Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w31_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 16.A N GLU 13.A O no hydrogen 2.810 N/A VAL 17.A N ILE 14.A O no hydrogen 2.942 N/A GLY 21.A N LEU 18.A O no hydrogen 3.048 N/A TYR 22.A N ALA 19.A O no hydrogen 3.373 N/A ASN 23.A ND2 ALA 19.A O no hydrogen 3.167 N/A LEU 26.A N HIS 24.A ND1 no hydrogen 2.746 N/A ARG 28.A N PRO 25.A O no hydrogen 3.067 N/A ARG 28.A NH1 HIS 24.A O no hydrogen 3.099 N/A GLN 29.A N LEU 26.A O no hydrogen 2.956 N/A TRP 30.A N LEU 26.A O no hydrogen 3.149 N/A GLN 31.A N LEU 27.A O no hydrogen 2.871 N/A GLN 31.A NE2 GLY 21.A O no hydrogen 2.814 N/A SER 32.A N GLN 29.A O no hydrogen 2.947 N/A SER 32.A OG GLN 29.A O no hydrogen 2.898 N/A ARG 34.A NH1 LEU 319.A O no hydrogen 2.938 N/A LYS 38.A NZ LYS 81.A O no hydrogen 2.902 N/A LYS 38.A NZ ASP 339.A OD2 no hydrogen 2.857 N/A MET 40.A N THR 37.A O no hydrogen 3.186 N/A LEU 41.A N LYS 38.A O no hydrogen 3.160 N/A ILE 42.A N ILE 326.A O no hydrogen 2.843 N/A PHE 43.A N SER 85.A O no hydrogen 3.322 N/A LEU 45.A N ILE 87.A O no hydrogen 2.870 N/A ILE 47.A N PHE 89.A O no hydrogen 2.858 N/A SER 48.A N ILE 66.A O no hydrogen 2.695 N/A SER 48.A OG ASP 53.A OD1 no hydrogen 2.689 N/A ASN 50.A N SER 48.A OG no hydrogen 3.361 N/A ASP 52.A N ASN 50.A OD1 no hydrogen 3.040 N/A ASP 53.A N ASN 50.A O no hydrogen 2.686 N/A PHE 54.A N ASP 53.A OD2 no hydrogen 2.875 N/A THR 55.A N ARG 65.A O no hydrogen 3.075 N/A THR 55.A OG1 ASP 53.A OD2 no hydrogen 2.695 N/A ILE 57.A N ILE 63.A O no hydrogen 2.838 N/A SER 59.A OG PRO 218.A O no hydrogen 3.066 N/A LEU 60.A N ILE 57.A O no hydrogen 3.211 N/A ILE 63.A N LEU 60.A O no hydrogen 3.182 N/A ARG 65.A N THR 55.A O no hydrogen 2.681 N/A ILE 66.A N PHE 46.A O no hydrogen 2.983 N/A GLY 67.A N ASP 53.A O no hydrogen 3.058 N/A ASN 69.A N PRO 51.A O no hydrogen 2.720 N/A ASN 69.A ND2 ASP 52.A OD1 no hydrogen 3.038 N/A ARG 70.A N GLY 67.A O no hydrogen 2.865 N/A LEU 71.A N VAL 68.A O no hydrogen 3.226 N/A TYR 74.A N ARG 70.A O no hydrogen 3.195 N/A TYR 74.A N LEU 71.A O no hydrogen 2.756 N/A LEU 75.A N LEU 71.A O no hydrogen 2.704 N/A LYS 76.A N LYS 72.A O no hydrogen 3.060 N/A VAL 79.A N LEU 75.A O no hydrogen 2.806 N/A ALA 80.A N LYS 76.A O no hydrogen 3.088 N/A LYS 81.A N PRO 77.A O no hydrogen 3.003 N/A LYS 81.A N LEU 78.A O no hydrogen 3.019 N/A LYS 81.A NZ ASP 336.A OD1 no hydrogen 3.424 N/A LYS 81.A NZ ASP 336.A OD2 no hydrogen 3.496 N/A GLY 82.A N VAL 79.A O no hydrogen 3.049 N/A LEU 83.A N LEU 78.A O no hydrogen 3.084 N/A SER 85.A OG TYR 127.A O no hydrogen 3.192 N/A VAL 86.A N TYR 127.A O no hydrogen 3.014 N/A ILE 87.A N PHE 43.A O no hydrogen 3.070 N/A LEU 88.A N ILE 129.A O no hydrogen 2.759 N/A PHE 89.A N LEU 45.A O no hydrogen 2.746 