Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w98_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 1.A O no hydrogen 2.598 N/A SER 7.A OG GLU 162.A OE1 no hydrogen 2.722 N/A ARG 11.A NH2 SER 1.A OG no hydrogen 3.200 N/A GLU 12.A N ASN 10.A OD1 no hydrogen 3.204 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.629 N/A VAL 14.A N ASN 10.A O no hydrogen 2.724 N/A TRP 15.A N ARG 11.A O no hydrogen 2.996 N/A LYS 16.A N GLU 12.A O no hydrogen 2.985 N/A ILE 17.A N GLU 13.A O no hydrogen 2.991 N/A MET 18.A N VAL 14.A O no hydrogen 3.017 N/A LEU 19.A N TRP 15.A O no hydrogen 2.763 N/A ASN 20.A N LYS 16.A O no hydrogen 2.792 N/A LYS 21.A N ILE 17.A O no hydrogen 2.777 N/A LYS 21.A NZ SER 140.A O no hydrogen 2.393 N/A GLU 22.A N MET 18.A O no hydrogen 3.274 N/A LYS 23.A N ASN 20.A O no hydrogen 3.196 N/A LYS 23.A NZ LEU 19.A O no hydrogen 3.570 N/A THR 24.A N LYS 21.A O no hydrogen 2.890 N/A TYR 25.A N LYS 21.A O no hydrogen 3.280 N/A ARG 27.A NE ASP 69.A OD2 no hydrogen 2.678 N/A GLN 29.A N GLN 29.A OE1 no hydrogen 2.546 N/A HIS 30.A N ASP 28.A OD1 no hydrogen 2.995 N/A PHE 31.A N ASP 28.A O no hydrogen 3.258 N/A GLU 33.A N HIS 30.A O no hydrogen 3.116 N/A GLN 34.A N PHE 31.A O no hydrogen 3.089 N/A GLN 34.A NE2 ALA 76.A O no hydrogen 3.496 N/A HIS 35.A N LEU 32.A O no hydrogen 2.984 N/A HIS 35.A NE2 MET 75.A O no hydrogen 2.956 N/A LEU 38.A N HIS 35.A O no hydrogen 2.769 N/A MET 42.A N GLN 39.A O no hydrogen 3.075 N/A ARG 43.A NE ASP 72.A OD1 no hydrogen 2.817 N/A ARG 43.A NH1 VAL 184.A O no hydrogen 2.693 N/A ARG 43.A NH2 ASP 72.A OD1 no hydrogen 3.487 N/A ARG 43.A NH2 ASP 72.A OD2 no hydrogen 2.827 N/A ARG 43.A NH2 VAL 184.A O no hydrogen 3.063 N/A ALA 44.A N PRO 40.A O no hydrogen 3.200 N/A ILE 45.A N LYS 41.A O no hydrogen 2.983 N/A LEU 46.A N MET 42.A O no hydrogen 2.835 N/A LEU 47.A N ARG 43.A O no hydrogen 2.918 N/A ASP 48.A N ALA 44.A O no hydrogen 2.839 N/A TRP 49.A N ILE 45.A O no hydrogen 3.003 N/A LEU 50.A N LEU 46.A O no hydrogen 3.020 N/A MET 51.A N LEU 47.A O no hydrogen 3.085 N/A GLU 52.A N ASP 48.A O no hydrogen 3.220 N/A VAL 53.A N TRP 49.A O no hydrogen 2.923 N/A CYS 54.A N LEU 50.A O no hydrogen 2.879 N/A CYS 54.A SG LEU 50.A O no hydrogen 3.378 N/A GLU 55.A N MET 51.A O no hydrogen 2.991 N/A VAL 56.A N GLU 52.A O no hydrogen 3.004 N/A TYR 57.A N VAL 53.A O no hydrogen 2.952 N/A LYS 