 2.843 N/A THR 35.A OG1 ARG 31.A O no hydrogen 3.013 N/A GLY 36.A N.A ILE 33.A O no hydrogen 3.422 N/A LYS 37.A N.A ALA 32.A O no hydrogen 3.058 N/A THR 38.A OG1.B GLY 36.A O.B no hydrogen 3.340 N/A THR 38.A OG1.B ASP 40.A O.A no hydrogen 2.522 N/A THR 39.A OG1.A ASP 40.A OD2.A no hydrogen 3.237 N/A PHE 44.A N GLN 134.A O no hydrogen 3.021 N/A ILE 46.A N PHE 136.A O no hydrogen 2.783 N/A SER 51.A N ASP 48.A OD1 no hydrogen 2.679 N/A SER 51.A OG VAL 45.A O no hydrogen 2.601 N/A LEU 52.A N ASP 48.A O no hydrogen 2.703 N/A MET 53.A N MET 49.A O no hydrogen 2.981 N/A MET 54.A N ASN 50.A O no hydrogen 3.394 N/A GLY 55.A N SER 51.A O no hydrogen 3.036 N/A GLU 56.A N MET 53.A O no hydrogen 3.305 N/A LYS 58.A N MET 54.A O no hydrogen 2.969 N/A ILE 59.A N GLY 55.A O no hydrogen 2.768 N/A ARG 69.A N GLU 65.A O no hydrogen 3.050 N/A ARG 69.A NH1 LYS 64.A O no hydrogen 3.025 N/A ILE 70.A N VAL 66.A O no hydrogen 2.923 N/A PHE 71.A N ALA 67.A O no hydrogen 2.926 N/A GLN 72.A N ILE 68.A O no hydrogen 2.740 N/A GLN 72.A NE2 ILE 68.A O no hydrogen 3.062 N/A GLY 73.A N ARG 69.A O no hydrogen 2.991 N/A CYS 74.A N ILE 70.A O no hydrogen 3.077 N/A CYS 74.A SG ILE 70.A O no hydrogen 3.628 N/A GLN 75.A N PHE 71.A O no hydrogen 3.366 N/A GLN 75.A NE2 SER 253.A O no hydrogen 3.639 N/A PHE 76.A N GLN 72.A O no hydrogen 3.264 N/A ARG 77.A N GLY 73.A O no hydrogen 3.025 N/A ARG 77.A NH2 GLU 84.A OE1 no hydrogen 3.283 N/A SER 78.A N CYS 74.A O no hydrogen 2.608 N/A VAL 79.A N GLN 75.A O no hydrogen 2.802 N/A GLU 80.A N PHE 76.A O no hydrogen 3.067 N/A ALA 81.A N ARG 77.A O no hydrogen 2.872 N/A VAL 82.A N SER 78.A O no hydrogen 2.865 N/A GLN 83.A N VAL 79.A O no hydrogen 3.163 N/A GLU 84.A N GLU 80.A O no hydrogen 2.997 N/A ILE 85.A N ALA 81.A O no hydrogen 2.836 N/A THR 86.A N VAL 82.A O no hydrogen 2.779 N/A THR 86.A OG1 VAL 82.A O no hydrogen 2.813 N/A GLU 87.A N GLN 83.A O no hydrogen 2.956 N/A TYR 88.A N GLU 84.A O no hydrogen 2.881 N/A TYR 88.A OH ALA 174.A O no hydrogen 2.551 N/A ALA 89.A N ILE 85.A O no hydrogen 2.925 N/A LYS 90.A N THR 86.A O no hydrogen 3.419 N/A SER 91.A N TYR 88.A O no hydrogen 2.966 N/A SER 91.A OG TYR 88.A O no hydrogen 2.827 N/A ILE 92.A N ALA 89.A O no hydrogen 2.930 N/A PHE 95.A N ILE 92.A O no hydrogen 2.886 N/A ASN 97.A N GLY 94.A O no hydrogen 3.200 N/A LEU 98.A N PHE 95.A O no hydrogen 3.186 N/A ASN 101.A N ASP 99.A OD2 no hydrogen 2.695 N/A ASN 101.A ND2 ASP 99.A OD2 no hydrogen 2.785 N/A GLN 103.A N ASP 99.A O no hydrogen 2.996 N/A GLN 103.A NE2 