Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pwx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 280.A O no hydrogen 2.680 N/A SER 7.A OG PRO 6.A O no hydrogen 2.414 N/A SER 7.A OG SER 7.A O no hydrogen 2.501 N/A VAL 10.A N SER 7.A O no hydrogen 3.038 N/A GLU 11.A N SER 7.A O no hydrogen 3.422 N/A GLY 12.A N ALA 8.A O no hydrogen 3.221 N/A CYS 13.A N VAL 10.A O no hydrogen 2.925 N/A CYS 13.A SG LYS 9.A O no hydrogen 3.702 N/A VAL 15.A N GLY 26.A O no hydrogen 3.002 N/A GLN 16.A N GLN 66.A O no hydrogen 2.948 N/A VAL 17.A N LEU 24.A O no hydrogen 2.889 N/A THR 18.A N LEU 64.A O no hydrogen 2.877 N/A THR 18.A OG1 THR 23.A OG1 no hydrogen 2.691 N/A CYS 19.A N THR 22.A O no hydrogen 2.964 N/A CYS 19.A SG SER 62.A O no hydrogen 3.605 N/A THR 22.A N CYS 19.A O no hydrogen 3.115 N/A THR 23.A OG1 THR 18.A OG1 no hydrogen 2.691 N/A LEU 24.A N VAL 17.A O no hydrogen 3.090 N/A ASN 25.A N CYS 142.A O no hydrogen 3.043 N/A ASN 25.A ND2 CYS 142.A O no hydrogen 3.048 N/A GLY 26.A N VAL 15.A O no hydrogen 2.644 N/A LEU 27.A N TYR 34.A O no hydrogen 2.728 N/A TRP 28.A N CYS 13.A O no hydrogen 2.666 N/A LEU 29.A N THR 32.A O no hydrogen 2.969 N/A ASP 30.A N THR 95.A OG1 no hydrogen 3.166 N/A THR 32.A N LEU 29.A O no hydrogen 2.925 N/A VAL 33.A N LEU 86.A O no hydrogen 2.870 N/A TYR 34.A N LEU 27.A O no hydrogen 2.794 N/A CYS 35.A N LEU 84.A O no hydrogen 3.303 N/A CYS 35.A SG PRO 36.A O no hydrogen 3.546 N/A ARG 37.A N CYS 82.A O no hydrogen 3.172 N/A ARG 37.A NE ASP 183.A OD2 no hydrogen 2.639 N/A ARG 37.A NH2 ASP 183.A OD1 no hydrogen 3.113 N/A VAL 39.A N PRO 36.A O no hydrogen 3.324 N/A ILE 40.A N ARG 37.A O no hydrogen 3.266 N/A CYS 41.A N HIS 38.A O no hydrogen 2.733 N/A CYS 41.A SG TYR 51.A OH no hydrogen 3.685 N/A THR 42.A N ASP 45.A OD2 no hydrogen 2.477 N/A THR 42.A OG1 ASP 45.A OD2 no hydrogen 2.547 N/A ASP 45.A N THR 42.A OG1 no hydrogen 3.057 N/A MET 46.A N THR 42.A O no hydrogen 3.261 N/A LEU 47.A N GLU 44.A O no hydrogen 3.128 N/A ASN 48.A N ASP 45.A O no hydrogen 3.165 N/A TYR 51.A OH ASP 183.A O no hydrogen 2.512 N/A GLU 52.A N GLU 52.A OE2 no hydrogen 2.901 N/A ASP 53.A N ASN 50.A OD1 no hydrogen 2.939 N/A LEU 54.A N ASN 50.A O no hydrogen 3.075 N/A LEU 55.A N TYR 51.A O no hydrogen 2.889 N/A ILE 56.A N GLU 52.A O no hydrogen 3.287 N/A ARG 57.A N ASP 53.A O no hydrogen 3.164 N/A LYS 58.A N LEU 55.A O no hydrogen 2.974 N/A SER 59.A N SER 62.A OG no hydrogen 3.013 N/A SER 62.A N SER 59.A O no hydrogen 2.823 N/A SER 62.A OG SER 59.A O no hydrogen 3.120 N/A PHE 63.A N ASN 60.A O no hydrogen 3.399 N/A LEU 64.A N THR 18.A O no hydrogen 3.002 N/A GLN 66.A N GLN 16.A O no hydrogen 2.879 N/A ALA 67.A N VAL 70.A O no hydrogen 2.634 N/A VAL 70.A N ALA 67.A O no hydrogen 3.154 N/A LEU 72.A N VAL 65.A O no hydrogen 2.814 N/A ILE 75.A