58.A N GLU 55.A O no hydrogen 3.037 N/A LEU 59.A N CYS 54.A O no hydrogen 2.768 N/A HIS 60.A N GLU 102.A OE2 no hydrogen 2.943 N/A HIS 60.A ND1 GLU 102.A OE1 no hydrogen 2.842 N/A HIS 60.A NE2 ASP 254.A OD2 no hydrogen 2.524 N/A ARG 61.A N ASN 257.A O no hydrogen 2.891 N/A ARG 61.A NH1 HIS 256.A O no hydrogen 2.736 N/A PHE 64.A N HIS 60.A O no hydrogen 3.236 N/A TYR 65.A N ARG 61.A O no hydrogen 2.897 N/A TYR 65.A OH ASP 181.A OD1 no hydrogen 2.660 N/A LEU 66.A N GLU 62.A O no hydrogen 2.942 N/A ALA 67.A N THR 63.A O no hydrogen 3.154 N/A GLN 68.A N PHE 64.A O no hydrogen 2.873 N/A GLN 68.A NE2 ASP 72.A OD2 no hydrogen 2.668 N/A GLN 68.A NE2 TYR 194.A OH no hydrogen 3.171 N/A ASP 69.A N TYR 65.A O no hydrogen 2.974 N/A PHE 70.A N LEU 66.A O no hydrogen 2.746 N/A PHE 71.A N ALA 67.A O no hydrogen 2.877 N/A ASP 72.A N GLN 68.A O no hydrogen 2.939 N/A ARG 73.A N ASP 69.A O no hydrogen 2.969 N/A ARG 73.A NH1 ASP 69.A OD1 no hydrogen 2.977 N/A ARG 73.A NH1 ARG 138.A O no hydrogen 3.030 N/A ARG 73.A NH2 ARG 138.A O no hydrogen 2.643 N/A TYR 74.A N PHE 70.A O no hydrogen 2.831 N/A MET 75.A N PHE 71.A O no hydrogen 3.041 N/A ALA 76.A N ASP 72.A O no hydrogen 3.329 N/A THR 77.A N TYR 74.A O no hydrogen 2.817 N/A THR 77.A OG1 TYR 74.A O no hydrogen 2.567 N/A THR 77.A OG1 GLN 78.A OE1 no hydrogen 3.423 N/A GLN 78.A N MET 75.A O no hydrogen 2.955 N/A VAL 81.A N HIS 35.A ND1 no hydrogen 3.069 N/A LEU 85.A N VAL 82.A O no hydrogen 2.939 N/A LEU 86.A N LYS 83.A O no hydrogen 3.272 N/A ILE 89.A N LEU 85.A O no hydrogen 3.174 N/A GLY 90.A N LEU 86.A O no hydrogen 2.881 N/A ILE 91.A N GLN 87.A O no hydrogen 2.960 N/A SER 92.A N LEU 88.A O no hydrogen 3.095 N/A SER 92.A OG LEU 88.A O no hydrogen 2.579 N/A SER 93.A N ILE 89.A O no hydrogen 3.043 N/A SER 93.A OG ILE 89.A O no hydrogen 2.685 N/A LEU 94.A N GLY 90.A O no hydrogen 2.968 N/A PHE 95.A N ILE 91.A O no hydrogen 2.860 N/A ILE 96.A N SER 92.A O no hydrogen 3.081 N/A ALA 97.A N SER 93.A O no hydrogen 3.057 N/A ALA 98.A N LEU 94.A O no hydrogen 2.816 N/A LYS 99.A N PHE 95.A O no hydrogen 3.040 N/A LYS 99.A NZ GLU 128.A OE1 no hydrogen 3.332 N/A LYS 99.A NZ GLU 128.A OE2 no hydrogen 2.613 N/A LEU 100.A N ILE 96.A O no hydrogen 3.011 N/A GLU 101.A N ALA 97.A O no hydrogen 2.884 N/A GLU 102.A N ALA 98.A O no hydrogen 3.033 N/A LYS 107.A N GLN 110.A OE1 no hydrogen 2.685 N/A GLN 