VAL 96.A O no hydrogen 2.996 N/A GLN 103.A NE2 LEU 98.A O no hydrogen 2.934 N/A VAL 104.A N LEU 100.A O no hydrogen 3.034 N/A THR 105.A N ASN 101.A O no hydrogen 2.892 N/A THR 105.A OG1 ASN 101.A O no hydrogen 2.889 N/A LEU 106.A N ASP 102.A O no hydrogen 2.765 N/A LEU 107.A N GLN 103.A O no hydrogen 3.201 N/A LYS 108.A N VAL 104.A O no hydrogen 2.879 N/A LYS 108.A NZ GLU 260.A O no hydrogen 3.400 N/A LYS 108.A NZ ILE 261.A O no hydrogen 2.770 N/A LYS 108.A NZ ASP 264.A O no hydrogen 2.924 N/A TYR 109.A N THR 105.A O no hydrogen 3.113 N/A GLY 110.A N LEU 106.A O no hydrogen 2.781 N/A VAL 111.A N LEU 107.A O no hydrogen 3.100 N/A ILE 114.A N GLY 110.A O no hydrogen 3.177 N/A ILE 115.A N VAL 111.A O no hydrogen 2.955 N/A TYR 116.A N HIS 112.A O no hydrogen 3.091 N/A THR 117.A N GLU 113.A O no hydrogen 3.350 N/A THR 117.A OG1 GLU 113.A O no hydrogen 2.644 N/A MET 118.A N ILE 114.A O no hydrogen 2.926 N/A LEU 119.A N ILE 115.A O no hydrogen 2.736 N/A ALA 120.A N TYR 116.A O no hydrogen 3.217 N/A ALA 120.A N THR 117.A O no hydrogen 2.982 N/A SER 121.A N MET 118.A O no hydrogen 2.776 N/A LEU 122.A N LEU 119.A O no hydrogen 3.231 N/A MET 123.A N ALA 120.A O no hydrogen 3.083 N/A ASN 124.A N GLY 127.A O no hydrogen 3.194 N/A ASP 126.A N ASN 124.A OD1 no hydrogen 2.624 N/A GLY 127.A N ASN 124.A O no hydrogen 3.100 N/A GLY 127.A N ASN 124.A OD1 no hydrogen 2.962 N/A VAL 128.A N MET 137.A O no hydrogen 2.770 N/A LEU 129.A N LEU 122.A O no hydrogen 2.967 N/A ILE 130.A N GLY 135.A O no hydrogen 2.699 N/A GLY 133.A N ILE 130.A O no hydrogen 2.976 N/A GLN 134.A N SER 131.A O no hydrogen 2.909 N/A GLY 135.A N ILE 130.A O no hydrogen 2.911 N/A PHE 136.A N PHE 44.A O no hydrogen 2.812 N/A MET 137.A N VAL 128.A O no hydrogen 2.849 N/A THR 138.A N ILE 46.A O no hydrogen 3.113 N/A THR 138.A OG1 ILE 46.A O no hydrogen 3.544 N/A ARG 139.A N ASP 126.A O no hydrogen 2.680 N/A ARG 139.A NE GLU 154.A OE1 no hydrogen 3.070 N/A ARG 139.A NE GLU 154.A OE2 no hydrogen 2.794 N/A ARG 139.A NH1 LYS 125.A O no hydrogen 3.184 N/A ARG 139.A NH2 GLU 154.A OE2 no hydrogen 2.498 N/A PHE 141.A N THR 138.A OG1 no hydrogen 3.190 N/A LEU 142.A N THR 138.A O no hydrogen 3.364 N/A LYS 143.A N ARG 139.A O no hydrogen 2.868 N/A SER 144.A N PHE 141.A O no hydrogen 3.098 N/A SER 144.A OG GLU 140.A O no hydrogen 3.194 N/A SER 144.A OG PHE 141.A O no hydrogen 2.518 N/A LEU 145.A N LEU 142.A O no hydrogen 3.455 N/A ARG 146.A NE GLU 65.A OE2 no hydrogen 3.502 N/A ARG 146.A NH1 GLU 249.A OE2 no hydrogen 2.922 