N LYS 87.A O no hydrogen 2.568 N/A HIS 77.A ND1 ASN 60.A OD1 no hydrogen 2.513 N/A SER 78.A N ARG 85.A O no hydrogen 3.052 N/A GLN 80.A N LEU 83.A O no hydrogen 2.851 N/A GLN 80.A NE2 GLU 174.A O no hydrogen 3.605 N/A ASN 81.A ND2 GLU 174.A O no hydrogen 2.852 N/A CYS 82.A N GLY 175.A O no hydrogen 2.866 N/A CYS 82.A SG ASP 183.A OD1 no hydrogen 3.669 N/A LEU 83.A N GLN 80.A O no hydrogen 2.777 N/A LEU 84.A N CYS 35.A O no hydrogen 2.729 N/A ARG 85.A N SER 78.A O no hydrogen 3.073 N/A ARG 85.A NH1 GLN 80.A OE1 no hydrogen 2.849 N/A LEU 86.A N VAL 33.A O no hydrogen 2.963 N/A LYS 87.A N GLY 76.A O no hydrogen 2.930 N/A VAL 88.A N ASP 31.A O no hydrogen 3.105 N/A ASP 89.A N ARG 73.A O no hydrogen 3.026 N/A ASN 92.A N ASP 30.A O no hydrogen 2.787 N/A ASN 92.A ND2 GLY 12.A O no hydrogen 3.417 N/A ASN 92.A ND2 TRP 28.A O no hydrogen 2.814 N/A LYS 94.A N ASN 92.A OD1 no hydrogen 2.984 N/A LYS 94.A NZ GLY 12.A O no hydrogen 3.267 N/A LYS 94.A NZ ASN 92.A OD1 no hydrogen 3.549 N/A THR 95.A N ASN 92.A O no hydrogen 3.278 N/A THR 95.A OG1 ASN 92.A O no hydrogen 2.563 N/A LYS 97.A NZ TYR 151.A O no hydrogen 3.111 N/A TYR 98.A OH ASP 30.A OD2 no hydrogen 3.286 N/A LYS 99.A N VAL 153.A O no hydrogen 3.062 N/A VAL 101.A N PHE 155.A O no hydrogen 2.814 N/A ARG 102.A NH1 ASP 172.A OD2 no hydrogen 2.603 N/A ARG 102.A NH1 LYS 176.A O no hydrogen 3.197 N/A ARG 102.A NH2 PHE 177.A O no hydrogen 3.159 N/A ILE 103.A N TYR 178.A OH no hydrogen 2.947 N/A GLY 106.A N MET 127.A O no hydrogen 3.181 N/A GLN 107.A N GLN 104.A O no hydrogen 3.360 N/A PHE 109.A N CYS 125.A O no hydrogen 2.744 N/A SER 110.A N PHE 147.A O no hydrogen 2.839 N/A VAL 111.A N TYR 123.A O no hydrogen 2.806 N/A LEU 112.A N VAL 145.A O no hydrogen 3.411 N/A ALA 113.A N GLY 121.A O no hydrogen 3.077 N/A CYS 114.A SG ASN 25.A OD1 no hydrogen 3.655 N/A TYR 115.A N SER 118.A O no hydrogen 2.914 N/A SER 118.A N TYR 115.A O no hydrogen 2.911 N/A SER 120.A N ALA 113.A O no hydrogen 2.653 N/A SER 120.A OG SER 118.A O no hydrogen 3.078 N/A VAL 122.A N PHE 5.A O no hydrogen 3.199 N/A TYR 123.A N VAL 111.A O no hydrogen 2.671 N/A CYS 125.A N PHE 109.A O no hydrogen 2.994 N/A CYS 125.A SG PHE 109.A O no hydrogen 4.018 N/A ARG 128.A N THR 132.A O no hydrogen 2.802 N/A ARG 128.A NH1 GLU 233.A OE2 no hydrogen 3.182 N/A HIS 131.A N ARG 128.A O no hydrogen 2.700 N/A THR 132.A N ASN 130.A OD1 no hydrogen 3.060 N/A THR 132.A OG1 ASN 130.A OD1 no hydrogen 2.815 N/A ILE 133.A N HIS 168.A O no hydrogen 2.832 N/A LYS 134.A NZ ASP 279.A OD2 no hydrogen 3.527 N/A SER 136.A N GLU 280.A OE2 no hydrogen 3.193 N/A SER 136.A OG GLU 280.A OE1 no hydrogen 2.790 N/A LEU 138.A N GLY 135.A O no hydrogen 3.096 N/A ASN 139.A N SER 136.A O no hydrogen 3.049 N/A GLY 140.A N GLU 162.A OE2 no hydrogen 3.036 N/A SER 141.A N LEU 138.A