Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q58_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 ASP 2.A OD1 no hydrogen 3.455 N/A ASN 8.A N ASP 5.A O no hydrogen 2.899 N/A TYR 9.A N PHE 6.A O no hydrogen 2.887 N/A TYR 10.A OH ASP 43.A OD1 no hydrogen 2.943 N/A LYS 12.A N TYR 9.A O no hydrogen 2.958 N/A PHE 13.A N TYR 9.A O no hydrogen 3.170 N/A PHE 13.A N TYR 10.A O no hydrogen 2.658 N/A LYS 14.A N TYR 10.A O no hydrogen 2.945 N/A LYS 14.A NZ ASP 43.A OD1 no hydrogen 2.586 N/A LYS 14.A NZ ASP 43.A OD2 no hydrogen 2.754 N/A VAL 15.A N ASP 11.A O no hydrogen 2.983 N/A ILE 16.A N LYS 12.A O no hydrogen 2.864 N/A TYR 18.A N LYS 14.A O no hydrogen 2.470 N/A ASN 19.A N VAL 15.A O no hydrogen 2.732 N/A VAL 20.A N VAL 17.A O no hydrogen 2.853 N/A LEU 21.A N TYR 18.A O no hydrogen 3.081 N/A GLU 36.A N PRO 33.A O no hydrogen 3.028 N/A TYR 37.A N PRO 33.A O no hydrogen 2.767 N/A TYR 37.A OH ASP 120.A OD2 no hydrogen 3.034 N/A TYR 38.A N VAL 34.A O no hydrogen 3.248 N/A TYR 38.A OH ASP 120.A OD1 no hydrogen 2.909 N/A ASN 40.A N GLU 36.A O no hydrogen 3.065 N/A CYS 41.A N TYR 37.A O no hydrogen 2.868 N/A ILE 42.A N TYR 38.A O no hydrogen 3.273 N/A ASP 43.A N LEU 39.A O no hydrogen 2.950 N/A TYR 44.A N ASN 40.A O no hydrogen 3.030 N/A TYR 44.A OH PRO 106.A O no hydrogen 3.384 N/A ASN 45.A N CYS 41.A O no hydrogen 2.929 N/A HIS 51.A N GLY 49.A O no hydrogen 2.581 N/A ARG 53.A NH2 TYR 192.A OH no hydrogen 2.988 N/A ARG 53.A NH2 THR 193.A OG1 no hydrogen 3.195 N/A GLY 54.A N GLU 83.A OE2 no hydrogen 3.012 N/A LYS 55.A N HIS 51.A O no hydrogen 3.373 N/A LYS 55.A NZ LYS 50.A O no hydrogen 2.598 N/A ILE 56.A N ILE 52.A O no hydrogen 3.113 N/A LEU 57.A N ARG 53.A O no hydrogen 3.138 N/A VAL 58.A N GLY 54.A O no hydrogen 2.968 N/A LEU 59.A N LYS 55.A O no hydrogen 2.515 N/A SER 61.A N LEU 57.A O no hydrogen 2.769 N/A SER 61.A N VAL 58.A O no hydrogen 3.244 N/A SER 61.A OG LEU 57.A O no hydrogen 2.843 N/A SER 61.A OG GLY 201.A O no hydrogen 2.852 N/A SER 62.A N LEU 59.A O no hydrogen 2.745 N/A LYS 71.A N ASN 69.A O no hydrogen 2.744 N/A SER 74.A N LYS 71.A O no hydrogen 2.787 N/A TYR 76.A N ARG 72.A O no hydrogen 3.419 N/A LEU 77.A N ASP 73.A O no hydrogen 3.102 N/A LEU 78.A N SER 74.A O no hydrogen 3.480 N/A GLY 79.A N ILE 75.A O no hydrogen 2.933 N/A TRP 80.A N TYR 76.A O no hydrogen 2.917 N/A TRP 80.A N LEU 77.A O no hydrogen 3.065 N/A TRP 80.A NE1 PHE 6.A O no hydrogen 2.962 N/A VAL 82.A N LEU 78.A O no hydrogen 2.538 N/A GLU 83.A N GLY 79.A O no hydrogen 3.359 N/A ALA 84.A N TRP 