N/A VAL 91.A N ILE 47.A O no hydrogen 2.690 N/A LEU 93.A N ASP 49.A OD2 no hydrogen 2.683 N/A ILE 94.A N ASP 49.A OD1 no hydrogen 2.725 N/A THR 97.A OG1 ILE 94.A O no hydrogen 3.119 N/A LYS 98.A NZ GLU 136.A O no hydrogen 3.482 N/A ASP 99.A N TYR 137.A O no hydrogen 3.321 N/A VAL 101.A N ASP 99.A OD2 no hydrogen 2.810 N/A THR 103.A N ASP 99.A OD2 no hydrogen 3.172 N/A THR 103.A OG1 ASP 99.A OD1 no hydrogen 2.754 N/A ALA 105.A N GLY 102.A O no hydrogen 2.929 N/A ASP 107.A N ALA 104.A O no hydrogen 3.015 N/A ALA 109.A N ASP 107.A OD2 no hydrogen 2.905 N/A GLY 110.A N ASP 107.A O no hydrogen 2.657 N/A GLN 114.A N GLY 110.A O no hydrogen 2.959 N/A GLN 114.A NE2 PRO 108.A O no hydrogen 2.893 N/A GLY 115.A N PRO 111.A O no hydrogen 2.719 N/A ILE 116.A N VAL 112.A O no hydrogen 2.928 N/A LYS 117.A N ILE 113.A O no hydrogen 3.166 N/A PHE 118.A N GLN 114.A O no hydrogen 3.025 N/A ILE 119.A N GLY 115.A O no hydrogen 2.824 N/A ARG 120.A N ILE 116.A O no hydrogen 2.825 N/A ARG 120.A NH1 PRO 124.A O no hydrogen 3.482 N/A GLU 121.A N PHE 118.A O no hydrogen 3.387 N/A TYR 122.A N PHE 118.A O no hydrogen 3.057 N/A PHE 123.A N ILE 119.A O no hydrogen 2.709 N/A LEU 126.A N PHE 123.A O no hydrogen 3.001 N/A TYR 127.A N ARG 84.A O no hydrogen 2.763 N/A ILE 128.A N HIS 174.A ND1 no hydrogen 2.731 N/A ILE 129.A N VAL 86.A O no hydrogen 2.762 N/A CYS 130.A N CYS 175.A O no hydrogen 2.842 N/A ASP 131.A N LEU 88.A O no hydrogen 3.085 N/A VAL 132.A N ALA 177.A O no hydrogen 2.688 N/A CYS 133.A SG CYS 143.A O no hydrogen 3.634 N/A TYR 137.A N LEU 134.A O no hydrogen 2.894 N/A THR 138.A OG1 LEU 134.A O no hydrogen 2.916 N/A THR 138.A OG1 CYS 135.A O no hydrogen 3.320 N/A THR 138.A OG1 HIS 142.A O no hydrogen 2.828 N/A SER 139.A N ASP 99.A O no hydrogen 2.827 N/A GLY 141.A N THR 138.A OG1 no hydrogen 3.251 N/A HIS 142.A N HIS 140.A ND1 no hydrogen 3.075 N/A VAL 145.A N SER 157.A OG no hydrogen 2.848 N/A TYR 147.A N THR 151.A O no hydrogen 2.678 N/A THR 151.A N ASP 149.A OD1 no hydrogen 3.334 N/A THR 151.A OG1 ASP 149.A OD1 no hydrogen 3.294 N/A THR 151.A OG1 ASP 149.A OD2 no hydrogen 3.218 N/A ASN 153.A N VAL 145.A O no hydrogen 2.692 N/A ARG 154.A NH1 ASP 183.A O no hydrogen 2.686 N/A ARG 156.A N ASN 153.A OD1 no hydrogen 3.325 N/A SER 157.A N ASN 153.A O no hydrogen 2.757 N/A SER 157.A OG ASN 153.A O no hydrogen 2.758 N/A VAL 158.A N ARG 154.A O no hydrogen 2.697 N/A SER 159.A N GLU 155.A O no hydrogen 3.026 N/A ARG 160.A N ARG 156.A O no hydrogen 2.866 N/A ARG 160.A NE VAL 101.A O no hydrogen 2.869 N/A ARG 160.A NH1 ASP 106.A OD2 no hydrogen 3.045 N/A ARG 160.A NH2 GLY 102.A O no hydrogen 2.837 N/A ARG 160.A NH2 ASP 106.A OD1 no hydrogen 2.830 N/A LEU 161.A N SER 157.A O no hydrogen 2.788 N/A ALA 162.A N VAL 158.A O no