Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q97_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 7.A N LEU 17.A O no hydrogen 3.081 N/A GLU 8.A N PHE 5.A O no hydrogen 3.012 N/A TYR 10.A N TYR 15.A O no hydrogen 2.763 N/A TYR 10.A OH GLU 8.A OE1 no hydrogen 2.666 N/A LYS 11.A NZ ASP 87.A OD2 no hydrogen 3.142 N/A ARG 14.A N TYR 10.A O no hydrogen 2.828 N/A ARG 14.A N LYS 11.A O no hydrogen 3.125 N/A ARG 14.A NE ASP 34.A OD1 no hydrogen 3.148 N/A ARG 14.A NE ASP 34.A OD2 no hydrogen 3.443 N/A ARG 14.A NH2 ASP 34.A OD2 no hydrogen 3.072 N/A TYR 15.A N TYR 10.A O no hydrogen 3.118 N/A TYR 15.A OH ASP 87.A OD2 no hydrogen 2.864 N/A ILE 16.A N LYS 33.A O no hydrogen 3.041 N/A LEU 17.A N GLU 8.A O no hydrogen 3.354 N/A VAL 18.A N LEU 31.A O no hydrogen 2.798 N/A LEU 21.A N VAL 29.A O no hydrogen 2.638 N/A GLY 22.A N VAL 29.A O no hydrogen 3.050 N/A GLY 24.A N SER 27.A O no hydrogen 2.894 N/A THR 28.A N ILE 45.A O no hydrogen 3.004 N/A VAL 29.A N GLY 22.A O no hydrogen 2.786 N/A TRP 30.A N MET 43.A O no hydrogen 2.807 N/A LEU 31.A N ARG 19.A O no hydrogen 2.797 N/A ALA 32.A N VAL 41.A O no hydrogen 2.854 N/A LYS 33.A N ILE 16.A O no hydrogen 2.865 N/A LYS 33.A NZ ASN 38.A OD1 no hydrogen 3.439 N/A ASP 34.A N THR 39.A O no hydrogen 2.665 N/A MET 35.A N ARG 14.A O no hydrogen 2.672 N/A VAL 36.A N ASP 34.A OD1 no hydrogen 2.879 N/A ASN 37.A N ASP 34.A OD1 no hydrogen 3.241 N/A THR 39.A N ASP 34.A O no hydrogen 3.335 N/A VAL 41.A N ALA 32.A O no hydrogen 2.949 N/A ALA 42.A N PHE 103.A O no hydrogen 2.876 N/A MET 43.A N TRP 30.A O no hydrogen 2.687 N/A LYS 44.A N MET 101.A O no hydrogen 2.608 N/A LYS 44.A NZ GLU 59.A OE1 no hydrogen 3.387 N/A LYS 44.A NZ GLU 59.A OE2 no hydrogen 2.910 N/A LYS 44.A NZ ASP 175.A OD1 no hydrogen 3.506 N/A ILE 45.A N THR 28.A O no hydrogen 2.785 N/A VAL 46.A N VAL 99.A O no hydrogen 2.789 N/A ARG 47.A N PHE 26.A O no hydrogen 2.961 N/A VAL 51.A N ASP 49.A OD1 no hydrogen 2.659 N/A TYR 52.A N ASP 49.A OD1 no hydrogen 3.476 N/A THR 53.A N ASP 49.A O no hydrogen 2.791 N/A THR 53.A OG1 ASP 49.A O no hydrogen 3.029 N/A GLU 54.A N LYS 50.A O no hydrogen 3.109 N/A ALA 55.A N VAL 51.A O no hydrogen 2.955 N/A ALA 56.A N TYR 52.A O no hydrogen 2.792 N/A GLU 57.A N THR 53.A O no hydrogen 2.762 N/A ASP 58.A N GLU 54.A O no hydrogen 3.138 N/A GLU 59.A N ALA 55.A O no hydrogen 3.279 N/A ILE 60.A N ALA 56.A O no hydrogen 2.918 N/A LYS 61.A N GLU 57.A O no hydrogen 3.214 N/A LEU 62.A N ASP 58.A O no hydrogen 3.015 N/A LEU 63.A N GLU 59.A