Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yis_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N ASN 3.A OD1 no hydrogen 2.917 N/A PHE 6.A N ASN 3.A OD1 no hydrogen 2.971 N/A LEU 7.A N ASN 3.A O no hydrogen 3.288 N/A THR 8.A N PRO 4.A O no hydrogen 3.191 N/A THR 8.A OG1 PRO 4.A O no hydrogen 3.406 N/A THR 8.A OG1 HIS 85.A NE2 no hydrogen 3.097 N/A THR 8.A OG1 TYR 89.A O no hydrogen 2.684 N/A GLY 9.A N TRP 5.A O no hydrogen 2.816 N/A PHE 10.A N PHE 6.A O no hydrogen 2.695 N/A SER 11.A N LEU 7.A O no hydrogen 2.913 N/A SER 11.A OG LEU 7.A O no hydrogen 2.669 N/A ASP 12.A N THR 8.A O no hydrogen 2.780 N/A ALA 13.A N GLY 9.A O no hydrogen 3.077 N/A GLU 14.A N PHE 10.A O no hydrogen 2.769 N/A CYS 15.A N SER 11.A O no hydrogen 2.929 N/A CYS 15.A SG SER 11.A O no hydrogen 3.239 N/A SER 18.A N VAL 36.A O no hydrogen 2.842 N/A LEU 20.A N LYS 34.A O no hydrogen 2.785 N/A GLN 22.A N ARG 32.A O no hydrogen 2.860 N/A ASN 24.A N GLY 30.A O no hydrogen 2.865 N/A TYR 27.A N ASN 24.A O no hydrogen 3.138 N/A GLY 30.A N TYR 27.A O no hydrogen 3.034 N/A TRP 31.A N THR 29.A OG1 no hydrogen 3.061 N/A ARG 32.A N GLN 22.A O no hydrogen 2.766 N/A LYS 34.A N LEU 20.A O no hydrogen 2.745 N/A LYS 34.A NZ GLN 22.A OE1 no hydrogen 3.092 N/A VAL 36.A N SER 18.A O no hydrogen 2.905 N/A PHE 37.A N ILE 73.A O no hydrogen 3.069 N/A ALA 38.A N SER 16.A O no hydrogen 3.198 N/A ILE 39.A N PHE 71.A O no hydrogen 3.023 N/A LEU 41.A N ILE 69.A O no hydrogen 2.975 N/A LYS 43.A N ASP 67.A O no hydrogen 2.969 N/A LYS 44.A N HIS 42.A ND1 no hydrogen 3.393 N/A ASP 45.A N HIS 42.A O no hydrogen 3.106 N/A ASN 46.A N LYS 43.A O no hydrogen 3.279 N/A LEU 49.A N ASP 45.A O no hydrogen 3.131 N/A LYS 50.A N ASN 46.A O no hydrogen 2.920 N/A LYS 50.A NZ GLU 47.A OE2 no hydrogen 3.238 N/A ARG 51.A N GLU 47.A O no hydrogen 3.112 N/A ILE 52.A N LEU 48.A O no hydrogen 3.116 N/A GLN 53.A N LEU 49.A O no hydrogen 2.841 N/A GLN 53.A NE2 GLY 59.A O no hydrogen 2.922 N/A SER 54.A N LYS 50.A O no hydrogen 3.086 N/A SER 54.A OG LYS 50.A O no hydrogen 2.989 N/A TYR 55.A N ARG 51.A O no hydrogen 2.911 N/A LEU 56.A N ILE 52.A O no hydrogen 3.051 N/A GLY 57.A N GLN 53.A O no hydrogen 2.831 N/A LYS 60.A N ARG 72.A O no hydrogen 3.130 N/A HIS 62.A N GLN 70.A O no hydrogen 2.857 N/A HIS 64.A N SER 68.A O no hydrogen 2.933 N/A SER 68.A N GLY 