110.A N LYS 107.A O no hydrogen 2.731 N/A PHE 111.A N LYS 107.A O no hydrogen 3.130 N/A ALA 112.A N LEU 108.A O no hydrogen 2.931 N/A TYR 113.A N HIS 109.A O no hydrogen 3.101 N/A VAL 114.A N GLN 110.A O no hydrogen 3.124 N/A THR 115.A N ALA 112.A O no hydrogen 3.231 N/A THR 115.A OG1 ALA 112.A O no hydrogen 2.565 N/A THR 115.A OG1 CYS 119.A O no hydrogen 3.404 N/A ASP 116.A N TYR 113.A O no hydrogen 2.957 N/A ALA 118.A N THR 115.A O no hydrogen 3.228 N/A CYS 119.A N THR 115.A OG1 no hydrogen 3.190 N/A SER 120.A N GLU 123.A OE1 no hydrogen 3.142 N/A SER 120.A OG GLU 123.A OE1 no hydrogen 2.541 N/A ILE 124.A N SER 120.A O no hydrogen 3.102 N/A LEU 125.A N GLY 121.A O no hydrogen 2.853 N/A THR 126.A N ASP 122.A O no hydrogen 3.017 N/A THR 126.A OG1 ASP 122.A O no hydrogen 3.000 N/A MET 127.A N GLU 123.A O no hydrogen 2.991 N/A GLU 128.A N ILE 124.A O no hydrogen 2.775 N/A MET 130.A N THR 126.A O no hydrogen 3.170 N/A ILE 131.A N MET 127.A O no hydrogen 2.920 N/A MET 132.A N GLU 128.A O no hydrogen 2.901 N/A LYS 133.A N LEU 129.A O no hydrogen 2.987 N/A ALA 134.A N MET 130.A O no hydrogen 2.948 N/A LEU 135.A N ILE 131.A O no hydrogen 2.945 N/A LYS 136.A N LYS 133.A O no hydrogen 2.961 N/A TRP 137.A N MET 132.A O no hydrogen 2.806 N/A ARG 138.A N LEU 135.A O no hydrogen 3.218 N/A SER 140.A N TYR 25.A OH no hydrogen 3.002 N/A THR 143.A OG1 GLU 62.A OE1 no hydrogen 2.788 N/A SER 146.A N THR 143.A OG1 no hydrogen 3.210 N/A SER 146.A OG THR 143.A O no hydrogen 2.950 N/A TRP 147.A N THR 143.A O no hydrogen 3.388 N/A LEU 148.A N ILE 144.A O no hydrogen 3.388 N/A ASN 149.A N VAL 145.A O no hydrogen 2.900 N/A VAL 150.A N SER 146.A O no hydrogen 3.006 N/A TYR 151.A N TRP 147.A O no hydrogen 2.925 N/A TYR 151.A OH GLY 195.A O no hydrogen 2.688 N/A MET 152.A N LEU 148.A O no hydrogen 2.957 N/A GLN 153.A N ASN 149.A O no hydrogen 3.193 N/A GLN 153.A NE2 VAL 163.A O no hydrogen 3.082 N/A GLN 153.A NE2 LEU 165.A O no hydrogen 2.978 N/A VAL 154.A N VAL 150.A O no hydrogen 3.189 N/A ALA 155.A N TYR 151.A O no hydrogen 2.986 N/A TYR 156.A N MET 152.A O no hydrogen 3.279 N/A TYR 156.A N GLN 153.A O no hydrogen 3.329 N/A LEU 157.A N VAL 154.A O no hydrogen 3.041 N/A GLU 162.A N LEU 160.A O no hydrogen 2.834 N/A LEU 164.A N GLU 162.A OE2 no hydrogen 2.998 N/A GLN 167.A N GLN 153.A OE1 no hydrogen 2.843 N/A TYR 168.A OH HIS 256.A NE2 no