O no hydrogen 2.949 N/A GLN 64.A N ILE 60.A O no hydrogen 2.910 N/A ARG 65.A N LYS 61.A O no hydrogen 2.835 N/A ARG 65.A NE CYS 145.A O no hydrogen 3.241 N/A VAL 66.A N LEU 62.A O no hydrogen 3.038 N/A ASN 67.A N LEU 63.A O no hydrogen 3.159 N/A ASN 67.A ND2 LEU 85.A O no hydrogen 3.273 N/A ASP 68.A N GLN 64.A O no hydrogen 2.787 N/A ALA 69.A N ARG 65.A O no hydrogen 2.898 N/A ASP 70.A N ASN 67.A O no hydrogen 3.469 N/A ASN 71.A N ASP 75.A OD2 no hydrogen 3.213 N/A THR 72.A N ASP 75.A OD2 no hydrogen 2.888 N/A ASP 75.A N THR 72.A OG1 no hydrogen 2.921 N/A SER 76.A N THR 72.A O no hydrogen 3.129 N/A MET 77.A N GLU 74.A O no hydrogen 2.861 N/A GLY 78.A N ASP 75.A O no hydrogen 2.755 N/A ALA 79.A N ASP 75.A O no hydrogen 2.873 N/A ASN 80.A N SER 76.A O no hydrogen 3.045 N/A HIS 81.A N GLY 78.A O no hydrogen 2.901 N/A ILE 82.A N ALA 79.A O no hydrogen 2.969 N/A LEU 83.A N ILE 173.A O no hydrogen 2.855 N/A LYS 84.A NZ ASP 70.A OD2 no hydrogen 2.992 N/A LEU 86.A N VAL 102.A O no hydrogen 2.596 N/A ASP 87.A N VAL 102.A O no hydrogen 3.336 N/A PHE 89.A N VAL 100.A O no hydrogen 3.056 N/A HIS 91.A N HIS 98.A O no hydrogen 2.767 N/A GLY 93.A N GLY 96.A O no hydrogen 2.671 N/A ASN 95.A ND2 HIS 98.A NE2 no hydrogen 2.792 N/A GLY 96.A N GLY 93.A O no hydrogen 3.074 N/A HIS 98.A N HIS 91.A O no hydrogen 2.823 N/A HIS 98.A ND1 VAL 46.A O no hydrogen 2.992 N/A VAL 100.A N PHE 89.A O no hydrogen 2.844 N/A MET 101.A N LYS 44.A O no hydrogen 2.786 N/A VAL 102.A N ASP 87.A O no hydrogen 2.645 N/A PHE 103.A N ALA 42.A O no hydrogen 2.844 N/A LEU 110.A N VAL 157.A O no hydrogen 2.985 N/A LEU 111.A N ASN 109.A OD1 no hydrogen 3.023 N/A ALA 112.A N ASN 109.A O no hydrogen 3.111 N/A ALA 112.A N ASN 109.A OD1 no hydrogen 3.419 N/A ILE 114.A N LEU 110.A O no hydrogen 2.839 N/A LYS 115.A N LEU 111.A O no hydrogen 2.955 N/A LYS 116.A N ALA 112.A O no hydrogen 2.801 N/A TYR 117.A N ILE 114.A O no hydrogen 3.338 N/A GLU 118.A N LYS 115.A O no hydrogen 2.846 N/A ARG 120.A N TYR 117.A O no hydrogen 2.865 N/A ILE 122.A N LEU 222.A O no hydrogen 2.949 N/A TYR 126.A N PRO 123.A O no hydrogen 2.909 N/A TYR 126.A OH ASN 167.A OD1 no hydrogen 3.287 N/A VAL 127.A N PRO 123.A O no hydrogen 2.983 N/A LYS 128.A N LEU 124.A O no hydrogen 2.756 N/A LYS 128.A NZ TRP 319.A O no hydrogen 2.684 N/A LYS 128.A NZ ASP 322.A OD1 no hydrogen 2.474 N/A LYS 128.A NZ ASP 322.A OD2 no hydrogen 3.329 N/A ILE 130.A N TYR 126.A O no hydrogen 2.916 N/A SER 131.A N VAL 127.A O no hydrogen 2.812 N/A SER 131.A OG