O no hydrogen 3.323 N/A SER 141.A OG LEU 138.A O no hydrogen 3.101 N/A SER 141.A OG SER 141.A O no hydrogen 2.420 N/A SER 141.A OG SER 144.A OG no hydrogen 3.272 N/A CYS 142.A SG HIS 38.A NE2 no hydrogen 3.484 N/A CYS 142.A SG HIS 159.A O no hydrogen 3.970 N/A CYS 142.A SG HIS 160.A O no hydrogen 3.148 N/A GLY 143.A N HIS 159.A O no hydrogen 2.884 N/A SER 144.A N SER 141.A O no hydrogen 3.433 N/A SER 144.A OG LEU 112.A O no hydrogen 3.286 N/A SER 144.A OG SER 141.A O no hydrogen 3.101 N/A SER 144.A OG SER 141.A OG no hydrogen 3.272 N/A GLY 146.A N TYR 157.A O no hydrogen 2.691 N/A PHE 147.A N SER 110.A O no hydrogen 2.786 N/A ASN 148.A N SER 154.A O no hydrogen 2.880 N/A ASN 148.A ND2 THR 108.A O no hydrogen 3.600 N/A ASP 150.A N CYS 152.A O no hydrogen 3.039 N/A CYS 152.A SG LYS 97.A O no hydrogen 3.712 N/A VAL 153.A N LYS 97.A O no hydrogen 2.618 N/A SER 154.A N ASN 148.A O no hydrogen 2.811 N/A SER 154.A OG ASP 150.A OD1 no hydrogen 3.389 N/A PHE 155.A N LYS 99.A O no hydrogen 2.890 N/A CYS 156.A N GLY 146.A O no hydrogen 3.161 N/A TYR 157.A N GLY 146.A O no hydrogen 3.396 N/A MET 158.A N THR 171.A O no hydrogen 2.930 N/A HIS 159.A N SER 144.A O no hydrogen 2.809 N/A HIS 160.A N ALA 169.A O no hydrogen 3.163 N/A MET 161.A N ALA 169.A O no hydrogen 2.898 N/A LEU 163.A N VAL 167.A O no hydrogen 2.665 N/A GLY 166.A N LEU 163.A O no hydrogen 3.156 N/A HIS 168.A N ILE 133.A O no hydrogen 2.779 N/A ALA 169.A N MET 161.A O no hydrogen 2.872 N/A THR 171.A N MET 158.A O no hydrogen 3.003 N/A THR 171.A OG1 ASP 172.A O no hydrogen 3.103 N/A ASP 172.A N LYS 176.A O no hydrogen 3.052 N/A GLU 174.A N ASP 172.A OD1 no hydrogen 2.624 N/A GLY 175.A N ASP 172.A O no hydrogen 2.811 N/A LYS 176.A N ASP 172.A OD1 no hydrogen 3.234 N/A LYS 176.A NZ GLU 174.A OE1 no hydrogen 3.531 N/A TYR 178.A N GLY 170.A O no hydrogen 2.959 N/A TYR 178.A OH CYS 156.A O no hydrogen 2.594 N/A GLN 185.A N MET 46.A O no hydrogen 2.853 N/A THR 192.A N ALA 189.A O no hydrogen 2.778 N/A THR 195.A N ASN 231.A O no hydrogen 2.839 N/A ILE 196.A N ASP 279.A OD1 no hydrogen 3.322 N/A THR 197.A OG1 GLU 233.A O no hydrogen 2.522 N/A ASN 199.A ND2 ASP 279.A O no hydrogen 2.682 N/A VAL 200.A N ILE 196.A O no hydrogen 3.224 N/A LEU 201.A N THR 197.A O no hydrogen 2.950 N/A ALA 202.A N LEU 198.A O no hydrogen 3.048 N/A TRP 203.A N ASN 199.A O no hydrogen 2.816 N/A LEU 204.A N VAL 200.A O no hydrogen 2.970 N/A LEU 204.A N LEU 201.A O no hydrogen 2.900 N/A TYR 205.A N LEU 201.A O no hydrogen 3.077 N/A TYR 205.A OH ILE 252.A O no hydrogen 2.775 N/A ALA 206.A N ALA 202.A O no hydrogen 2.918 N/A ALA 207.A N TRP 203.A O no hydrogen 3.187 N/A VAL 208.A N LEU 204.A O no hydrogen 3.049 N/A ILE 209.A N TYR 205.A O no hydrogen 3.226 N/A ASN 210.A N VAL 208.A O no hydrogen 2.573 N/A ASN 210.A ND2 