80.A O no hydrogen 3.070 N/A ILE 85.A N VAL 81.A O no hydrogen 2.729 N/A GLN 86.A N VAL 82.A O no hydrogen 2.681 N/A ALA 87.A N GLU 83.A O no hydrogen 2.871 N/A LEU 88.A N ALA 84.A O no hydrogen 3.068 N/A ILE 89.A N ILE 85.A O no hydrogen 3.182 N/A LEU 90.A N GLN 86.A O no hydrogen 3.138 N/A ILE 91.A N ALA 87.A O no hydrogen 2.929 N/A ALA 92.A N LEU 88.A O no hydrogen 3.219 N/A ASP 93.A N ILE 89.A O no hydrogen 2.892 N/A ASP 94.A N LEU 90.A O no hydrogen 2.838 N/A ILE 95.A N ILE 91.A O no hydrogen 3.141 N/A ILE 95.A N ALA 92.A O no hydrogen 2.860 N/A MET 96.A N ALA 92.A O no hydrogen 3.016 N/A ASP 97.A N ASP 93.A O no hydrogen 2.821 N/A SER 98.A N ILE 95.A O no hydrogen 2.817 N/A GLY 99.A N ASP 94.A O no hydrogen 2.844 N/A ARG 102.A N ALA 105.A O no hydrogen 2.956 N/A ARG 102.A NE ASP 94.A OD1 no hydrogen 2.789 N/A ARG 102.A NE ASP 94.A OD2 no hydrogen 2.883 N/A ARG 102.A NH1 ASP 94.A OD1 no hydrogen 3.115 N/A TRP 108.A NE1 ASP 120.A OD2 no hydrogen 2.569 N/A TYR 109.A OH GLY 99.A O no hydrogen 2.499 N/A ILE 110.A N CYS 107.A O no hydrogen 2.847 N/A VAL 111.A N CYS 107.A O no hydrogen 3.069 N/A HIS 112.A N TRP 108.A O no hydrogen 2.860 N/A ASN 116.A ND2 HIS 112.A O no hydrogen 3.375 N/A ALA 117.A N GLY 113.A O no hydrogen 3.195 N/A ILE 118.A N GLN 114.A O no hydrogen 2.996 N/A ASN 119.A N SER 115.A O no hydrogen 3.423 N/A ASP 120.A N ASN 116.A O no hydrogen 2.933 N/A ILE 121.A N ALA 117.A O no hydrogen 3.119 N/A PHE 123.A N ASN 119.A O no hydrogen 3.056 N/A LEU 124.A N ASP 120.A O no hydrogen 2.904 N/A LYS 125.A N ILE 121.A O no hydrogen 2.851 N/A LYS 125.A NZ TYR 151.A OH no hydrogen 2.481 N/A MET 126.A N PHE 122.A O no hydrogen 2.886 N/A LEU 127.A N PHE 123.A O no hydrogen 3.022 N/A SER 128.A N LEU 124.A O no hydrogen 3.050 N/A SER 128.A OG LYS 125.A O no hydrogen 2.565 N/A LEU 129.A N LYS 125.A O no hydrogen 2.822 N/A SER 130.A N MET 126.A O no hydrogen 3.112 N/A SER 130.A OG MET 126.A O no hydrogen 3.516 N/A SER 130.A OG LEU 127.A O no hydrogen 3.442 N/A LEU 131.A N LEU 127.A O no hydrogen 2.702 N/A ILE 132.A N SER 128.A O no hydrogen 2.847 N/A PHE 133.A N SER 130.A O no hydrogen 3.327 N/A GLU 134.A N LEU 131.A O no hydrogen 3.070 N/A SER 136.A OG ASN 141.A OD1 no hydrogen 2.501 N/A SER 137.A N GLU 134.A O no hydrogen 3.110 N/A SER 137.A OG GLU 134.A O no hydrogen 2.858 N/A VAL 138.A N LEU 135.A O no hydrogen 2.440 N/A PHE 139.A N LEU 135.A O no hydrogen 2.874 N/A GLY 140.A N SER 136.A O no hydrogen 3.319 N/A VAL 144.A N ASN 141.A O no hydrogen 3.034 N/A MET 145.A N ASN 