VAL 127.A O no hydrogen 2.769 N/A LYS 132.A N LYS 128.A O no hydrogen 3.036 N/A LYS 132.A NZ LEU 320.A O no hydrogen 2.831 N/A LYS 132.A NZ MET 326.A O no hydrogen 2.977 N/A LYS 132.A NZ GLU 327.A O no hydrogen 3.495 N/A LYS 132.A NZ ILE 329.A O no hydrogen 3.056 N/A GLN 133.A N GLN 129.A O no hydrogen 3.106 N/A GLN 133.A NE2 ILE 169.A O no hydrogen 3.037 N/A LEU 134.A N ILE 130.A O no hydrogen 2.827 N/A LEU 135.A N SER 131.A O no hydrogen 2.955 N/A LEU 136.A N LYS 132.A O no hydrogen 3.084 N/A GLY 137.A N GLN 133.A O no hydrogen 3.066 N/A LEU 138.A N LEU 134.A O no hydrogen 2.959 N/A ASP 139.A N LEU 135.A O no hydrogen 2.891 N/A TYR 140.A N LEU 136.A O no hydrogen 3.107 N/A TYR 140.A OH VAL 66.A O no hydrogen 2.579 N/A MET 141.A N GLY 137.A O no hydrogen 2.886 N/A HIS 142.A N LEU 138.A O no hydrogen 2.803 N/A HIS 142.A ND1 ILE 147.A O no hydrogen 3.196 N/A ARG 143.A N ASP 139.A O no hydrogen 3.018 N/A ARG 143.A NH1 ASP 139.A OD1 no hydrogen 3.124 N/A ARG 143.A NH1 ASP 139.A OD2 no hydrogen 3.166 N/A ARG 143.A NH1 ASP 333.A OD1 no hydrogen 3.493 N/A ARG 143.A NH2 ASP 333.A OD2 no hydrogen 2.487 N/A ARG 144.A N TYR 140.A O no hydrogen 2.988 N/A CYS 145.A N TYR 140.A O no hydrogen 3.122 N/A CYS 145.A N MET 141.A O no hydrogen 3.138 N/A CYS 145.A SG TYR 140.A O no hydrogen 3.780 N/A ILE 147.A N MET 141.A O no hydrogen 3.076 N/A ILE 148.A N CYS 180.A O no hydrogen 3.015 N/A HIS 149.A N ASP 211.A OD2 no hydrogen 2.805 N/A HIS 149.A NE2 ALA 174.A O no hydrogen 2.896 N/A THR 150.A N ASP 211.A OD1 no hydrogen 2.764 N/A THR 150.A OG1 HIS 149.A O no hydrogen 2.488 N/A THR 150.A OG1 ASN 178.A O no hydrogen 2.877 N/A ASP 151.A N HIS 149.A ND1 no hydrogen 3.072 N/A LYS 153.A NZ ASP 151.A OD2 no hydrogen 3.504 N/A LYS 153.A NZ THR 192.A OG1 no hydrogen 3.036 N/A ASN 156.A N LYS 153.A O no hydrogen 3.030 N/A ASN 156.A ND2 ASP 151.A O no hydrogen 2.805 N/A ASN 156.A ND2 ASP 151.A OD2 no hydrogen 3.183 N/A VAL 157.A N PRO 154.A O no hydrogen 2.913 N/A LEU 158.A N LYS 172.A O no hydrogen 2.870 N/A MET 159.A N GLU 108.A O no hydrogen 2.871 N/A GLU 160.A N GLN 170.A O no hydrogen 2.860 N/A VAL 162.A N LEU 168.A O no hydrogen 3.032 N/A ASP 163.A N LEU 168.A O no hydrogen 3.206 N/A ASN 167.A N SER 164.A O no hydrogen 2.710 N/A LEU 168.A N ASP 163.A O no hydrogen 2.754 N/A GLN 170.A N GLU 160.A O no hydrogen 2.888 N/A ILE 171.A N GLN 133.A OE1 no hydrogen 2.928 N/A LYS 172.A N LEU 158.A O no hydrogen 2.770 N/A LYS 172.A NZ ASN 80.A O no hydrogen 2.814 N/A ILE 173.A N HIS 