Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wmh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ASN 1.A O no hydrogen 2.768 N/A ASP 6.A N PRO 2.A O no hydrogen 3.422 N/A LEU 7.A N GLU 3.A O no hydrogen 3.175 N/A ARG 8.A N SER 4.A O no hydrogen 3.071 N/A ARG 8.A NH1 GLN 208.A OE1 no hydrogen 2.843 N/A ARG 8.A NH2 GLN 208.A OE1 no hydrogen 3.226 N/A ALA 9.A N ALA 5.A O no hydrogen 3.070 N/A LEU 10.A N ASP 6.A O no hydrogen 3.058 N/A ALA 11.A N LEU 7.A O no hydrogen 2.995 N/A LYS 12.A N ARG 8.A O no hydrogen 2.949 N/A HIS 13.A N ALA 9.A O no hydrogen 2.931 N/A HIS 13.A NE2 SER 90.A O no hydrogen 2.753 N/A LEU 14.A N LEU 10.A O no hydrogen 2.922 N/A TYR 15.A N ALA 11.A O no hydrogen 2.895 N/A ASP 16.A N LYS 12.A O no hydrogen 3.001 N/A SER 17.A N HIS 13.A O no hydrogen 3.098 N/A SER 17.A OG HIS 13.A O no hydrogen 2.847 N/A SER 17.A OG SER 90.A OG no hydrogen 3.344 N/A TYR 18.A N LEU 14.A O no hydrogen 2.885 N/A TYR 18.A OH ASP 169.A OD1 no hydrogen 2.902 N/A ILE 19.A N TYR 15.A O no hydrogen 2.899 N/A LYS 20.A N ASP 16.A O no hydrogen 3.034 N/A LYS 20.A NZ ASP 16.A OD1 no hydrogen 3.424 N/A LYS 20.A NZ ASP 16.A OD2 no hydrogen 2.785 N/A SER 21.A N SER 17.A O no hydrogen 2.833 N/A SER 21.A OG SER 17.A O no hydrogen 2.819 N/A PHE 22.A N TYR 18.A O no hydrogen 2.989 N/A LYS 26.A N ASP 169.A OD1 no hydrogen 2.767 N/A LYS 26.A NZ LEU 167.A O no hydrogen 2.775 N/A ALA 27.A N ASP 169.A OD2 no hydrogen 3.042 N/A LYS 28.A N THR 25.A OG1 no hydrogen 3.144 N/A ALA 29.A N THR 25.A O no hydrogen 2.961 N/A ARG 30.A N LYS 26.A O no hydrogen 2.781 N/A ARG 30.A NH1 MET 122.A O no hydrogen 3.447 N/A ARG 30.A NH2 SER 120.A O no hydrogen 2.823 N/A ARG 30.A NH2 MET 122.A O no hydrogen 2.503 N/A ALA 31.A N ALA 27.A O no hydrogen 3.077 N/A ILE 32.A N LYS 28.A O no hydrogen 2.967 N/A LEU 33.A N ALA 29.A O no hydrogen 2.814 N/A THR 34.A N ARG 30.A O no hydrogen 3.049 N/A THR 34.A OG1 ARG 30.A O no hydrogen 2.700 N/A GLY 35.A N ILE 32.A O no hydrogen 3.126 N/A LYS 40.A NZ ASP 39.A OD1 no hydrogen 3.357 N/A LYS 40.A NZ ASP 39.A OD2 no hydrogen 3.209 N/A PHE 43.A N GLN 133.A O no hydrogen 2.946 N/A ILE 45.A N PHE 135.A O no hydrogen 2.835 N/A SER 50.A N ASP 47.A OD1 no hydrogen 2.864 N/A SER 50.A OG VAL 44.A O no hydrogen 2.746 N/A LEU 51.A N ASP 47.A O no hydrogen 2.737 N/A MET 52.A N MET 48.A O no hydrogen 2.811 N/A MET 53.A N ASN 49.A O no hydrogen 3.002 N/A GLY 54.A N SER 50.A O no hydrogen 2.829 N/A GLU 55.A N