N/A ARG 146.A NH2 GLU 65.A OE1 no hydrogen 2.739 N/A ARG 146.A NH2 GLU 249.A OE2 no hydrogen 3.161 N/A GLY 150.A N ARG 146.A O no hydrogen 3.402 N/A ASP 151.A N PRO 148.A O no hydrogen 3.224 N/A PHE 152.A N PHE 149.A O no hydrogen 3.397 N/A LYS 156.A N MET 153.A O no hydrogen 2.748 N/A LYS 156.A NZ PHE 152.A O no hydrogen 2.921 N/A LYS 156.A NZ HIS 238.A ND1 no hydrogen 2.815 N/A PHE 157.A N MET 153.A O no hydrogen 2.972 N/A GLU 158.A N GLU 154.A O no hydrogen 2.881 N/A PHE 159.A N PRO 155.A O no hydrogen 2.975 N/A ALA 160.A N LYS 156.A O no hydrogen 2.727 N/A VAL 161.A N PHE 157.A O no hydrogen 2.806 N/A LYS 162.A N GLU 158.A O no hydrogen 3.384 N/A PHE 163.A N PHE 159.A O no hydrogen 2.661 N/A ASN 164.A N ALA 160.A O no hydrogen 2.697 N/A ASN 164.A ND2 ALA 120.A O no hydrogen 3.103 N/A ALA 165.A N LYS 162.A O no hydrogen 3.126 N/A LEU 166.A N PHE 163.A O no hydrogen 3.080 N/A GLU 167.A N ASN 164.A O no hydrogen 2.744 N/A ASP 169.A N ASP 172.A OD2 no hydrogen 3.047 N/A SER 171.A OG ASP 169.A OD1 no hydrogen 2.479 N/A ASP 172.A N ASP 169.A O no hydrogen 2.855 N/A ASP 172.A N ASP 169.A OD1 no hydrogen 3.158 N/A LEU 173.A N ASP 169.A O no hydrogen 3.033 N/A ALA 174.A N ASP 170.A O no hydrogen 2.951 N/A PHE 176.A N ASP 172.A O no hydrogen 3.183 N/A ILE 177.A N LEU 173.A O no hydrogen 2.798 N/A ALA 178.A N ALA 174.A O no hydrogen 3.298 N/A VAL 179.A N ILE 175.A O no hydrogen 2.947 N/A VAL 179.A N PHE 176.A O no hydrogen 3.189 N/A ILE 180.A N PHE 176.A O no hydrogen 3.110 N/A ILE 181.A N ILE 177.A O no hydrogen 3.203 N/A LEU 182.A N ALA 178.A O no hydrogen 3.406 N/A SER 183.A OG ILE 180.A O no hydrogen 2.749 N/A ARG 186.A NH1 GLU 113.A OE1 no hydrogen 3.202 N/A ARG 186.A NH1 GLU 113.A OE2 no hydrogen 2.760 N/A ARG 186.A NH2 GLU 113.A OE1 no hydrogen 2.792 N/A ARG 186.A NH2 ILE 180.A O no hydrogen 3.158 N/A LEU 190.A N ASP 102.A OD1 no hydrogen 2.812 N/A LEU 190.A N ASP 102.A OD2 no hydrogen 3.202 N/A ASN 191.A N ASP 102.A OD2 no hydrogen 2.985 N/A LYS 193.A NZ ASP 197.A OD1 no hydrogen 3.019 N/A GLU 196.A N VAL 192.A O no hydrogen 2.896 N/A ASP 197.A N LYS 193.A O no hydrogen 2.957 N/A ILE 198.A N PRO 194.A O no hydrogen 3.274 N/A GLN 199.A N ILE 195.A O no hydrogen 3.068 N/A ASP 200.A N GLU 196.A O no hydrogen 2.864 N/A ASN 201.A N ASP 197.A O no hydrogen 3.227 N/A LEU 202.A N ILE 198.A O no hydrogen 2.897 N/A LEU 203.A N GLN 199.A O no hydrogen 2.691 N/A GLN 204.A N ASP 200.A O no hydrogen 3.029 N/A ALA 205.A N ASN 201.A O no hydrogen 2.978 N/A LEU 206.A N