81.A O no hydrogen 2.660 N/A ALA 174.A N ASN 156.A O no hydrogen 2.860 N/A GLY 177.A N ASP 175.A OD1 no hydrogen 2.726 N/A ALA 179.A N LEU 176.A O no hydrogen 2.998 N/A CYS 180.A N ILE 148.A O no hydrogen 2.985 N/A CYS 180.A SG TRP 181.A O no hydrogen 3.557 N/A CYS 180.A SG HIS 185.A ND1 no hydrogen 3.973 N/A TRP 181.A N GLU 184.A O no hydrogen 3.011 N/A TYR 182.A N GLY 146.A O no hydrogen 3.082 N/A GLU 184.A N TRP 181.A O no hydrogen 3.163 N/A HIS 185.A N GLU 349.A OE2 no hydrogen 2.492 N/A HIS 185.A NE2 TRP 206.A O no hydrogen 2.952 N/A THR 192.A OG1 ASP 151.A OD1 no hydrogen 2.642 N/A ARG 193.A NH2 ASP 231.A OD1 no hydrogen 2.588 N/A TYR 195.A N THR 192.A O no hydrogen 2.814 N/A TYR 195.A OH GLU 221.A OE1 no hydrogen 2.481 N/A ARG 196.A N ARG 193.A O no hydrogen 3.094 N/A ARG 196.A NE ILE 190.A O no hydrogen 3.096 N/A ARG 196.A NE GLN 191.A O no hydrogen 3.189 N/A ARG 196.A NH2 GLN 191.A O no hydrogen 2.686 N/A SER 197.A N GLN 191.A OE1 no hydrogen 2.821 N/A SER 197.A OG GLN 191.A OE1 no hydrogen 3.285 N/A SER 197.A OG GLU 199.A OE1 no hydrogen 2.977 N/A LEU 201.A N SER 197.A O no hydrogen 2.926 N/A LEU 202.A N PRO 198.A O no hydrogen 2.843 N/A LEU 202.A N GLU 199.A O no hydrogen 3.104 N/A GLY 203.A N VAL 200.A O no hydrogen 3.384 N/A ALA 204.A N GLU 199.A O no hydrogen 3.017 N/A TRP 206.A NE1 ASN 188.A OD1 no hydrogen 3.100 N/A CYS 208.A N GLY 345.A O no hydrogen 2.952 N/A CYS 208.A SG PRO 344.A O no hydrogen 3.899 N/A CYS 208.A SG GLY 345.A O no hydrogen 3.803 N/A GLY 209.A N TRP 346.A O no hydrogen 2.995 N/A ALA 210.A N GLY 207.A O no hydrogen 3.143 N/A ASP 211.A N CYS 208.A O no hydrogen 2.993 N/A ILE 212.A N GLY 209.A O no hydrogen 2.995 N/A TRP 213.A N GLY 209.A O no hydrogen 3.320 N/A SER 214.A N ALA 210.A O no hydrogen 3.202 N/A SER 214.A OG TYR 195.A O no hydrogen 2.811 N/A SER 214.A OG ALA 210.A O no hydrogen 3.441 N/A THR 215.A N ASP 211.A O no hydrogen 2.901 N/A THR 215.A OG1 ASP 211.A O no hydrogen 2.911 N/A ALA 216.A N ILE 212.A O no hydrogen 3.051 N/A CYS 217.A N TRP 213.A O no hydrogen 3.204 N/A CYS 217.A SG GLU 194.A O no hydrogen 3.780 N/A CYS 217.A SG TRP 213.A O no hydrogen 3.560 N/A LEU 218.A N SER 214.A O no hydrogen 2.945 N/A ILE 219.A N THR 215.A O no hydrogen 2.821 N/A PHE 220.A N ALA 216.A O no hydrogen 3.047 N/A GLU 221.A N CYS 217.A O no hydrogen 3.163 N/A LEU 222.A N LEU 218.A O no hydrogen 2.903 N/A ILE 223.A N ILE 219.A O no hydrogen 3.065 N/A THR 224.A N PHE 220.A O no hydrogen 2.956 N/A THR 224.A OG1 PHE 220.A O no