Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u25_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N GLU 271.A OE2 no hydrogen 2.882 N/A SER 6.A N PRO 3.A O no hydrogen 3.099 N/A TYR 7.A N GLU 271.A OE2 no hydrogen 2.768 N/A ARG 9.A N SER 6.A O no hydrogen 3.058 N/A ALA 10.A N TYR 7.A O no hydrogen 3.061 N/A GLU 11.A N ALA 8.A O no hydrogen 3.094 N/A GLN 14.A N GLN 14.A OE1 no hydrogen 2.705 N/A ASP 15.A N ARG 12.A O no hydrogen 2.898 N/A PHE 16.A N PRO 13.A O no hydrogen 2.856 N/A PHE 19.A N TYR 113.A O no hydrogen 2.780 N/A VAL 20.A N TYR 113.A O no hydrogen 3.195 N/A ARG 22.A N SER 111.A O no hydrogen 2.535 N/A LEU 23.A N ALA 147.A O no hydrogen 2.522 N/A ASP 24.A N PRO 109.A O no hydrogen 2.703 N/A ASN 25.A ND2 ALA 71.A O no hydrogen 3.234 N/A GLY 27.A N ASN 25.A OD1 no hydrogen 2.638 N/A LYS 28.A N ASP 26.A OD1 no hydrogen 2.997 N/A ARG 33.A N SER 70.A OG no hydrogen 2.867 N/A ARG 33.A NH2 LEU 31.A O no hydrogen 2.878 N/A ASN 34.A ND2 ALA 217.A O no hydrogen 3.156 N/A ARG 36.A N GLY 68.A O no hydrogen 3.365 N/A ARG 36.A NH1 ASN 34.A O no hydrogen 2.867 N/A ARG 36.A NH1 GLY 218.A O no hydrogen 3.131 N/A ARG 36.A NH2 GLY 218.A O no hydrogen 3.461 N/A THR 37.A N ASP 40.A OD2 no hydrogen 2.881 N/A SER 38.A N ILE 66.A O no hydrogen 2.948 N/A SER 38.A OG ILE 66.A O no hydrogen 3.135 N/A ASP 40.A N THR 37.A O no hydrogen 2.974 N/A ARG 43.A N GLU 245.A O no hydrogen 2.690 N/A PHE 49.A N GLU 46.A O no hydrogen 3.027 N/A HIS 50.A N LYS 47.A O no hydrogen 2.730 N/A ASP 52.A N TYR 241.A OH no hydrogen 3.088 N/A ALA 54.A N ASP 52.A OD1 no hydrogen 3.018 N/A TYR 55.A N ASP 52.A O no hydrogen 3.083 N/A TYR 55.A OH ASP 238.A OD1 no hydrogen 3.047 N/A SER 58.A N ASP 238.A OD1 no hydrogen 2.527 N/A ARG 59.A NH1 ASP 40.A O no hydrogen 2.902 N/A ARG 59.A NH2 ASP 40.A O no hydrogen 3.247 N/A GLU 60.A N SER 58.A OG no hydrogen 3.205 N/A ALA 63.A N GLY 61.A O no hydrogen 2.946 N/A ILE 66.A N SER 38.A OG no hydrogen 3.193 N/A SER 67.A N LEU 211.A O no hydrogen 2.962 N/A GLY 68.A N ARG 36.A O no hydrogen 3.198 N/A SER 69.A OG SER 70.A O no hydrogen 2.677 N/A SER 70.A N ARG 33.A O no hydrogen 2.929 N/A SER 70.A OG ARG 33.A O no hydrogen 3.384 N/A SER 70.A OG ALA 71.A O no hydrogen 2.907 N/A ALA 71.A N GLU 216.A O no hydrogen 3.118 N/A THR 73.A N GLN 76.A OE1 no hydrogen 2.866 N/A GLN 76.A N THR 73.A OG1 no hydrogen 3.091 N/A GLN 76.A NE2 ASN 25.A OD1 no hydrogen 2.991 N/A GLN 76.A NE2 GLU 