65.A O no hydrogen 3.415 N/A ILE 69.A N LEU 41.A O no hydrogen 2.808 N/A GLN 70.A N HIS 62.A O no hydrogen 2.822 N/A PHE 71.A N ILE 39.A O no hydrogen 2.810 N/A ARG 72.A N LYS 60.A O no hydrogen 2.851 N/A ARG 72.A NE ASP 74.A OD2 no hydrogen 3.329 N/A ARG 72.A NH1 GLN 70.A OE1 no hydrogen 2.759 N/A ILE 73.A N PHE 37.A O no hydrogen 2.982 N/A LEU 79.A N SER 75.A O no hydrogen 2.923 N/A GLU 80.A N LYS 77.A O no hydrogen 3.305 N/A VAL 81.A N GLU 78.A O no hydrogen 3.097 N/A ILE 83.A N LEU 79.A O no hydrogen 2.987 N/A ASN 84.A N GLU 80.A O no hydrogen 3.033 N/A HIS 85.A N VAL 81.A O no hydrogen 3.031 N/A HIS 85.A NE2 THR 8.A OG1 no hydrogen 3.097 N/A PHE 86.A N ILE 82.A O no hydrogen 3.288 N/A GLU 87.A N ILE 83.A O no hydrogen 3.009 N/A ASN 88.A N ASN 84.A O no hydrogen 3.254 N/A ASN 88.A N HIS 85.A O no hydrogen 2.881 N/A ASN 88.A ND2 ASN 84.A O no hydrogen 2.905 N/A TYR 89.A N HIS 85.A O no hydrogen 2.840 N/A VAL 92.A N ASP 12.A OD2 no hydrogen 2.774 N/A THR 93.A N ASP 12.A OD1 no hydrogen 2.976 N/A THR 93.A OG1 ASP 12.A OD1 no hydrogen 2.542 N/A ALA 94.A N GLU 204.A OE2 no hydrogen 3.134 N/A LYS 95.A N THR 93.A OG1 no hydrogen 3.423 N/A LYS 95.A NZ CYS 15.A O no hydrogen 2.811 N/A GLN 96.A N THR 93.A O no hydrogen 3.041 N/A GLN 96.A NE2 LEU 91.A O no hydrogen 3.306 N/A ALA 97.A N ALA 94.A O no hydrogen 2.808 N/A TYR 99.A N LYS 95.A O no hydrogen 2.932 N/A TYR 99.A OH GLU 87.A OE1 no hydrogen 2.562 N/A THR 100.A N GLN 96.A O no hydrogen 3.056 N/A THR 100.A OG1 GLN 96.A O no hydrogen 3.116 N/A LEU 101.A N ALA 97.A O no hydrogen 3.246 N/A PHE 102.A N ASP 98.A O no hydrogen 2.976 N/A LYS 103.A N TYR 99.A O no hydrogen 2.903 N/A LYS 103.A NZ GLU 87.A OE1 no hydrogen 3.305 N/A LYS 104.A N THR 100.A O no hydrogen 3.275 N/A ALA 105.A N LEU 101.A O no hydrogen 2.881 N/A LEU 106.A N PHE 102.A O no hydrogen 2.885 N/A ASP 107.A N LYS 103.A O no hydrogen 3.029 N/A VAL 108.A N LYS 104.A O no hydrogen 3.437 N/A ILE 109.A N ALA 105.A O no hydrogen 3.181 N/A LYS 110.A N LEU 106.A O no hydrogen 2.817 N/A LYS 110.A NZ ASP 107.A OD1 no hydrogen 3.499 N/A ASN 111.A N ASP 107.A O no hydrogen 3.222 N/A ASN 111.A ND2 GLU 113.A OE1 no hydrogen 2.933 N/A LYS 112.A N ILE 109.A O no hydrogen 2.966 N/A GLU 113.A N VAL 108.A O no hydrogen 3.093 N/A LEU 115.A N LYS 112.A O no hydrogen 3.455 N/A SER 116.A OG GLU 