hydrogen 2.878 N/A VAL 164.A N ARG 160.A O no hydrogen 3.084 N/A ALA 165.A N LEU 161.A O no hydrogen 2.945 N/A VAL 166.A N ALA 162.A O no hydrogen 3.009 N/A ASN 167.A N ALA 163.A O no hydrogen 2.852 N/A ASN 167.A ND2 ASP 106.A OD2 no hydrogen 2.688 N/A TYR 168.A N VAL 164.A O no hydrogen 2.922 N/A TYR 168.A OH ALA 105.A O no hydrogen 2.890 N/A ALA 169.A N ALA 165.A O no hydrogen 3.057 N/A LYS 170.A N VAL 166.A O no hydrogen 2.773 N/A ALA 171.A N ASN 167.A O no hydrogen 2.823 N/A GLY 172.A N TYR 168.A O no hydrogen 3.052 N/A GLY 172.A N ALA 169.A O no hydrogen 3.010 N/A ALA 173.A N TYR 168.A O no hydrogen 3.031 N/A HIS 174.A N ILE 128.A O no hydrogen 2.994 N/A CYS 175.A N ILE 128.A O no hydrogen 3.001 N/A CYS 175.A SG PHE 203.A O no hydrogen 3.299 N/A VAL 176.A N PHE 203.A O no hydrogen 3.142 N/A ALA 177.A N CYS 130.A O no hydrogen 2.818 N/A SER 179.A N VAL 132.A O no hydrogen 3.017 N/A SER 179.A OG ASP 131.A OD1 no hydrogen 2.691 N/A SER 179.A OG ASP 131.A OD2 no hydrogen 3.149 N/A ILE 182.A N ASP 180.A OD1 no hydrogen 2.918 N/A ARG 185.A N ILE 182.A O no hydrogen 3.221 N/A ARG 185.A NE ASP 180.A OD2 no hydrogen 2.690 N/A ARG 185.A NH2 PRO 178.A O no hydrogen 2.734 N/A ARG 185.A NH2 TYR 207.A O no hydrogen 3.185 N/A ARG 187.A N GLU 255.A OE1 no hydrogen 3.132 N/A ARG 187.A NE ASP 188.A OD2 no hydrogen 3.326 N/A ARG 187.A NH2 ASP 188.A OD2 no hydrogen 2.828 N/A ILE 189.A N ARG 185.A O no hydrogen 2.964 N/A LYS 190.A N ILE 186.A O no hydrogen 2.881 N/A LYS 190.A NZ GLY 256.A O no hydrogen 2.900 N/A LYS 190.A NZ ASP 258.A OD1 no hydrogen 3.432 N/A ARG 191.A N ARG 187.A O no hydrogen 2.905 N/A GLY 192.A N ASP 188.A O no hydrogen 2.850 N/A LEU 193.A N ILE 189.A O no hydrogen 2.950 N/A ILE 194.A N LYS 190.A O no hydrogen 2.856 N/A ASN 195.A N ARG 191.A O no hydrogen 2.813 N/A ALA 196.A N GLY 192.A O no hydrogen 2.849 N/A ASN 197.A N ILE 194.A O no hydrogen 3.056 N/A LEU 198.A N LEU 193.A O no hydrogen 2.808 N/A LYS 201.A N LEU 198.A O no hydrogen 3.095 N/A THR 202.A OG1 LEU 198.A O no hydrogen 2.697 N/A PHE 203.A N HIS 174.A O no hydrogen 2.998 N/A VAL 204.A N ASP 258.A OD2 no hydrogen 2.736 N/A LEU 205.A N VAL 176.A O no hydrogen 3.045 N/A SER 206.A N GLY 259.A O no hydrogen 3.125 N/A SER 206.A OG ASP 252.A OD2 no hydrogen 2.695 N/A TYR 207.A N PRO 178.A O no hydrogen 3.393 N/A TYR 207.A OH ASP 131.A OD1 no hydrogen 3.148 N/A ALA 208.A N SER 206.A O no hydrogen 2.662 N/A ALA 209.A N ILE 261.A O no hydrogen 3.352 N/A LYS 210.A NZ SER 179.A O no hydrogen 3.424 N/A PHE 211.A N LYS 263.A O no hydrogen 3.018 N/A SER 212.A N LEU 237.A O no hydrogen 2.768 N/A TYR 216.A OH PHE 211.A O no hydrogen 2.680 N/A PHE 219.A N SER 290.A OG no hydrogen 3.100 N/A ARG 220.A N GLY 217.A O no hydrogen 2.688 N/A ASP 221.A N PRO 