Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4krd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N SER 2.A OG no hydrogen 3.050 N/A GLN 5.A N SER 2.A O no hydrogen 3.092 N/A GLN 5.A NE2 ASN 25.A OD1 no hydrogen 2.966 N/A GLN 5.A NE2 THR 27.A OG1 no hydrogen 2.812 N/A LYS 7.A N LEU 24.A O no hydrogen 2.796 N/A GLN 8.A NE2 GLU 36.A OE2 no hydrogen 2.716 N/A LEU 9.A N LYS 22.A O no hydrogen 2.688 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.787 N/A LEU 12.A N VAL 20.A O no hydrogen 2.740 N/A GLY 13.A N VAL 20.A O no hydrogen 3.268 N/A GLY 15.A N ALA 18.A O no hydrogen 2.678 N/A THR 19.A N GLU 36.A O no hydrogen 3.029 N/A VAL 20.A N GLY 13.A O no hydrogen 2.813 N/A TYR 21.A N LEU 34.A O no hydrogen 2.745 N/A LYS 22.A N GLU 10.A O no hydrogen 2.843 N/A GLY 23.A N VAL 32.A O no hydrogen 2.865 N/A LEU 24.A N LYS 7.A O no hydrogen 2.851 N/A ASN 25.A N VAL 30.A O no hydrogen 3.030 N/A LYS 26.A N GLN 5.A O no hydrogen 2.870 N/A LYS 26.A NZ SER 4.A O no hydrogen 2.985 N/A THR 27.A N ASN 25.A OD1 no hydrogen 2.890 N/A THR 28.A N ASN 25.A OD1 no hydrogen 3.315 N/A GLY 29.A N ASN 25.A O no hydrogen 2.824 N/A VAL 30.A N THR 28.A OG1 no hydrogen 3.293 N/A VAL 32.A N GLY 23.A O no hydrogen 2.937 N/A ALA 33.A N PHE 81.A O no hydrogen 2.872 N/A LEU 34.A N TYR 21.A O no hydrogen 2.733 N/A LYS 35.A N LEU 79.A O no hydrogen 2.861 N/A LYS 35.A NZ GLU 52.A OE1 no hydrogen 2.738 N/A LYS 35.A NZ GLU 52.A OE2 no hydrogen 3.443 N/A LYS 35.A NZ ASP 144.A OD1 no hydrogen 3.397 N/A GLU 36.A N THR 19.A O no hydrogen 2.819 N/A VAL 37.A N LEU 77.A O no hydrogen 2.780 N/A LEU 39.A N ASN 75.A O no hydrogen 2.786 N/A GLU 42.A N ASP 40.A OD1 no hydrogen 3.113 N/A GLU 43.A N.A ASP 40.A O no hydrogen 2.819 N/A GLU 43.A N.B ASP 40.A O no hydrogen 2.883 N/A GLY 44.A N ASP 40.A O no hydrogen 3.044 N/A ILE 50.A N PRO 46.A O no hydrogen 3.419 N/A ARG 51.A N SER 47.A O no hydrogen 2.982 N/A ARG 51.A NH1 ALA 148.A O no hydrogen 3.321 N/A GLU 52.A N THR 48.A O no hydrogen 3.062 N/A ILE 53.A N ALA 49.A O no hydrogen 2.939 N/A SER 54.A N ILE 50.A O no hydrogen 2.944 N/A SER 54.A OG ARG 51.A O no hydrogen 2.702 N/A LEU 55.A N GLU 52.A O no hydrogen 3.259 N/A MET 56.A N ILE 53.A O no hydrogen 3.011 N/A GLU 58.A N LEU 55.A O no hydrogen 3.101 N/A LEU 59.A N LEU 55.A O no hydrogen 3.021 N/A LYS 60.A N GLU 58.A O no hydrogen 2.896 N/A ASN 63.A N HIS 61.A ND1 no hydrogen 2.882 N/A ASN 63.A ND2 LEU 140.A O no hydrogen 2.933 N/A ILE 64.A N HIS 61.A O no