hydrogen 2.833 N/A GLY 225.A N GLU 221.A O no hydrogen 2.517 N/A ASP 226.A N THR 224.A OG1 no hydrogen 3.127 N/A HIS 234.A N LYS 230.A O no hydrogen 3.040 N/A ILE 235.A N ASP 231.A O no hydrogen 2.854 N/A ALA 236.A N ASP 232.A O no hydrogen 2.997 N/A GLN 237.A N ASP 233.A O no hydrogen 3.062 N/A GLN 237.A N HIS 234.A O no hydrogen 3.138 N/A ILE 238.A N HIS 234.A O no hydrogen 3.179 N/A ILE 239.A N ILE 235.A O no hydrogen 3.036 N/A GLU 240.A N ALA 236.A O no hydrogen 2.914 N/A LEU 241.A N GLN 237.A O no hydrogen 3.013 N/A LEU 242.A N ILE 238.A O no hydrogen 2.817 N/A GLY 243.A N ILE 239.A O no hydrogen 2.561 N/A LEU 249.A N PRO 246.A O no hydrogen 3.004 N/A LEU 250.A N PRO 246.A O no hydrogen 3.500 N/A ARG 251.A N SER 247.A O no hydrogen 2.691 N/A ASN 252.A N TYR 248.A O no hydrogen 3.111 N/A ASN 252.A N LEU 249.A O no hydrogen 3.241 N/A GLY 253.A N LEU 250.A O no hydrogen 3.335 N/A LYS 254.A N GLY 203.A O no hydrogen 3.411 N/A TYR 255.A N LEU 202.A O no hydrogen 2.980 N/A THR 256.A OG1 LEU 250.A O no hydrogen 2.773 N/A THR 256.A OG1 GLY 253.A O no hydrogen 3.139 N/A THR 258.A N TYR 255.A O no hydrogen 2.908 N/A THR 258.A OG1 TYR 255.A O no hydrogen 2.960 N/A PHE 259.A N THR 256.A O no hydrogen 3.251 N/A PHE 260.A N THR 256.A O no hydrogen 2.851 N/A ASN 261.A N LEU 263.A O no hydrogen 3.039 N/A ASN 261.A ND2 LEU 263.A O no hydrogen 3.606 N/A SER 262.A OG ASN 261.A OD1 no hydrogen 3.190 N/A ARG 265.A N PHE 259.A O no hydrogen 3.155 N/A TRP 273.A N GLU 240.A O no hydrogen 2.765 N/A TRP 273.A NE1 GLU 281.A OE1 no hydrogen 3.226 N/A ASP 277.A N PRO 274.A O no hydrogen 3.015 N/A VAL 278.A N PRO 274.A O no hydrogen 3.104 N/A LEU 279.A N LEU 275.A O no hydrogen 3.083 N/A THR 280.A N GLU 276.A O no hydrogen 3.088 N/A THR 280.A OG1 GLU 276.A O no hydrogen 3.179 N/A THR 280.A OG1 ASP 277.A O no hydrogen 3.173 N/A GLU 281.A N ASP 277.A O no hydrogen 2.738 N/A LYS 282.A N VAL 278.A O no hydrogen 2.699 N/A LYS 282.A NZ TYR 283.A OH no hydrogen 3.458 N/A TYR 283.A N VAL 278.A O no hydrogen 3.339 N/A TYR 283.A OH ASP 226.A OD2 no hydrogen 2.888 N/A LYS 284.A NZ GLU 281.A O no hydrogen 2.866 N/A PHE 285.A N LEU 279.A O no hydrogen 3.019 N/A ALA 290.A N SER 286.A O no hydrogen 2.880 N/A LYS 291.A N LYS 287.A O no hydrogen 2.969 N/A LYS 291.A NZ GLU 276.A OE1 no hydrogen 3.379 N/A LYS 291.A NZ GLU 276.A OE2 no hydrogen 3.315 N/A GLU 292.A N ASP 288.A O no hydrogen 2.919 N/A ILE 293.A N GLU 289.A O no hydrogen 2.889 N/A SER 294.A N ALA 290.A O no hydrogen 2.963 N/A SER 294.A