218.A O no hydrogen 2.832 N/A ALA 222.A N PRO 218.A O no hydrogen 3.113 N/A ALA 223.A N PHE 219.A O no hydrogen 2.749 N/A CYS 224.A SG ASP 221.A O no hydrogen 3.282 N/A SER 228.A OG HIS 140.A O no hydrogen 2.893 N/A ASN 229.A ND2 SER 228.A O no hydrogen 2.698 N/A ARG 232.A NH2 SER 225.A O no hydrogen 3.044 N/A CYS 234.A SG ASP 231.A O no hydrogen 3.955 N/A TYR 235.A N.A ARG 232.A O no hydrogen 3.420 N/A TYR 235.A N.B ARG 232.A O no hydrogen 3.270 N/A GLN 236.A N ARG 232.A O no hydrogen 3.176 N/A LEU 237.A N LYS 210.A O no hydrogen 2.979 N/A GLY 241.A N PRO 238.A O no hydrogen 2.696 N/A ARG 242.A N ALA 240.A O no hydrogen 2.818 N/A ARG 242.A NE ASP 274.A OD2 no hydrogen 3.092 N/A ARG 242.A NH2 ASP 274.A OD1 no hydrogen 3.111 N/A ALA 245.A N GLY 241.A O no hydrogen 3.111 N/A ARG 246.A N ARG 242.A O no hydrogen 2.892 N/A ARG 247.A N GLY 243.A O no hydrogen 3.046 N/A ALA 248.A N LEU 244.A O no hydrogen 2.810 N/A LEU 249.A N ALA 245.A O no hydrogen 2.945 N/A GLU 250.A N ARG 246.A O no hydrogen 3.162 N/A ARG 251.A N ARG 247.A O no hydrogen 2.863 N/A ARG 251.A NE ASP 252.A OD1 no hydrogen 2.898 N/A ARG 251.A NH1 ASP 183.A OD1 no hydrogen 2.696 N/A ASP 252.A N ALA 248.A O no hydrogen 2.903 N/A MET 253.A N LEU 249.A O no hydrogen 3.115 N/A SER 254.A N GLU 250.A O no hydrogen 3.023 N/A SER 254.A OG ARG 251.A O no hydrogen 3.543 N/A GLU 255.A N ARG 251.A O no hydrogen 2.879 N/A GLU 255.A N ASP 252.A O no hydrogen 3.140 N/A GLY 256.A N MET 253.A O no hydrogen 3.121 N/A ALA 257.A N ASP 252.A O no hydrogen 3.050 N/A ASP 258.A N VAL 204.A O no hydrogen 2.691 N/A GLY 259.A N VAL 204.A O no hydrogen 3.211 N/A ILE 260.A N PRO 283.A O no hydrogen 3.141 N/A ILE 261.A N SER 206.A O no hydrogen 2.814 N/A VAL 262.A N CYS 285.A O no hydrogen 2.798 N/A LYS 263.A N ALA 209.A O no hydrogen 2.925 N/A SER 265.A N GLU 292.A OE1 no hydrogen 3.353 N/A SER 265.A N GLU 292.A OE2 no hydrogen 3.194 N/A SER 265.A OG TYR 287.A O no hydrogen 3.428 N/A SER 265.A OG GLU 292.A OE1 no hydrogen 2.984 N/A PHE 267.A N GLU 292.A OE2 no hydrogen 3.341 N/A TYR 268.A N SER 265.A O no hydrogen 2.771 N/A ILE 271.A N TYR 268.A O no hydrogen 2.865 N/A MET 272.A N TYR 268.A O no hydrogen 3.295 N/A ARG 273.A N LEU 269.A O no hydrogen 3.174 N/A ARG 273.A NH2 ARG 320.A O no hydrogen 2.686 N/A ASP 274.A N ASP 270.A O no hydrogen 3.049 N/A ALA 275.A N ILE 271.A O no hydrogen 2.952 N/A SER 276.A N MET 272.A O no hydrogen 2.901 N/A SER 276.A OG ARG 273.A O no hydrogen 2.791 N/A GLU 277.A N ASP 274.A O no hydrogen 3.090 N/A ILE 278.A N ASP 274.A O no hydrogen 3.018 N/A CYS 279.A N ALA 275.A O no hydrogen 2.680 N/A CYS 279.A SG LEU 249.A O no hydrogen 3.963 N/A LEU 282.A N CYS 279.A O no hydrogen 2.891 N/A CYS 285.A N ILE 260.A O no hydrogen 2.699 N/A CYS 