LEU 51.A O no hydrogen 3.016 N/A ASP 56.A N MET 53.A O no hydrogen 3.117 N/A LYS 57.A N MET 53.A O no hydrogen 2.892 N/A ILE 58.A N GLY 54.A O no hydrogen 2.696 N/A LYS 61.A NZ GLU 79.A OE1 no hydrogen 2.793 N/A ARG 68.A N GLU 64.A O no hydrogen 2.981 N/A ARG 68.A NE GLU 55.A OE2 no hydrogen 3.244 N/A ARG 68.A NH2 GLU 55.A OE2 no hydrogen 3.456 N/A ILE 69.A N VAL 65.A O no hydrogen 3.050 N/A PHE 70.A N ALA 66.A O no hydrogen 2.751 N/A GLN 71.A N ILE 67.A O no hydrogen 2.779 N/A GLN 71.A NE2 SER 252.A O no hydrogen 3.660 N/A GLY 72.A N ARG 68.A O no hydrogen 3.053 N/A CYS 73.A N ILE 69.A O no hydrogen 2.987 N/A CYS 73.A SG ILE 69.A O no hydrogen 3.334 N/A GLN 74.A N PHE 70.A O no hydrogen 2.908 N/A GLN 74.A NE2 SER 252.A O no hydrogen 3.034 N/A PHE 75.A N GLN 71.A O no hydrogen 3.000 N/A ARG 76.A N GLY 72.A O no hydrogen 3.157 N/A ARG 76.A NH1 ARG 76.A O no hydrogen 3.085 N/A ARG 76.A NH1 GLU 83.A OE2 no hydrogen 3.394 N/A SER 77.A N CYS 73.A O no hydrogen 2.841 N/A SER 77.A OG CYS 73.A O no hydrogen 2.798 N/A VAL 78.A N GLN 74.A O no hydrogen 3.115 N/A GLU 79.A N PHE 75.A O no hydrogen 3.011 N/A ALA 80.A N ARG 76.A O no hydrogen 2.850 N/A VAL 81.A N SER 77.A O no hydrogen 2.856 N/A GLN 82.A N VAL 78.A O no hydrogen 3.141 N/A GLU 83.A N GLU 79.A O no hydrogen 3.003 N/A ILE 84.A N ALA 80.A O no hydrogen 2.809 N/A THR 85.A N VAL 81.A O no hydrogen 2.830 N/A THR 85.A OG1 VAL 81.A O no hydrogen 2.833 N/A GLU 86.A N GLN 82.A O no hydrogen 2.982 N/A TYR 87.A N GLU 83.A O no hydrogen 2.883 N/A TYR 87.A OH ALA 173.A O no hydrogen 2.562 N/A ALA 88.A N ILE 84.A O no hydrogen 2.655 N/A LYS 89.A N THR 85.A O no hydrogen 3.239 N/A SER 90.A N TYR 87.A O no hydrogen 2.916 N/A SER 90.A OG TYR 87.A O no hydrogen 2.675 N/A ILE 91.A N ALA 88.A O no hydrogen 2.938 N/A PHE 94.A N ILE 91.A O no hydrogen 2.930 N/A ASN 96.A N GLY 93.A O no hydrogen 3.207 N/A LEU 97.A N PHE 94.A O no hydrogen 3.224 N/A ASN 100.A N ASP 98.A OD1 no hydrogen 2.822 N/A ASN 100.A ND2 ASP 98.A OD1 no hydrogen 3.558 N/A GLN 102.A N ASP 98.A O no hydrogen 2.983 N/A GLN 102.A NE2 LEU 97.A O no hydrogen 2.768 N/A VAL 103.A N LEU 99.A O no hydrogen 3.178 N/A THR 104.A N ASN 100.A O no hydrogen 3.074 N/A THR 104.A OG1 ASN 100.A O no hydrogen 3.079 N/A LEU 105.A N ASP 101.A O no hydrogen 2.838 N/A LEU 106.A N GLN 102.A O no hydrogen 3.129 N/A LYS 107.A N VAL 103.A O no hydrogen 2.822 N/A LYS 107.A NZ GLU 259.A O no hydrogen 3.028 N/A LYS 107.A NZ ILE 260.A