29.A O no hydrogen 2.874 N/A LEU 77.A N THR 73.A O no hydrogen 2.958 N/A LYS 78.A N PRO 74.A O no hydrogen 3.197 N/A ASN 79.A N ALA 75.A O no hydrogen 3.016 N/A ASN 79.A ND2 ALA 30.A O no hydrogen 2.474 N/A VAL 80.A N GLN 76.A O no hydrogen 2.890 N/A ALA 81.A N LEU 77.A O no hydrogen 2.783 N/A ALA 82.A N LYS 78.A O no hydrogen 2.868 N/A LYS 83.A N ASN 79.A O no hydrogen 3.167 N/A LEU 84.A N VAL 80.A O no hydrogen 3.120 N/A ARG 85.A N ALA 81.A O no hydrogen 3.180 N/A GLU 86.A N LYS 83.A O no hydrogen 3.361 N/A LYS 87.A N LEU 84.A O no hydrogen 2.982 N/A THR 88.A N LEU 84.A O no hydrogen 3.089 N/A GLY 90.A N THR 88.A OG1 no hydrogen 2.889 N/A TYR 93.A N TRP 210.A O no hydrogen 2.846 N/A ASP 94.A N ARG 178.A O no hydrogen 2.747 N/A VAL 95.A N HIS 212.A O no hydrogen 2.864 N/A ASP 96.A N PHE 180.A O no hydrogen 2.798 N/A LEU 97.A N HIS 214.A O no hydrogen 3.287 N/A ARG 98.A N ASP 96.A OD1 no hydrogen 3.243 N/A ARG 98.A NE GLU 100.A OE1 no hydrogen 2.703 N/A ARG 98.A NH1 ASP 24.A OD2 no hydrogen 3.083 N/A ARG 98.A NH2 ASP 24.A OD1 no hydrogen 2.990 N/A ARG 98.A NH2 ASP 24.A OD2 no hydrogen 3.040 N/A GLN 99.A N ALA 184.A O no hydrogen 2.953 N/A GLU 100.A N GLU 100.A OE2 no hydrogen 2.760 N/A SER 101.A OG ASP 131.A OD1 no hydrogen 2.650 N/A HIS 102.A N GLU 132.A OE1 no hydrogen 2.851 N/A HIS 102.A ND1 GLU 100.A O no hydrogen 3.055 N/A HIS 102.A NE2 ASP 96.A OD2 no hydrogen 2.566 N/A GLY 103.A N VAL 110.A O no hydrogen 3.054 N/A TYR 104.A N GLN 167.A O no hydrogen 2.693 N/A TYR 104.A OH PHE 72.A O no hydrogen 3.345 N/A LEU 105.A N ILE 108.A O no hydrogen 3.088 N/A ASP 106.A N LYS 165.A O no hydrogen 2.717 N/A ILE 108.A N LEU 105.A O no hydrogen 2.838 N/A VAL 110.A N GLY 103.A O no hydrogen 2.994 N/A SER 111.A N ARG 22.A O no hydrogen 2.964 N/A SER 111.A OG ASP 24.A OD1 no hydrogen 2.769 N/A TRP 112.A N SER 101.A O no hydrogen 2.792 N/A TYR 113.A N VAL 20.A O no hydrogen 2.654 N/A ASP 117.A N GLY 114.A O no hydrogen 2.584 N/A TRP 118.A N GLU 115.A O no hydrogen 3.299 N/A ASN 120.A ND2 GLN 99.A O no hydrogen 3.119 N/A ASN 120.A ND2 SER 101.A OG no hydrogen 3.050 N/A LEU 121.A N TRP 118.A O no hydrogen 2.945 N/A LYS 123.A N ASN 120.A O no hydrogen 3.025 N/A LYS 123.A NZ ASN 120.A OD1 no hydrogen 2.688 N/A SER 124.A N GLU 127.A OE2 no hydrogen 2.926 N/A GLN 125.A NE2 ARG 181.A O no hydrogen 3.010 N/A GLU 127.A N SER 124.A OG no hydrogen 2.995 N/A ALA 128.A N SER 124.A O no hydrogen 2.787 N/A