285.A SG ALA 286.A O no hydrogen 3.759 N/A ALA 286.A N LEU 325.A O no hydrogen 3.029 N/A TYR 287.A N VAL 262.A O no hydrogen 3.042 N/A TYR 287.A OH TYR 329.A OH no hydrogen 3.227 N/A HIS 288.A N ILE 327.A O no hydrogen 2.959 N/A VAL 289.A N GLU 292.A OE1 no hydrogen 3.146 N/A GLY 291.A N LEU 215.A O no hydrogen 2.831 N/A TYR 293.A N VAL 289.A O no hydrogen 2.909 N/A TYR 293.A OH PRO 61.A O no hydrogen 2.696 N/A ALA 294.A N SER 290.A O no hydrogen 2.704 N/A MET 295.A N GLY 291.A O no hydrogen 2.924 N/A LEU 296.A N GLU 292.A O no hydrogen 3.017 N/A HIS 297.A N TYR 293.A O no hydrogen 3.270 N/A ALA 298.A N ALA 294.A O no hydrogen 2.895 N/A ALA 299.A N MET 295.A O no hydrogen 3.064 N/A ALA 300.A N LEU 296.A O no hydrogen 2.850 N/A GLU 301.A N HIS 297.A O no hydrogen 2.862 N/A LYS 302.A N ALA 298.A O no hydrogen 3.028 N/A GLY 303.A N ALA 300.A O no hydrogen 2.879 N/A VAL 304.A N ALA 299.A O no hydrogen 2.786 N/A THR 309.A N ASP 306.A OD2 no hydrogen 3.290 N/A THR 309.A OG1 ASP 306.A OD2 no hydrogen 2.699 N/A ILE 310.A N ASP 306.A O no hydrogen 2.787 N/A ALA 311.A N LEU 307.A O no hydrogen 2.752 N/A PHE 312.A N LYS 308.A O no hydrogen 3.019 N/A GLU 313.A N THR 309.A O no hydrogen 2.880 N/A SER 314.A N ILE 310.A O no hydrogen 2.955 N/A SER 314.A OG ILE 310.A O no hydrogen 2.995 N/A SER 314.A OG ALA 311.A O no hydrogen 2.935 N/A SER 314.A OG HIS 315.A ND1 no hydrogen 3.068 N/A HIS 315.A N ALA 311.A O no hydrogen 3.111 N/A HIS 315.A ND1 SER 314.A OG no hydrogen 3.068 N/A HIS 315.A NE2 THR 328.A OG1 no hydrogen 3.044 N/A GLN 316.A N.A PHE 312.A O no hydrogen 2.739 N/A GLN 316.A N.B PHE 312.A O no hydrogen 2.919 N/A GLN 316.A NE2.A ARG 34.A O no hydrogen 3.401 N/A GLY 317.A N GLU 313.A O no hydrogen 3.031 N/A PHE 318.A N SER 314.A O no hydrogen 3.203 N/A PHE 318.A N HIS 315.A O no hydrogen 3.095 N/A LEU 319.A N HIS 315.A O no hydrogen 3.394 N/A ARG 320.A N GLN 316.A O.A no hydrogen 2.850 N/A ARG 320.A N GLN 316.A O.B no hydrogen 2.834 N/A ALA 321.A N GLY 317.A O no hydrogen 2.899 N/A GLY 322.A N LEU 319.A O no hydrogen 3.056 N/A ALA 323.A N PHE 318.A O no hydrogen 2.994 N/A ARG 324.A N ILE 284.A O no hydrogen 2.943 N/A ILE 326.A N MET 40.A O no hydrogen 2.730 N/A ILE 327.A N ALA 286.A O no hydrogen 2.833 N/A THR 328.A N ILE 42.A O no hydrogen 3.194 N/A THR 328.A OG1 HIS 315.A NE2 no hydrogen 3.044 N/A LEU 330.A N THR 328.A OG1 no hydrogen 2.930 N/A GLU 333.A N GLU 333.A OE2 no hydrogen 2.684 N/A PHE 334.A N LEU 330.A O no hydrogen 2.974 N/A LEU 335.A N ALA 331.A O no hydrogen 2.847 N/A ASP 336.A N GLU 333.A O no hydrogen 2.823 N/A TRP 337.A N GLU 333.A O no hydrogen 2.995 N/A LEU 338.A N PHE 334.A O no hydrogen 2.818 N/A ASP 339.A N ASP 336.A O no hydrogen 2.999 N/A GLU 340.A N TRP 337.A O no hydrogen 3.046 N/A