hydrogen 3.102 N/A VAL 65.A N LEU 142.A O no hydrogen 2.984 N/A ARG 66.A N GLU 82.A OE1 no hydrogen 2.895 N/A ARG 66.A NE GLU 82.A OE1 no hydrogen 3.229 N/A ARG 66.A NH1 GLU 82.A OE2 no hydrogen 3.234 N/A TYR 68.A N VAL 80.A O no hydrogen 2.703 N/A VAL 70.A N ASP 69.A OD1 no hydrogen 2.762 N/A ILE 71.A N THR 78.A O no hydrogen 2.796 N/A THR 73.A N LYS 76.A O no hydrogen 2.861 N/A LYS 76.A N THR 73.A O no hydrogen 3.014 N/A LYS 76.A NZ GLU 36.A OE1 no hydrogen 3.272 N/A LEU 77.A N VAL 37.A O no hydrogen 3.077 N/A THR 78.A N ILE 71.A O no hydrogen 2.792 N/A LEU 79.A N LYS 35.A O no hydrogen 2.821 N/A VAL 80.A N ASP 69.A O no hydrogen 2.787 N/A PHE 81.A N ALA 33.A O no hydrogen 2.873 N/A GLU 82.A N ARG 66.A O no hydrogen 2.941 N/A ASN 86.A N ILE 134.A O no hydrogen 2.881 N/A ASP 87.A N ASN 86.A OD1 no hydrogen 3.065 N/A LEU 88.A N LEU 132.A O no hydrogen 2.794 N/A LYS 90.A N ASP 87.A O no hydrogen 3.005 N/A LYS 90.A N ASP 87.A OD1 no hydrogen 2.908 N/A LYS 90.A NZ LEU 12.A O no hydrogen 3.090 N/A TYR 91.A N ASP 87.A O no hydrogen 2.945 N/A MET 92.A N LEU 88.A O no hydrogen 2.969 N/A ASP 93.A N LYS 89.A O no hydrogen 3.029 N/A ARG 95.A N MET 92.A O no hydrogen 2.612 N/A ARG 95.A NH1 GLY 97.A O no hydrogen 3.516 N/A ARG 95.A NH2 GLY 97.A O no hydrogen 3.290 N/A ARG 95.A NH2 GLU 99.A OE2 no hydrogen 2.996 N/A ARG 96.A NE ASP 93.A OD1 no hydrogen 2.984 N/A ARG 96.A NH1 GLU 194.A OE2 no hydrogen 3.267 N/A ARG 96.A NH1 GLY 198.A O no hydrogen 2.797 N/A ARG 96.A NH2 ASP 93.A OD1 no hydrogen 2.691 N/A LEU 98.A N MET 195.A O no hydrogen 2.861 N/A LEU 100.A N GLU 257.A OE2 no hydrogen 2.916 N/A LEU 102.A N GLU 99.A O no hydrogen 3.065 N/A VAL 103.A N GLU 99.A O no hydrogen 3.071 N/A LYS 104.A N LEU 100.A O no hydrogen 3.037 N/A LYS 104.A NZ TRP 289.A O no hydrogen 2.922 N/A LYS 104.A NZ GLU 292.A OE1 no hydrogen 2.539 N/A TYR 105.A N ASN 101.A O no hydrogen 3.274 N/A PHE 106.A N LEU 102.A O no hydrogen 2.787 N/A GLN 107.A N VAL 103.A O no hydrogen 2.963 N/A GLN 107.A NE2 CYS 188.A O no hydrogen 3.262 N/A TRP 108.A N LYS 104.A O no hydrogen 2.830 N/A GLN 109.A N TYR 105.A O no hydrogen 3.234 N/A LEU 110.A N PHE 106.A O no hydrogen 2.952 N/A LEU 111.A N GLN 107.A O no hydrogen 3.020 N/A GLN 112.A N TRP 108.A O no hydrogen 2.897 N/A GLY 113.A N GLN 109.A O no hydrogen 3.006 N/A LEU 114.A N LEU 110.A O no hydrogen 2.940 N/A ALA 115.A N LEU 111.A O no hydrogen 2.829 N/A PHE 116.A N GLN 112.A O no hydrogen 3.193 N/A CYS 117.A N GLY 113.A