141.A O no hydrogen 2.993 N/A LYS 146.A N ASP 142.A O no hydrogen 2.996 N/A GLN 148.A N VAL 144.A O no hydrogen 2.824 N/A LYS 149.A N MET 145.A O no hydrogen 2.990 N/A ILE 150.A N LYS 146.A O no hydrogen 3.234 N/A TYR 151.A N ILE 147.A O no hydrogen 2.967 N/A ASN 152.A N GLN 148.A O no hydrogen 2.827 N/A GLU 153.A N LYS 149.A O no hydrogen 3.160 N/A SER 154.A N ILE 150.A O no hydrogen 3.218 N/A SER 154.A OG ILE 150.A O no hydrogen 2.755 N/A ILE 155.A N TYR 151.A O no hydrogen 3.131 N/A PHE 156.A N ASN 152.A O no hydrogen 2.931 N/A PHE 157.A N GLU 153.A O no hydrogen 2.857 N/A THR 158.A N SER 154.A O no hydrogen 2.890 N/A THR 158.A OG1 SER 154.A O no hydrogen 2.590 N/A VAL 159.A N ILE 155.A O no hydrogen 3.135 N/A VAL 159.A N PHE 156.A O no hydrogen 2.842 N/A LEU 160.A N PHE 156.A O no hydrogen 2.964 N/A GLY 161.A N PHE 157.A O no hydrogen 2.707 N/A GLN 162.A N THR 158.A O no hydrogen 2.743 N/A GLN 162.A NE2 ASP 93.A OD1 no hydrogen 3.358 N/A HIS 163.A N VAL 159.A O no hydrogen 3.087 N/A HIS 163.A N LEU 160.A O no hydrogen 3.028 N/A LEU 164.A N LEU 160.A O no hydrogen 2.993 N/A ASP 165.A N GLY 161.A O no hydrogen 2.981 N/A LEU 166.A N GLN 162.A O no hydrogen 3.204 N/A LEU 166.A N HIS 163.A O no hydrogen 3.005 N/A SER 167.A N HIS 163.A O no hydrogen 2.926 N/A SER 167.A N LEU 164.A O no hydrogen 3.088 N/A SER 167.A OG HIS 163.A O no hydrogen 2.729 N/A ALA 174.A N SER 172.A O no hydrogen 2.814 N/A GLU 179.A N LYS 176.A O no hydrogen 2.506 N/A ARG 180.A N LYS 176.A O no hydrogen 2.804 N/A TYR 181.A N ILE 177.A O no hydrogen 2.944 N/A TYR 181.A OH ASP 233.A OD2 no hydrogen 2.815 N/A PHE 182.A N SER 178.A O no hydrogen 3.302 N/A SER 183.A OG GLU 179.A O no hydrogen 2.878 N/A MET 184.A N ARG 180.A O no hydrogen 3.092 N/A VAL 185.A N TYR 181.A O no hydrogen 2.862 N/A GLU 186.A N PHE 182.A O no hydrogen 2.999 N/A MET 187.A N MET 184.A O no hydrogen 2.518 N/A LYS 188.A N MET 184.A O no hydrogen 2.676 N/A LYS 188.A NZ ASP 165.A OD2 no hydrogen 2.689 N/A SER 190.A N VAL 185.A O no hydrogen 3.319 N/A SER 190.A OG VAL 185.A O no hydrogen 3.137 N/A ARG 191.A NH2 GLU 186.A OE2 no hydrogen 3.245 N/A THR 193.A OG1 THR 189.A O no hydrogen 2.451 N/A PHE 194.A N SER 190.A O no hydrogen 3.085 N/A TYR 195.A N SER 190.A O no hydrogen 3.035 N/A MET 196.A N ARG 191.A O no hydrogen 2.612 N/A VAL 198.A N PHE 194.A O no hydrogen 3.038 N/A PHE 199.A N TYR 195.A O no hydrogen 2.935 N/A PHE 200.A N MET 196.A O no hydrogen 2.755 N/A GLY 201.A N PRO 197.A O no hydrogen 2.767 N/A THR 203.A N PHE 200.A O no