hydrogen 3.059 N/A GLN 170.A NE2 ASP 252.A O no hydrogen 2.662 N/A GLN 170.A NE2 HIS 256.A ND1 no hydrogen 3.087 N/A GLN 171.A NE2 GLN 171.A O no hydrogen 3.344 N/A GLN 171.A NE2 SER 242.A O no hydrogen 3.000 N/A PHE 173.A N PRO 169.A O no hydrogen 3.477 N/A ILE 174.A N GLN 170.A O no hydrogen 3.242 N/A GLN 175.A N ILE 172.A O no hydrogen 3.164 N/A GLN 175.A NE2 SER 242.A O no hydrogen 3.083 N/A ILE 176.A N ILE 172.A O no hydrogen 3.161 N/A ALA 177.A N PHE 173.A O no hydrogen 2.986 N/A GLU 178.A N ILE 174.A O no hydrogen 3.092 N/A LEU 179.A N ILE 176.A O no hydrogen 3.252 N/A LEU 180.A N ILE 176.A O no hydrogen 3.137 N/A ASP 181.A N ALA 177.A O no hydrogen 2.717 N/A CYS 183.A N LEU 179.A O no hydrogen 2.962 N/A CYS 183.A SG LEU 179.A O no hydrogen 3.331 N/A VAL 184.A N LEU 180.A O no hydrogen 2.881 N/A LEU 185.A N LEU 182.A O no hydrogen 3.006 N/A ASP 186.A N CYS 183.A O no hydrogen 3.294 N/A ASP 188.A N ASP 186.A OD1 no hydrogen 2.772 N/A CYS 189.A N ASP 186.A O no hydrogen 3.138 N/A CYS 189.A SG ASP 186.A O no hydrogen 3.284 N/A LEU 190.A N VAL 187.A O no hydrogen 3.367 N/A GLU 191.A N ASP 188.A O no hydrogen 3.140 N/A PHE 192.A N CYS 189.A O no hydrogen 2.971 N/A TYR 194.A OH ASP 69.A OD2 no hydrogen 2.754 N/A GLY 195.A N GLU 22.A OE2 no hydrogen 3.071 N/A ILE 196.A N PRO 193.A O no hydrogen 2.826 N/A LEU 197.A N PRO 193.A O no hydrogen 3.077 N/A ALA 198.A N TYR 194.A O no hydrogen 3.106 N/A ALA 199.A N GLY 195.A O no hydrogen 3.028 N/A SER 200.A N ILE 196.A O no hydrogen 2.782 N/A SER 200.A OG ILE 196.A O no hydrogen 2.634 N/A ALA 201.A N LEU 197.A O no hydrogen 2.996 N/A LEU 202.A N ALA 198.A O no hydrogen 3.147 N/A TYR 203.A N ALA 199.A O no hydrogen 2.900 N/A HIS 204.A N SER 200.A O no hydrogen 3.093 N/A HIS 204.A ND1 SER 200.A O no hydrogen 2.882 N/A PHE 205.A N LEU 202.A O no hydrogen 2.931 N/A SER 206.A N TYR 203.A O no hydrogen 2.880 N/A SER 206.A OG LEU 202.A O no hydrogen 2.778 N/A SER 206.A OG SER 207.A O no hydrogen 3.476 N/A SER 207.A OG GLU 209.A OE1 no hydrogen 3.463 N/A GLU 209.A N SER 207.A OG no hydrogen 3.237 N/A GLU 209.A N GLU 209.A OE1 no hydrogen 2.731 N/A LEU 210.A N SER 207.A OG no hydrogen 3.206 N/A MET 211.A N SER 207.A O no hydrogen 3.041 N/A GLN 212.A N SER 208.A O no hydrogen 2.911 N/A LYS 213.A N GLU 209.A O no hydrogen 2.993 N/A VAL 214.A N LEU 210.A O no hydrogen 3.020 N/A SER 