O no hydrogen 3.177 N/A CYS 117.A SG GLY 113.A O no hydrogen 3.543 N/A HIS 118.A N LEU 114.A O no hydrogen 2.918 N/A HIS 118.A NE2 ASP 184.A OD2 no hydrogen 2.905 N/A GLU 119.A N ALA 115.A O no hydrogen 2.892 N/A ASN 120.A N PHE 116.A O no hydrogen 3.207 N/A ASN 120.A N CYS 117.A O no hydrogen 2.921 N/A ASN 120.A ND2 PHE 116.A O no hydrogen 2.744 N/A LYS 121.A N HIS 118.A O no hydrogen 2.923 N/A ILE 122.A N CYS 117.A O no hydrogen 2.968 N/A LEU 123.A N ARG 149.A O no hydrogen 2.869 N/A HIS 124.A N ASP 184.A OD2 no hydrogen 2.998 N/A HIS 124.A NE2 GLY 143.A O no hydrogen 2.862 N/A ARG 125.A N ASP 184.A OD1 no hydrogen 2.946 N/A ARG 125.A NE LEU 147.A O no hydrogen 2.807 N/A ARG 125.A NH1 TYR 179.A OH no hydrogen 3.068 N/A ARG 125.A NH2 LEU 147.A O no hydrogen 2.915 N/A ASP 126.A N HIS 124.A ND1 no hydrogen 2.996 N/A LYS 128.A NZ ASP 126.A OD2 no hydrogen 3.542 N/A LYS 128.A NZ THR 164.A OG1 no hydrogen 2.708 N/A ASN 131.A N LYS 128.A O no hydrogen 2.942 N/A ASN 131.A ND2 ASP 126.A O no hydrogen 2.715 N/A ASN 131.A ND2 ASP 126.A OD2 no hydrogen 3.171 N/A LEU 132.A N PRO 129.A O no hydrogen 3.111 N/A LEU 133.A N LYS 141.A O no hydrogen 2.823 N/A ILE 134.A N ASN 86.A O no hydrogen 2.752 N/A ASN 135.A N GLN 139.A O no hydrogen 3.128 N/A GLY 138.A N ASN 135.A O no hydrogen 3.054 N/A GLN 139.A N ASN 135.A OD1 no hydrogen 3.099 N/A LYS 141.A N LEU 133.A O no hydrogen 2.733 N/A LYS 141.A NZ GLU 62.A O no hydrogen 3.212 N/A LYS 141.A NZ GLU 82.A OE1 no hydrogen 3.525 N/A LYS 141.A NZ GLU 82.A OE2 no hydrogen 3.402 N/A LEU 142.A N ASN 63.A O no hydrogen 2.838 N/A GLY 143.A N ASN 131.A O no hydrogen 2.861 N/A PHE 145.A N GLU 52.A OE2 no hydrogen 2.952 N/A GLY 146.A N ASP 144.A OD1 no hydrogen 3.308 N/A ALA 148.A N PHE 145.A O no hydrogen 3.099 N/A ARG 149.A N LEU 123.A O no hydrogen 2.936 N/A PHE 151.A N LYS 121.A O no hydrogen 3.019 N/A SER 159.A OG GLU 161.A OE1 no hydrogen 2.849 N/A THR 164.A N ASP 126.A OD1 no hydrogen 3.246 N/A THR 164.A OG1 ASP 126.A OD1 no hydrogen 2.762 N/A TRP 166.A NE1 GLY 204.A O no hydrogen 2.889 N/A TYR 167.A N THR 164.A O no hydrogen 2.778 N/A TYR 167.A OH GLU 194.A OE1 no hydrogen 2.526 N/A ARG 168.A N LEU 165.A O no hydrogen 3.098 N/A ARG 168.A NE VAL 163.A O no hydrogen 3.019 N/A ARG 168.A NH2 VAL 163.A O no hydrogen 2.899 N/A VAL 172.A N ALA 169.A O no hydrogen 3.000 N/A LEU 173.A N ALA 169.A O no hydrogen 2.926 N/A MET 174.A N PRO 170.A O no hydrogen 2.902 N/A GLY 175.A N VAL 172.A O no hydrogen 