O no hydrogen 3.055 N/A LYS 107.A NZ LYS 262.A O no hydrogen 2.469 N/A TYR 108.A N THR 104.A O no hydrogen 3.286 N/A GLY 109.A N LEU 105.A O no hydrogen 2.868 N/A GLY 109.A N LEU 106.A O no hydrogen 3.187 N/A VAL 110.A N LEU 106.A O no hydrogen 2.986 N/A ILE 113.A N GLY 109.A O no hydrogen 3.209 N/A ILE 114.A N VAL 110.A O no hydrogen 2.795 N/A TYR 115.A N HIS 111.A O no hydrogen 3.120 N/A THR 116.A N GLU 112.A O no hydrogen 3.156 N/A THR 116.A OG1 GLU 112.A O no hydrogen 2.758 N/A MET 117.A N ILE 113.A O no hydrogen 2.834 N/A LEU 118.A N ILE 114.A O no hydrogen 2.727 N/A ALA 119.A N TYR 115.A O no hydrogen 3.253 N/A SER 120.A N MET 117.A O no hydrogen 3.138 N/A LEU 121.A N LEU 118.A O no hydrogen 2.825 N/A MET 122.A N ALA 119.A O no hydrogen 3.105 N/A ASN 123.A N GLY 126.A O no hydrogen 3.092 N/A ASP 125.A N ASN 123.A OD1 no hydrogen 2.865 N/A GLY 126.A N ASN 123.A OD1 no hydrogen 3.088 N/A VAL 127.A N MET 136.A O no hydrogen 2.907 N/A LEU 128.A N LEU 121.A O no hydrogen 2.985 N/A ILE 129.A N GLY 134.A O no hydrogen 2.931 N/A GLY 132.A N ILE 129.A O no hydrogen 3.215 N/A GLN 133.A N SER 130.A O no hydrogen 2.969 N/A GLN 133.A NE2 LYS 59.A O no hydrogen 3.437 N/A GLN 133.A NE2 SER 130.A O no hydrogen 3.211 N/A GLN 133.A NE2 GLU 131.A OE1 no hydrogen 3.493 N/A GLY 134.A N ILE 129.A O no hydrogen 2.968 N/A PHE 135.A N PHE 43.A O no hydrogen 3.080 N/A MET 136.A N VAL 127.A O no hydrogen 2.863 N/A THR 137.A N ILE 45.A O no hydrogen 3.082 N/A ARG 138.A N ASP 125.A O no hydrogen 2.693 N/A ARG 138.A NE GLU 153.A OE1 no hydrogen 2.811 N/A ARG 138.A NE GLU 153.A OE2 no hydrogen 2.850 N/A ARG 138.A NH1 LYS 124.A O no hydrogen 3.315 N/A ARG 138.A NH2 GLU 153.A OE1 no hydrogen 2.390 N/A PHE 140.A N THR 137.A OG1 no hydrogen 3.214 N/A LEU 141.A N THR 137.A O no hydrogen 3.267 N/A LYS 142.A N ARG 138.A O no hydrogen 2.978 N/A SER 143.A N PHE 140.A O no hydrogen 3.123 N/A SER 143.A OG PHE 140.A O no hydrogen 2.737 N/A LEU 144.A N LEU 141.A O no hydrogen 3.350 N/A ARG 145.A NE GLU 64.A OE2 no hydrogen 2.920 N/A ARG 145.A NH1 LYS 146.A O no hydrogen 3.362 N/A ARG 145.A NH1 GLU 248.A OE1 no hydrogen 2.679 N/A ARG 145.A NH2 GLU 64.A OE1 no hydrogen 2.662 N/A ARG 145.A NH2 GLU 64.A OE2 no hydrogen 3.055 N/A ARG 145.A NH2 GLU 248.A OE2 no hydrogen 3.341 N/A GLY 149.A N ARG 145.A O no hydrogen 3.253 N/A ASP 150.A N PRO 147.A O no hydrogen 3.343 N/A PHE 151.A N PHE 148.A O no hydrogen 3.343 N/A LYS 155.A NZ PHE 151.A O