LEU 129.A N GLN 125.A O no hydrogen 2.994 N/A ALA 130.A N HIS 126.A O no hydrogen 3.020 N/A ALA 130.A N GLU 127.A O no hydrogen 2.794 N/A ASP 131.A N GLU 127.A O no hydrogen 2.944 N/A GLU 132.A N ALA 128.A O no hydrogen 3.198 N/A ARG 133.A N LEU 129.A O no hydrogen 3.147 N/A HIS 134.A N ALA 130.A O no hydrogen 3.186 N/A ARG 135.A N ASP 131.A O no hydrogen 3.105 N/A ARG 135.A NH1 ASP 131.A OD1 no hydrogen 3.203 N/A ARG 135.A NH1 ASP 131.A OD2 no hydrogen 2.353 N/A LEU 136.A N GLU 132.A O no hydrogen 3.085 N/A LEU 136.A N ARG 133.A O no hydrogen 3.233 N/A HIS 137.A N ARG 133.A O no hydrogen 2.890 N/A ALA 138.A N HIS 134.A O no hydrogen 3.106 N/A LEU 140.A N HIS 137.A O no hydrogen 3.318 N/A HIS 141.A N VAL 163.A O no hydrogen 2.735 N/A LYS 142.A N ALA 139.A O no hydrogen 3.402 N/A VAL 144.A N ARG 161.A O no hydrogen 2.743 N/A TYR 145.A OH GLY 157.A O no hydrogen 2.596 N/A ILE 146.A N GLU 159.A O no hydrogen 3.082 N/A ALA 147.A N TRP 21.A O no hydrogen 3.142 N/A GLY 150.A N LEU 154.A O no hydrogen 2.970 N/A GLU 159.A N ILE 146.A O no hydrogen 3.006 N/A ARG 161.A N VAL 144.A O no hydrogen 3.225 N/A ARG 161.A NE ASP 106.A OD2 no hydrogen 2.314 N/A ARG 162.A NE HIS 141.A O no hydrogen 3.294 N/A VAL 163.A N LYS 142.A O no hydrogen 2.941 N/A GLN 164.A N ASP 106.A OD1 no hydrogen 2.812 N/A LYS 165.A N ASP 106.A OD1 no hydrogen 2.976 N/A LYS 165.A NZ GLN 167.A OE1 no hydrogen 3.293 N/A GLN 167.A N TYR 104.A O no hydrogen 2.609 N/A THR 168.A N GLU 171.A OE1 no hydrogen 3.385 N/A VAL 172.A N THR 168.A O no hydrogen 2.999 N/A ALA 173.A N GLU 169.A O no hydrogen 2.911 N/A GLU 174.A N GLN 170.A O no hydrogen 3.016 N/A ALA 175.A N GLU 171.A O no hydrogen 3.317 N/A ALA 175.A N VAL 172.A O no hydrogen 3.222 N/A ALA 176.A N ALA 173.A O no hydrogen 2.794 N/A GLY 177.A N GLU 174.A O no hydrogen 3.377 N/A ARG 178.A N ILE 92.A O no hydrogen 2.879 N/A ARG 178.A NH1 TYR 93.A OH no hydrogen 3.207 N/A TYR 179.A OH ASP 96.A OD2 no hydrogen 2.504 N/A PHE 180.A N ASP 94.A O no hydrogen 2.969 N/A ARG 181.A NE ARG 98.A O no hydrogen 2.738 N/A ARG 181.A NH1 GLU 132.A OE1 no hydrogen 3.284 N/A ARG 181.A NH1 GLU 132.A OE2 no hydrogen 2.853 N/A ARG 181.A NH1 TYR 179.A OH no hydrogen 3.385 N/A ARG 181.A NH2 ARG 98.A O no hydrogen 2.652 N/A ARG 181.A NH2 GLU 132.A OE1 no hydrogen 3.076 N/A ILE 182.A N ASP 96.A O no hydrogen 2.810 N/A ALA 183.A N GLN 125.A OE1 no hydrogen 2.803 N/A ALA 184.A N LEU 97.A O no hydrogen 