2.764 N/A SER 176.A N ASP 171.A O no hydrogen 2.943 N/A THR 178.A N SER 176.A OG no hydrogen 3.240 N/A TYR 179.A OH SER 159.A O no hydrogen 3.387 N/A THR 181.A N SER 180.A OG no hydrogen 2.458 N/A ILE 183.A N SER 180.A O no hydrogen 3.127 N/A ASP 184.A N THR 181.A O no hydrogen 3.180 N/A ILE 185.A N THR 181.A O no hydrogen 3.454 N/A TRP 186.A N SER 182.A O no hydrogen 3.081 N/A SER 187.A N ILE 183.A O no hydrogen 3.504 N/A SER 187.A OG TYR 167.A O no hydrogen 2.918 N/A SER 187.A OG ILE 183.A O no hydrogen 3.361 N/A CYS 188.A N ASP 184.A O no hydrogen 2.903 N/A CYS 188.A SG ASP 184.A O no hydrogen 3.336 N/A GLY 189.A N ILE 185.A O no hydrogen 3.020 N/A CYS 190.A N TRP 186.A O no hydrogen 3.081 N/A CYS 190.A SG TRP 166.A O no hydrogen 3.943 N/A CYS 190.A SG TRP 186.A O no hydrogen 3.675 N/A ILE 191.A N SER 187.A O no hydrogen 2.930 N/A LEU 192.A N CYS 188.A O no hydrogen 3.002 N/A ALA 193.A N GLY 189.A O no hydrogen 3.101 N/A GLU 194.A N CYS 190.A O no hydrogen 3.005 N/A MET 195.A N ILE 191.A O no hydrogen 2.865 N/A ILE 196.A N LEU 192.A O no hydrogen 3.114 N/A THR 197.A N ALA 193.A O no hydrogen 3.048 N/A THR 197.A OG1 ALA 193.A O no hydrogen 3.308 N/A GLY 198.A N GLU 194.A O no hydrogen 2.774 N/A LYS 199.A N THR 197.A OG1 no hydrogen 3.176 N/A GLY 204.A N GLN 210.A OE1 no hydrogen 2.900 N/A THR 205.A N GLU 209.A OE1 no hydrogen 2.924 N/A THR 205.A OG1 GLU 209.A OE1 no hydrogen 2.619 N/A GLU 209.A N ASN 206.A OD1 no hydrogen 3.080 N/A GLN 210.A N ASN 206.A O no hydrogen 2.931 N/A GLN 210.A NE2 TRP 166.A O no hydrogen 3.297 N/A GLN 210.A NE2 PHE 202.A O no hydrogen 2.947 N/A LEU 211.A N ASP 207.A O no hydrogen 3.309 N/A LYS 212.A N GLU 208.A O no hydrogen 3.063 N/A LEU 213.A N GLU 209.A O no hydrogen 2.939 N/A ILE 214.A N GLN 210.A O no hydrogen 2.990 N/A PHE 215.A N LEU 211.A O no hydrogen 2.794 N/A ASP 216.A N LYS 212.A O no hydrogen 2.922 N/A ILE 217.A N ILE 214.A O no hydrogen 3.142 N/A MET 218.A N ILE 214.A O no hydrogen 2.793 N/A THR 220.A N ARG 242.A O no hydrogen 3.076 N/A THR 220.A OG1 ARG 242.A O no hydrogen 3.345 N/A SER 224.A N ASN 222.A OD1 no hydrogen 2.946 N/A LEU 225.A N ASN 222.A O no hydrogen 2.869 N/A VAL 229.A N TRP 226.A O no hydrogen 2.982 N/A THR 230.A N PRO 227.A O no hydrogen 3.398 N/A THR 230.A OG1 PRO 227.A O no hydrogen 3.260 N/A LYS 231.A N SER 228.A O no hydrogen 2.943 N/A LYS 231.A NZ THR 230.A OG1 no hydrogen 3.348 N/A LEU 232.A N VAL 229.A O no hydrogen 3.265 N/A LYS 234.A N MET 174.A O no