215.A N MET 211.A O no hydrogen 2.802 N/A SER 215.A OG MET 211.A O no hydrogen 3.053 N/A SER 215.A OG SER 215.A O no hydrogen 2.290 N/A TYR 217.A N SER 215.A O no hydrogen 2.362 N/A GLN 218.A N ASP 221.A OD2 no hydrogen 3.029 N/A ASP 221.A N GLN 218.A O no hydrogen 3.212 N/A ILE 222.A N TRP 219.A O no hydrogen 3.240 N/A CYS 225.A SG ILE 196.A O no hydrogen 3.872 N/A CYS 225.A SG SER 200.A OG no hydrogen 3.128 N/A VAL 226.A N ILE 222.A O no hydrogen 2.682 N/A LYS 227.A N GLU 223.A O no hydrogen 2.915 N/A TRP 228.A N ASN 224.A O no hydrogen 2.992 N/A MET 229.A N CYS 225.A O no hydrogen 2.711 N/A VAL 230.A N VAL 226.A O no hydrogen 2.956 N/A ALA 233.A N MET 229.A O no hydrogen 3.052 N/A MET 234.A N VAL 230.A O no hydrogen 2.951 N/A VAL 235.A N PRO 231.A O no hydrogen 2.943 N/A ILE 236.A N PHE 232.A O no hydrogen 3.048 N/A ARG 237.A N ALA 233.A O no hydrogen 2.706 N/A ARG 237.A NH2 HIS 204.A O no hydrogen 3.245 N/A GLU 238.A N MET 234.A O no hydrogen 2.782 N/A THR 239.A N VAL 235.A O no hydrogen 3.221 N/A THR 239.A N ILE 236.A O no hydrogen 3.072 N/A THR 239.A OG1 VAL 235.A O no hydrogen 3.429 N/A GLY 240.A N ILE 236.A O no hydrogen 2.958 N/A GLY 240.A N ARG 237.A O no hydrogen 3.331 N/A SER 242.A N GLU 178.A OE1 no hydrogen 2.929 N/A SER 242.A OG GLU 178.A OE1 no hydrogen 3.479 N/A SER 242.A OG GLU 178.A OE2 no hydrogen 2.714 N/A LYS 245.A NZ GLU 55.A OE1 no hydrogen 3.131 N/A HIS 246.A ND1 ASP 252.A OD1 no hydrogen 2.821 N/A VAL 250.A N PHE 247.A O no hydrogen 3.215 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 3.329 N/A ASP 254.A N ALA 251.A O no hydrogen 2.911 N/A ALA 255.A N ASP 252.A O no hydrogen 3.262 N/A ASN 257.A N ASP 254.A O no hydrogen 3.004 N/A ASN 257.A ND2 ASP 254.A OD1 no hydrogen 2.664 N/A ILE 258.A N ALA 255.A O no hydrogen 3.250 N/A GLN 259.A N LEU 59.A O no hydrogen 2.850 N/A GLN 259.A NE2 ASP 181.A OD2 no hydrogen 3.113 N/A GLN 259.A NE2 THR 260.A O no hydrogen 2.999 N/A HIS 261.A N GLU 55.A OE2 no hydrogen 2.716 N/A HIS 261.A NE2 ASP 48.A OD1 no hydrogen 3.054 N/A HIS 261.A NE2 ASP 48.A OD2 no hydrogen 2.787 N/A ARG 262.A NH1 GLU 178.A OE2 no hydrogen 3.084 N/A SER 264.A N ARG 262.A O no hydrogen 2.800 N/A LEU 267.A N ASP 263.A O no hydrogen 3.388 N/A LEU 268.A N SER 264.A O no hydrogen 2.647 N/A ASP 269.A N ASP 266.A O no hydrogen 3.293 N/A LYS 270.A N LEU 267.A O no hydrogen 3.207 N/A