ALA 206.A O no hydrogen 2.843 N/A GLY 211.A N VAL 208.A O no hydrogen 3.216 N/A ASP 212.A N ALA 207.A O no hydrogen 3.311 N/A LEU 216.A N ARG 213.A O no hydrogen 2.727 N/A THR 218.A OG1 THR 219.A O no hydrogen 3.359 N/A PHE 223.A N THR 219.A O no hydrogen 2.794 N/A ASN 224.A N LEU 220.A O no hydrogen 2.915 N/A ASN 224.A ND2 LEU 235.A O no hydrogen 3.484 N/A LEU 225.A N ASP 222.A O no hydrogen 3.296 N/A ALA 227.A N PHE 223.A O no hydrogen 3.029 N/A MET 228.A N ASN 224.A O no hydrogen 2.720 N/A LYS 229.A N LEU 225.A O no hydrogen 3.208 N/A TYR 230.A N VAL 226.A O no hydrogen 3.150 N/A ASN 231.A N MET 228.A O no hydrogen 3.356 N/A TYR 232.A N ALA 227.A O no hydrogen 2.836 N/A GLU 233.A N THR 195.A O no hydrogen 2.889 N/A LEU 235.A N ASN 224.A OD1 no hydrogen 2.887 N/A GLN 237.A NE2 ASP 241.A OD2 no hydrogen 2.996 N/A HIS 239.A N THR 236.A O no hydrogen 3.093 N/A HIS 239.A N THR 236.A OG1 no hydrogen 3.099 N/A VAL 240.A N THR 236.A O no hydrogen 3.196 N/A ASP 241.A N GLN 237.A O no hydrogen 2.735 N/A ILE 242.A N ASP 238.A O no hydrogen 3.124 N/A LEU 243.A N HIS 239.A O no hydrogen 3.371 N/A GLY 244.A N ASP 241.A O no hydrogen 2.921 N/A SER 247.A N LEU 243.A O no hydrogen 2.803 N/A SER 247.A OG ILE 252.A O no hydrogen 2.801 N/A ALA 248.A N GLY 244.A O no hydrogen 2.783 N/A GLN 249.A N PRO 245.A O no hydrogen 3.349 N/A THR 250.A N LEU 246.A O no hydrogen 3.368 N/A THR 250.A OG1 LEU 246.A O no hydrogen 2.512 N/A THR 250.A OG1 SER 247.A O no hydrogen 3.297 N/A GLY 251.A N SER 247.A O no hydrogen 2.863 N/A ASP 256.A N ALA 253.A O no hydrogen 2.914 N/A MET 257.A N VAL 254.A O no hydrogen 2.610 N/A CYS 258.A N VAL 254.A O no hydrogen 2.919 N/A CYS 258.A SG VAL 254.A O no hydrogen 3.447 N/A ALA 259.A N LEU 255.A O no hydrogen 3.079 N/A LEU 261.A N MET 257.A O no hydrogen 2.699 N/A LYS 262.A N CYS 258.A O no hydrogen 2.571 N/A LYS 262.A NZ THR 218.A OG1 no hydrogen 2.711 N/A LYS 262.A NZ ASP 222.A OD1 no hydrogen 2.651 N/A GLU 263.A N ALA 259.A O no hydrogen 3.254 N/A GLU 263.A N ALA 260.A O no hydrogen 3.216 N/A LEU 264.A N ALA 260.A O no hydrogen 3.163 N/A LEU 265.A N LEU 261.A O no hydrogen 2.818 N/A GLN 266.A N LYS 262.A O no hydrogen 3.044 N/A ASN 267.A N GLU 263.A O no hydrogen 2.549 N/A ASN 267.A ND2 GLU 263.A O no hydrogen 3.330 N/A ILE 271.A N SER 274.A O no hydrogen 2.709 N/A LEU 272.A N ASP 212.A OD2 no hydrogen 3.160 N/A SER 274.A OG ILE 276.A O no hydrogen 2.881 N/A ILE 276.A N SER 274.A OG no hydrogen 3.166 N/A THR 282.A N ASP 285.A OD2 no hydrogen 2.521 N/A ASP 285.A N THR 282.A O no hydrogen 2.996 N/A ASP 285.A N THR 282.A OG1 no hydrogen 3.230 N/A VAL 286.A N THR 282.A O no hydrogen 3.396 N/A VAL 287.A N PRO 283.A O no hydrogen 2.987 N/A ARG 288.A NE ASP 285.A O no hydrogen 3.034 N/A ARG 288.A NH2 LYS 2.A O no hydrogen 3.158 N/A