hydrogen 3.187 N/A TYR 235.A N LEU 232.A O no hydrogen 3.476 N/A TYR 235.A OH GLU 223.A OE2 no hydrogen 2.359 N/A ASN 238.A N ASN 236.A OD1 no hydrogen 3.113 N/A ILE 239.A N ASN 236.A O no hydrogen 3.534 N/A GLN 241.A NE2 PRO 221.A O no hydrogen 3.135 N/A ARG 242.A N THR 220.A OG1 no hydrogen 2.907 N/A ARG 245.A N ILE 217.A O no hydrogen 2.756 N/A ARG 248.A NE LEU 259.A O no hydrogen 3.011 N/A GLN 249.A N ASP 246.A OD2 no hydrogen 2.803 N/A VAL 250.A N ASP 246.A O no hydrogen 3.102 N/A LEU 251.A N LEU 247.A O no hydrogen 3.071 N/A GLN 252.A N ARG 248.A O no hydrogen 2.724 N/A HIS 254.A N LEU 251.A O no hydrogen 2.883 N/A THR 255.A N GLN 252.A O no hydrogen 3.067 N/A GLU 257.A N THR 255.A OG1 no hydrogen 3.101 N/A LEU 263.A N ASP 260.A OD1 no hydrogen 2.642 N/A MET 264.A N ASP 260.A O no hydrogen 3.000 N/A ASP 265.A N GLY 261.A O no hydrogen 2.891 N/A PHE 266.A N ASN 262.A O no hydrogen 3.037 N/A LEU 267.A N LEU 263.A O no hydrogen 3.022 N/A HIS 268.A N MET 264.A O no hydrogen 3.072 N/A GLY 269.A N ASP 265.A O no hydrogen 2.972 N/A LEU 270.A N PHE 266.A O no hydrogen 3.208 N/A LEU 270.A N LEU 267.A O no hydrogen 3.136 N/A LEU 271.A N LEU 267.A O no hydrogen 3.010 N/A GLN 272.A NE2 HIS 268.A O no hydrogen 2.770 N/A ASN 274.A ND2 LEU 225.A O no hydrogen 3.255 N/A ASP 276.A N ASN 274.A OD1 no hydrogen 2.933 N/A MET 277.A N ASN 274.A O no hydrogen 2.914 N/A ARG 278.A N PRO 275.A O no hydrogen 3.243 N/A ARG 278.A NE GLN 272.A O no hydrogen 2.771 N/A ARG 278.A NH1 ASP 171.A OD1 no hydrogen 3.537 N/A ARG 278.A NH1 SER 182.A O no hydrogen 2.991 N/A ARG 278.A NH2 ASP 171.A OD1 no hydrogen 2.821 N/A ARG 278.A NH2 GLN 272.A O no hydrogen 3.415 N/A ARG 278.A NH2 LEU 273.A O no hydrogen 3.043 N/A LEU 279.A N GLY 269.A O no hydrogen 3.076 N/A SER 280.A N GLN 283.A OE1 no hydrogen 3.071 N/A LYS 282.A NZ GLU 119.A OE1 no hydrogen 3.327 N/A GLN 283.A N SER 280.A OG no hydrogen 3.066 N/A ALA 284.A N SER 280.A O no hydrogen 2.926 N/A LEU 285.A N ALA 281.A O no hydrogen 3.040 N/A HIS 286.A N GLN 283.A O no hydrogen 2.965 N/A HIS 287.A N ALA 284.A O no hydrogen 3.183 N/A HIS 287.A NE2 ASP 265.A OD2 no hydrogen 2.607 N/A TRP 289.A N HIS 287.A ND1 no hydrogen 3.090 N/A PHE 290.A N HIS 287.A O no hydrogen 2.859 N/A ALA 291.A N PRO 288.A O no hydrogen 2.783 N/A TYR 293.A N PHE 290.A O no hydrogen 3.052 N/A TYR 294.A N ALA 291.A O no hydrogen 3.088 N/A TYR 294.A OH LEU 285.A O no hydrogen 2.554 N/A TYR 294.A OH HIS 286.A ND1 no hydrogen 3.117 N/A