hydrogen 2.940 N/A THR 203.A OG1 PHE 199.A O no hydrogen 3.296 N/A LEU 204.A N PHE 200.A O no hydrogen 3.380 N/A SER 205.A N GLY 201.A O no hydrogen 2.791 N/A SER 205.A OG ILE 207.A O no hydrogen 2.891 N/A GLU 206.A N LEU 202.A O no hydrogen 3.005 N/A ILE 207.A N SER 205.A OG no hydrogen 3.150 N/A GLN 213.A N SER 211.A O no hydrogen 2.483 N/A LEU 216.A N GLN 213.A O no hydrogen 3.102 N/A ALA 219.A N LEU 216.A O no hydrogen 2.883 N/A ILE 220.A N LEU 216.A O no hydrogen 3.093 N/A ILE 220.A N ILE 217.A O no hydrogen 3.043 N/A LEU 221.A N ILE 217.A O no hydrogen 2.959 N/A LYS 223.A N ILE 220.A O no hydrogen 2.975 N/A LYS 223.A NZ GLU 226.A OE2 no hydrogen 2.639 N/A LYS 223.A NZ TYR 298.A OH no hydrogen 3.174 N/A LEU 224.A N ILE 220.A O no hydrogen 2.898 N/A GLY 225.A N LEU 221.A O no hydrogen 2.872 N/A GLU 226.A N TYR 222.A O no hydrogen 3.078 N/A PHE 227.A N LYS 223.A O no hydrogen 2.616 N/A TYR 228.A N LEU 224.A O no hydrogen 2.957 N/A GLN 229.A N GLY 225.A O no hydrogen 3.078 N/A GLN 229.A NE2 THR 189.A OG1 no hydrogen 2.955 N/A VAL 230.A N GLU 226.A O no hydrogen 2.765 N/A HIS 231.A N PHE 227.A O no hydrogen 3.169 N/A HIS 231.A N TYR 228.A O no hydrogen 2.491 N/A HIS 231.A ND1 TYR 295.A OH no hydrogen 2.559 N/A ASN 232.A N TYR 228.A O no hydrogen 2.894 N/A ASP 233.A N GLN 229.A O no hydrogen 3.070 N/A SER 235.A N HIS 231.A O no hydrogen 3.090 N/A SER 235.A OG HIS 231.A O no hydrogen 2.689 N/A ASP 236.A N ASP 233.A O no hydrogen 3.264 N/A TYR 237.A N ASP 233.A O no hydrogen 3.365 N/A TYR 237.A OH ASN 292.A OD1 no hydrogen 2.482 N/A LEU 238.A N VAL 234.A O no hydrogen 2.821 N/A ASN 240.A ND2 ASP 236.A OD2 no hydrogen 3.112 N/A ASN 240.A ND2 PHE 239.A O no hydrogen 3.314 N/A ARG 249.A N ASP 245.A O no hydrogen 3.471 N/A LYS 251.A NZ ASP 165.A O no hydrogen 3.173 N/A LYS 251.A NZ ASP 165.A OD1 no hydrogen 2.943 N/A THR 253.A OG1 ASP 246.A OD1 no hydrogen 3.303 N/A THR 253.A OG1 LYS 251.A O no hydrogen 2.264 N/A LEU 256.A N THR 253.A O no hydrogen 3.303 N/A GLN 257.A N THR 253.A O no hydrogen 3.163 N/A GLN 257.A N TRP 254.A O no hydrogen 3.115 N/A LYS 258.A N TRP 254.A O no hydrogen 3.348 N/A PHE 260.A N GLN 257.A O no hydrogen 3.223 N/A LYS 268.A N ASP 264.A O no hydrogen 2.766 N/A LYS 268.A NZ PHE 260.A O no hydrogen 3.224 N/A LEU 269.A N GLU 265.A O no hydrogen 3.303 N/A LYS 270.A N GLU 266.A O no hydrogen 3.370 N/A ILE 271.A N MET 267.A O no hydrogen 3.116 N/A SER 272.A N LYS 268.A O no hydrogen 3.382 N/A SER 272.A OG LEU 269.A O no hydrogen 3.198 N/A GLU 273.A N LYS 270.A O no