3.231 N/A THR 185.A OG1 GLN 99.A OE1 no hydrogen 2.387 N/A HIS 187.A NE2 ARG 116.A O no hydrogen 2.923 N/A THR 191.A N ASN 194.A OD1 no hydrogen 3.243 N/A THR 191.A OG1 GLU 193.A OE1 no hydrogen 3.499 N/A ASN 194.A N THR 191.A OG1 no hydrogen 2.969 N/A ASN 194.A ND2 ALA 183.A O no hydrogen 3.029 N/A ILE 195.A N THR 191.A O no hydrogen 3.050 N/A ASP 196.A N PRO 192.A O no hydrogen 2.895 N/A ARG 197.A N GLU 193.A O no hydrogen 2.984 N/A ARG 197.A NE ARG 181.A O no hydrogen 3.136 N/A ARG 197.A NH2 ARG 181.A O no hydrogen 3.372 N/A PHE 198.A N ASN 194.A O no hydrogen 3.036 N/A LEU 199.A N ILE 195.A O no hydrogen 2.914 N/A ALA 200.A N ASP 196.A O no hydrogen 3.034 N/A PHE 201.A N ARG 197.A O no hydrogen 3.294 N/A TYR 202.A N PHE 198.A O no hydrogen 2.838 N/A ARG 203.A N LEU 199.A O no hydrogen 3.092 N/A THR 204.A N PHE 201.A O no hydrogen 3.033 N/A THR 204.A OG1 PHE 201.A O no hydrogen 3.184 N/A LEU 205.A N TYR 202.A O no hydrogen 3.226 N/A ALA 209.A N PRO 206.A O no hydrogen 2.942 N/A TRP 210.A N PRO 91.A O no hydrogen 3.069 N/A TRP 210.A NE1 SER 67.A OG no hydrogen 3.197 N/A LEU 211.A N HIS 65.A O no hydrogen 3.024 N/A HIS 212.A N TYR 93.A O no hydrogen 2.798 N/A PHE 213.A N SER 67.A O no hydrogen 2.788 N/A HIS 214.A N VAL 95.A O no hydrogen 3.378 N/A CYS 215.A SG GLU 216.A OE2 no hydrogen 3.586 N/A ARG 221.A NH1 GLU 100.A OE1 no hydrogen 3.283 N/A ARG 221.A NH1 GLU 100.A OE2 no hydrogen 2.790 N/A ARG 221.A NH1 ALA 184.A O no hydrogen 2.883 N/A ARG 221.A NH2 GLU 100.A OE1 no hydrogen 2.913 N/A ARG 221.A NH2 GLU 216.A OE2 no hydrogen 3.122 N/A THR 222.A OG1 GLY 218.A O no hydrogen 3.427 N/A THR 223.A N VAL 219.A O no hydrogen 3.074 N/A THR 223.A OG1 VAL 219.A O no hydrogen 2.520 N/A ALA 224.A N GLY 220.A O no hydrogen 2.904 N/A PHE 225.A N ARG 221.A O no hydrogen 3.154 N/A THR 227.A OG1 PHE 225.A O no hydrogen 3.028 N/A LYS 230.A N THR 227.A O no hydrogen 2.883 N/A LYS 230.A NZ ALA 63.A O no hydrogen 3.054 N/A LYS 230.A NZ LEU 64.A O no hydrogen 3.099 N/A ASN 231.A N ASP 228.A O no hydrogen 2.845 N/A VAL 234.A N ASN 231.A O no hydrogen 2.992 N/A SER 235.A OG ASP 238.A OD2 no hydrogen 2.874 N/A ASP 238.A N SER 235.A OG no hydrogen 3.415 N/A ILE 239.A N SER 235.A O no hydrogen 3.002 N/A LEU 240.A N LEU 236.A O no hydrogen 2.930 N/A TYR 241.A N LYS 237.A O no hydrogen 2.822 N/A ARG 242.A N ASP 238.A O no hydrogen 2.809 N/A ARG 242.A NE ASP 228.A OD2 no hydrogen 3.273 N/A ARG 242.A NH1 