LEU 202.A O no hydrogen 2.815 N/A GLU 207.A N LEU 203.A O no hydrogen 2.884 N/A LEU 208.A N GLN 204.A O no hydrogen 3.035 N/A GLN 209.A N ALA 205.A O no hydrogen 2.845 N/A GLN 209.A NE2 ASP 172.A OD1 no hydrogen 2.996 N/A LEU 210.A N LEU 206.A O no hydrogen 2.911 N/A LYS 211.A N GLU 207.A O no hydrogen 3.168 N/A LEU 212.A N LEU 208.A O no hydrogen 3.034 N/A ASN 213.A N GLN 209.A O no hydrogen 2.999 N/A ASN 213.A ND2 ASP 169.A OD2 no hydrogen 2.696 N/A ASN 213.A ND2 ASP 172.A OD1 no hydrogen 3.295 N/A ASN 213.A ND2 ASP 172.A OD2 no hydrogen 3.163 N/A HIS 214.A N LEU 210.A O no hydrogen 2.878 N/A HIS 214.A NE2 GLU 167.A O no hydrogen 3.235 N/A GLU 216.A N GLU 216.A OE2 no hydrogen 2.486 N/A SER 217.A N HIS 214.A O no hydrogen 3.024 N/A SER 218.A N GLU 216.A O no hydrogen 3.233 N/A LYS 223.A N GLN 219.A O no hydrogen 2.896 N/A LEU 224.A N LEU 220.A O no hydrogen 2.840 N/A LEU 225.A N PHE 221.A O no hydrogen 3.241 N/A GLN 226.A N ALA 222.A O no hydrogen 3.428 N/A LYS 227.A N LEU 224.A O no hydrogen 2.990 N/A MET 228.A N LEU 225.A O no hydrogen 3.317 N/A THR 229.A N GLN 226.A O no hydrogen 3.319 N/A THR 229.A OG1 GLN 226.A O no hydrogen 3.326 N/A LEU 231.A N LYS 227.A O no hydrogen 3.302 N/A ARG 232.A N MET 228.A O no hydrogen 3.014 N/A GLN 233.A N THR 229.A O no hydrogen 3.414 N/A ILE 234.A N ASP 230.A O no hydrogen 3.131 N/A VAL 235.A N LEU 231.A O no hydrogen 3.074 N/A THR 236.A N ARG 232.A O no hydrogen 3.069 N/A THR 236.A OG1 ARG 232.A O no hydrogen 3.350 N/A GLU 237.A N GLN 233.A O no hydrogen 2.996 N/A HIS 238.A N ILE 234.A O no hydrogen 3.019 N/A VAL 239.A N VAL 235.A O no hydrogen 3.005 N/A GLN 240.A N THR 236.A O no hydrogen 3.244 N/A LEU 241.A N GLU 237.A O no hydrogen 3.055 N/A LEU 242.A N HIS 238.A O no hydrogen 2.922 N/A GLN 243.A N VAL 239.A O no hydrogen 2.896 N/A VAL 244.A N GLN 240.A O no hydrogen 3.107 N/A ILE 245.A N LEU 241.A O no hydrogen 3.176 N/A LYS 246.A N LEU 242.A O no hydrogen 2.954 N/A LYS 247.A N VAL 244.A O no hydrogen 2.986 N/A THR 248.A N VAL 244.A O no hydrogen 3.027 N/A THR 248.A N ILE 245.A O no hydrogen 3.155 N/A THR 248.A OG1 VAL 244.A O no hydrogen 3.100 N/A THR 248.A OG1 ILE 245.A O no hydrogen 3.384 N/A GLU 249.A N ILE 245.A O no hydrogen 2.650 N/A MET 252.A N GLU 249.A O no hydrogen 2.989 N/A LEU 257.A N HIS 255.A ND1 no hydrogen 3.171 N/A GLN 259.A N HIS 255.A O no hydrogen 2.882 N/A GLU 260.A N PRO 256.A O no hydrogen 2.895 N/A ILE 261.A N LEU 257.A O no hydrogen 3.297 N/A TYR 262.A N LEU 258.A O no hydrogen 3.015 N/A