hydrogen 3.122 N/A ASN 274.A ND2 LYS 270.A O no hydrogen 3.510 N/A TYR 275.A N ILE 271.A O no hydrogen 3.151 N/A TYR 275.A OH LYS 251.A O no hydrogen 2.631 N/A GLY 276.A N ILE 247.A O no hydrogen 2.349 N/A LYS 277.A N ASN 274.A O no hydrogen 3.080 N/A ASN 278.A N ASN 274.A O no hydrogen 2.562 N/A SER 280.A OG ASN 278.A OD1 no hydrogen 2.419 N/A LEU 281.A N ASN 278.A OD1 no hydrogen 2.924 N/A VAL 282.A N ASN 278.A O no hydrogen 3.153 N/A LYS 283.A N SER 279.A O no hydrogen 2.449 N/A ASP 284.A N SER 280.A O no hydrogen 2.597 N/A CYS 285.A N LEU 281.A O no hydrogen 3.205 N/A CYS 285.A SG LEU 281.A O no hydrogen 3.271 N/A TYR 286.A N VAL 282.A O no hydrogen 3.097 N/A ASN 287.A N LYS 283.A O no hydrogen 2.846 N/A LEU 288.A N ASP 284.A O no hydrogen 2.810 N/A LEU 289.A N CYS 285.A O no hydrogen 3.199 N/A LYS 290.A N ASN 287.A O no hydrogen 2.300 N/A ILE 291.A N TYR 286.A O no hydrogen 2.865 N/A GLU 293.A N LYS 290.A O no hydrogen 2.800 N/A HIS 294.A NE2 LEU 289.A O no hydrogen 2.617 N/A TYR 295.A N ILE 291.A O no hydrogen 3.070 N/A TYR 295.A OH HIS 231.A ND1 no hydrogen 2.559 N/A LEU 296.A N ASN 292.A O no hydrogen 3.228 N/A LEU 296.A N GLU 293.A O no hydrogen 2.772 N/A GLU 297.A N HIS 294.A O no hydrogen 2.640 N/A TYR 298.A N HIS 294.A O no hydrogen 2.802 N/A ARG 300.A N GLU 297.A O no hydrogen 3.101 N/A ARG 300.A NE ASP 304.A OD2 no hydrogen 3.417 N/A ALA 302.A N TYR 298.A O no hydrogen 2.758 N/A ASP 304.A N ARG 300.A O no hydrogen 2.576 N/A TYR 305.A N ASN 301.A O no hydrogen 2.691 N/A ILE 307.A N LEU 303.A O no hydrogen 2.798 N/A LYS 308.A N ASP 304.A O no hydrogen 3.063 N/A LEU 309.A N TYR 305.A O no hydrogen 3.349 N/A VAL 310.A N LEU 306.A O no hydrogen 2.878 N/A LYS 311.A N ILE 307.A O no hydrogen 3.301 N/A ASP 312.A N LEU 309.A O no hydrogen 3.296 N/A ILE 313.A N VAL 310.A O no hydrogen 3.034 N/A GLN 319.A N ASP 315.A O no hydrogen 2.332 N/A PHE 322.A N LEU 318.A O no hydrogen 3.441 N/A ILE 323.A N GLN 319.A O no hydrogen 3.125 N/A HIS 324.A N LYS 320.A O no hydrogen 2.604 N/A LEU 325.A N VAL 321.A O no hydrogen 2.549 N/A ILE 326.A N PHE 322.A O no hydrogen 2.625 N/A HIS 327.A N HIS 324.A O no hydrogen 2.920 N/A GLN 328.A N HIS 324.A O no hydrogen 3.106 N/A ILE 329.A N LEU 325.A O no hydrogen 3.112 N/A SER 330.A N ILE 326.A O no hydrogen 3.321 N/A GLU 331.A N HIS 327.A O no hydrogen 3.009 N/A LEU 332.A N GLN 328.A O no hydrogen 2.530 N/A ILE 333.A N ILE 329.A O no hydrogen 2.732 N/A THR 334.A N SER 330.A O no hydrogen 2.497 N/A THR 334.A OG1 SER 330.A O no hydrogen 3.028 N/A