no hydrogen 2.647 N/A PHE 156.A N MET 152.A O no hydrogen 3.164 N/A GLU 157.A N GLU 153.A O no hydrogen 3.034 N/A PHE 158.A N PRO 154.A O no hydrogen 3.036 N/A ALA 159.A N LYS 155.A O no hydrogen 2.847 N/A VAL 160.A N PHE 156.A O no hydrogen 3.039 N/A PHE 162.A N PHE 158.A O no hydrogen 2.837 N/A ASN 163.A N ALA 159.A O no hydrogen 2.621 N/A ASN 163.A ND2 ALA 119.A O no hydrogen 3.295 N/A ALA 164.A N LYS 161.A O no hydrogen 3.214 N/A LEU 165.A N PHE 162.A O no hydrogen 2.964 N/A GLU 166.A N ASN 163.A O no hydrogen 2.971 N/A ASP 168.A N ASP 171.A OD2 no hydrogen 2.772 N/A SER 170.A OG ASP 168.A OD1 no hydrogen 2.685 N/A ASP 171.A N ASP 168.A OD1 no hydrogen 3.244 N/A LEU 172.A N ASP 168.A O no hydrogen 2.967 N/A ALA 173.A N ASP 169.A O no hydrogen 2.857 N/A PHE 175.A N ASP 171.A O no hydrogen 3.138 N/A ILE 176.A N LEU 172.A O no hydrogen 2.856 N/A ALA 177.A N ALA 173.A O no hydrogen 3.243 N/A VAL 178.A N ILE 174.A O no hydrogen 2.930 N/A ILE 179.A N PHE 175.A O no hydrogen 3.020 N/A ILE 180.A N ILE 176.A O no hydrogen 3.129 N/A LEU 181.A N ALA 177.A O no hydrogen 3.255 N/A SER 182.A OG ILE 179.A O no hydrogen 2.820 N/A ARG 185.A N SER 182.A O no hydrogen 3.426 N/A ARG 185.A NH1 GLU 112.A OE1 no hydrogen 2.985 N/A ARG 185.A NH1 GLU 112.A OE2 no hydrogen 3.507 N/A ARG 185.A NH2 GLU 112.A OE2 no hydrogen 2.851 N/A ARG 185.A NH2 ILE 179.A O no hydrogen 3.261 N/A LEU 188.A N ARG 185.A O no hydrogen 3.454 N/A LEU 189.A N ASP 101.A OD1 no hydrogen 2.825 N/A ASN 190.A N ASP 101.A OD2 no hydrogen 2.816 N/A LYS 192.A NZ ASP 196.A OD1 no hydrogen 3.186 N/A LYS 192.A NZ ASP 196.A OD2 no hydrogen 2.785 N/A GLU 195.A N VAL 191.A O no hydrogen 3.058 N/A ASP 196.A N LYS 192.A O no hydrogen 2.926 N/A ILE 197.A N PRO 193.A O no hydrogen 3.232 N/A GLN 198.A N ILE 194.A O no hydrogen 2.742 N/A ASP 199.A N GLU 195.A O no hydrogen 2.764 N/A ASN 200.A N ASP 196.A O no hydrogen 3.277 N/A LEU 201.A N ILE 197.A O no hydrogen 2.961 N/A LEU 202.A N GLN 198.A O no hydrogen 2.759 N/A GLN 203.A N ASP 199.A O no hydrogen 3.059 N/A GLN 203.A NE2 ASP 199.A OD1 no hydrogen 3.063 N/A ALA 204.A N ASN 200.A O no hydrogen 3.006 N/A LEU 205.A N LEU 201.A O no hydrogen 2.796 N/A GLU 206.A N LEU 202.A O no hydrogen 2.920 N/A LEU 207.A N GLN 203.A O no hydrogen 3.061 N/A GLN 208.A N ALA 204.A O no hydrogen 2.885 N/A GLN 208.A NE2 ASP 171.A OD1 no hydrogen 2.975 N/A LEU 209.A N LEU 205.A O no hydrogen 2.925 N/A LYS 210.A N GLU 206.A O no hydrogen 