SER 58.A O no hydrogen 2.811 N/A ARG 242.A NH1 GLU 60.A O no hydrogen 2.764 N/A ARG 242.A NH2 GLU 60.A O no hydrogen 3.084 N/A ARG 242.A NH2 ASP 228.A OD1 no hydrogen 2.602 N/A ARG 242.A NH2 ASP 228.A OD2 no hydrogen 3.374 N/A GLN 243.A N ILE 239.A O no hydrogen 2.904 N/A GLN 243.A NE2 ASP 228.A OD2 no hydrogen 2.999 N/A GLU 245.A N TYR 241.A O no hydrogen 2.923 N/A GLY 247.A N HIS 244.A O no hydrogen 3.017 N/A GLY 248.A N GLN 243.A O no hydrogen 3.038 N/A PHE 249.A N THR 223.A OG1 no hydrogen 3.304 N/A TYR 251.A OH GLY 220.A O no hydrogen 2.727 N/A LYS 257.A NZ HIS 50.A NE2 no hydrogen 3.465 N/A THR 258.A OG1 LYS 259.A O no hydrogen 3.410 N/A ASP 262.A N LYS 259.A O no hydrogen 3.091 N/A SER 263.A N ASP 260.A O no hydrogen 3.406 N/A SER 263.A OG ASP 260.A O no hydrogen 2.741 N/A LYS 265.A N ASP 262.A O no hydrogen 2.776 N/A THR 266.A N SER 263.A O no hydrogen 3.303 N/A THR 266.A OG1 SER 263.A O no hydrogen 3.345 N/A LYS 267.A NZ TRP 264.A O no hydrogen 3.318 N/A TYR 268.A OH GLU 11.A OE2 no hydrogen 2.679 N/A TYR 269.A N LYS 265.A O no hydrogen 3.002 N/A TYR 269.A N THR 266.A O no hydrogen 2.811 N/A ARG 270.A N THR 266.A O no hydrogen 2.970 N/A GLU 271.A N LYS 267.A O no hydrogen 2.874 N/A LYS 272.A N TYR 268.A O no hydrogen 3.089 N/A ILE 273.A N TYR 269.A O no hydrogen 3.198 N/A VAL 274.A N ARG 270.A O no hydrogen 3.291 N/A GLN 277.A N VAL 274.A O no hydrogen 3.182 N/A TYR 279.A N ILE 275.A O no hydrogen 3.169 N/A TYR 279.A OH VAL 234.A O no hydrogen 2.962 N/A ARG 280.A N GLU 276.A O no hydrogen 2.979 N/A TYR 281.A N GLN 277.A O no hydrogen 2.892 N/A TYR 281.A OH THR 292.A O no hydrogen 2.890 N/A VAL 282.A N PHE 278.A O no hydrogen 2.813 N/A GLN 283.A N TYR 279.A O no hydrogen 2.902 N/A GLU 284.A N ARG 280.A O no hydrogen 2.990 N/A ASN 285.A N VAL 282.A O no hydrogen 3.370 N/A TYR 290.A N ASN 285.A O no hydrogen 3.169 N/A TYR 290.A OH LEU 229.A O no hydrogen 3.086 N/A GLN 291.A NE2 GLY 289.A O no hydrogen 2.828 N/A SER 295.A N ASP 196.A OD1 no hydrogen 2.814 N/A SER 295.A OG ASP 196.A OD2 no hydrogen 2.446 N/A TRP 297.A N PRO 293.A O no hydrogen 3.028 N/A LEU 298.A N TRP 294.A O no hydrogen 2.685 N/A LYS 299.A N SER 295.A O no hydrogen 3.222 N/A LYS 299.A NZ SER 295.A O no hydrogen 3.358 N/A SER 300.A N TRP 297.A O no hydrogen 3.139 N/A SER 300.A OG HIS 301.A ND1 no hydrogen 3.391 N/A HIS 301.A N LEU 298.A O no hydrogen 3.268 N/A HIS 301.A ND1 TRP 297.A O no hydrogen 3.132 N/A