113.A O no hydrogen 3.039 N/A GLY 119.A N SER 116.A OG no hydrogen 3.158 N/A LEU 120.A N SER 116.A O no hydrogen 3.064 N/A LEU 121.A N GLN 117.A O no hydrogen 2.946 N/A LYS 122.A N LYS 118.A O no hydrogen 3.216 N/A LEU 123.A N GLY 119.A O no hydrogen 3.063 N/A VAL 124.A N LEU 120.A O no hydrogen 2.957 N/A GLY 125.A N LEU 121.A O no hydrogen 3.122 N/A ILE 126.A N LYS 122.A O no hydrogen 2.973 N/A LYS 127.A N LEU 123.A O no hydrogen 2.643 N/A LYS 127.A NZ ILE 19.A O no hydrogen 2.912 N/A ALA 128.A N VAL 124.A O no hydrogen 2.960 N/A SER 129.A N ILE 126.A O no hydrogen 3.297 N/A SER 129.A OG ILE 150.A O no hydrogen 2.546 N/A LEU 130.A N LYS 127.A O no hydrogen 3.042 N/A ASN 131.A N ASP 98.A OD1 no hydrogen 3.110 N/A ASN 131.A ND2 PHE 17.A O no hydrogen 2.838 N/A GLY 133.A N LEU 130.A O no hydrogen 2.940 N/A LEU 138.A N ASN 135.A O no hydrogen 3.222 N/A LEU 138.A N ASN 135.A OD1 no hydrogen 2.915 N/A LYS 139.A N ASN 135.A O no hydrogen 3.249 N/A LYS 139.A NZ LEU 134.A O no hydrogen 3.547 N/A GLU 140.A N GLY 136.A O no hydrogen 2.976 N/A ALA 141.A N SER 137.A O no hydrogen 3.183 N/A PHE 142.A N LEU 138.A O no hydrogen 2.762 N/A TRP 145.A N PHE 142.A O no hydrogen 2.983 N/A GLU 147.A N ASN 144.A O no hydrogen 2.975 N/A LEU 148.A N ASN 144.A O no hydrogen 3.424 N/A GLN 149.A N TRP 145.A O no hydrogen 2.882 N/A GLN 149.A NE2 ALA 128.A O no hydrogen 3.518 N/A ILE 150.A N GLY 125.A O no hydrogen 3.137 N/A ARG 152.A NH1 ASP 98.A OD1 no hydrogen 2.876 N/A ARG 152.A NH1 SER 129.A O no hydrogen 3.056 N/A ARG 152.A NH2 ASP 98.A OD1 no hydrogen 3.363 N/A ARG 152.A NH2 ASP 98.A OD2 no hydrogen 3.310 N/A TYR 155.A OH GLU 204.A OE1 no hydrogen 2.522 N/A ASN 164.A N ASP 162.A OD2 no hydrogen 2.867 N/A ASN 164.A ND2 ASP 162.A OD2 no hydrogen 2.754 N/A TRP 165.A N ASP 162.A O no hydrogen 2.854 N/A TRP 165.A NE1 ASP 12.A OD2 no hydrogen 2.842 N/A SER 167.A N PRO 163.A O no hydrogen 3.418 N/A SER 167.A OG ASN 164.A O no hydrogen 3.038 N/A GLY 168.A N ASN 164.A O no hydrogen 3.051 N/A PHE 169.A N TRP 165.A O no hydrogen 2.885 N/A ALA 170.A N ILE 166.A O no hydrogen 2.751 N/A SER 171.A N SER 167.A O no hydrogen 2.934 N/A SER 171.A OG SER 167.A O no hydrogen 2.812 N/A SER 171.A OG GLN 255.A O no hydrogen 3.191 N/A GLY 172.A N PHE 169.A O no hydrogen 3.258 N/A ASP 173.A N PHE 169.A O no hydrogen 2.849 N/A SER 