3.197 N/A LEU 211.A N LEU 207.A O no hydrogen 2.952 N/A ASN 212.A N GLN 208.A O no hydrogen 2.839 N/A ASN 212.A ND2 ASP 168.A OD2 no hydrogen 2.893 N/A ASN 212.A ND2 ASP 171.A OD1 no hydrogen 2.995 N/A ASN 212.A ND2 ASP 171.A OD2 no hydrogen 3.332 N/A HIS 213.A N LEU 209.A O no hydrogen 2.796 N/A SER 216.A N HIS 213.A O no hydrogen 2.877 N/A LEU 219.A N SER 216.A O no hydrogen 3.302 N/A LYS 222.A N GLN 218.A O no hydrogen 2.901 N/A LYS 222.A NZ SER 217.A O no hydrogen 2.891 N/A LEU 223.A N LEU 219.A O no hydrogen 2.710 N/A LEU 224.A N PHE 220.A O no hydrogen 3.110 N/A GLN 225.A N ALA 221.A O no hydrogen 3.168 N/A LYS 226.A N LEU 223.A O no hydrogen 2.984 N/A MET 227.A N LEU 224.A O no hydrogen 3.006 N/A THR 228.A N GLN 225.A O no hydrogen 3.155 N/A THR 228.A OG1 GLN 225.A O no hydrogen 3.261 N/A LEU 230.A N LYS 226.A O no hydrogen 2.993 N/A ARG 231.A N MET 227.A O no hydrogen 3.223 N/A ARG 231.A NH1 ASP 184.A OD2 no hydrogen 3.541 N/A ARG 231.A NH2 ASP 184.A OD2 no hydrogen 3.011 N/A GLN 232.A N THR 228.A O no hydrogen 3.273 N/A ILE 233.A N ASP 229.A O no hydrogen 3.147 N/A VAL 234.A N LEU 230.A O no hydrogen 3.083 N/A THR 235.A N ARG 231.A O no hydrogen 3.001 N/A THR 235.A OG1 ARG 231.A O no hydrogen 2.980 N/A GLU 236.A N GLN 232.A O no hydrogen 2.964 N/A HIS 237.A N ILE 233.A O no hydrogen 2.961 N/A VAL 238.A N VAL 234.A O no hydrogen 2.986 N/A GLN 239.A N THR 235.A O no hydrogen 3.149 N/A LEU 240.A N GLU 236.A O no hydrogen 2.951 N/A LEU 241.A N HIS 237.A O no hydrogen 2.986 N/A GLN 242.A N VAL 238.A O no hydrogen 3.068 N/A GLN 242.A NE2 VAL 238.A O no hydrogen 3.588 N/A VAL 243.A N GLN 239.A O no hydrogen 3.242 N/A ILE 244.A N LEU 240.A O no hydrogen 3.227 N/A LYS 245.A N LEU 241.A O no hydrogen 3.141 N/A LYS 245.A NZ GLN 242.A O no hydrogen 3.437 N/A LYS 245.A NZ GLN 242.A OE1 no hydrogen 3.194 N/A THR 247.A N VAL 243.A O no hydrogen 3.186 N/A THR 247.A OG1 VAL 243.A O no hydrogen 3.499 N/A GLU 248.A N ILE 244.A O no hydrogen 2.466 N/A ASP 250.A N ASP 250.A OD1 no hydrogen 2.521 N/A MET 251.A N GLU 248.A O no hydrogen 3.084 N/A HIS 254.A N GLN 74.A OE1 no hydrogen 3.280 N/A LEU 256.A N HIS 254.A ND1 no hydrogen 3.067 N/A GLN 258.A N HIS 254.A O no hydrogen 2.908 N/A GLU 259.A N PRO 255.A O no hydrogen 2.766 N/A ILE 260.A N LEU 256.A O no hydrogen 3.057 N/A TYR 261.A N LEU 257.A O no hydrogen 2.860 N/A LYS 262.A N GLN 258.A O no hydrogen 2.947 N/A LEU 264.A N TYR 261.A O no hydrogen 2.960 N/A