OG SER 298.A OG no hydrogen 3.035 N/A ASP 295.A N LYS 291.A O no hydrogen 2.872 N/A PHE 296.A N GLU 292.A O no hydrogen 3.112 N/A LEU 297.A N ILE 293.A O no hydrogen 2.981 N/A SER 298.A N SER 294.A O no hydrogen 2.762 N/A SER 298.A OG SER 294.A O no hydrogen 2.604 N/A SER 298.A OG SER 294.A OG no hydrogen 3.035 N/A MET 300.A N LEU 297.A O no hydrogen 2.819 N/A LEU 301.A N LEU 297.A O no hydrogen 2.974 N/A LEU 301.A N SER 298.A O no hydrogen 2.862 N/A ARG 306.A N ASP 304.A OD1 no hydrogen 2.885 N/A ARG 306.A NE ASP 304.A OD1 no hydrogen 3.067 N/A ARG 306.A NH2 ASP 304.A OD2 no hydrogen 3.020 N/A LYS 307.A N ASP 304.A O no hydrogen 2.726 N/A ARG 308.A N ASP 304.A O no hydrogen 3.177 N/A ARG 308.A NE GLN 302.A O no hydrogen 3.100 N/A ARG 308.A NH1 GLU 199.A OE1 no hydrogen 2.833 N/A ARG 308.A NH1 GLY 209.A O no hydrogen 3.120 N/A ARG 308.A NH2 GLU 199.A OE2 no hydrogen 2.764 N/A ARG 308.A NH2 GLN 302.A O no hydrogen 3.016 N/A ALA 309.A N PRO 299.A O no hydrogen 3.233 N/A ASP 310.A N GLY 338.A O no hydrogen 3.383 N/A GLY 313.A N ASP 310.A OD2 no hydrogen 3.170 N/A LEU 314.A N ASP 310.A O no hydrogen 3.249 N/A VAL 315.A N ALA 311.A O no hydrogen 3.078 N/A VAL 315.A N GLY 312.A O no hydrogen 3.250 N/A ASN 316.A N GLY 313.A O no hydrogen 3.094 N/A ASN 316.A ND2 VAL 331.A O no hydrogen 2.898 N/A HIS 317.A N LEU 314.A O no hydrogen 3.116 N/A TRP 319.A N HIS 317.A ND1 no hydrogen 2.927 N/A LEU 320.A N HIS 317.A O no hydrogen 3.082 N/A LYS 321.A N PRO 318.A O no hydrogen 3.023 N/A LYS 321.A NZ GLU 328.A OE2 no hydrogen 2.607 N/A THR 323.A N LEU 320.A O no hydrogen 3.422 N/A THR 323.A OG1 LEU 320.A O no hydrogen 2.803 N/A MET 326.A N THR 323.A O no hydrogen 3.228 N/A GLU 327.A N GLU 327.A OE1 no hydrogen 2.640 N/A ILE 329.A N MET 326.A O no hydrogen 3.055 N/A VAL 331.A N ASN 316.A OD1 no hydrogen 2.794 N/A ARG 334.A NE ASP 310.A OD2 no hydrogen 2.841 N/A ARG 334.A NH1 ASP 342.A OD1 no hydrogen 3.499 N/A ARG 334.A NH1 ASP 342.A OD2 no hydrogen 2.766 N/A ARG 334.A NH2 ASP 310.A OD1 no hydrogen 3.005 N/A ARG 334.A NH2 ASP 342.A OD1 no hydrogen 2.954 N/A TYR 337.A OH HIS 317.A NE2 no hydrogen 3.151 N/A GLY 338.A N GLU 335.A O no hydrogen 3.009 N/A SER 339.A OG ARG 306.A O no hydrogen 2.714 N/A GLY 340.A N ARG 308.A O no hydrogen 3.050 N/A SER 341.A N SER 339.A OG no hydrogen 3.075 N/A SER 341.A OG SER 339.A OG no hydrogen 3.400 N/A ILE 343.A N GLY 340.A O no hydrogen 2.705 N/A TRP 346.A N ILE 343.A O no hydrogen 3.020 N/A VAL 350.A N TYR 182.A O no hydrogen 3.015 N/A