174.A OG ALA 170.A O no hydrogen 2.698 N/A SER 175.A N GLY 197.A O no hydrogen 2.925 N/A ASN 177.A N ARG 195.A O no hydrogen 3.021 N/A ASN 177.A ND2 SER 175.A OG no hydrogen 3.146 N/A LYS 179.A N GLN 193.A O no hydrogen 2.858 N/A LYS 179.A NZ GLN 193.A OE1 no hydrogen 2.848 N/A SER 181.A N ARG 191.A O no hydrogen 3.253 N/A SER 181.A OG ASN 182.A O no hydrogen 3.347 N/A SER 183.A OG SER 186.A OG no hydrogen 2.821 N/A SER 186.A N SER 183.A O no hydrogen 3.083 N/A SER 186.A OG SER 183.A OG no hydrogen 2.821 N/A ASN 189.A N SER 186.A O no hydrogen 2.991 N/A GLN 193.A N LYS 179.A O no hydrogen 3.024 N/A ARG 195.A N ASN 177.A O no hydrogen 3.084 N/A ARG 195.A NH1 ASN 177.A OD1 no hydrogen 3.084 N/A PHE 196.A N VAL 235.A O no hydrogen 3.070 N/A GLY 197.A N SER 175.A O no hydrogen 3.021 N/A ILE 198.A N PHE 233.A O no hydrogen 3.055 N/A LEU 200.A N ALA 231.A O no hydrogen 2.925 N/A ILE 202.A N ASN 229.A O no hydrogen 2.903 N/A ARG 203.A N ASN 201.A OD1 no hydrogen 2.959 N/A GLU 204.A N ASN 201.A O no hydrogen 2.783 N/A LYS 205.A N ILE 202.A O no hydrogen 3.003 N/A ILE 208.A N GLU 204.A O no hydrogen 3.023 N/A GLN 209.A N LYS 205.A O no hydrogen 2.983 N/A GLN 209.A NE2 LYS 205.A O no hydrogen 3.472 N/A TYR 210.A N ALA 206.A O no hydrogen 2.780 N/A LEU 211.A N LEU 207.A O no hydrogen 2.694 N/A VAL 212.A N ILE 208.A O no hydrogen 3.146 N/A ALA 213.A N GLN 209.A O no hydrogen 3.065 N/A TYR 214.A N TYR 210.A O no hydrogen 2.941 N/A TYR 214.A N LEU 211.A O no hydrogen 2.897 N/A PHE 215.A N LEU 211.A O no hydrogen 3.130 N/A ASP 216.A N ALA 213.A O no hydrogen 3.334 N/A LEU 217.A N VAL 212.A O no hydrogen 3.020 N/A LEU 221.A N SER 218.A O no hydrogen 3.181 N/A TYR 225.A N ARG 232.A O no hydrogen 2.892 N/A ALA 231.A N LEU 200.A O no hydrogen 2.898 N/A ARG 232.A N TYR 225.A O no hydrogen 3.036 N/A PHE 233.A N ILE 198.A O no hydrogen 3.121 N/A GLU 234.A N ASN 223.A O no hydrogen 3.197 N/A VAL 235.A N PHE 196.A O no hydrogen 2.805 N/A ILE 241.A N LYS 237.A O no hydrogen 2.974 N/A THR 242.A N PHE 238.A O no hydrogen 2.872 N/A THR 242.A OG1 PHE 238.A O no hydrogen 3.264 N/A ASP 243.A N SER 239.A O no hydrogen 2.746 N/A LYS 244.A N ASP 240.A O no hydrogen 2.943 N/A LYS 244.A NZ ASP 216.A O no hydrogen 2.580 N/A ILE 245.A N ASP 240.A O no hydrogen 3.182 N/A ILE 246.A N ILE 241.A O no hydrogen 2.997 N/A PHE 248.A N ILE 245.A O no hydrogen 3.124 N/A PHE 249.A N ILE 245.A O no hydrogen 3.176 N/A ASP 250.A N ILE 246.A O no hydrogen 2.779 N/A LYS 251.A N PHE 248.A O no hydrogen 2.977 N/A TYR 252.A N PHE 248.A O no hydrogen 2.923 N/A SER 253.A OG GLN 255.A OE1 no hydrogen 3.282 N/A GLN 255.A N SER 171.A OG no hydrogen 2.799 N/A LYS 257.A N ASP 45.A OD2 no hydrogen 3.347 N/A LYS 258.A NZ SER 171.A O no hydrogen 3.283 N/A LYS 258.A NZ SER 174.A O no hydrogen 3.060 N/A SER 259.A N GLY 256.A O no hydrogen 3.136 N/A SER 259.A OG GLY 256.A O no hydrogen 3.170 N/A GLN 260.A N LYS 257.A O no hydrogen 3.240 N/A TYR 262.A N LYS 258.A O no hydrogen 2.941 N/A TYR 262.A OH ASP 250.A OD1 no hydrogen 2.651 N/A GLN 263.A N SER 259.A O no hydrogen 2.909 N/A ASN 264.A N GLN 260.A O no hydrogen 3.370 N/A PHE 265.A N ASP 261.A O no hydrogen 2.837 N/A LYS 266.A N TYR 262.A O no hydrogen 2.948 N/A LYS 266.A NZ ASP 250.A OD1 no hydrogen 2.747 N/A LYS 266.A NZ ASP 250.A OD2 no hydrogen 3.171 N/A GLU 267.A N GLN 263.A O no hydrogen 3.047 N/A VAL 268.A N ASN 264.A O no hydrogen 2.971 N/A ALA 269.A N PHE 265.A O no hydrogen 2.905 N/A ASP 270.A N LYS 266.A O no hydrogen 2.768 N/A ILE 271.A N GLU 267.A O no hydrogen 3.075 N/A ILE 272.A N VAL 268.A O no hydrogen 2.929 N/A LYS 273.A N ALA 269.A O no hydrogen 2.990 N/A SER 274.A N ASP 270.A O no hydrogen 3.321 N/A SER 274.A OG ASP 270.A O no hydrogen 3.345 N/A SER 274.A OG ILE 271.A O no hydrogen 3.011 N/A LYS 275.A N ILE 272.A O no hydrogen 2.924 N/A ASN 276.A N ILE 271.A O no hydrogen 3.136 N/A HIS 277.A N HIS 277.A ND1 no hydrogen 2.951 N/A THR 279.A OG1 ASN 276.A O no hydrogen 2.999 N/A GLY 282.A N THR 279.A OG1 no hydrogen 2.964 N/A PHE 283.A N THR 279.A O no hydrogen 3.078 N/A GLN 284.A N SER 280.A O no hydrogen 3.016 N/A GLU 285.A N GLU 281.A O no hydrogen 2.978 N/A ILE 286.A N GLY 282.A O no hydrogen 2.965 N/A LEU 287.A N PHE 283.A O no hydrogen 2.964 N/A ASP 288.A N GLN 284.A O no hydrogen 2.744 N/A ILE 289.A N GLU 285.A O no hydrogen 2.940 N/A LYS 290.A N ILE 286.A O no hydrogen 2.758 N/A ALA 291.A N LEU 287.A O no hydrogen 2.925 N/A SER 292.A N ASP 288.A O no hydrogen 3.342 N/A SER 292.A OG ILE 289.A O no hydrogen 2.717 N/A MET 293.A N LYS 290.A O no hydrogen 2.975 N/A ASN 294.A N ASP 261.A OD1 no hydrogen 3.141 N/A ASN 294.A ND2 PHE 176.A O no hydrogen 3.092 N/A